REM -------------------------------------------------------------------- 3QH2 REM 3QH2 REM STRIDE: Knowledge-based secondary structure assignment 3QH2 REM Please cite: D.Frishman & P.Argos, Proteins 23, 566-579, 1995 3QH2 REM 3QH2 REM Residue accessible surface area calculation 3QH2 REM Please cite: F.Eisenhaber & P.Argos, J.Comp.Chem. 14, 1272-1280, 1993 3QH2 REM F.Eisenhaber et al., J.Comp.Chem., 1994, submitted 3QH2 REM 3QH2 REM ------------------------ General information ----------------------- 3QH2 REM 3QH2 HDR ISOMERASE 25-JAN-11 3QH2 3QH2 CMP MOL_ID: 1; 3QH2 CMP MOLECULE: REGULATORY PROTEIN TENI; 3QH2 CMP CHAIN: A, B, C, D; 3QH2 CMP ENGINEERED: YES 3QH2 SRC MOL_ID: 1; 3QH2 SRC ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; 3QH2 SRC ORGANISM_TAXID: 1423; 3QH2 SRC GENE: TENI, BSU11660; 3QH2 SRC EXPRESSION_SYSTEM: ESCHERICHIA COLI; 3QH2 SRC EXPRESSION_SYSTEM_TAXID: 469008; 3QH2 SRC EXPRESSION_SYSTEM_STRAIN: BL21(DE3); 3QH2 SRC EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; 3QH2 SRC EXPRESSION_SYSTEM_PLASMID: PET28B 3QH2 AUT Y.HAN,Y.ZHANG,A.HAZRA,A.CHATTERJEE,R.LAI,T.P.BEGLEY,S.E.EALIC 3QH2 REM 3QH2 REM -------------------- Secondary structure summary ------------------- 3QH2 REM 3QH2 CHN 3QH2.pdb A 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 1 SHMELHAITDDSKPVEELARIIITIQNEVDFIHIRERSKSAADILKLLDL 50 3QH2 STR EEEEE HHHHHHHHHHHTTTT EEEE TTTT HHHHHHHHHH 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 51 IFEGGIDKRKLVMNGRVDIALFSTIHRVQLPSGSFSPKQIRARFPHLHIG 100 3QH2 STR HHHH GGGEEEETTHHHHHHH EEEETTTT HHHHHHHTTTTEEE 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 101 RSVHSLEEAVQAEKEDADYVLFGHVFGRGVSLLSDIKQRISIPVIAIGGM 150 3QH2 STR EEE HHHHHHHHHH EEEE HHHHHHHHHHHHH EEEETTT 3QH2 REM 3QH2 REM . . . . 3QH2 SEQ 151 TPDRLRDVKQAGADGIAVMSGIFSSAEPLEAARRYSRKLKEMRYE 195 3QH2 STR GGGHHHHHHH EEEEHHHHHHTTTHHHHHHHHHHHHHHHHH 3QH2 REM 3QH2 CHN 3QH2.pdb B 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 1 HMELHAITDDSKPVEELARIIITIQNEVDFIHIRERSKSAADILKLLDLI 50 3QH2 STR EEEEE HHHHHHHHHHHTTTT EEEE TTTT HHHHHHHHHHH 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 51 FEGGIDKRKLVMNGRVDIALFSTIHRVQLPSGSFSPKQIRARFPHLHIGR 100 3QH2 STR HHH GGGEEEETTHHHHHH EEEETTTT HHHHHHHTTTTEEEE 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 101 SVHSLEEAVQAEKEDADYVLFGHVFETLEGRGVSLLSDIKQRISIPVIAI 150 3QH2 STR EE HHHHHHHHHH EEEE TTTTTTTTHHHHHHHHHHHH EEEE 3QH2 REM 3QH2 REM . . . . 3QH2 SEQ 151 GGMTPDRLRDVKQAGADGIAVMSGIFSSAEPLEAARRYSRKLKEMR 196 3QH2 STR TTT GGGHHHHHHH EEEE HHHHHTTTHHHHHHHHHHHHHHH 3QH2 REM 3QH2 CHN 3QH2.pdb C 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 1 HMELHAITDDSKPVEELARIIITIQNEVDFIHIRERSKSAADILKLLDLI 50 3QH2 STR EEEEE HHHHHHHHHHHTTTT EEEE TTTT HHHHHHHHHHH 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 51 FEGGIDKRKLVMNGRVDIALFSTIHRVQLPSGSFSPKQIRARFPHLHIGR 100 3QH2 STR HHH GGGEEEETTHHHHHH EEEETTTT HHHHHHHTTTTEEEE 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 101 SVHSLEEAVQAEKEDADYVLFGHVFEGLEGRGVSLLSDIKQRISIPVIAI 150 3QH2 STR EE HHHHHHHHHH EEEE TTTT HHHHHHHHHHH EEEE 3QH2 REM 3QH2 REM . . . . 3QH2 SEQ 151 GGMTPDRLRDVKQAGADGIAVMSGIFSSAEPLEAARRYSRKLKEMR 196 3QH2 STR TTT GGGHHHHHHH EEEE HHHHHTTTHHHHHHHHHHHHHHH 3QH2 REM 3QH2 CHN 3QH2.pdb D 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 1 SHMELHAITDDSKPVEELARIIITIQNEVDFIHIRERSKSAADILKLLDL 50 3QH2 STR EEEEE HHHHHHHHHHHTTTT EEEE TTTT HHHHHHHHHH 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 51 IFEGGIDKRKLVMNGRVDIALFSTIHRVQLPSGSFSPKQIRARFPHLHIG 100 3QH2 STR HHHH GGGEEEETTHHHHHH EEEETTTT HHHHHHHTTTTEEE 3QH2 REM 3QH2 REM . . . . . 3QH2 SEQ 101 RSVHSLEEAVQAEKEDADYVLFGHVFEGRGVSLLSDIKQRISIPVIAIGG 150 3QH2 STR EEE HHHHHHHHHH EEEE IIIII HHHHHHHHHH EEEETT 3QH2 REM 3QH2 REM . . . . 3QH2 SEQ 151 MTPDRLRDVKQAGADGIAVMSGIFSSAEPLEAARRYSRKLKEMRYE 196 3QH2 STR T GGGHHHHHHH EEEEHHHHHHTTTHHHHHHHHHHHHHHHHH 3QH2 REM 3QH2 REM 3QH2 REM 3QH2 LOC AlphaHelix VAL 13 A ILE 23 A 3QH2 LOC AlphaHelix ALA 39 A GLY 52 A 3QH2 LOC AlphaHelix VAL 65 A SER 71 A 3QH2 LOC AlphaHelix PRO 85 A ARG 91 A 3QH2 LOC AlphaHelix LEU 104 A GLU 113 A 3QH2 LOC AlphaHelix GLY 134 A ARG 146 A 3QH2 LOC AlphaHelix LEU 162 A ALA 168 A 3QH2 LOC AlphaHelix MET 176 A SER 181 A 3QH2 LOC AlphaHelix PRO 185 A TYR 201 A 3QH2 LOC AlphaHelix VAL 13 B ILE 23 B 3QH2 LOC AlphaHelix ALA 39 B GLY 52 B 3QH2 LOC AlphaHelix VAL 65 B PHE 70 B 3QH2 LOC AlphaHelix PRO 85 B ARG 91 B 3QH2 LOC AlphaHelix LEU 104 B GLU 113 B 3QH2 LOC AlphaHelix ARG 135 B ARG 146 B 3QH2 LOC AlphaHelix LEU 162 B ALA 168 B 3QH2 LOC AlphaHelix SER 177 B SER 181 B 3QH2 LOC AlphaHelix PRO 185 B MET 199 B 3QH2 LOC AlphaHelix VAL 13 C ILE 23 C 3QH2 LOC AlphaHelix ALA 39 C GLY 52 C 3QH2 LOC AlphaHelix VAL 65 C PHE 70 C 3QH2 LOC AlphaHelix PRO 85 C ARG 91 C 3QH2 LOC AlphaHelix LEU 104 C GLU 113 C 3QH2 LOC AlphaHelix GLY 136 C ARG 146 C 3QH2 LOC AlphaHelix LEU 162 C ALA 168 C 3QH2 LOC AlphaHelix SER 177 C SER 181 C 3QH2 LOC AlphaHelix PRO 185 C MET 199 C 3QH2 LOC AlphaHelix VAL 13 D ILE 23 D 3QH2 LOC AlphaHelix ALA 39 D GLY 52 D 3QH2 LOC AlphaHelix VAL 65 D PHE 70 D 3QH2 LOC AlphaHelix PRO 85 D ARG 91 D 3QH2 LOC AlphaHelix LEU 104 D GLU 113 D 3QH2 LOC AlphaHelix VAL 137 D ARG 146 D 3QH2 LOC AlphaHelix LEU 162 D ALA 168 D 3QH2 LOC AlphaHelix MET 176 D SER 181 D 3QH2 LOC AlphaHelix PRO 185 D TYR 201 D 3QH2 LOC 310Helix LYS 56 A LYS 58 A 3QH2 LOC 310Helix PRO 159 A ARG 161 A 3QH2 LOC 310Helix LYS 56 B LYS 58 B 3QH2 LOC 310Helix PRO 159 B ARG 161 B 3QH2 LOC 310Helix LYS 56 C LYS 58 C 3QH2 LOC 310Helix PRO 159 C ARG 161 C 3QH2 LOC 310Helix LYS 56 D LYS 58 D 3QH2 LOC 310Helix PRO 159 D ARG 161 D 3QH2 LOC PiHelix VAL 123 D ARG 135 D 3QH2 LOC Strand GLU 2 A ILE 6 A 3QH2 LOC Strand PHE 29 A ILE 32 A 3QH2 LOC Strand LEU 59 A ASN 62 A 3QH2 LOC Strand ARG 75 A LEU 78 A 3QH2 LOC Strand HIS 96 A VAL 101 A 3QH2 LOC Strand TYR 117 A PHE 120 A 3QH2 LOC Strand VAL 151 A ILE 154 A 3QH2 LOC Strand GLY 172 A VAL 175 A 3QH2 LOC Strand GLU 2 B ILE 6 B 3QH2 LOC Strand PHE 29 B ILE 32 B 3QH2 LOC Strand LEU 59 B ASN 62 B 3QH2 LOC Strand ARG 75 B LEU 78 B 3QH2 LOC Strand HIS 96 B VAL 101 B 3QH2 LOC Strand TYR 117 B PHE 120 B 3QH2 LOC Strand VAL 151 B ILE 154 B 3QH2 LOC Strand GLY 172 B VAL 175 B 3QH2 LOC Strand GLU 2 C ILE 6 C 3QH2 LOC Strand PHE 29 C ILE 32 C 3QH2 LOC Strand LEU 59 C ASN 62 C 3QH2 LOC Strand ARG 75 C LEU 78 C 3QH2 LOC Strand HIS 96 C VAL 101 C 3QH2 LOC Strand TYR 117 C PHE 120 C 3QH2 LOC Strand VAL 151 C ILE 154 C 3QH2 LOC Strand GLY 172 C VAL 175 C 3QH2 LOC Strand GLU 2 D ILE 6 D 3QH2 LOC Strand PHE 29 D ILE 32 D 3QH2 LOC Strand LEU 59 D ASN 62 D 3QH2 LOC Strand ARG 75 D LEU 78 D 3QH2 LOC Strand HIS 96 D VAL 101 D 3QH2 LOC Strand TYR 117 D PHE 120 D 3QH2 LOC Strand VAL 151 D ILE 154 D 3QH2 LOC Strand GLY 172 D VAL 175 D 3QH2 LOC TurnI ILE 23 A GLU 26 A 3QH2 LOC TurnI GLN 24 A VAL 27 A 3QH2 LOC TurnI GLU 34 A LYS 37 A 3QH2 LOC TurnIV MET 61 A ARG 64 A 3QH2 LOC TurnII PRO 79 A SER 82 A 3QH2 LOC TurnI PHE 92 A LEU 95 A 3QH2 LOC TurnIV ILE 154 A MET 157 A 3QH2 LOC TurnVIII SER 182 A PRO 185 A 3QH2 LOC TurnI ILE 23 B GLU 26 B 3QH2 LOC TurnI GLN 24 B VAL 27 B 3QH2 LOC TurnI GLU 34 B LYS 37 B 3QH2 LOC TurnIV MET 61 B ARG 64 B 3QH2 LOC TurnII PRO 79 B SER 82 B 3QH2 LOC TurnI PHE 92 B LEU 95 B 3QH2 LOC TurnI HIS 122 B GLU 125 B 3QH2 LOC TurnIV THR 126 B GLY 134 B 3QH2 LOC TurnI' LEU 132 B ARG 135 B 3QH2 LOC TurnIV ILE 154 B MET 157 B 3QH2 LOC TurnVIII SER 182 B PRO 185 B 3QH2 LOC TurnI ILE 23 C GLU 26 C 3QH2 LOC TurnI GLN 24 C VAL 27 C 3QH2 LOC TurnI GLU 34 C LYS 37 C 3QH2 LOC TurnII MET 61 C ARG 64 C 3QH2 LOC TurnII PRO 79 C SER 82 C 3QH2 LOC TurnI PHE 92 C LEU 95 C 3QH2 LOC TurnVIII HIS 122 C GLU 125 C 3QH2 LOC TurnIV ILE 154 C MET 157 C 3QH2 LOC TurnVIII SER 182 C PRO 185 C 3QH2 LOC TurnI ILE 23 D GLU 26 D 3QH2 LOC TurnI GLN 24 D VAL 27 D 3QH2 LOC TurnI GLU 34 D LYS 37 D 3QH2 LOC TurnIV MET 61 D ARG 64 D 3QH2 LOC TurnII PRO 79 D SER 82 D 3QH2 LOC TurnI PHE 92 D LEU 95 D 3QH2 LOC TurnIV ILE 154 D MET 157 D 3QH2 LOC TurnIV SER 182 D PRO 185 D 3QH2 REM 3QH2 REM --------------- Detailed secondary structure assignment------------- 3QH2 REM 3QH2 REM |---Residue---| |--Structure--| |-Phi-| |-Psi-| |-Area-| 3QH2 ASG SER A -1 1 C Coil 360.00 -20.40 99.7 3QH2 ASG HIS A 0 2 C Coil -82.08 121.16 102.3 3QH2 ASG MET A 1 3 C Coil -103.01 129.56 10.6 3QH2 ASG GLU A 2 4 E Strand -76.84 147.84 66.7 3QH2 ASG LEU A 3 5 E Strand -119.31 114.11 2.4 3QH2 ASG HIS A 4 6 E Strand -107.55 120.58 4.2 3QH2 ASG ALA A 5 7 E Strand -91.43 135.29 0.0 3QH2 ASG ILE A 6 8 E Strand -117.05 119.96 6.0 3QH2 ASG THR A 7 9 C Coil -64.32 162.29 0.2 3QH2 ASG ASP A 8 10 C Coil -116.32 11.74 16.7 3QH2 ASG ASP A 9 11 C Coil 50.20 41.04 36.0 3QH2 ASG SER A 10 12 C Coil -133.59 -5.24 91.5 3QH2 ASG LYS A 11 13 C Coil -123.36 148.93 29.4 3QH2 ASG PRO A 12 14 C Coil -58.56 152.47 74.5 3QH2 ASG VAL A 13 15 H AlphaHelix -63.54 -35.89 7.6 3QH2 ASG GLU A 14 16 H AlphaHelix -58.77 -46.26 86.7 3QH2 ASG GLU A 15 17 H AlphaHelix -66.44 -44.53 77.0 3QH2 ASG LEU A 16 18 H AlphaHelix -64.49 -38.94 0.0 3QH2 ASG ALA A 17 19 H AlphaHelix -57.98 -47.74 5.6 3QH2 ASG ARG A 18 20 H AlphaHelix -58.31 -44.73 158.6 3QH2 ASG ILE A 19 21 H AlphaHelix -63.29 -45.69 19.5 3QH2 ASG ILE A 20 22 H AlphaHelix -58.54 -43.32 0.0 3QH2 ASG ILE A 21 23 H AlphaHelix -64.24 -42.51 23.7 3QH2 ASG THR A 22 24 H AlphaHelix -65.16 -32.32 37.8 3QH2 ASG ILE A 23 25 H AlphaHelix -93.49 -3.44 0.0 3QH2 ASG GLN A 24 26 T Turn -57.51 -31.72 0.6 3QH2 ASG ASN A 25 27 T Turn -85.99 -4.04 38.0 3QH2 ASG GLU A 26 28 T Turn -101.41 -11.51 57.4 3QH2 ASG VAL A 27 29 T Turn -126.42 163.98 2.6 3QH2 ASG ASP A 28 30 C Coil -88.94 -34.73 51.6 3QH2 ASG PHE A 29 31 E Strand -144.80 150.12 29.3 3QH2 ASG ILE A 30 32 E Strand -125.49 116.29 0.0 3QH2 ASG HIS A 31 33 E Strand -91.51 119.45 1.0 3QH2 ASG ILE A 32 34 E Strand -81.85 110.99 1.5 3QH2 ASG ARG A 33 35 C Coil -134.48 57.90 83.7 3QH2 ASG GLU A 34 36 T Turn -94.99 71.72 6.2 3QH2 ASG ARG A 35 37 T Turn -50.55 -37.67 162.5 3QH2 ASG SER A 36 38 T Turn -89.14 -2.46 99.9 3QH2 ASG LYS A 37 39 T Turn -98.22 151.16 39.0 3QH2 ASG SER A 38 40 C Coil -73.09 162.50 45.1 3QH2 ASG ALA A 39 41 H AlphaHelix -50.59 -45.93 8.3 3QH2 ASG ALA A 40 42 H AlphaHelix -58.19 -40.86 28.3 3QH2 ASG ASP A 41 43 H AlphaHelix -71.92 -41.10 68.3 3QH2 ASG ILE A 42 44 H AlphaHelix -63.46 -43.46 5.6 3QH2 ASG LEU A 43 45 H AlphaHelix -63.46 -30.71 37.6 3QH2 ASG LYS A 44 46 H AlphaHelix -69.51 -38.99 96.9 3QH2 ASG LEU A 45 47 H AlphaHelix -59.29 -44.33 0.0 3QH2 ASG LEU A 46 48 H AlphaHelix -68.70 -41.57 1.6 3QH2 ASG ASP A 47 49 H AlphaHelix -54.91 -47.52 91.4 3QH2 ASG LEU A 48 50 H AlphaHelix -57.24 -46.34 57.2 3QH2 ASG ILE A 49 51 H AlphaHelix -76.03 -29.54 0.0 3QH2 ASG PHE A 50 52 H AlphaHelix -64.87 -42.44 37.9 3QH2 ASG GLU A 51 53 H AlphaHelix -73.47 -17.65 119.3 3QH2 ASG GLY A 52 54 H AlphaHelix -85.09 -10.13 13.0 3QH2 ASG GLY A 53 55 C Coil 103.68 4.65 7.1 3QH2 ASG ILE A 54 56 C Coil -47.94 146.22 14.3 3QH2 ASG ASP A 55 57 C Coil -82.45 108.81 29.2 3QH2 ASG LYS A 56 58 G 310Helix -57.16 -24.36 73.6 3QH2 ASG ARG A 57 59 G 310Helix -71.16 -14.45 167.9 3QH2 ASG LYS A 58 60 G 310Helix -84.78 -8.03 38.7 3QH2 ASG LEU A 59 61 E Strand -89.48 136.40 0.6 3QH2 ASG VAL A 60 62 E Strand -124.67 128.94 1.2 3QH2 ASG MET A 61 63 E Strand -92.89 122.87 1.6 3QH2 ASG ASN A 62 64 E Strand -87.25 126.53 22.2 3QH2 ASG GLY A 63 65 T Turn 80.85 -52.40 10.7 3QH2 ASG ARG A 64 66 T Turn -86.48 84.15 31.7 3QH2 ASG VAL A 65 67 H AlphaHelix -65.07 -35.06 1.0 3QH2 ASG ASP A 66 68 H AlphaHelix -60.16 -44.21 4.8 3QH2 ASG ILE A 67 69 H AlphaHelix -64.94 -45.97 0.0 3QH2 ASG ALA A 68 70 H AlphaHelix -54.16 -47.48 0.0 3QH2 ASG LEU A 69 71 H AlphaHelix -62.76 -46.81 20.9 3QH2 ASG PHE A 70 72 H AlphaHelix -85.41 -0.12 35.9 3QH2 ASG SER A 71 73 H AlphaHelix -109.34 9.19 12.1 3QH2 ASG THR A 72 74 C Coil 49.52 40.34 84.5 3QH2 ASG ILE A 73 75 C Coil -93.11 129.16 0.8 3QH2 ASG HIS A 74 76 C Coil -99.17 9.56 100.2 3QH2 ASG ARG A 75 77 E Strand -133.27 127.90 71.6 3QH2 ASG VAL A 76 78 E Strand -126.19 149.67 1.0 3QH2 ASG GLN A 77 79 E Strand -117.56 123.53 0.2 3QH2 ASG LEU A 78 80 E Strand -103.98 117.38 0.2 3QH2 ASG PRO A 79 81 T Turn -62.12 154.75 39.5 3QH2 ASG SER A 80 82 T Turn -55.90 127.76 50.9 3QH2 ASG GLY A 81 83 T Turn 90.00 3.59 54.3 3QH2 ASG SER A 82 84 T Turn -103.95 -149.65 20.3 3QH2 ASG PHE A 83 85 C Coil -60.18 152.10 3.5 3QH2 ASG SER A 84 86 C Coil -86.82 153.66 29.9 3QH2 ASG PRO A 85 87 H AlphaHelix -61.98 -32.68 0.0 3QH2 ASG LYS A 86 88 H AlphaHelix -58.88 -47.86 116.5 3QH2 ASG GLN A 87 89 H AlphaHelix -53.96 -51.32 72.9 3QH2 ASG ILE A 88 90 H AlphaHelix -59.95 -46.61 0.0 3QH2 ASG ARG A 89 91 H AlphaHelix -70.08 -29.52 63.8 3QH2 ASG ALA A 90 92 H AlphaHelix -63.49 -38.30 81.7 3QH2 ASG ARG A 91 93 H AlphaHelix -90.18 -34.90 100.4 3QH2 ASG PHE A 92 94 T Turn -132.31 67.53 4.2 3QH2 ASG PRO A 93 95 T Turn -64.07 -14.67 84.5 3QH2 ASG HIS A 94 96 T Turn -76.55 -6.70 89.7 3QH2 ASG LEU A 95 97 T Turn -83.59 140.96 3.5 3QH2 ASG HIS A 96 98 E Strand -86.66 129.23 79.6 3QH2 ASG ILE A 97 99 E Strand -118.01 119.44 0.2 3QH2 ASG GLY A 98 100 E Strand -103.24 149.00 0.0 3QH2 ASG ARG A 99 101 E Strand -119.51 136.69 21.2 3QH2 ASG SER A 100 102 E Strand -86.04 122.18 20.0 3QH2 ASG VAL A 101 103 E Strand -130.54 154.66 0.8 3QH2 ASG HIS A 102 104 C Coil -132.66 9.66 99.6 3QH2 ASG SER A 103 105 C Coil -158.78 165.38 34.1 3QH2 ASG LEU A 104 106 H AlphaHelix -63.33 -41.54 15.4 3QH2 ASG GLU A 105 107 H AlphaHelix -68.71 -38.36 131.1 3QH2 ASG GLU A 106 108 H AlphaHelix -66.23 -38.14 39.5 3QH2 ASG ALA A 107 109 H AlphaHelix -59.95 -47.58 0.4 3QH2 ASG VAL A 108 110 H AlphaHelix -60.47 -43.72 33.1 3QH2 ASG GLN A 109 111 H AlphaHelix -61.67 -42.76 87.4 3QH2 ASG ALA A 110 112 H AlphaHelix -56.99 -39.64 2.0 3QH2 ASG GLU A 111 113 H AlphaHelix -67.72 -39.19 56.3 3QH2 ASG LYS A 112 114 H AlphaHelix -63.01 -36.99 144.8 3QH2 ASG GLU A 113 115 H AlphaHelix -83.39 11.84 57.6 3QH2 ASG ASP A 114 116 C Coil 72.28 30.96 78.4 3QH2 ASG ALA A 115 117 C Coil -58.86 148.96 4.5 3QH2 ASG ASP A 116 118 C Coil -79.83 -27.04 43.7 3QH2 ASG TYR A 117 119 E Strand -165.36 164.61 20.4 3QH2 ASG VAL A 118 120 E Strand -124.01 153.66 0.2 3QH2 ASG LEU A 119 121 E Strand -104.40 119.50 9.3 3QH2 ASG PHE A 120 122 E Strand -108.88 129.90 4.2 3QH2 ASG GLY A 121 123 C Coil -162.36 177.66 5.9 3QH2 ASG HIS A 122 124 C Coil -87.55 133.54 150.0 3QH2 ASG VAL A 123 125 C Coil -76.72 -38.70 6.6 3QH2 ASG PHE A 124 126 C Coil -121.05 360.00 78.6 3QH2 ASG GLY A 134 127 H AlphaHelix 360.00 -37.58 90.7 3QH2 ASG ARG A 135 128 H AlphaHelix -68.76 -40.21 86.1 3QH2 ASG GLY A 136 129 H AlphaHelix -63.11 -46.70 12.4 3QH2 ASG VAL A 137 130 H AlphaHelix -66.39 -40.57 28.8 3QH2 ASG SER A 138 131 H AlphaHelix -57.79 -45.03 81.5 3QH2 ASG LEU A 139 132 H AlphaHelix -64.36 -39.05 60.8 3QH2 ASG LEU A 140 133 H AlphaHelix -58.74 -45.22 0.0 3QH2 ASG SER A 141 134 H AlphaHelix -63.38 -40.58 50.7 3QH2 ASG ASP A 142 135 H AlphaHelix -66.77 -40.61 61.8 3QH2 ASG ILE A 143 136 H AlphaHelix -63.02 -42.61 0.6 3QH2 ASG LYS A 144 137 H AlphaHelix -59.94 -20.27 46.4 3QH2 ASG GLN A 145 138 H AlphaHelix -91.58 -29.78 161.7 3QH2 ASG ARG A 146 139 H AlphaHelix -75.47 -36.59 136.4 3QH2 ASG ILE A 147 140 C Coil -122.69 160.26 6.7 3QH2 ASG SER A 148 141 C Coil -114.95 11.82 104.3 3QH2 ASG ILE A 149 142 C Coil -93.77 155.68 25.5 3QH2 ASG PRO A 150 143 C Coil -60.43 146.55 56.5 3QH2 ASG VAL A 151 144 E Strand -118.32 117.20 0.0 3QH2 ASG ILE A 152 145 E Strand -96.66 121.81 0.8 3QH2 ASG ALA A 153 146 E Strand -83.99 136.46 0.0 3QH2 ASG ILE A 154 147 E Strand -136.95 151.65 47.5 3QH2 ASG GLY A 155 148 T Turn 113.17 99.85 10.7 3QH2 ASG GLY A 156 149 T Turn 71.99 23.40 42.0 3QH2 ASG MET A 157 150 T Turn -68.81 122.06 9.9 3QH2 ASG THR A 158 151 C Coil -132.20 158.74 53.7 3QH2 ASG PRO A 159 152 G 310Helix -52.90 -37.45 32.5 3QH2 ASG ASP A 160 153 G 310Helix -73.47 -14.09 138.2 3QH2 ASG ARG A 161 154 G 310Helix -99.68 0.75 98.2 3QH2 ASG LEU A 162 155 H AlphaHelix -70.89 -31.19 0.4 3QH2 ASG ARG A 163 156 H AlphaHelix -68.52 -45.19 129.5 3QH2 ASG ASP A 164 157 H AlphaHelix -57.51 -43.68 85.1 3QH2 ASG VAL A 165 158 H AlphaHelix -66.58 -43.64 0.0 3QH2 ASG LYS A 166 159 H AlphaHelix -66.99 -45.72 56.0 3QH2 ASG GLN A 167 160 H AlphaHelix -58.96 -35.56 145.8 3QH2 ASG ALA A 168 161 H AlphaHelix -72.88 -6.84 20.6 3QH2 ASG GLY A 169 162 C Coil 111.16 -3.49 28.0 3QH2 ASG ALA A 170 163 C Coil -54.67 138.69 6.8 3QH2 ASG ASP A 171 164 C Coil -86.76 -8.57 54.2 3QH2 ASG GLY A 172 165 E Strand -178.41 173.66 0.0 3QH2 ASG ILE A 173 166 E Strand -135.87 152.86 0.4 3QH2 ASG ALA A 174 167 E Strand -119.91 140.36 1.1 3QH2 ASG VAL A 175 168 E Strand -136.54 127.67 4.3 3QH2 ASG MET A 176 169 H AlphaHelix -107.88 -79.88 76.3 3QH2 ASG SER A 177 170 H AlphaHelix -69.30 -29.73 74.6 3QH2 ASG GLY A 178 171 H AlphaHelix -55.83 -26.55 28.0 3QH2 ASG ILE A 179 172 H AlphaHelix -105.96 -53.03 0.0 3QH2 ASG PHE A 180 173 H AlphaHelix -80.58 -12.76 2.0 3QH2 ASG SER A 181 174 H AlphaHelix -100.14 11.87 86.5 3QH2 ASG SER A 182 175 T Turn -86.98 157.28 36.1 3QH2 ASG ALA A 183 176 T Turn -70.64 -33.35 94.1 3QH2 ASG GLU A 184 177 T Turn -129.89 84.29 126.3 3QH2 ASG PRO A 185 178 H AlphaHelix -53.83 -37.68 18.2 3QH2 ASG LEU A 186 179 H AlphaHelix -65.83 -43.06 11.7 3QH2 ASG GLU A 187 180 H AlphaHelix -67.33 -37.43 58.6 3QH2 ASG ALA A 188 181 H AlphaHelix -57.51 -47.92 1.0 3QH2 ASG ALA A 189 182 H AlphaHelix -61.66 -42.48 0.0 3QH2 ASG ARG A 190 183 H AlphaHelix -56.22 -38.74 61.7 3QH2 ASG ARG A 191 184 H AlphaHelix -59.51 -40.70 122.0 3QH2 ASG TYR A 192 185 H AlphaHelix -68.60 -45.01 8.8 3QH2 ASG SER A 193 186 H AlphaHelix -71.80 -35.39 24.3 3QH2 ASG ARG A 194 187 H AlphaHelix -62.10 -45.31 114.9 3QH2 ASG LYS A 195 188 H AlphaHelix -64.26 -39.39 25.4 3QH2 ASG LEU A 196 189 H AlphaHelix -62.28 -43.00 18.6 3QH2 ASG LYS A 197 190 H AlphaHelix -61.51 -48.57 60.8 3QH2 ASG GLU A 198 191 H AlphaHelix -53.32 -43.72 118.6 3QH2 ASG MET A 199 192 H AlphaHelix -66.92 -38.85 30.1 3QH2 ASG ARG A 200 193 H AlphaHelix -64.29 -37.62 146.4 3QH2 ASG TYR A 201 194 H AlphaHelix -83.22 -21.70 92.1 3QH2 ASG GLU A 202 195 C Coil -90.57 360.00 123.3 3QH2 ASG HIS B 0 1 C Coil 360.00 130.36 135.0 3QH2 ASG MET B 1 2 C Coil -116.45 126.55 14.2 3QH2 ASG GLU B 2 3 E Strand -71.68 148.16 57.5 3QH2 ASG LEU B 3 4 E Strand -119.05 116.35 2.8 3QH2 ASG HIS B 4 5 E Strand -103.45 125.83 4.0 3QH2 ASG ALA B 5 6 E Strand -96.57 135.92 0.0 3QH2 ASG ILE B 6 7 E Strand -118.96 119.04 5.2 3QH2 ASG THR B 7 8 C Coil -65.85 159.64 0.2 3QH2 ASG ASP B 8 9 C Coil -113.13 13.26 14.8 3QH2 ASG ASP B 9 10 C Coil 50.71 41.62 39.1 3QH2 ASG SER B 10 11 C Coil -138.12 -9.40 88.7 3QH2 ASG LYS B 11 12 C Coil -121.29 153.09 32.6 3QH2 ASG PRO B 12 13 C Coil -62.31 151.36 73.9 3QH2 ASG VAL B 13 14 H AlphaHelix -58.25 -33.76 6.4 3QH2 ASG GLU B 14 15 H AlphaHelix -66.31 -43.83 81.5 3QH2 ASG GLU B 15 16 H AlphaHelix -67.08 -41.76 72.9 3QH2 ASG LEU B 16 17 H AlphaHelix -65.18 -40.77 0.0 3QH2 ASG ALA B 17 18 H AlphaHelix -58.51 -43.88 7.6 3QH2 ASG ARG B 18 19 H AlphaHelix -60.06 -45.87 158.0 3QH2 ASG ILE B 19 20 H AlphaHelix -62.78 -43.86 20.0 3QH2 ASG ILE B 20 21 H AlphaHelix -58.57 -43.91 0.0 3QH2 ASG ILE B 21 22 H AlphaHelix -66.25 -42.05 47.2 3QH2 ASG THR B 22 23 H AlphaHelix -60.13 -39.30 76.3 3QH2 ASG ILE B 23 24 H AlphaHelix -96.04 2.29 0.2 3QH2 ASG GLN B 24 25 T Turn -62.90 -32.16 29.5 3QH2 ASG ASN B 25 26 T Turn -86.31 -1.04 132.4 3QH2 ASG GLU B 26 27 T Turn -99.95 -12.35 53.3 3QH2 ASG VAL B 27 28 T Turn -126.71 161.38 3.7 3QH2 ASG ASP B 28 29 C Coil -88.04 -36.73 56.8 3QH2 ASG PHE B 29 30 E Strand -142.39 149.97 34.7 3QH2 ASG ILE B 30 31 E Strand -123.97 116.76 0.0 3QH2 ASG HIS B 31 32 E Strand -91.22 122.31 1.4 3QH2 ASG ILE B 32 33 E Strand -83.67 108.49 1.9 3QH2 ASG ARG B 33 34 C Coil -128.83 56.50 76.6 3QH2 ASG GLU B 34 35 T Turn -93.13 68.23 5.8 3QH2 ASG ARG B 35 36 T Turn -50.25 -38.56 158.4 3QH2 ASG SER B 36 37 T Turn -98.47 9.28 95.9 3QH2 ASG LYS B 37 38 T Turn -96.00 150.87 34.1 3QH2 ASG SER B 38 39 C Coil -77.70 163.00 47.4 3QH2 ASG ALA B 39 40 H AlphaHelix -56.72 -37.04 8.5 3QH2 ASG ALA B 40 41 H AlphaHelix -60.80 -40.11 25.4 3QH2 ASG ASP B 41 42 H AlphaHelix -74.43 -37.60 72.2 3QH2 ASG ILE B 42 43 H AlphaHelix -65.96 -37.27 6.0 3QH2 ASG LEU B 43 44 H AlphaHelix -67.11 -32.62 40.6 3QH2 ASG LYS B 44 45 H AlphaHelix -67.27 -45.85 95.4 3QH2 ASG LEU B 45 46 H AlphaHelix -52.10 -51.58 0.2 3QH2 ASG LEU B 46 47 H AlphaHelix -60.70 -42.12 2.2 3QH2 ASG ASP B 47 48 H AlphaHelix -59.68 -40.26 95.0 3QH2 ASG LEU B 48 49 H AlphaHelix -65.06 -44.10 63.7 3QH2 ASG ILE B 49 50 H AlphaHelix -76.28 -27.92 0.0 3QH2 ASG PHE B 50 51 H AlphaHelix -66.31 -45.99 65.9 3QH2 ASG GLU B 51 52 H AlphaHelix -73.12 -18.29 163.4 3QH2 ASG GLY B 52 53 H AlphaHelix -84.53 -1.96 43.2 3QH2 ASG GLY B 53 54 C Coil 94.81 12.39 54.7 3QH2 ASG ILE B 54 55 C Coil -54.92 145.04 13.5 3QH2 ASG ASP B 55 56 C Coil -78.40 109.39 76.6 3QH2 ASG LYS B 56 57 G 310Helix -62.12 -26.32 43.6 3QH2 ASG ARG B 57 58 G 310Helix -61.40 -20.35 78.4 3QH2 ASG LYS B 58 59 G 310Helix -90.65 -9.63 40.1 3QH2 ASG LEU B 59 60 E Strand -85.68 137.71 0.8 3QH2 ASG VAL B 60 61 E Strand -125.50 129.05 0.8 3QH2 ASG MET B 61 62 E Strand -93.02 120.33 2.2 3QH2 ASG ASN B 62 63 E Strand -82.74 121.90 23.6 3QH2 ASG GLY B 63 64 T Turn 85.05 -47.79 9.7 3QH2 ASG ARG B 64 65 T Turn -85.77 85.38 32.3 3QH2 ASG VAL B 65 66 H AlphaHelix -63.06 -35.79 1.0 3QH2 ASG ASP B 66 67 H AlphaHelix -62.80 -44.19 2.3 3QH2 ASG ILE B 67 68 H AlphaHelix -63.14 -39.14 0.0 3QH2 ASG ALA B 68 69 H AlphaHelix -58.49 -46.73 0.3 3QH2 ASG LEU B 69 70 H AlphaHelix -62.70 -40.75 15.0 3QH2 ASG PHE B 70 71 H AlphaHelix -90.94 6.58 26.2 3QH2 ASG SER B 71 72 C Coil -118.85 2.74 12.1 3QH2 ASG THR B 72 73 C Coil 61.97 32.14 95.5 3QH2 ASG ILE B 73 74 C Coil -94.19 125.50 1.2 3QH2 ASG HIS B 74 75 C Coil -101.14 4.89 98.2 3QH2 ASG ARG B 75 76 E Strand -124.62 132.81 64.5 3QH2 ASG VAL B 76 77 E Strand -128.54 145.47 0.4 3QH2 ASG GLN B 77 78 E Strand -111.56 120.83 0.0 3QH2 ASG LEU B 78 79 E Strand -100.37 117.26 0.2 3QH2 ASG PRO B 79 80 T Turn -69.14 161.40 41.5 3QH2 ASG SER B 80 81 T Turn -61.87 132.70 47.7 3QH2 ASG GLY B 81 82 T Turn 89.00 -6.48 52.5 3QH2 ASG SER B 82 83 T Turn -93.90 -149.22 19.9 3QH2 ASG PHE B 83 84 C Coil -62.21 147.99 3.6 3QH2 ASG SER B 84 85 C Coil -80.11 150.18 31.8 3QH2 ASG PRO B 85 86 H AlphaHelix -63.59 -25.59 0.0 3QH2 ASG LYS B 86 87 H AlphaHelix -65.78 -49.40 53.8 3QH2 ASG GLN B 87 88 H AlphaHelix -54.31 -50.14 74.1 3QH2 ASG ILE B 88 89 H AlphaHelix -57.95 -50.58 0.0 3QH2 ASG ARG B 89 90 H AlphaHelix -66.88 -30.67 51.3 3QH2 ASG ALA B 90 91 H AlphaHelix -58.32 -40.22 88.5 3QH2 ASG ARG B 91 92 H AlphaHelix -103.36 -24.31 116.5 3QH2 ASG PHE B 92 93 T Turn -131.99 71.49 2.8 3QH2 ASG PRO B 93 94 T Turn -68.49 -15.17 90.7 3QH2 ASG HIS B 94 95 T Turn -71.23 -18.32 84.8 3QH2 ASG LEU B 95 96 T Turn -74.27 130.27 1.7 3QH2 ASG HIS B 96 97 E Strand -79.67 130.57 87.2 3QH2 ASG ILE B 97 98 E Strand -121.09 120.38 0.0 3QH2 ASG GLY B 98 99 E Strand -101.20 149.93 0.0 3QH2 ASG ARG B 99 100 E Strand -120.60 135.23 21.6 3QH2 ASG SER B 100 101 E Strand -89.79 121.03 18.8 3QH2 ASG VAL B 101 102 E Strand -128.95 152.75 0.0 3QH2 ASG HIS B 102 103 C Coil -131.70 18.13 86.1 3QH2 ASG SER B 103 104 C Coil -164.66 163.38 26.9 3QH2 ASG LEU B 104 105 H AlphaHelix -56.58 -50.66 48.7 3QH2 ASG GLU B 105 106 H AlphaHelix -63.87 -43.64 136.9 3QH2 ASG GLU B 106 107 H AlphaHelix -61.35 -35.48 38.6 3QH2 ASG ALA B 107 108 H AlphaHelix -63.51 -45.26 0.2 3QH2 ASG VAL B 108 109 H AlphaHelix -60.51 -41.50 12.0 3QH2 ASG GLN B 109 110 H AlphaHelix -68.34 -36.47 95.6 3QH2 ASG ALA B 110 111 H AlphaHelix -61.33 -41.86 1.6 3QH2 ASG GLU B 111 112 H AlphaHelix -64.65 -38.35 53.2 3QH2 ASG LYS B 112 113 H AlphaHelix -66.71 -34.36 147.0 3QH2 ASG GLU B 113 114 H AlphaHelix -84.39 12.06 58.9 3QH2 ASG ASP B 114 115 C Coil 73.13 31.15 90.4 3QH2 ASG ALA B 115 116 C Coil -58.10 147.59 4.3 3QH2 ASG ASP B 116 117 C Coil -79.61 -27.58 62.4 3QH2 ASG TYR B 117 118 E Strand -164.42 167.76 31.3 3QH2 ASG VAL B 118 119 E Strand -125.46 150.20 0.0 3QH2 ASG LEU B 119 120 E Strand -101.07 120.19 9.5 3QH2 ASG PHE B 120 121 E Strand -114.82 129.07 0.0 3QH2 ASG GLY B 121 122 C Coil -171.59 -170.74 2.1 3QH2 ASG HIS B 122 123 T Turn -82.49 116.79 72.0 3QH2 ASG VAL B 123 124 T Turn -66.19 -43.11 8.6 3QH2 ASG PHE B 124 125 T Turn -110.42 7.81 45.5 3QH2 ASG GLU B 125 126 T Turn -65.54 135.10 112.3 3QH2 ASG THR B 126 127 T Turn -103.81 360.00 173.4 3QH2 ASG LEU B 132 128 T Turn 360.00 15.00 68.2 3QH2 ASG GLU B 133 129 T Turn 59.24 37.97 194.2 3QH2 ASG GLY B 134 130 T Turn 77.58 3.41 75.1 3QH2 ASG ARG B 135 131 H AlphaHelix -91.90 2.32 126.4 3QH2 ASG GLY B 136 132 H AlphaHelix -42.59 -58.07 1.1 3QH2 ASG VAL B 137 133 H AlphaHelix -71.35 -36.50 51.9 3QH2 ASG SER B 138 134 H AlphaHelix -68.12 -45.39 77.6 3QH2 ASG LEU B 139 135 H AlphaHelix -60.53 -37.86 11.4 3QH2 ASG LEU B 140 136 H AlphaHelix -55.40 -47.62 0.0 3QH2 ASG SER B 141 137 H AlphaHelix -65.46 -43.02 48.4 3QH2 ASG ASP B 142 138 H AlphaHelix -62.05 -42.76 71.5 3QH2 ASG ILE B 143 139 H AlphaHelix -63.44 -44.50 0.0 3QH2 ASG LYS B 144 140 H AlphaHelix -60.46 -30.96 58.2 3QH2 ASG GLN B 145 141 H AlphaHelix -77.35 -32.00 169.2 3QH2 ASG ARG B 146 142 H AlphaHelix -91.52 -30.31 147.3 3QH2 ASG ILE B 147 143 C Coil -113.50 164.21 9.5 3QH2 ASG SER B 148 144 C Coil -114.53 5.78 106.6 3QH2 ASG ILE B 149 145 C Coil -94.45 155.57 26.1 3QH2 ASG PRO B 150 146 C Coil -56.38 149.09 51.9 3QH2 ASG VAL B 151 147 E Strand -123.57 119.86 0.0 3QH2 ASG ILE B 152 148 E Strand -106.69 126.23 0.6 3QH2 ASG ALA B 153 149 E Strand -87.50 137.17 0.0 3QH2 ASG ILE B 154 150 E Strand -138.06 151.13 46.5 3QH2 ASG GLY B 155 151 T Turn 109.86 101.58 7.6 3QH2 ASG GLY B 156 152 T Turn 72.45 23.01 33.7 3QH2 ASG MET B 157 153 T Turn -69.13 122.65 9.2 3QH2 ASG THR B 158 154 C Coil -132.51 162.43 50.9 3QH2 ASG PRO B 159 155 G 310Helix -54.61 -37.77 28.8 3QH2 ASG ASP B 160 156 G 310Helix -73.13 -5.31 138.7 3QH2 ASG ARG B 161 157 G 310Helix -108.74 -1.04 91.2 3QH2 ASG LEU B 162 158 H AlphaHelix -72.32 -30.15 0.0 3QH2 ASG ARG B 163 159 H AlphaHelix -63.71 -49.92 39.3 3QH2 ASG ASP B 164 160 H AlphaHelix -53.05 -47.22 76.1 3QH2 ASG VAL B 165 161 H AlphaHelix -65.15 -41.10 0.0 3QH2 ASG LYS B 166 162 H AlphaHelix -61.36 -46.37 68.8 3QH2 ASG GLN B 167 163 H AlphaHelix -64.92 -33.35 153.0 3QH2 ASG ALA B 168 164 H AlphaHelix -67.87 -18.25 13.5 3QH2 ASG GLY B 169 165 C Coil 109.13 12.16 27.5 3QH2 ASG ALA B 170 166 C Coil -60.78 144.38 6.8 3QH2 ASG ASP B 171 167 C Coil -88.33 -6.16 51.1 3QH2 ASG GLY B 172 168 E Strand 178.27 175.82 0.0 3QH2 ASG ILE B 173 169 E Strand -130.99 160.03 0.0 3QH2 ASG ALA B 174 170 E Strand -125.25 134.20 1.5 3QH2 ASG VAL B 175 171 E Strand -131.74 131.50 3.1 3QH2 ASG MET B 176 172 C Coil -112.83 -85.42 79.7 3QH2 ASG SER B 177 173 H AlphaHelix -57.68 -34.26 77.1 3QH2 ASG GLY B 178 174 H AlphaHelix -57.54 -19.50 23.1 3QH2 ASG ILE B 179 175 H AlphaHelix -112.18 -52.68 0.0 3QH2 ASG PHE B 180 176 H AlphaHelix -78.41 -11.41 1.8 3QH2 ASG SER B 181 177 H AlphaHelix -97.46 -11.73 84.9 3QH2 ASG SER B 182 178 T Turn -61.53 149.13 33.6 3QH2 ASG ALA B 183 179 T Turn -73.02 -20.08 105.6 3QH2 ASG GLU B 184 180 T Turn -133.23 82.75 97.7 3QH2 ASG PRO B 185 181 H AlphaHelix -57.95 -37.45 18.2 3QH2 ASG LEU B 186 182 H AlphaHelix -59.64 -46.35 37.5 3QH2 ASG GLU B 187 183 H AlphaHelix -66.30 -43.73 74.8 3QH2 ASG ALA B 188 184 H AlphaHelix -54.62 -49.08 0.0 3QH2 ASG ALA B 189 185 H AlphaHelix -61.97 -36.21 0.0 3QH2 ASG ARG B 190 186 H AlphaHelix -63.90 -40.73 89.3 3QH2 ASG ARG B 191 187 H AlphaHelix -55.22 -37.85 119.2 3QH2 ASG TYR B 192 188 H AlphaHelix -72.35 -43.67 7.4 3QH2 ASG SER B 193 189 H AlphaHelix -74.18 -29.33 30.8 3QH2 ASG ARG B 194 190 H AlphaHelix -64.98 -46.78 143.0 3QH2 ASG LYS B 195 191 H AlphaHelix -61.64 -38.26 70.8 3QH2 ASG LEU B 196 192 H AlphaHelix -66.45 -36.23 19.3 3QH2 ASG LYS B 197 193 H AlphaHelix -72.42 -46.65 61.4 3QH2 ASG GLU B 198 194 H AlphaHelix -56.05 -23.90 82.4 3QH2 ASG MET B 199 195 H AlphaHelix -85.12 39.54 45.6 3QH2 ASG ARG B 200 196 C Coil -155.48 360.00 202.6 3QH2 ASG HIS C 0 1 C Coil 360.00 116.61 134.7 3QH2 ASG MET C 1 2 C Coil -102.30 123.09 37.7 3QH2 ASG GLU C 2 3 E Strand -66.65 145.92 62.5 3QH2 ASG LEU C 3 4 E Strand -117.73 116.85 3.6 3QH2 ASG HIS C 4 5 E Strand -109.38 121.02 3.4 3QH2 ASG ALA C 5 6 E Strand -90.45 139.28 0.0 3QH2 ASG ILE C 6 7 E Strand -122.06 120.42 5.4 3QH2 ASG THR C 7 8 C Coil -63.26 158.95 0.2 3QH2 ASG ASP C 8 9 C Coil -111.60 3.89 14.4 3QH2 ASG ASP C 9 10 C Coil 57.21 40.65 40.1 3QH2 ASG SER C 10 11 C Coil -134.60 -15.36 92.3 3QH2 ASG LYS C 11 12 C Coil -112.08 158.14 30.7 3QH2 ASG PRO C 12 13 C Coil -69.62 151.83 70.9 3QH2 ASG VAL C 13 14 H AlphaHelix -59.45 -35.08 13.1 3QH2 ASG GLU C 14 15 H AlphaHelix -61.41 -42.19 105.0 3QH2 ASG GLU C 15 16 H AlphaHelix -70.71 -47.77 80.3 3QH2 ASG LEU C 16 17 H AlphaHelix -56.74 -44.33 0.0 3QH2 ASG ALA C 17 18 H AlphaHelix -59.58 -41.65 6.2 3QH2 ASG ARG C 18 19 H AlphaHelix -64.98 -36.77 160.7 3QH2 ASG ILE C 19 20 H AlphaHelix -68.02 -42.94 21.8 3QH2 ASG ILE C 20 21 H AlphaHelix -57.11 -45.68 0.0 3QH2 ASG ILE C 21 22 H AlphaHelix -61.49 -44.79 19.8 3QH2 ASG THR C 22 23 H AlphaHelix -63.90 -33.45 40.6 3QH2 ASG ILE C 23 24 H AlphaHelix -97.92 -5.40 0.0 3QH2 ASG GLN C 24 25 T Turn -55.11 -29.49 0.8 3QH2 ASG ASN C 25 26 T Turn -89.20 -8.58 45.5 3QH2 ASG GLU C 26 27 T Turn -92.04 -8.85 56.5 3QH2 ASG VAL C 27 28 T Turn -129.28 162.23 2.3 3QH2 ASG ASP C 28 29 C Coil -89.75 -34.69 53.5 3QH2 ASG PHE C 29 30 E Strand -143.23 147.53 32.9 3QH2 ASG ILE C 30 31 E Strand -124.72 117.26 0.2 3QH2 ASG HIS C 31 32 E Strand -94.06 121.85 1.4 3QH2 ASG ILE C 32 33 E Strand -83.93 109.57 1.7 3QH2 ASG ARG C 33 34 C Coil -129.79 55.19 81.8 3QH2 ASG GLU C 34 35 T Turn -91.77 71.53 7.0 3QH2 ASG ARG C 35 36 T Turn -49.44 -39.55 119.7 3QH2 ASG SER C 36 37 T Turn -97.95 5.43 96.4 3QH2 ASG LYS C 37 38 T Turn -97.04 153.37 37.2 3QH2 ASG SER C 38 39 C Coil -79.79 161.45 50.4 3QH2 ASG ALA C 39 40 H AlphaHelix -49.79 -40.23 8.9 3QH2 ASG ALA C 40 41 H AlphaHelix -61.72 -45.23 28.9 3QH2 ASG ASP C 41 42 H AlphaHelix -65.28 -43.12 79.6 3QH2 ASG ILE C 42 43 H AlphaHelix -62.81 -40.74 5.4 3QH2 ASG LEU C 43 44 H AlphaHelix -63.74 -34.52 37.9 3QH2 ASG LYS C 44 45 H AlphaHelix -62.91 -45.62 55.7 3QH2 ASG LEU C 45 46 H AlphaHelix -58.80 -49.80 0.0 3QH2 ASG LEU C 46 47 H AlphaHelix -59.86 -38.70 2.2 3QH2 ASG ASP C 47 48 H AlphaHelix -63.76 -41.05 110.4 3QH2 ASG LEU C 48 49 H AlphaHelix -61.82 -45.82 71.3 3QH2 ASG ILE C 49 50 H AlphaHelix -71.74 -32.17 0.2 3QH2 ASG PHE C 50 51 H AlphaHelix -65.39 -41.84 31.0 3QH2 ASG GLU C 51 52 H AlphaHelix -70.09 -21.53 65.5 3QH2 ASG GLY C 52 53 H AlphaHelix -91.01 1.45 16.5 3QH2 ASG GLY C 53 54 C Coil 99.24 3.45 5.1 3QH2 ASG ILE C 54 55 C Coil -48.37 137.83 13.1 3QH2 ASG ASP C 55 56 C Coil -74.53 110.45 23.3 3QH2 ASG LYS C 56 57 G 310Helix -66.41 -24.87 73.5 3QH2 ASG ARG C 57 58 G 310Helix -64.15 -15.89 176.6 3QH2 ASG LYS C 58 59 G 310Helix -90.04 -9.11 39.5 3QH2 ASG LEU C 59 60 E Strand -85.09 143.75 0.9 3QH2 ASG VAL C 60 61 E Strand -130.40 129.85 1.0 3QH2 ASG MET C 61 62 E Strand -94.21 121.19 1.4 3QH2 ASG ASN C 62 63 E Strand -84.10 115.15 13.2 3QH2 ASG GLY C 63 64 T Turn 87.41 -43.03 8.5 3QH2 ASG ARG C 64 65 T Turn -85.60 85.75 34.1 3QH2 ASG VAL C 65 66 H AlphaHelix -69.57 -32.85 0.0 3QH2 ASG ASP C 66 67 H AlphaHelix -60.80 -46.70 1.2 3QH2 ASG ILE C 67 68 H AlphaHelix -59.02 -41.01 0.0 3QH2 ASG ALA C 68 69 H AlphaHelix -59.14 -51.89 0.2 3QH2 ASG LEU C 69 70 H AlphaHelix -57.68 -42.02 11.5 3QH2 ASG PHE C 70 71 H AlphaHelix -87.44 3.40 24.8 3QH2 ASG SER C 71 72 C Coil -118.57 -2.60 13.8 3QH2 ASG THR C 72 73 C Coil 59.67 40.37 80.0 3QH2 ASG ILE C 73 74 C Coil -97.17 124.87 1.2 3QH2 ASG HIS C 74 75 C Coil -100.80 10.97 95.7 3QH2 ASG ARG C 75 76 E Strand -127.82 133.67 61.3 3QH2 ASG VAL C 76 77 E Strand -132.74 145.31 0.4 3QH2 ASG GLN C 77 78 E Strand -111.04 120.20 0.2 3QH2 ASG LEU C 78 79 E Strand -97.69 115.09 0.0 3QH2 ASG PRO C 79 80 T Turn -60.66 155.83 26.4 3QH2 ASG SER C 80 81 T Turn -57.42 127.20 48.7 3QH2 ASG GLY C 81 82 T Turn 89.82 -2.39 51.6 3QH2 ASG SER C 82 83 T Turn -91.20 -153.83 19.6 3QH2 ASG PHE C 83 84 C Coil -59.14 151.92 2.9 3QH2 ASG SER C 84 85 C Coil -88.41 149.11 31.5 3QH2 ASG PRO C 85 86 H AlphaHelix -59.49 -36.61 0.0 3QH2 ASG LYS C 86 87 H AlphaHelix -59.89 -43.87 44.9 3QH2 ASG GLN C 87 88 H AlphaHelix -71.69 -37.72 76.7 3QH2 ASG ILE C 88 89 H AlphaHelix -61.52 -45.33 0.0 3QH2 ASG ARG C 89 90 H AlphaHelix -70.91 -32.51 59.0 3QH2 ASG ALA C 90 91 H AlphaHelix -62.64 -37.38 89.5 3QH2 ASG ARG C 91 92 H AlphaHelix -89.83 -31.14 111.7 3QH2 ASG PHE C 92 93 T Turn -134.67 75.44 1.6 3QH2 ASG PRO C 93 94 T Turn -66.54 -13.72 92.9 3QH2 ASG HIS C 94 95 T Turn -75.56 -15.05 80.2 3QH2 ASG LEU C 95 96 T Turn -77.03 137.57 2.5 3QH2 ASG HIS C 96 97 E Strand -90.06 126.13 85.5 3QH2 ASG ILE C 97 98 E Strand -119.88 119.08 0.2 3QH2 ASG GLY C 98 99 E Strand -99.91 152.98 0.0 3QH2 ASG ARG C 99 100 E Strand -122.67 130.95 19.2 3QH2 ASG SER C 100 101 E Strand -83.83 115.83 21.0 3QH2 ASG VAL C 101 102 E Strand -122.03 161.20 0.2 3QH2 ASG HIS C 102 103 C Coil -138.80 9.47 97.7 3QH2 ASG SER C 103 104 C Coil -159.17 168.77 45.5 3QH2 ASG LEU C 104 105 H AlphaHelix -68.88 -39.84 61.6 3QH2 ASG GLU C 105 106 H AlphaHelix -65.87 -44.68 74.4 3QH2 ASG GLU C 106 107 H AlphaHelix -58.10 -38.27 37.6 3QH2 ASG ALA C 107 108 H AlphaHelix -67.42 -44.95 0.0 3QH2 ASG VAL C 108 109 H AlphaHelix -61.65 -42.25 34.2 3QH2 ASG GLN C 109 110 H AlphaHelix -62.03 -40.12 98.6 3QH2 ASG ALA C 110 111 H AlphaHelix -60.25 -39.34 0.8 3QH2 ASG GLU C 111 112 H AlphaHelix -69.78 -40.12 50.2 3QH2 ASG LYS C 112 113 H AlphaHelix -61.77 -25.29 71.4 3QH2 ASG GLU C 113 114 H AlphaHelix -95.80 12.59 58.1 3QH2 ASG ASP C 114 115 C Coil 71.41 30.72 94.9 3QH2 ASG ALA C 115 116 C Coil -62.00 147.49 5.2 3QH2 ASG ASP C 116 117 C Coil -81.29 -25.94 62.0 3QH2 ASG TYR C 117 118 E Strand -166.97 171.33 31.7 3QH2 ASG VAL C 118 119 E Strand -126.85 156.96 0.0 3QH2 ASG LEU C 119 120 E Strand -109.90 132.15 7.8 3QH2 ASG PHE C 120 121 E Strand -121.85 131.88 4.2 3QH2 ASG GLY C 121 122 C Coil -161.83 178.84 8.2 3QH2 ASG HIS C 122 123 T Turn -78.36 124.29 123.1 3QH2 ASG VAL C 123 124 T Turn -72.43 -43.91 0.0 3QH2 ASG PHE C 124 125 T Turn -118.84 145.45 16.1 3QH2 ASG GLU C 125 126 T Turn -155.59 360.00 180.6 3QH2 ASG GLY C 131 127 C Coil 360.00 69.30 133.2 3QH2 ASG LEU C 132 128 C Coil -118.86 -164.25 173.4 3QH2 ASG GLU C 133 129 C Coil -68.81 172.21 136.6 3QH2 ASG GLY C 134 130 C Coil -68.65 137.22 7.1 3QH2 ASG ARG C 135 131 C Coil -44.52 -46.92 70.7 3QH2 ASG GLY C 136 132 H AlphaHelix -95.07 7.03 7.1 3QH2 ASG VAL C 137 133 H AlphaHelix -63.75 -38.82 16.2 3QH2 ASG SER C 138 134 H AlphaHelix -72.67 -38.84 68.7 3QH2 ASG LEU C 139 135 H AlphaHelix -58.09 -46.22 57.5 3QH2 ASG LEU C 140 136 H AlphaHelix -51.86 -44.79 0.2 3QH2 ASG SER C 141 137 H AlphaHelix -68.60 -42.38 47.4 3QH2 ASG ASP C 142 138 H AlphaHelix -60.36 -43.89 84.2 3QH2 ASG ILE C 143 139 H AlphaHelix -62.41 -44.29 0.0 3QH2 ASG LYS C 144 140 H AlphaHelix -57.37 -40.83 58.7 3QH2 ASG GLN C 145 141 H AlphaHelix -67.69 -39.56 88.2 3QH2 ASG ARG C 146 142 H AlphaHelix -75.23 -44.39 148.9 3QH2 ASG ILE C 147 143 C Coil -104.04 164.53 8.2 3QH2 ASG SER C 148 144 C Coil -111.68 8.17 105.7 3QH2 ASG ILE C 149 145 C Coil -101.14 157.84 27.3 3QH2 ASG PRO C 150 146 C Coil -55.93 147.95 54.9 3QH2 ASG VAL C 151 147 E Strand -126.49 123.45 0.0 3QH2 ASG ILE C 152 148 E Strand -109.52 129.02 0.4 3QH2 ASG ALA C 153 149 E Strand -93.76 139.03 0.0 3QH2 ASG ILE C 154 150 E Strand -142.92 153.63 48.3 3QH2 ASG GLY C 155 151 T Turn 110.60 100.91 11.7 3QH2 ASG GLY C 156 152 T Turn 65.82 29.36 41.9 3QH2 ASG MET C 157 153 T Turn -69.80 129.01 9.0 3QH2 ASG THR C 158 154 C Coil -140.72 153.26 41.3 3QH2 ASG PRO C 159 155 G 310Helix -52.20 -36.65 35.1 3QH2 ASG ASP C 160 156 G 310Helix -60.00 -46.00 139.6 3QH2 ASG ARG C 161 157 G 310Helix -79.19 -0.76 99.9 3QH2 ASG LEU C 162 158 H AlphaHelix -66.67 -34.42 2.1 3QH2 ASG ARG C 163 159 H AlphaHelix -56.97 -48.41 46.5 3QH2 ASG ASP C 164 160 H AlphaHelix -59.86 -44.83 91.5 3QH2 ASG VAL C 165 161 H AlphaHelix -64.96 -38.53 0.2 3QH2 ASG LYS C 166 162 H AlphaHelix -69.95 -37.61 35.4 3QH2 ASG GLN C 167 163 H AlphaHelix -56.02 -44.82 86.1 3QH2 ASG ALA C 168 164 H AlphaHelix -66.85 -18.82 13.7 3QH2 ASG GLY C 169 165 C Coil 108.50 12.64 29.1 3QH2 ASG ALA C 170 166 C Coil -55.35 140.82 9.1 3QH2 ASG ASP C 171 167 C Coil -80.66 -11.41 53.3 3QH2 ASG GLY C 172 168 E Strand 178.38 172.85 0.0 3QH2 ASG ILE C 173 169 E Strand -128.15 160.81 0.6 3QH2 ASG ALA C 174 170 E Strand -128.28 142.35 1.5 3QH2 ASG VAL C 175 171 E Strand -135.68 131.67 3.3 3QH2 ASG MET C 176 172 C Coil -113.45 -84.89 77.5 3QH2 ASG SER C 177 173 H AlphaHelix -61.16 -32.22 74.2 3QH2 ASG GLY C 178 174 H AlphaHelix -52.81 -22.19 23.5 3QH2 ASG ILE C 179 175 H AlphaHelix -114.85 -54.64 0.0 3QH2 ASG PHE C 180 176 H AlphaHelix -73.44 -15.81 2.8 3QH2 ASG SER C 181 177 H AlphaHelix -95.29 -5.42 87.1 3QH2 ASG SER C 182 178 T Turn -76.49 146.01 32.7 3QH2 ASG ALA C 183 179 T Turn -66.89 -20.75 100.0 3QH2 ASG GLU C 184 180 T Turn -137.01 82.80 125.2 3QH2 ASG PRO C 185 181 H AlphaHelix -55.19 -37.44 20.0 3QH2 ASG LEU C 186 182 H AlphaHelix -67.82 -41.51 10.2 3QH2 ASG GLU C 187 183 H AlphaHelix -59.96 -47.85 33.6 3QH2 ASG ALA C 188 184 H AlphaHelix -57.22 -46.12 0.0 3QH2 ASG ALA C 189 185 H AlphaHelix -60.17 -39.79 0.0 3QH2 ASG ARG C 190 186 H AlphaHelix -65.24 -41.87 80.3 3QH2 ASG ARG C 191 187 H AlphaHelix -47.85 -42.34 112.5 3QH2 ASG TYR C 192 188 H AlphaHelix -70.88 -46.36 7.2 3QH2 ASG SER C 193 189 H AlphaHelix -76.08 -25.30 31.7 3QH2 ASG ARG C 194 190 H AlphaHelix -75.22 -44.88 127.6 3QH2 ASG LYS C 195 191 H AlphaHelix -53.34 -46.30 56.7 3QH2 ASG LEU C 196 192 H AlphaHelix -61.30 -44.61 20.6 3QH2 ASG LYS C 197 193 H AlphaHelix -63.42 -41.13 65.8 3QH2 ASG GLU C 198 194 H AlphaHelix -53.24 -53.78 132.0 3QH2 ASG MET C 199 195 H AlphaHelix -61.40 -29.71 72.9 3QH2 ASG ARG C 200 196 C Coil -69.58 360.00 207.2 3QH2 ASG SER D -1 1 C Coil 360.00 32.74 99.1 3QH2 ASG HIS D 0 2 C Coil -90.67 109.07 101.2 3QH2 ASG MET D 1 3 C Coil -87.60 129.86 10.0 3QH2 ASG GLU D 2 4 E Strand -72.26 146.62 63.9 3QH2 ASG LEU D 3 5 E Strand -119.59 113.47 1.4 3QH2 ASG HIS D 4 6 E Strand -105.18 127.80 4.8 3QH2 ASG ALA D 5 7 E Strand -102.59 131.86 0.0 3QH2 ASG ILE D 6 8 E Strand -112.80 120.90 5.6 3QH2 ASG THR D 7 9 C Coil -66.95 157.89 0.2 3QH2 ASG ASP D 8 10 C Coil -113.37 16.01 24.4 3QH2 ASG ASP D 9 11 C Coil 48.66 47.90 42.4 3QH2 ASG SER D 10 12 C Coil -139.09 -12.07 78.1 3QH2 ASG LYS D 11 13 C Coil -116.05 152.60 28.6 3QH2 ASG PRO D 12 14 C Coil -65.65 154.96 67.1 3QH2 ASG VAL D 13 15 H AlphaHelix -57.02 -45.42 6.8 3QH2 ASG GLU D 14 16 H AlphaHelix -60.83 -39.84 105.7 3QH2 ASG GLU D 15 17 H AlphaHelix -68.11 -49.18 103.5 3QH2 ASG LEU D 16 18 H AlphaHelix -60.11 -42.89 0.0 3QH2 ASG ALA D 17 19 H AlphaHelix -56.48 -43.68 4.8 3QH2 ASG ARG D 18 20 H AlphaHelix -63.56 -40.51 77.7 3QH2 ASG ILE D 19 21 H AlphaHelix -62.86 -48.05 22.9 3QH2 ASG ILE D 20 22 H AlphaHelix -55.37 -46.53 0.0 3QH2 ASG ILE D 21 23 H AlphaHelix -64.06 -36.91 51.0 3QH2 ASG THR D 22 24 H AlphaHelix -67.82 -38.48 72.4 3QH2 ASG ILE D 23 25 H AlphaHelix -95.31 0.87 0.0 3QH2 ASG GLN D 24 26 T Turn -58.28 -30.53 31.5 3QH2 ASG ASN D 25 27 T Turn -88.81 -3.77 131.7 3QH2 ASG GLU D 26 28 T Turn -100.24 -7.07 43.2 3QH2 ASG VAL D 27 29 T Turn -128.05 160.58 3.3 3QH2 ASG ASP D 28 30 C Coil -89.86 -36.74 50.7 3QH2 ASG PHE D 29 31 E Strand -140.08 148.68 31.7 3QH2 ASG ILE D 30 32 E Strand -120.75 120.75 0.4 3QH2 ASG HIS D 31 33 E Strand -93.54 121.78 1.4 3QH2 ASG ILE D 32 34 E Strand -83.44 106.98 1.0 3QH2 ASG ARG D 33 35 C Coil -125.64 57.34 84.2 3QH2 ASG GLU D 34 36 T Turn -95.32 72.68 6.7 3QH2 ASG ARG D 35 37 T Turn -54.20 -35.87 115.7 3QH2 ASG SER D 36 38 T Turn -88.41 -1.66 101.2 3QH2 ASG LYS D 37 39 T Turn -93.95 148.48 37.8 3QH2 ASG SER D 38 40 C Coil -74.69 165.20 57.4 3QH2 ASG ALA D 39 41 H AlphaHelix -56.81 -42.69 9.5 3QH2 ASG ALA D 40 42 H AlphaHelix -57.27 -41.06 26.6 3QH2 ASG ASP D 41 43 H AlphaHelix -70.54 -39.09 67.9 3QH2 ASG ILE D 42 44 H AlphaHelix -70.32 -40.60 5.0 3QH2 ASG LEU D 43 45 H AlphaHelix -62.30 -29.68 32.5 3QH2 ASG LYS D 44 46 H AlphaHelix -72.27 -40.22 90.3 3QH2 ASG LEU D 45 47 H AlphaHelix -56.29 -48.25 0.2 3QH2 ASG LEU D 46 48 H AlphaHelix -65.06 -43.51 1.8 3QH2 ASG ASP D 47 49 H AlphaHelix -55.76 -43.22 115.1 3QH2 ASG LEU D 48 50 H AlphaHelix -64.12 -41.76 74.2 3QH2 ASG ILE D 49 51 H AlphaHelix -79.03 -29.81 0.0 3QH2 ASG PHE D 50 52 H AlphaHelix -62.75 -49.98 46.8 3QH2 ASG GLU D 51 53 H AlphaHelix -70.93 -20.26 92.8 3QH2 ASG GLY D 52 54 H AlphaHelix -82.66 -3.73 40.3 3QH2 ASG GLY D 53 55 C Coil 98.58 9.77 55.9 3QH2 ASG ILE D 54 56 C Coil -51.75 147.56 11.8 3QH2 ASG ASP D 55 57 C Coil -82.54 109.41 76.2 3QH2 ASG LYS D 56 58 G 310Helix -63.02 -24.31 81.0 3QH2 ASG ARG D 57 59 G 310Helix -68.22 -17.69 99.4 3QH2 ASG LYS D 58 60 G 310Helix -86.00 -6.75 40.1 3QH2 ASG LEU D 59 61 E Strand -87.68 137.51 0.4 3QH2 ASG VAL D 60 62 E Strand -126.54 127.37 1.0 3QH2 ASG MET D 61 63 E Strand -89.68 121.39 1.7 3QH2 ASG ASN D 62 64 E Strand -84.72 121.42 12.1 3QH2 ASG GLY D 63 65 T Turn 86.60 -52.97 10.3 3QH2 ASG ARG D 64 66 T Turn -82.28 80.04 36.3 3QH2 ASG VAL D 65 67 H AlphaHelix -57.02 -40.12 0.4 3QH2 ASG ASP D 66 68 H AlphaHelix -61.89 -40.93 1.0 3QH2 ASG ILE D 67 69 H AlphaHelix -62.87 -42.72 0.0 3QH2 ASG ALA D 68 70 H AlphaHelix -57.85 -50.08 0.0 3QH2 ASG LEU D 69 71 H AlphaHelix -54.03 -51.04 31.4 3QH2 ASG PHE D 70 72 H AlphaHelix -87.14 12.59 36.3 3QH2 ASG SER D 71 73 C Coil -123.33 5.62 11.2 3QH2 ASG THR D 72 74 C Coil 56.53 30.71 80.6 3QH2 ASG ILE D 73 75 C Coil -91.63 132.88 0.6 3QH2 ASG HIS D 74 76 C Coil -104.73 6.40 95.5 3QH2 ASG ARG D 75 77 E Strand -135.40 133.65 63.7 3QH2 ASG VAL D 76 78 E Strand -130.22 144.21 0.6 3QH2 ASG GLN D 77 79 E Strand -111.70 122.80 0.0 3QH2 ASG LEU D 78 80 E Strand -101.79 121.30 0.2 3QH2 ASG PRO D 79 81 T Turn -67.46 161.16 27.7 3QH2 ASG SER D 80 82 T Turn -61.52 123.36 52.9 3QH2 ASG GLY D 81 83 T Turn 96.15 -5.57 54.1 3QH2 ASG SER D 82 84 T Turn -92.84 -147.94 19.4 3QH2 ASG PHE D 83 85 C Coil -62.29 152.24 3.6 3QH2 ASG SER D 84 86 C Coil -86.83 147.60 30.2 3QH2 ASG PRO D 85 87 H AlphaHelix -59.93 -29.72 0.0 3QH2 ASG LYS D 86 88 H AlphaHelix -67.76 -42.64 52.5 3QH2 ASG GLN D 87 89 H AlphaHelix -53.98 -51.75 76.7 3QH2 ASG ILE D 88 90 H AlphaHelix -66.50 -43.31 0.0 3QH2 ASG ARG D 89 91 H AlphaHelix -67.92 -29.19 69.3 3QH2 ASG ALA D 90 92 H AlphaHelix -60.30 -39.56 83.0 3QH2 ASG ARG D 91 93 H AlphaHelix -97.56 -26.48 99.1 3QH2 ASG PHE D 92 94 T Turn -133.92 66.76 3.6 3QH2 ASG PRO D 93 95 T Turn -71.04 -4.54 91.4 3QH2 ASG HIS D 94 96 T Turn -79.12 -5.50 101.8 3QH2 ASG LEU D 95 97 T Turn -87.68 139.82 4.0 3QH2 ASG HIS D 96 98 E Strand -91.92 133.72 78.9 3QH2 ASG ILE D 97 99 E Strand -127.74 119.28 0.0 3QH2 ASG GLY D 98 100 E Strand -104.01 153.97 0.0 3QH2 ASG ARG D 99 101 E Strand -120.46 135.46 20.4 3QH2 ASG SER D 100 102 E Strand -86.08 121.39 19.2 3QH2 ASG VAL D 101 103 E Strand -131.46 153.42 0.2 3QH2 ASG HIS D 102 104 C Coil -131.29 9.75 74.2 3QH2 ASG SER D 103 105 C Coil -158.10 165.69 31.1 3QH2 ASG LEU D 104 106 H AlphaHelix -60.14 -47.09 24.4 3QH2 ASG GLU D 105 107 H AlphaHelix -65.58 -40.79 132.0 3QH2 ASG GLU D 106 108 H AlphaHelix -63.84 -33.35 38.5 3QH2 ASG ALA D 107 109 H AlphaHelix -69.28 -42.78 0.0 3QH2 ASG VAL D 108 110 H AlphaHelix -60.88 -43.82 54.6 3QH2 ASG GLN D 109 111 H AlphaHelix -65.23 -38.71 102.0 3QH2 ASG ALA D 110 112 H AlphaHelix -59.05 -40.87 1.4 3QH2 ASG GLU D 111 113 H AlphaHelix -67.36 -35.36 59.9 3QH2 ASG LYS D 112 114 H AlphaHelix -66.44 -34.84 72.4 3QH2 ASG GLU D 113 115 H AlphaHelix -87.61 14.63 71.4 3QH2 ASG ASP D 114 116 C Coil 74.89 28.77 43.6 3QH2 ASG ALA D 115 117 C Coil -59.47 150.24 6.3 3QH2 ASG ASP D 116 118 C Coil -83.24 -23.41 46.1 3QH2 ASG TYR D 117 119 E Strand -169.29 166.25 19.0 3QH2 ASG VAL D 118 120 E Strand -126.46 151.42 0.0 3QH2 ASG LEU D 119 121 E Strand -103.45 117.78 10.3 3QH2 ASG PHE D 120 122 E Strand -109.10 128.15 0.0 3QH2 ASG GLY D 121 123 C Coil -159.50 179.75 3.7 3QH2 ASG HIS D 122 124 C Coil -91.91 127.14 77.0 3QH2 ASG VAL D 123 125 I PiHelix -71.41 -50.53 1.5 3QH2 ASG PHE D 124 126 I PiHelix -111.56 158.53 36.0 3QH2 ASG GLU D 125 127 I PiHelix -73.05 360.00 114.2 3QH2 ASG GLY D 134 128 I PiHelix 360.00 141.00 67.1 3QH2 ASG ARG D 135 129 I PiHelix -78.33 -19.66 110.7 3QH2 ASG GLY D 136 130 C Coil 97.90 152.09 25.5 3QH2 ASG VAL D 137 131 H AlphaHelix -78.34 -19.79 51.4 3QH2 ASG SER D 138 132 H AlphaHelix -61.22 -45.65 98.8 3QH2 ASG LEU D 139 133 H AlphaHelix -67.77 -36.06 48.7 3QH2 ASG LEU D 140 134 H AlphaHelix -56.30 -48.86 0.0 3QH2 ASG SER D 141 135 H AlphaHelix -63.83 -37.24 61.7 3QH2 ASG ASP D 142 136 H AlphaHelix -66.97 -49.05 66.4 3QH2 ASG ILE D 143 137 H AlphaHelix -55.10 -43.64 0.0 3QH2 ASG LYS D 144 138 H AlphaHelix -61.71 -35.95 63.9 3QH2 ASG GLN D 145 139 H AlphaHelix -80.11 -27.16 90.9 3QH2 ASG ARG D 146 140 H AlphaHelix -71.40 -38.32 130.7 3QH2 ASG ILE D 147 141 C Coil -116.48 160.17 8.0 3QH2 ASG SER D 148 142 C Coil -117.45 38.94 106.4 3QH2 ASG ILE D 149 143 C Coil -121.58 162.15 25.1 3QH2 ASG PRO D 150 144 C Coil -65.95 155.27 56.9 3QH2 ASG VAL D 151 145 E Strand -123.59 121.18 0.0 3QH2 ASG ILE D 152 146 E Strand -104.12 122.32 1.2 3QH2 ASG ALA D 153 147 E Strand -83.31 133.93 0.0 3QH2 ASG ILE D 154 148 E Strand -138.11 151.44 45.9 3QH2 ASG GLY D 155 149 T Turn 111.44 101.19 17.4 3QH2 ASG GLY D 156 150 T Turn 72.37 21.78 34.6 3QH2 ASG MET D 157 151 T Turn -68.10 117.38 8.6 3QH2 ASG THR D 158 152 C Coil -124.57 163.98 45.5 3QH2 ASG PRO D 159 153 G 310Helix -54.25 -38.35 35.8 3QH2 ASG ASP D 160 154 G 310Helix -89.98 12.07 134.5 3QH2 ASG ARG D 161 155 G 310Helix -106.95 -5.85 86.8 3QH2 ASG LEU D 162 156 H AlphaHelix -66.97 -35.93 0.0 3QH2 ASG ARG D 163 157 H AlphaHelix -66.23 -40.61 92.5 3QH2 ASG ASP D 164 158 H AlphaHelix -63.91 -37.68 85.3 3QH2 ASG VAL D 165 159 H AlphaHelix -72.10 -40.81 0.0 3QH2 ASG LYS D 166 160 H AlphaHelix -74.54 -38.51 51.1 3QH2 ASG GLN D 167 161 H AlphaHelix -57.90 -37.35 147.5 3QH2 ASG ALA D 168 162 H AlphaHelix -77.03 -2.07 23.0 3QH2 ASG GLY D 169 163 C Coil 104.30 6.51 26.2 3QH2 ASG ALA D 170 164 C Coil -57.43 139.98 7.6 3QH2 ASG ASP D 171 165 C Coil -82.67 -11.24 54.0 3QH2 ASG GLY D 172 166 E Strand -179.86 173.00 0.0 3QH2 ASG ILE D 173 167 E Strand -127.95 155.67 0.0 3QH2 ASG ALA D 174 168 E Strand -120.44 135.75 1.2 3QH2 ASG VAL D 175 169 E Strand -130.09 126.55 3.9 3QH2 ASG MET D 176 170 H AlphaHelix -106.94 -79.57 77.5 3QH2 ASG SER D 177 171 H AlphaHelix -63.60 -36.46 75.0 3QH2 ASG GLY D 178 172 H AlphaHelix -55.10 -20.09 25.0 3QH2 ASG ILE D 179 173 H AlphaHelix -113.39 -52.41 0.0 3QH2 ASG PHE D 180 174 H AlphaHelix -79.77 -11.50 2.2 3QH2 ASG SER D 181 175 H AlphaHelix -94.47 2.78 88.6 3QH2 ASG SER D 182 176 T Turn -91.25 139.35 29.2 3QH2 ASG ALA D 183 177 T Turn -76.64 -5.23 105.3 3QH2 ASG GLU D 184 178 T Turn -125.49 67.62 127.3 3QH2 ASG PRO D 185 179 H AlphaHelix -59.69 -32.46 23.1 3QH2 ASG LEU D 186 180 H AlphaHelix -63.00 -47.72 44.8 3QH2 ASG GLU D 187 181 H AlphaHelix -65.93 -38.30 71.5 3QH2 ASG ALA D 188 182 H AlphaHelix -60.19 -48.07 0.0 3QH2 ASG ALA D 189 183 H AlphaHelix -60.77 -43.18 0.0 3QH2 ASG ARG D 190 184 H AlphaHelix -58.55 -36.92 83.0 3QH2 ASG ARG D 191 185 H AlphaHelix -57.79 -37.37 111.0 3QH2 ASG TYR D 192 186 H AlphaHelix -70.56 -55.68 6.6 3QH2 ASG SER D 193 187 H AlphaHelix -61.25 -34.79 10.1 3QH2 ASG ARG D 194 188 H AlphaHelix -65.50 -45.93 120.1 3QH2 ASG LYS D 195 189 H AlphaHelix -58.83 -43.27 50.5 3QH2 ASG LEU D 196 190 H AlphaHelix -61.59 -46.12 20.7 3QH2 ASG LYS D 197 191 H AlphaHelix -61.21 -46.26 128.9 3QH2 ASG GLU D 198 192 H AlphaHelix -51.50 -47.76 100.7 3QH2 ASG MET D 199 193 H AlphaHelix -61.03 -36.34 20.3 3QH2 ASG ARG D 200 194 H AlphaHelix -64.10 -45.44 132.0 3QH2 ASG TYR D 201 195 H AlphaHelix -77.91 -16.91 94.0 3QH2 ASG GLU D 202 196 C Coil -112.70 360.00 150.3 3QH2 REM 3QH2 REM ------------------ Mainchain hydrogen bonds ------------------------ 3QH2 REM 3QH2 REM Definition of Stickle et al., J.Mol.Biol. 226:1143-1159, 1992 3QH2 REM A1 is the angle between the planes of donor complex and O..N-C 3QH2 REM A2 is the angle between the planes of acceptor complex and N..O=C 3QH2 REM 3QH2 HBT 606 3QH2 HBI 0 3QH2 HBC 154 3QH2.pdb A 195 3QH2 HBC 147 3QH2.pdb B 196 3QH2 HBC 152 3QH2.pdb C 196 3QH2 HBC 153 3QH2.pdb D 196 3QH2 REM 3QH2 REM |--Residue 1--| |--Residue 2--| N-O N..O=C O..N-C A1 A2 3QH2 DNR GLU A 2 3 -> ASP A 171 163 3.2 135.6 113.1 5.9 21.9 3QH2 ACC GLU A 2 3 -> ILE A 173 165 3.0 158.9 104.0 0.2 86.9 3QH2 ACC LEU A 3 4 -> ASP A 28 29 3.0 152.6 129.0 24.7 5.7 3QH2 ACC LEU A 3 4 -> PHE A 29 30 3.3 150.9 108.8 16.2 43.4 3QH2 DNR HIS A 4 5 -> ILE A 173 165 3.0 163.0 121.0 3.6 20.9 3QH2 ACC HIS A 4 5 -> VAL A 175 167 3.0 171.0 106.2 18.2 23.4 3QH2 DNR ALA A 5 6 -> PHE A 29 30 3.0 157.5 114.9 16.8 64.4 3QH2 ACC ALA A 5 6 -> HIS A 31 32 3.0 167.5 111.4 5.0 8.9 3QH2 DNR ILE A 6 7 -> VAL A 175 167 3.0 144.9 114.9 13.7 78.1 3QH2 DNR THR A 7 8 -> HIS A 31 32 3.1 169.8 120.3 1.4 9.8 3QH2 ACC PRO A 12 13 -> GLU A 15 16 3.3 120.5 118.4 54.0 73.5 3QH2 ACC PRO A 12 13 -> LEU A 16 17 3.1 159.8 119.4 13.3 11.4 3QH2 ACC VAL A 13 14 -> ALA A 17 18 3.0 157.7 123.1 14.5 81.1 3QH2 ACC GLU A 14 15 -> ARG A 18 19 3.3 145.4 120.0 15.0 63.7 3QH2 DNR GLU A 15 16 -> PRO A 12 13 3.3 120.5 118.4 54.0 73.5 3QH2 ACC GLU A 15 16 -> ILE A 19 20 3.1 158.4 116.4 14.2 46.7 3QH2 DNR LEU A 16 17 -> PRO A 12 13 3.1 159.8 119.4 13.3 11.4 3QH2 ACC LEU A 16 17 -> ILE A 20 21 3.0 157.3 120.6 12.0 59.9 3QH2 DNR ALA A 17 18 -> VAL A 13 14 3.0 157.7 123.1 14.5 81.1 3QH2 ACC ALA A 17 18 -> ILE A 21 22 3.1 160.5 118.4 11.3 63.5 3QH2 DNR ARG A 18 19 -> GLU A 14 15 3.3 145.4 120.0 15.0 63.7 3QH2 ACC ARG A 18 19 -> THR A 22 23 3.1 158.2 118.2 13.9 55.5 3QH2 DNR ILE A 19 20 -> GLU A 15 16 3.1 158.4 116.4 14.2 46.7 3QH2 ACC ILE A 19 20 -> THR A 22 23 3.2 111.7 115.1 57.8 86.1 3QH2 ACC ILE A 19 20 -> ILE A 23 24 3.2 162.2 114.3 26.3 57.2 3QH2 DNR ILE A 20 21 -> LEU A 16 17 3.0 157.3 120.6 12.0 59.9 3QH2 ACC ILE A 20 21 -> ILE A 23 24 3.5 107.9 121.3 42.8 82.2 3QH2 DNR ILE A 21 22 -> ALA A 17 18 3.1 160.5 118.4 11.3 63.5 3QH2 DNR THR A 22 23 -> ARG A 18 19 3.1 158.2 118.2 13.9 55.5 3QH2 DNR THR A 22 23 -> ILE A 19 20 3.2 111.7 115.1 57.8 86.1 3QH2 DNR ILE A 23 24 -> ILE A 19 20 3.2 162.2 114.3 26.3 57.2 3QH2 DNR ILE A 23 24 -> ILE A 20 21 3.5 107.9 121.3 42.8 82.2 3QH2 ACC ILE A 23 24 -> GLU A 26 27 3.0 131.0 130.4 6.4 71.6 3QH2 DNR GLU A 26 27 -> ILE A 23 24 3.0 131.0 130.4 6.4 71.6 3QH2 DNR ASP A 28 29 -> LEU A 3 4 3.0 152.6 129.0 24.7 5.7 3QH2 DNR PHE A 29 30 -> LEU A 3 4 3.3 150.9 108.8 16.2 43.4 3QH2 ACC PHE A 29 30 -> ALA A 5 6 3.0 157.5 114.9 16.8 64.4 3QH2 DNR ILE A 30 31 -> LYS A 58 59 3.0 160.7 109.1 3.6 85.2 3QH2 ACC ILE A 30 31 -> VAL A 60 61 3.0 146.5 119.0 13.6 72.0 3QH2 DNR HIS A 31 32 -> ALA A 5 6 3.0 167.5 111.4 5.0 8.9 3QH2 ACC HIS A 31 32 -> THR A 7 8 3.1 169.8 120.3 1.4 9.8 3QH2 DNR ILE A 32 33 -> VAL A 60 61 3.0 178.6 112.4 12.7 48.1 3QH2 ACC ILE A 32 33 -> ASN A 62 63 3.0 149.4 134.6 2.2 61.3 3QH2 ACC GLU A 34 35 -> LYS A 37 38 3.1 125.9 129.1 5.3 75.3 3QH2 DNR LYS A 37 38 -> GLU A 34 35 3.1 125.9 129.1 5.3 75.3 3QH2 ACC SER A 38 39 -> ASP A 41 42 3.1 114.1 122.1 54.1 87.7 3QH2 ACC SER A 38 39 -> ILE A 42 43 3.0 162.3 117.6 10.2 36.7 3QH2 ACC ALA A 39 40 -> LEU A 43 44 3.0 161.7 123.2 9.8 75.5 3QH2 ACC ALA A 40 41 -> LYS A 44 45 3.1 140.7 120.4 31.9 63.5 3QH2 DNR ASP A 41 42 -> SER A 38 39 3.1 114.1 122.1 54.1 87.7 3QH2 ACC ASP A 41 42 -> LYS A 44 45 3.2 104.1 127.5 56.1 86.3 3QH2 ACC ASP A 41 42 -> LEU A 45 46 3.0 153.8 114.2 16.8 54.9 3QH2 DNR ILE A 42 43 -> SER A 38 39 3.0 162.3 117.6 10.2 36.7 3QH2 ACC ILE A 42 43 -> LEU A 46 47 3.0 160.0 111.2 20.6 41.8 3QH2 DNR LEU A 43 44 -> ALA A 39 40 3.0 161.7 123.2 9.8 75.5 3QH2 ACC LEU A 43 44 -> LEU A 46 47 3.4 97.1 120.8 56.5 86.4 3QH2 ACC LEU A 43 44 -> ASP A 47 48 3.0 147.2 121.7 8.1 71.9 3QH2 DNR LYS A 44 45 -> ALA A 40 41 3.1 140.7 120.4 31.9 63.5 3QH2 DNR LYS A 44 45 -> ASP A 41 42 3.2 104.1 127.5 56.1 86.3 3QH2 ACC LYS A 44 45 -> LEU A 48 49 3.1 152.6 121.5 8.7 71.4 3QH2 DNR LEU A 45 46 -> ASP A 41 42 3.0 153.8 114.2 16.8 54.9 3QH2 ACC LEU A 45 46 -> ILE A 49 50 3.0 159.7 114.4 13.6 46.5 3QH2 DNR LEU A 46 47 -> ILE A 42 43 3.0 160.0 111.2 20.6 41.8 3QH2 DNR LEU A 46 47 -> LEU A 43 44 3.4 97.1 120.8 56.5 86.4 3QH2 ACC LEU A 46 47 -> ILE A 49 50 3.3 108.8 115.2 59.6 89.2 3QH2 ACC LEU A 46 47 -> PHE A 50 51 3.0 162.6 123.7 14.0 69.7 3QH2 DNR ASP A 47 48 -> LEU A 43 44 3.0 147.2 121.7 8.1 71.9 3QH2 ACC ASP A 47 48 -> GLU A 51 52 3.0 156.9 124.1 11.0 83.7 3QH2 DNR LEU A 48 49 -> LYS A 44 45 3.1 152.6 121.5 8.7 71.4 3QH2 ACC LEU A 48 49 -> GLY A 52 53 3.0 145.6 117.9 47.8 60.2 3QH2 DNR ILE A 49 50 -> LEU A 45 46 3.0 159.7 114.4 13.6 46.5 3QH2 DNR ILE A 49 50 -> LEU A 46 47 3.3 108.8 115.2 59.6 89.2 3QH2 ACC ILE A 49 50 -> GLY A 52 53 3.2 98.0 133.7 45.0 88.9 3QH2 ACC ILE A 49 50 -> GLY A 53 54 3.1 146.1 100.9 45.9 72.1 3QH2 ACC ILE A 49 50 -> ILE A 54 55 3.1 156.6 123.8 17.0 71.9 3QH2 DNR PHE A 50 51 -> LEU A 46 47 3.0 162.6 123.7 14.0 69.7 3QH2 ACC PHE A 50 51 -> GLY A 53 54 3.3 104.5 135.0 21.9 82.0 3QH2 DNR GLU A 51 52 -> ASP A 47 48 3.0 156.9 124.1 11.0 83.7 3QH2 DNR GLY A 52 53 -> LEU A 48 49 3.0 145.6 117.9 47.8 60.2 3QH2 DNR GLY A 52 53 -> ILE A 49 50 3.2 98.0 133.7 45.0 88.9 3QH2 DNR GLY A 53 54 -> ILE A 49 50 3.1 146.1 100.9 45.9 72.1 3QH2 DNR GLY A 53 54 -> PHE A 50 51 3.3 104.5 135.0 21.9 82.0 3QH2 DNR ILE A 54 55 -> ILE A 49 50 3.1 156.6 123.8 17.0 71.9 3QH2 ACC ASP A 55 56 -> LYS A 58 59 3.2 130.5 130.1 9.0 61.3 3QH2 ACC LYS A 56 57 -> LEU A 59 60 3.1 114.5 130.6 0.3 78.2 3QH2 DNR LYS A 58 59 -> ASP A 55 56 3.2 130.5 130.1 9.0 61.3 3QH2 ACC LYS A 58 59 -> ILE A 30 31 3.0 160.7 109.1 3.6 85.2 3QH2 DNR LEU A 59 60 -> LYS A 56 57 3.1 114.5 130.6 0.3 78.2 3QH2 DNR VAL A 60 61 -> ILE A 30 31 3.0 146.5 119.0 13.6 72.0 3QH2 ACC VAL A 60 61 -> ILE A 32 33 3.0 178.6 112.4 12.7 48.1 3QH2 DNR MET A 61 62 -> ARG A 75 76 3.0 151.6 112.3 8.9 48.7 3QH2 ACC MET A 61 62 -> GLN A 77 78 3.0 149.6 110.1 7.8 65.3 3QH2 DNR ASN A 62 63 -> ILE A 32 33 3.0 149.4 134.6 2.2 61.3 3QH2 ACC ASN A 62 63 -> ARG A 64 65 3.0 94.0 96.4 9.9 37.9 3QH2 DNR GLY A 63 64 -> GLN A 77 78 3.0 169.8 116.0 11.1 43.8 3QH2 DNR ARG A 64 65 -> ASN A 62 63 3.0 94.0 96.4 9.9 37.9 3QH2 ACC ARG A 64 65 -> ILE A 67 68 3.3 111.3 118.4 54.8 83.7 3QH2 ACC ARG A 64 65 -> ALA A 68 69 3.2 157.2 117.8 5.8 44.2 3QH2 ACC VAL A 65 66 -> LEU A 69 70 3.0 158.5 122.0 16.1 67.9 3QH2 ACC ASP A 66 67 -> LEU A 69 70 3.3 105.9 117.8 59.6 84.6 3QH2 ACC ASP A 66 67 -> PHE A 70 71 3.1 157.6 119.5 13.7 69.2 3QH2 DNR ILE A 67 68 -> ARG A 64 65 3.3 111.3 118.4 54.8 83.7 3QH2 ACC ILE A 67 68 -> PHE A 70 71 3.3 111.9 111.2 55.3 88.6 3QH2 ACC ILE A 67 68 -> SER A 71 72 3.0 161.4 116.3 46.0 74.6 3QH2 DNR ALA A 68 69 -> ARG A 64 65 3.2 157.2 117.8 5.8 44.2 3QH2 ACC ALA A 68 69 -> SER A 71 72 3.3 107.5 133.2 28.0 77.5 3QH2 ACC ALA A 68 69 -> ILE A 73 74 3.0 146.9 124.3 24.4 32.6 3QH2 DNR LEU A 69 70 -> VAL A 65 66 3.0 158.5 122.0 16.1 67.9 3QH2 DNR LEU A 69 70 -> ASP A 66 67 3.3 105.9 117.8 59.6 84.6 3QH2 DNR PHE A 70 71 -> ASP A 66 67 3.1 157.6 119.5 13.7 69.2 3QH2 DNR PHE A 70 71 -> ILE A 67 68 3.3 111.9 111.2 55.3 88.6 3QH2 DNR SER A 71 72 -> ILE A 67 68 3.0 161.4 116.3 46.0 74.6 3QH2 DNR SER A 71 72 -> ALA A 68 69 3.3 107.5 133.2 28.0 77.5 3QH2 DNR ILE A 73 74 -> ALA A 68 69 3.0 146.9 124.3 24.4 32.6 3QH2 ACC HIS A 74 75 -> HIS A 96 97 3.0 165.1 114.4 9.8 46.5 3QH2 ACC ARG A 75 76 -> MET A 61 62 3.0 151.6 112.3 8.9 48.7 3QH2 DNR VAL A 76 77 -> HIS A 96 97 3.1 177.8 112.5 6.4 71.7 3QH2 ACC VAL A 76 77 -> GLY A 98 99 3.0 164.5 121.5 1.4 26.4 3QH2 DNR GLN A 77 78 -> MET A 61 62 3.0 149.6 110.1 7.8 65.3 3QH2 ACC GLN A 77 78 -> GLY A 63 64 3.0 169.8 116.0 11.1 43.8 3QH2 DNR LEU A 78 79 -> GLY A 98 99 3.0 146.7 119.1 15.7 77.3 3QH2 ACC LEU A 78 79 -> SER A 100 101 3.1 147.9 115.5 1.7 83.8 3QH2 ACC PRO A 79 80 -> SER A 82 83 3.2 135.4 131.5 22.8 68.2 3QH2 DNR SER A 82 83 -> PRO A 79 80 3.2 135.4 131.5 22.8 68.2 3QH2 ACC SER A 84 85 -> GLN A 87 88 3.3 115.4 116.5 58.2 84.2 3QH2 ACC SER A 84 85 -> ILE A 88 89 3.3 156.8 115.8 8.3 34.6 3QH2 ACC PRO A 85 86 -> ARG A 89 90 3.0 159.5 121.5 19.3 58.0 3QH2 ACC LYS A 86 87 -> ARG A 89 90 3.3 103.6 116.8 59.2 85.2 3QH2 ACC LYS A 86 87 -> ALA A 90 91 3.0 155.5 118.4 22.2 69.1 3QH2 DNR GLN A 87 88 -> SER A 84 85 3.3 115.4 116.5 58.2 84.2 3QH2 ACC GLN A 87 88 -> ALA A 90 91 3.3 108.3 120.7 51.7 81.4 3QH2 ACC GLN A 87 88 -> ARG A 91 92 3.5 154.0 112.3 19.6 54.2 3QH2 DNR ILE A 88 89 -> SER A 84 85 3.3 156.8 115.8 8.3 34.6 3QH2 ACC ILE A 88 89 -> ARG A 91 92 3.2 117.0 121.8 46.3 76.8 3QH2 ACC ILE A 88 89 -> PHE A 92 93 3.0 170.2 126.7 14.2 37.8 3QH2 DNR ARG A 89 90 -> PRO A 85 86 3.0 159.5 121.5 19.3 58.0 3QH2 DNR ARG A 89 90 -> LYS A 86 87 3.3 103.6 116.8 59.2 85.2 3QH2 DNR ALA A 90 91 -> LYS A 86 87 3.0 155.5 118.4 22.2 69.1 3QH2 DNR ALA A 90 91 -> GLN A 87 88 3.3 108.3 120.7 51.7 81.4 3QH2 DNR ARG A 91 92 -> GLN A 87 88 3.5 154.0 112.3 19.6 54.2 3QH2 DNR ARG A 91 92 -> ILE A 88 89 3.2 117.0 121.8 46.3 76.8 3QH2 DNR PHE A 92 93 -> ILE A 88 89 3.0 170.2 126.7 14.2 37.8 3QH2 ACC PHE A 92 93 -> LEU A 95 96 3.1 135.3 124.3 10.6 60.5 3QH2 DNR LEU A 95 96 -> PHE A 92 93 3.1 135.3 124.3 10.6 60.5 3QH2 DNR HIS A 96 97 -> HIS A 74 75 3.0 165.1 114.4 9.8 46.5 3QH2 ACC HIS A 96 97 -> VAL A 76 77 3.1 177.8 112.5 6.4 71.7 3QH2 ACC ILE A 97 98 -> ASP A 116 117 3.0 162.6 128.4 26.2 8.9 3QH2 DNR GLY A 98 99 -> VAL A 76 77 3.0 164.5 121.5 1.4 26.4 3QH2 ACC GLY A 98 99 -> LEU A 78 79 3.0 146.7 119.1 15.7 77.3 3QH2 DNR ARG A 99 100 -> TYR A 117 118 3.1 153.9 106.6 3.7 29.3 3QH2 ACC ARG A 99 100 -> LEU A 119 120 3.0 146.9 106.7 9.6 60.4 3QH2 DNR SER A 100 101 -> LEU A 78 79 3.1 147.9 115.5 1.7 83.8 3QH2 DNR VAL A 101 102 -> LEU A 119 120 3.0 165.8 116.2 2.9 88.6 3QH2 ACC VAL A 101 102 -> GLY A 121 122 3.4 165.5 104.2 3.6 18.2 3QH2 ACC SER A 103 104 -> ALA A 107 108 3.1 152.3 120.6 14.9 55.3 3QH2 ACC LEU A 104 105 -> VAL A 108 109 3.0 154.3 118.3 14.1 55.9 3QH2 ACC GLU A 105 106 -> GLN A 109 110 3.0 152.6 123.4 12.5 72.0 3QH2 ACC GLU A 106 107 -> ALA A 110 111 3.0 153.0 121.8 19.2 71.3 3QH2 DNR ALA A 107 108 -> SER A 103 104 3.1 152.3 120.6 14.9 55.3 3QH2 ACC ALA A 107 108 -> ALA A 110 111 3.2 106.5 117.0 59.3 87.0 3QH2 ACC ALA A 107 108 -> GLU A 111 112 3.2 155.6 113.5 17.7 64.2 3QH2 DNR VAL A 108 109 -> LEU A 104 105 3.0 154.3 118.3 14.1 55.9 3QH2 ACC VAL A 108 109 -> GLU A 111 112 3.3 110.7 123.8 52.5 80.6 3QH2 ACC VAL A 108 109 -> LYS A 112 113 3.2 153.4 115.7 16.4 39.0 3QH2 DNR GLN A 109 110 -> GLU A 105 106 3.0 152.6 123.4 12.5 72.0 3QH2 ACC GLN A 109 110 -> GLU A 113 114 3.0 165.5 111.9 19.7 40.1 3QH2 DNR ALA A 110 111 -> GLU A 106 107 3.0 153.0 121.8 19.2 71.3 3QH2 DNR ALA A 110 111 -> ALA A 107 108 3.2 106.5 117.0 59.3 87.0 3QH2 ACC ALA A 110 111 -> GLU A 113 114 3.3 102.6 122.6 53.4 83.5 3QH2 ACC ALA A 110 111 -> ALA A 115 116 3.1 155.2 128.5 11.1 69.2 3QH2 DNR GLU A 111 112 -> ALA A 107 108 3.2 155.6 113.5 17.7 64.2 3QH2 DNR GLU A 111 112 -> VAL A 108 109 3.3 110.7 123.8 52.5 80.6 3QH2 ACC GLU A 111 112 -> ASP A 114 115 3.1 108.6 139.9 3.0 81.4 3QH2 DNR LYS A 112 113 -> VAL A 108 109 3.2 153.4 115.7 16.4 39.0 3QH2 DNR GLU A 113 114 -> GLN A 109 110 3.0 165.5 111.9 19.7 40.1 3QH2 DNR GLU A 113 114 -> ALA A 110 111 3.3 102.6 122.6 53.4 83.5 3QH2 DNR ASP A 114 115 -> GLU A 111 112 3.1 108.6 139.9 3.0 81.4 3QH2 DNR ALA A 115 116 -> ALA A 110 111 3.1 155.2 128.5 11.1 69.2 3QH2 DNR ASP A 116 117 -> ILE A 97 98 3.0 162.6 128.4 26.2 8.9 3QH2 ACC TYR A 117 118 -> ARG A 99 100 3.1 153.9 106.6 3.7 29.3 3QH2 DNR VAL A 118 119 -> PRO A 150 142 3.0 167.0 111.6 2.0 44.5 3QH2 ACC VAL A 118 119 -> ILE A 152 144 3.0 161.5 118.9 2.0 40.7 3QH2 DNR LEU A 119 120 -> ARG A 99 100 3.0 146.9 106.7 9.6 60.4 3QH2 ACC LEU A 119 120 -> VAL A 101 102 3.0 165.8 116.2 2.9 88.6 3QH2 DNR PHE A 120 121 -> ILE A 152 144 3.0 157.3 108.1 16.1 89.5 3QH2 ACC PHE A 120 121 -> ILE A 154 146 3.0 152.9 115.2 18.0 70.9 3QH2 DNR GLY A 121 122 -> VAL A 101 102 3.4 165.5 104.2 3.6 18.2 3QH2 DNR VAL A 123 124 -> ILE A 154 146 3.0 144.6 106.0 16.3 42.8 3QH2 DNR PHE A 124 125 -> GLY A 155 147 3.2 137.1 130.8 26.6 67.9 3QH2 ACC GLY A 134 126 -> SER A 138 130 3.3 150.4 127.1 10.7 66.5 3QH2 ACC ARG A 135 127 -> LEU A 139 131 3.2 148.4 122.6 17.4 64.8 3QH2 ACC GLY A 136 128 -> LEU A 139 131 3.2 108.8 121.6 59.9 79.2 3QH2 ACC GLY A 136 128 -> LEU A 140 132 3.0 155.2 116.2 18.7 38.8 3QH2 ACC VAL A 137 129 -> SER A 141 133 3.0 156.3 117.1 17.9 63.2 3QH2 DNR SER A 138 130 -> GLY A 134 126 3.3 150.4 127.1 10.7 66.5 3QH2 ACC SER A 138 130 -> ASP A 142 134 3.0 153.0 115.1 22.5 49.3 3QH2 DNR LEU A 139 131 -> ARG A 135 127 3.2 148.4 122.6 17.4 64.8 3QH2 DNR LEU A 139 131 -> GLY A 136 128 3.2 108.8 121.6 59.9 79.2 3QH2 ACC LEU A 139 131 -> ASP A 142 134 3.2 103.3 119.9 58.1 88.4 3QH2 ACC LEU A 139 131 -> ILE A 143 135 3.0 156.1 119.1 15.3 70.8 3QH2 DNR LEU A 140 132 -> GLY A 136 128 3.0 155.2 116.2 18.7 38.8 3QH2 ACC LEU A 140 132 -> LYS A 144 136 3.1 156.5 118.2 15.2 60.0 3QH2 DNR SER A 141 133 -> VAL A 137 129 3.0 156.3 117.1 17.9 63.2 3QH2 ACC SER A 141 133 -> LYS A 144 136 3.4 105.3 118.4 59.2 84.4 3QH2 DNR ASP A 142 134 -> SER A 138 130 3.0 153.0 115.1 22.5 49.3 3QH2 DNR ASP A 142 134 -> LEU A 139 131 3.2 103.3 119.9 58.1 88.4 3QH2 ACC ASP A 142 134 -> GLN A 145 137 3.3 111.0 132.3 31.2 78.8 3QH2 ACC ASP A 142 134 -> ARG A 146 138 3.2 151.3 117.6 33.4 37.6 3QH2 DNR ILE A 143 135 -> LEU A 139 131 3.0 156.1 119.1 15.3 70.8 3QH2 ACC ILE A 143 135 -> ARG A 146 138 3.0 113.8 121.9 48.7 88.8 3QH2 ACC ILE A 143 135 -> ILE A 147 139 3.0 171.8 111.2 15.0 65.7 3QH2 DNR LYS A 144 136 -> LEU A 140 132 3.1 156.5 118.2 15.2 60.0 3QH2 DNR LYS A 144 136 -> SER A 141 133 3.4 105.3 118.4 59.2 84.4 3QH2 DNR GLN A 145 137 -> ASP A 142 134 3.3 111.0 132.3 31.2 78.8 3QH2 DNR ARG A 146 138 -> ASP A 142 134 3.2 151.3 117.6 33.4 37.6 3QH2 DNR ARG A 146 138 -> ILE A 143 135 3.0 113.8 121.9 48.7 88.8 3QH2 DNR ILE A 147 139 -> ILE A 143 135 3.0 171.8 111.2 15.0 65.7 3QH2 ACC PRO A 150 142 -> VAL A 118 119 3.0 167.0 111.6 2.0 44.5 3QH2 ACC VAL A 151 143 -> ASP A 171 163 3.0 157.0 123.1 22.8 53.6 3QH2 DNR ILE A 152 144 -> VAL A 118 119 3.0 161.5 118.9 2.0 40.7 3QH2 ACC ILE A 152 144 -> PHE A 120 121 3.0 157.3 108.1 16.1 89.5 3QH2 DNR ALA A 153 145 -> GLY A 172 164 3.0 133.2 115.2 9.4 64.1 3QH2 ACC ALA A 153 145 -> ALA A 174 166 3.0 159.5 108.6 20.5 75.5 3QH2 DNR ILE A 154 146 -> PHE A 120 121 3.0 152.9 115.2 18.0 70.9 3QH2 ACC ILE A 154 146 -> VAL A 123 124 3.0 144.6 106.0 16.3 42.8 3QH2 ACC GLY A 155 147 -> PHE A 124 125 3.2 137.1 130.8 26.6 67.9 3QH2 ACC THR A 158 150 -> ARG A 161 153 3.0 127.0 131.0 17.7 77.5 3QH2 ACC PRO A 159 151 -> LEU A 162 154 3.3 112.0 131.4 4.8 78.6 3QH2 DNR ARG A 161 153 -> THR A 158 150 3.0 127.0 131.0 17.7 77.5 3QH2 ACC ARG A 161 153 -> VAL A 165 157 3.5 154.1 120.1 17.9 35.4 3QH2 DNR LEU A 162 154 -> PRO A 159 151 3.3 112.0 131.4 4.8 78.6 3QH2 ACC LEU A 162 154 -> VAL A 165 157 3.4 101.8 120.1 58.3 79.8 3QH2 ACC LEU A 162 154 -> LYS A 166 158 3.0 150.5 124.2 18.2 63.5 3QH2 ACC ARG A 163 155 -> GLN A 167 159 3.0 160.2 124.7 7.0 79.5 3QH2 ACC ASP A 164 156 -> ALA A 168 160 3.1 148.7 122.7 26.0 68.6 3QH2 DNR VAL A 165 157 -> ARG A 161 153 3.5 154.1 120.1 17.9 35.4 3QH2 DNR VAL A 165 157 -> LEU A 162 154 3.4 101.8 120.1 58.3 79.8 3QH2 ACC VAL A 165 157 -> ALA A 168 160 3.3 105.3 126.3 55.2 80.6 3QH2 ACC VAL A 165 157 -> GLY A 169 161 3.4 148.1 96.3 46.9 48.8 3QH2 ACC VAL A 165 157 -> ALA A 170 162 3.4 148.5 128.4 19.2 57.9 3QH2 DNR LYS A 166 158 -> LEU A 162 154 3.0 150.5 124.2 18.2 63.5 3QH2 ACC LYS A 166 158 -> GLY A 169 161 3.0 118.8 131.9 13.0 82.8 3QH2 DNR GLN A 167 159 -> ARG A 163 155 3.0 160.2 124.7 7.0 79.5 3QH2 DNR ALA A 168 160 -> ASP A 164 156 3.1 148.7 122.7 26.0 68.6 3QH2 DNR ALA A 168 160 -> VAL A 165 157 3.3 105.3 126.3 55.2 80.6 3QH2 DNR GLY A 169 161 -> VAL A 165 157 3.4 148.1 96.3 46.9 48.8 3QH2 DNR GLY A 169 161 -> LYS A 166 158 3.0 118.8 131.9 13.0 82.8 3QH2 DNR ALA A 170 162 -> VAL A 165 157 3.4 148.5 128.4 19.2 57.9 3QH2 DNR ASP A 171 163 -> VAL A 151 143 3.0 157.0 123.1 22.8 53.6 3QH2 ACC ASP A 171 163 -> GLU A 2 3 3.2 135.6 113.1 5.9 21.9 3QH2 ACC GLY A 172 164 -> ALA A 153 145 3.0 133.2 115.2 9.4 64.1 3QH2 DNR ILE A 173 165 -> GLU A 2 3 3.0 158.9 104.0 0.2 86.9 3QH2 ACC ILE A 173 165 -> HIS A 4 5 3.0 163.0 121.0 3.6 20.9 3QH2 DNR ALA A 174 166 -> ALA A 153 145 3.0 159.5 108.6 20.5 75.5 3QH2 DNR VAL A 175 167 -> HIS A 4 5 3.0 171.0 106.2 18.2 23.4 3QH2 ACC VAL A 175 167 -> ILE A 6 7 3.0 144.9 114.9 13.7 78.1 3QH2 ACC MET A 176 168 -> ILE A 179 171 3.1 125.0 132.4 19.9 61.6 3QH2 ACC MET A 176 168 -> PHE A 180 172 3.0 160.3 120.7 1.4 27.1 3QH2 ACC SER A 177 169 -> SER A 181 173 3.1 126.3 142.6 5.4 39.7 3QH2 DNR ILE A 179 171 -> MET A 176 168 3.1 125.0 132.4 19.9 61.6 3QH2 ACC ILE A 179 171 -> SER A 182 174 3.2 115.3 134.3 14.0 70.8 3QH2 DNR PHE A 180 172 -> MET A 176 168 3.0 160.3 120.7 1.4 27.1 3QH2 DNR SER A 181 173 -> SER A 177 169 3.1 126.3 142.6 5.4 39.7 3QH2 DNR SER A 182 174 -> ILE A 179 171 3.2 115.3 134.3 14.0 70.8 3QH2 ACC GLU A 184 176 -> GLU A 187 179 3.0 124.5 117.4 57.6 81.2 3QH2 ACC GLU A 184 176 -> ALA A 188 180 3.0 166.4 116.3 6.8 8.8 3QH2 ACC PRO A 185 177 -> ALA A 189 181 3.0 152.2 120.4 16.7 69.4 3QH2 ACC LEU A 186 178 -> ARG A 190 182 3.0 155.4 120.1 10.6 64.4 3QH2 DNR GLU A 187 179 -> GLU A 184 176 3.0 124.5 117.4 57.6 81.2 3QH2 ACC GLU A 187 179 -> ARG A 191 183 3.2 152.0 114.3 21.5 68.8 3QH2 DNR ALA A 188 180 -> GLU A 184 176 3.0 166.4 116.3 6.8 8.8 3QH2 ACC ALA A 188 180 -> ARG A 191 183 3.1 113.7 123.3 51.1 83.0 3QH2 ACC ALA A 188 180 -> TYR A 192 184 3.5 154.1 108.3 15.0 37.5 3QH2 DNR ALA A 189 181 -> PRO A 185 177 3.0 152.2 120.4 16.7 69.4 3QH2 ACC ALA A 189 181 -> TYR A 192 184 3.1 116.0 124.3 54.6 82.6 3QH2 ACC ALA A 189 181 -> SER A 193 185 3.0 159.4 114.2 14.0 19.3 3QH2 DNR ARG A 190 182 -> LEU A 186 178 3.0 155.4 120.1 10.6 64.4 3QH2 ACC ARG A 190 182 -> ARG A 194 186 3.0 155.8 127.7 9.0 80.1 3QH2 DNR ARG A 191 183 -> GLU A 187 179 3.2 152.0 114.3 21.5 68.8 3QH2 DNR ARG A 191 183 -> ALA A 188 180 3.1 113.7 123.3 51.1 83.0 3QH2 ACC ARG A 191 183 -> LYS A 195 187 3.3 142.8 129.5 13.5 81.0 3QH2 DNR TYR A 192 184 -> ALA A 188 180 3.5 154.1 108.3 15.0 37.5 3QH2 DNR TYR A 192 184 -> ALA A 189 181 3.1 116.0 124.3 54.6 82.6 3QH2 ACC TYR A 192 184 -> LEU A 196 188 3.1 153.6 119.9 17.3 50.4 3QH2 DNR SER A 193 185 -> ALA A 189 181 3.0 159.4 114.2 14.0 19.3 3QH2 ACC SER A 193 185 -> LYS A 197 189 3.0 154.8 120.7 14.4 70.8 3QH2 DNR ARG A 194 186 -> ARG A 190 182 3.0 155.8 127.7 9.0 80.1 3QH2 ACC ARG A 194 186 -> GLU A 198 190 3.0 158.6 119.2 6.7 64.0 3QH2 DNR LYS A 195 187 -> ARG A 191 183 3.3 142.8 129.5 13.5 81.0 3QH2 ACC LYS A 195 187 -> MET A 199 191 3.1 152.2 120.3 20.8 68.2 3QH2 DNR LEU A 196 188 -> TYR A 192 184 3.1 153.6 119.9 17.3 50.4 3QH2 ACC LEU A 196 188 -> MET A 199 191 3.2 107.1 122.8 56.6 81.2 3QH2 ACC LEU A 196 188 -> ARG A 200 192 3.1 154.9 116.1 19.8 49.9 3QH2 DNR LYS A 197 189 -> SER A 193 185 3.0 154.8 120.7 14.4 70.8 3QH2 ACC LYS A 197 189 -> ARG A 200 192 3.1 113.2 118.5 56.0 88.1 3QH2 ACC LYS A 197 189 -> TYR A 201 193 3.1 162.1 115.3 22.6 48.9 3QH2 DNR GLU A 198 190 -> ARG A 194 186 3.0 158.6 119.2 6.7 64.0 3QH2 ACC GLU A 198 190 -> TYR A 201 193 3.2 107.1 122.4 50.6 79.8 3QH2 ACC GLU A 198 190 -> GLU A 202 194 3.0 158.1 118.1 36.6 59.6 3QH2 DNR MET A 199 191 -> LYS A 195 187 3.1 152.2 120.3 20.8 68.2 3QH2 DNR MET A 199 191 -> LEU A 196 188 3.2 107.1 122.8 56.6 81.2 3QH2 ACC MET A 199 191 -> GLU A 202 194 3.4 101.6 122.4 41.3 87.8 3QH2 DNR ARG A 200 192 -> LEU A 196 188 3.1 154.9 116.1 19.8 49.9 3QH2 DNR ARG A 200 192 -> LYS A 197 189 3.1 113.2 118.5 56.0 88.1 3QH2 DNR TYR A 201 193 -> LYS A 197 189 3.1 162.1 115.3 22.6 48.9 3QH2 DNR TYR A 201 193 -> GLU A 198 190 3.2 107.1 122.4 50.6 79.8 3QH2 DNR GLU A 202 194 -> GLU A 198 190 3.0 158.1 118.1 36.6 59.6 3QH2 DNR GLU A 202 194 -> MET A 199 191 3.4 101.6 122.4 41.3 87.8 3QH2 DNR GLU B 2 2 -> ASP B 171 166 3.3 136.8 111.1 11.0 18.2 3QH2 ACC GLU B 2 2 -> ILE B 173 168 3.0 157.0 103.8 4.4 82.5 3QH2 ACC LEU B 3 3 -> ASP B 28 28 3.0 156.6 127.9 24.2 5.9 3QH2 ACC LEU B 3 3 -> PHE B 29 29 3.4 145.4 108.0 12.5 41.6 3QH2 DNR HIS B 4 4 -> ILE B 173 168 3.0 164.5 121.0 1.7 0.4 3QH2 ACC HIS B 4 4 -> VAL B 175 170 3.0 173.3 109.1 14.2 50.1 3QH2 DNR ALA B 5 5 -> PHE B 29 29 3.0 155.9 116.6 8.3 64.9 3QH2 ACC ALA B 5 5 -> HIS B 31 31 3.0 168.9 112.2 5.6 8.8 3QH2 DNR ILE B 6 6 -> VAL B 175 170 3.0 150.0 117.6 22.1 77.6 3QH2 DNR THR B 7 7 -> HIS B 31 31 3.1 170.2 121.1 3.3 5.7 3QH2 ACC PRO B 12 12 -> GLU B 15 15 3.2 125.4 118.0 52.8 72.1 3QH2 ACC PRO B 12 12 -> LEU B 16 16 3.1 160.5 118.9 13.3 3.7 3QH2 ACC VAL B 13 13 -> ALA B 17 17 3.0 153.6 126.0 16.2 82.6 3QH2 ACC GLU B 14 14 -> ARG B 18 18 3.2 149.2 117.0 17.1 62.1 3QH2 DNR GLU B 15 15 -> PRO B 12 12 3.2 125.4 118.0 52.8 72.1 3QH2 ACC GLU B 15 15 -> ARG B 18 18 3.3 106.5 119.4 58.0 82.7 3QH2 ACC GLU B 15 15 -> ILE B 19 19 3.2 153.3 117.4 14.3 53.1 3QH2 DNR LEU B 16 16 -> PRO B 12 12 3.1 160.5 118.9 13.3 3.7 3QH2 ACC LEU B 16 16 -> ILE B 19 19 3.3 109.1 118.0 59.7 84.0 3QH2 ACC LEU B 16 16 -> ILE B 20 20 3.0 158.9 120.6 13.1 56.1 3QH2 DNR ALA B 17 17 -> VAL B 13 13 3.0 153.6 126.0 16.2 82.6 3QH2 ACC ALA B 17 17 -> ILE B 21 21 3.1 153.4 118.0 18.8 62.2 3QH2 DNR ARG B 18 18 -> GLU B 14 14 3.2 149.2 117.0 17.1 62.1 3QH2 DNR ARG B 18 18 -> GLU B 15 15 3.3 106.5 119.4 58.0 82.7 3QH2 ACC ARG B 18 18 -> ILE B 21 21 3.3 108.8 118.9 55.9 82.7 3QH2 ACC ARG B 18 18 -> THR B 22 22 3.0 157.4 120.8 12.3 52.9 3QH2 DNR ILE B 19 19 -> GLU B 15 15 3.2 153.3 117.4 14.3 53.1 3QH2 DNR ILE B 19 19 -> LEU B 16 16 3.3 109.1 118.0 59.7 84.0 3QH2 ACC ILE B 19 19 -> ILE B 23 23 3.1 163.7 112.6 28.0 63.6 3QH2 DNR ILE B 20 20 -> LEU B 16 16 3.0 158.9 120.6 13.1 56.1 3QH2 DNR ILE B 21 21 -> ALA B 17 17 3.1 153.4 118.0 18.8 62.2 3QH2 DNR ILE B 21 21 -> ARG B 18 18 3.3 108.8 118.9 55.9 82.7 3QH2 DNR THR B 22 22 -> ARG B 18 18 3.0 157.4 120.8 12.3 52.9 3QH2 DNR ILE B 23 23 -> ILE B 19 19 3.1 163.7 112.6 28.0 63.6 3QH2 ACC ILE B 23 23 -> GLU B 26 26 3.0 126.8 133.7 7.0 67.5 3QH2 DNR GLU B 26 26 -> ILE B 23 23 3.0 126.8 133.7 7.0 67.5 3QH2 DNR ASP B 28 28 -> LEU B 3 3 3.0 156.6 127.9 24.2 5.9 3QH2 DNR PHE B 29 29 -> LEU B 3 3 3.4 145.4 108.0 12.5 41.6 3QH2 ACC PHE B 29 29 -> ALA B 5 5 3.0 155.9 116.6 8.3 64.9 3QH2 DNR ILE B 30 30 -> LYS B 58 58 3.0 153.5 110.4 0.1 87.6 3QH2 ACC ILE B 30 30 -> VAL B 60 60 3.0 148.5 115.3 15.4 69.0 3QH2 DNR HIS B 31 31 -> ALA B 5 5 3.0 168.9 112.2 5.6 8.8 3QH2 ACC HIS B 31 31 -> THR B 7 7 3.1 170.2 121.1 3.3 5.7 3QH2 DNR ILE B 32 32 -> VAL B 60 60 3.0 179.4 111.6 10.4 86.3 3QH2 ACC ILE B 32 32 -> ASN B 62 62 3.0 147.2 133.4 7.3 62.0 3QH2 ACC GLU B 34 34 -> LYS B 37 37 3.0 129.3 128.6 6.1 73.7 3QH2 DNR LYS B 37 37 -> GLU B 34 34 3.0 129.3 128.6 6.1 73.7 3QH2 ACC SER B 38 38 -> ASP B 41 41 3.1 116.3 122.9 49.8 84.9 3QH2 ACC SER B 38 38 -> ILE B 42 42 3.0 160.7 115.6 11.2 24.7 3QH2 ACC ALA B 39 39 -> LEU B 43 43 3.0 156.8 122.8 16.5 84.4 3QH2 ACC ALA B 40 40 -> LYS B 44 44 3.2 142.3 120.1 26.9 64.3 3QH2 DNR ASP B 41 41 -> SER B 38 38 3.1 116.3 122.9 49.8 84.9 3QH2 ACC ASP B 41 41 -> LYS B 44 44 3.3 102.7 125.3 57.4 86.3 3QH2 ACC ASP B 41 41 -> LEU B 45 45 3.0 153.0 117.7 7.0 59.5 3QH2 DNR ILE B 42 42 -> SER B 38 38 3.0 160.7 115.6 11.2 24.7 3QH2 ACC ILE B 42 42 -> LEU B 46 46 3.0 155.6 117.8 10.6 61.0 3QH2 DNR LEU B 43 43 -> ALA B 39 39 3.0 156.8 122.8 16.5 84.4 3QH2 ACC LEU B 43 43 -> ASP B 47 47 3.0 149.6 123.9 16.5 72.3 3QH2 DNR LYS B 44 44 -> ALA B 40 40 3.2 142.3 120.1 26.9 64.3 3QH2 DNR LYS B 44 44 -> ASP B 41 41 3.3 102.7 125.3 57.4 86.3 3QH2 ACC LYS B 44 44 -> LEU B 48 48 3.0 158.3 115.7 17.5 60.6 3QH2 DNR LEU B 45 45 -> ASP B 41 41 3.0 153.0 117.7 7.0 59.5 3QH2 ACC LEU B 45 45 -> LEU B 48 48 3.1 111.1 121.4 57.1 83.1 3QH2 ACC LEU B 45 45 -> ILE B 49 49 3.1 161.3 113.4 12.9 41.3 3QH2 DNR LEU B 46 46 -> ILE B 42 42 3.0 155.6 117.8 10.6 61.0 3QH2 ACC LEU B 46 46 -> ILE B 49 49 3.3 109.2 113.2 58.2 89.5 3QH2 ACC LEU B 46 46 -> PHE B 50 50 3.0 162.2 125.6 16.8 79.6 3QH2 DNR ASP B 47 47 -> LEU B 43 43 3.0 149.6 123.9 16.5 72.3 3QH2 ACC ASP B 47 47 -> PHE B 50 50 3.5 102.9 119.0 58.8 86.0 3QH2 ACC ASP B 47 47 -> GLU B 51 51 3.1 153.8 123.9 10.9 81.8 3QH2 DNR LEU B 48 48 -> LYS B 44 44 3.0 158.3 115.7 17.5 60.6 3QH2 DNR LEU B 48 48 -> LEU B 45 45 3.1 111.1 121.4 57.1 83.1 3QH2 ACC LEU B 48 48 -> GLY B 52 52 3.0 146.1 121.0 40.3 62.1 3QH2 DNR ILE B 49 49 -> LEU B 45 45 3.1 161.3 113.4 12.9 41.3 3QH2 DNR ILE B 49 49 -> LEU B 46 46 3.3 109.2 113.2 58.2 89.5 3QH2 ACC ILE B 49 49 -> GLY B 52 52 3.3 96.5 130.6 51.5 87.9 3QH2 ACC ILE B 49 49 -> GLY B 53 53 3.2 143.9 97.6 50.7 70.8 3QH2 ACC ILE B 49 49 -> ILE B 54 54 3.1 158.5 126.7 4.4 70.9 3QH2 DNR PHE B 50 50 -> LEU B 46 46 3.0 162.2 125.6 16.8 79.6 3QH2 DNR PHE B 50 50 -> ASP B 47 47 3.5 102.9 119.0 58.8 86.0 3QH2 ACC PHE B 50 50 -> GLY B 53 53 3.1 111.7 135.9 11.9 81.6 3QH2 DNR GLU B 51 51 -> ASP B 47 47 3.1 153.8 123.9 10.9 81.8 3QH2 DNR GLY B 52 52 -> LEU B 48 48 3.0 146.1 121.0 40.3 62.1 3QH2 DNR GLY B 52 52 -> ILE B 49 49 3.3 96.5 130.6 51.5 87.9 3QH2 DNR GLY B 53 53 -> ILE B 49 49 3.2 143.9 97.6 50.7 70.8 3QH2 DNR GLY B 53 53 -> PHE B 50 50 3.1 111.7 135.9 11.9 81.6 3QH2 DNR ILE B 54 54 -> ILE B 49 49 3.1 158.5 126.7 4.4 70.9 3QH2 ACC ASP B 55 55 -> LYS B 58 58 3.0 131.6 128.9 1.3 59.8 3QH2 ACC LYS B 56 56 -> LEU B 59 59 3.2 116.2 129.6 5.8 81.3 3QH2 DNR LYS B 58 58 -> ASP B 55 55 3.0 131.6 128.9 1.3 59.8 3QH2 ACC LYS B 58 58 -> ILE B 30 30 3.0 153.5 110.4 0.1 87.6 3QH2 DNR LEU B 59 59 -> LYS B 56 56 3.2 116.2 129.6 5.8 81.3 3QH2 DNR VAL B 60 60 -> ILE B 30 30 3.0 148.5 115.3 15.4 69.0 3QH2 ACC VAL B 60 60 -> ILE B 32 32 3.0 179.4 111.6 10.4 86.3 3QH2 DNR MET B 61 61 -> ARG B 75 75 3.0 146.1 114.1 6.9 55.7 3QH2 ACC MET B 61 61 -> GLN B 77 77 3.0 145.3 109.2 1.6 68.2 3QH2 DNR ASN B 62 62 -> ILE B 32 32 3.0 147.2 133.4 7.3 62.0 3QH2 ACC ASN B 62 62 -> ARG B 64 64 3.0 94.9 94.9 7.5 33.8 3QH2 DNR GLY B 63 63 -> GLN B 77 77 3.0 164.7 116.1 24.2 55.6 3QH2 DNR ARG B 64 64 -> ASN B 62 62 3.0 94.9 94.9 7.5 33.8 3QH2 ACC ARG B 64 64 -> ILE B 67 67 3.3 110.7 116.2 58.3 86.4 3QH2 ACC ARG B 64 64 -> ALA B 68 68 3.2 155.9 118.3 11.3 47.7 3QH2 ACC VAL B 65 65 -> LEU B 69 69 3.0 157.1 118.2 15.2 61.9 3QH2 ACC ASP B 66 66 -> PHE B 70 70 3.1 159.9 115.2 17.9 60.0 3QH2 DNR ILE B 67 67 -> ARG B 64 64 3.3 110.7 116.2 58.3 86.4 3QH2 ACC ILE B 67 67 -> PHE B 70 70 3.5 105.2 115.1 53.0 88.3 3QH2 ACC ILE B 67 67 -> SER B 71 71 3.2 153.3 111.9 58.1 77.8 3QH2 DNR ALA B 68 68 -> ARG B 64 64 3.2 155.9 118.3 11.3 47.7 3QH2 ACC ALA B 68 68 -> SER B 71 71 3.3 110.4 132.5 11.1 80.1 3QH2 ACC ALA B 68 68 -> ILE B 73 73 3.1 145.9 123.8 27.5 27.2 3QH2 DNR LEU B 69 69 -> VAL B 65 65 3.0 157.1 118.2 15.2 61.9 3QH2 DNR PHE B 70 70 -> ASP B 66 66 3.1 159.9 115.2 17.9 60.0 3QH2 DNR PHE B 70 70 -> ILE B 67 67 3.5 105.2 115.1 53.0 88.3 3QH2 DNR SER B 71 71 -> ILE B 67 67 3.2 153.3 111.9 58.1 77.8 3QH2 DNR SER B 71 71 -> ALA B 68 68 3.3 110.4 132.5 11.1 80.1 3QH2 DNR ILE B 73 73 -> ALA B 68 68 3.1 145.9 123.8 27.5 27.2 3QH2 ACC HIS B 74 74 -> HIS B 96 96 3.0 164.2 113.0 18.2 27.8 3QH2 ACC ARG B 75 75 -> MET B 61 61 3.0 146.1 114.1 6.9 55.7 3QH2 DNR VAL B 76 76 -> HIS B 96 96 3.1 175.6 110.6 1.6 43.4 3QH2 ACC VAL B 76 76 -> GLY B 98 98 3.0 162.0 118.0 0.1 12.2 3QH2 DNR GLN B 77 77 -> MET B 61 61 3.0 145.3 109.2 1.6 68.2 3QH2 ACC GLN B 77 77 -> GLY B 63 63 3.0 164.7 116.1 24.2 55.6 3QH2 DNR LEU B 78 78 -> GLY B 98 98 3.0 145.2 122.2 5.9 87.2 3QH2 ACC LEU B 78 78 -> SER B 100 100 3.1 150.7 115.5 5.2 87.5 3QH2 ACC PRO B 79 79 -> SER B 82 82 3.2 135.5 132.8 8.0 66.9 3QH2 DNR SER B 82 82 -> PRO B 79 79 3.2 135.5 132.8 8.0 66.9 3QH2 ACC SER B 84 84 -> ILE B 88 88 3.3 154.2 119.0 6.0 45.1 3QH2 ACC PRO B 85 85 -> ARG B 89 89 3.0 152.4 126.6 14.1 75.4 3QH2 ACC LYS B 86 86 -> ALA B 90 90 3.0 158.4 121.6 26.6 70.9 3QH2 ACC GLN B 87 87 -> ALA B 90 90 3.3 105.3 122.6 50.9 81.4 3QH2 DNR ILE B 88 88 -> SER B 84 84 3.3 154.2 119.0 6.0 45.1 3QH2 ACC ILE B 88 88 -> ARG B 91 91 3.3 118.6 123.0 39.8 72.1 3QH2 ACC ILE B 88 88 -> PHE B 92 92 3.0 167.4 128.6 19.9 20.9 3QH2 DNR ARG B 89 89 -> PRO B 85 85 3.0 152.4 126.6 14.1 75.4 3QH2 DNR ALA B 90 90 -> LYS B 86 86 3.0 158.4 121.6 26.6 70.9 3QH2 DNR ALA B 90 90 -> GLN B 87 87 3.3 105.3 122.6 50.9 81.4 3QH2 DNR ARG B 91 91 -> ILE B 88 88 3.3 118.6 123.0 39.8 72.1 3QH2 DNR PHE B 92 92 -> ILE B 88 88 3.0 167.4 128.6 19.9 20.9 3QH2 ACC PHE B 92 92 -> LEU B 95 95 3.2 128.3 125.9 5.9 65.6 3QH2 DNR LEU B 95 95 -> PHE B 92 92 3.2 128.3 125.9 5.9 65.6 3QH2 DNR HIS B 96 96 -> HIS B 74 74 3.0 164.2 113.0 18.2 27.8 3QH2 ACC HIS B 96 96 -> VAL B 76 76 3.1 175.6 110.6 1.6 43.4 3QH2 ACC ILE B 97 97 -> ASP B 116 116 3.0 157.7 126.8 29.0 1.2 3QH2 DNR GLY B 98 98 -> VAL B 76 76 3.0 162.0 118.0 0.1 12.2 3QH2 ACC GLY B 98 98 -> LEU B 78 78 3.0 145.2 122.2 5.9 87.2 3QH2 DNR ARG B 99 99 -> TYR B 117 117 3.1 152.0 107.1 11.2 34.5 3QH2 ACC ARG B 99 99 -> LEU B 119 119 3.0 149.7 107.1 13.7 66.4 3QH2 DNR SER B 100 100 -> LEU B 78 78 3.1 150.7 115.5 5.2 87.5 3QH2 DNR VAL B 101 101 -> LEU B 119 119 3.0 163.3 112.6 2.0 89.8 3QH2 ACC SER B 103 103 -> ALA B 107 107 3.0 156.1 121.7 17.1 62.1 3QH2 ACC LEU B 104 104 -> VAL B 108 108 3.0 160.2 114.1 14.4 30.0 3QH2 ACC GLU B 105 105 -> GLN B 109 109 3.0 159.5 117.9 19.0 62.0 3QH2 ACC GLU B 106 106 -> GLN B 109 109 3.4 99.4 119.7 59.2 87.9 3QH2 ACC GLU B 106 106 -> ALA B 110 110 3.0 149.8 120.3 23.0 74.6 3QH2 DNR ALA B 107 107 -> SER B 103 103 3.0 156.1 121.7 17.1 62.1 3QH2 ACC ALA B 107 107 -> ALA B 110 110 3.3 106.2 119.5 54.9 86.7 3QH2 ACC ALA B 107 107 -> GLU B 111 111 3.3 155.4 114.6 13.5 66.9 3QH2 DNR VAL B 108 108 -> LEU B 104 104 3.0 160.2 114.1 14.4 30.0 3QH2 ACC VAL B 108 108 -> GLU B 111 111 3.5 107.6 120.1 55.3 80.2 3QH2 ACC VAL B 108 108 -> LYS B 112 112 3.3 149.5 119.1 19.5 47.5 3QH2 DNR GLN B 109 109 -> GLU B 105 105 3.0 159.5 117.9 19.0 62.0 3QH2 DNR GLN B 109 109 -> GLU B 106 106 3.4 99.4 119.7 59.2 87.9 3QH2 ACC GLN B 109 109 -> GLU B 113 113 3.0 159.0 111.8 23.2 49.9 3QH2 DNR ALA B 110 110 -> GLU B 106 106 3.0 149.8 120.3 23.0 74.6 3QH2 DNR ALA B 110 110 -> ALA B 107 107 3.3 106.2 119.5 54.9 86.7 3QH2 ACC ALA B 110 110 -> GLU B 113 113 3.3 103.2 121.7 53.7 87.0 3QH2 ACC ALA B 110 110 -> ALA B 115 115 3.0 152.4 127.6 9.3 73.1 3QH2 DNR GLU B 111 111 -> ALA B 107 107 3.3 155.4 114.6 13.5 66.9 3QH2 DNR GLU B 111 111 -> VAL B 108 108 3.5 107.6 120.1 55.3 80.2 3QH2 ACC GLU B 111 111 -> ASP B 114 114 3.1 109.4 140.3 4.2 80.5 3QH2 DNR LYS B 112 112 -> VAL B 108 108 3.3 149.5 119.1 19.5 47.5 3QH2 DNR GLU B 113 113 -> GLN B 109 109 3.0 159.0 111.8 23.2 49.9 3QH2 DNR GLU B 113 113 -> ALA B 110 110 3.3 103.2 121.7 53.7 87.0 3QH2 DNR ASP B 114 114 -> GLU B 111 111 3.1 109.4 140.3 4.2 80.5 3QH2 DNR ALA B 115 115 -> ALA B 110 110 3.0 152.4 127.6 9.3 73.1 3QH2 DNR ASP B 116 116 -> ILE B 97 97 3.0 157.7 126.8 29.0 1.2 3QH2 ACC TYR B 117 117 -> ARG B 99 99 3.1 152.0 107.1 11.2 34.5 3QH2 DNR VAL B 118 118 -> PRO B 150 145 3.1 160.1 112.8 3.0 68.0 3QH2 ACC VAL B 118 118 -> ILE B 152 147 3.0 158.1 118.3 9.0 39.3 3QH2 DNR LEU B 119 119 -> ARG B 99 99 3.0 149.7 107.1 13.7 66.4 3QH2 ACC LEU B 119 119 -> VAL B 101 101 3.0 163.3 112.6 2.0 89.8 3QH2 DNR PHE B 120 120 -> ILE B 152 147 3.0 163.6 109.8 8.3 83.7 3QH2 ACC PHE B 120 120 -> ILE B 154 149 3.0 144.3 114.7 14.5 78.7 3QH2 DNR VAL B 123 123 -> ILE B 154 149 3.0 147.2 116.5 13.7 27.7 3QH2 DNR PHE B 124 124 -> GLY B 155 150 3.3 129.9 122.5 32.3 70.2 3QH2 ACC LEU B 132 127 -> ARG B 135 130 3.2 118.0 131.5 11.7 73.9 3QH2 DNR ARG B 135 130 -> LEU B 132 127 3.2 118.0 131.5 11.7 73.9 3QH2 ACC ARG B 135 130 -> LEU B 139 134 3.0 174.4 127.5 2.5 67.4 3QH2 ACC GLY B 136 131 -> LEU B 140 135 3.1 148.0 126.5 23.9 69.7 3QH2 ACC VAL B 137 132 -> SER B 141 136 3.3 142.8 114.4 17.5 59.3 3QH2 ACC SER B 138 133 -> ASP B 142 137 3.0 153.5 113.9 13.9 29.7 3QH2 DNR LEU B 139 134 -> ARG B 135 130 3.0 174.4 127.5 2.5 67.4 3QH2 ACC LEU B 139 134 -> ILE B 143 138 3.0 160.6 121.5 12.0 89.8 3QH2 DNR LEU B 140 135 -> GLY B 136 131 3.1 148.0 126.5 23.9 69.7 3QH2 ACC LEU B 140 135 -> ILE B 143 138 3.5 104.9 117.7 59.1 84.3 3QH2 ACC LEU B 140 135 -> LYS B 144 139 3.1 153.6 122.9 13.5 67.2 3QH2 DNR SER B 141 136 -> VAL B 137 132 3.3 142.8 114.4 17.5 59.3 3QH2 ACC SER B 141 136 -> GLN B 145 140 3.2 150.2 116.6 34.5 61.9 3QH2 DNR ASP B 142 137 -> SER B 138 133 3.0 153.5 113.9 13.9 29.7 3QH2 ACC ASP B 142 137 -> GLN B 145 140 3.2 106.7 129.0 44.3 80.4 3QH2 ACC ASP B 142 137 -> ARG B 146 141 3.1 153.6 113.4 37.8 53.2 3QH2 DNR ILE B 143 138 -> LEU B 139 134 3.0 160.6 121.5 12.0 89.8 3QH2 DNR ILE B 143 138 -> LEU B 140 135 3.5 104.9 117.7 59.1 84.3 3QH2 ACC ILE B 143 138 -> ARG B 146 141 3.1 112.8 124.4 37.5 85.4 3QH2 ACC ILE B 143 138 -> ILE B 147 142 3.0 168.8 116.2 15.9 88.0 3QH2 DNR LYS B 144 139 -> LEU B 140 135 3.1 153.6 122.9 13.5 67.2 3QH2 DNR GLN B 145 140 -> SER B 141 136 3.2 150.2 116.6 34.5 61.9 3QH2 DNR GLN B 145 140 -> ASP B 142 137 3.2 106.7 129.0 44.3 80.4 3QH2 DNR ARG B 146 141 -> ASP B 142 137 3.1 153.6 113.4 37.8 53.2 3QH2 DNR ARG B 146 141 -> ILE B 143 138 3.1 112.8 124.4 37.5 85.4 3QH2 DNR ILE B 147 142 -> ILE B 143 138 3.0 168.8 116.2 15.9 88.0 3QH2 ACC PRO B 150 145 -> VAL B 118 118 3.1 160.1 112.8 3.0 68.0 3QH2 ACC VAL B 151 146 -> ASP B 171 166 3.0 160.8 124.8 20.9 43.4 3QH2 DNR ILE B 152 147 -> VAL B 118 118 3.0 158.1 118.3 9.0 39.3 3QH2 ACC ILE B 152 147 -> PHE B 120 120 3.0 163.6 109.8 8.3 83.7 3QH2 DNR ALA B 153 148 -> GLY B 172 167 3.0 140.3 113.8 6.7 57.5 3QH2 ACC ALA B 153 148 -> ALA B 174 169 3.0 163.6 109.2 27.1 73.6 3QH2 DNR ILE B 154 149 -> PHE B 120 120 3.0 144.3 114.7 14.5 78.7 3QH2 ACC ILE B 154 149 -> VAL B 123 123 3.0 147.2 116.5 13.7 27.7 3QH2 ACC GLY B 155 150 -> PHE B 124 124 3.3 129.9 122.5 32.3 70.2 3QH2 ACC THR B 158 153 -> ARG B 161 156 3.0 126.9 129.2 3.9 79.2 3QH2 ACC PRO B 159 154 -> LEU B 162 157 3.5 113.9 130.2 4.6 77.8 3QH2 DNR ARG B 161 156 -> THR B 158 153 3.0 126.9 129.2 3.9 79.2 3QH2 ACC ARG B 161 156 -> VAL B 165 160 3.3 154.4 117.5 13.1 26.1 3QH2 DNR LEU B 162 157 -> PRO B 159 154 3.5 113.9 130.2 4.6 77.8 3QH2 ACC LEU B 162 157 -> LYS B 166 161 3.0 152.3 125.9 15.5 71.6 3QH2 ACC ARG B 163 158 -> GLN B 167 162 3.0 167.0 118.8 9.9 71.6 3QH2 ACC ASP B 164 159 -> ALA B 168 163 3.0 154.6 119.4 23.3 60.4 3QH2 DNR VAL B 165 160 -> ARG B 161 156 3.3 154.4 117.5 13.1 26.1 3QH2 ACC VAL B 165 160 -> ALA B 168 163 3.3 102.1 124.3 58.4 84.9 3QH2 ACC VAL B 165 160 -> GLY B 169 164 3.3 146.4 104.5 37.7 56.4 3QH2 ACC VAL B 165 160 -> ALA B 170 165 3.2 152.5 128.6 7.7 58.1 3QH2 DNR LYS B 166 161 -> LEU B 162 157 3.0 152.3 125.9 15.5 71.6 3QH2 ACC LYS B 166 161 -> GLY B 169 164 3.0 114.1 134.3 32.3 80.8 3QH2 DNR GLN B 167 162 -> ARG B 163 158 3.0 167.0 118.8 9.9 71.6 3QH2 DNR ALA B 168 163 -> ASP B 164 159 3.0 154.6 119.4 23.3 60.4 3QH2 DNR ALA B 168 163 -> VAL B 165 160 3.3 102.1 124.3 58.4 84.9 3QH2 DNR GLY B 169 164 -> VAL B 165 160 3.3 146.4 104.5 37.7 56.4 3QH2 DNR GLY B 169 164 -> LYS B 166 161 3.0 114.1 134.3 32.3 80.8 3QH2 DNR ALA B 170 165 -> VAL B 165 160 3.2 152.5 128.6 7.7 58.1 3QH2 DNR ASP B 171 166 -> VAL B 151 146 3.0 160.8 124.8 20.9 43.4 3QH2 ACC ASP B 171 166 -> GLU B 2 2 3.3 136.8 111.1 11.0 18.2 3QH2 ACC GLY B 172 167 -> ALA B 153 148 3.0 140.3 113.8 6.7 57.5 3QH2 DNR ILE B 173 168 -> GLU B 2 2 3.0 157.0 103.8 4.4 82.5 3QH2 ACC ILE B 173 168 -> HIS B 4 4 3.0 164.5 121.0 1.7 0.4 3QH2 DNR ALA B 174 169 -> ALA B 153 148 3.0 163.6 109.2 27.1 73.6 3QH2 DNR VAL B 175 170 -> HIS B 4 4 3.0 173.3 109.1 14.2 50.1 3QH2 ACC VAL B 175 170 -> ILE B 6 6 3.0 150.0 117.6 22.1 77.6 3QH2 ACC MET B 176 171 -> ILE B 179 174 3.2 128.6 129.5 12.3 64.7 3QH2 ACC MET B 176 171 -> PHE B 180 175 3.1 160.9 121.6 6.1 29.2 3QH2 ACC SER B 177 172 -> SER B 181 176 3.0 132.1 137.8 9.8 37.4 3QH2 DNR ILE B 179 174 -> MET B 176 171 3.2 128.6 129.5 12.3 64.7 3QH2 ACC ILE B 179 174 -> SER B 182 177 3.3 112.5 130.8 29.9 75.4 3QH2 DNR PHE B 180 175 -> MET B 176 171 3.1 160.9 121.6 6.1 29.2 3QH2 DNR SER B 181 176 -> SER B 177 172 3.0 132.1 137.8 9.8 37.4 3QH2 DNR SER B 182 177 -> ILE B 179 174 3.3 112.5 130.8 29.9 75.4 3QH2 ACC GLU B 184 179 -> GLU B 187 182 3.0 128.6 118.5 54.0 76.3 3QH2 ACC GLU B 184 179 -> ALA B 188 183 3.0 163.9 117.6 5.4 22.7 3QH2 ACC PRO B 185 180 -> ALA B 189 184 3.0 155.5 120.6 12.4 73.5 3QH2 ACC LEU B 186 181 -> ARG B 190 185 3.0 150.5 119.9 24.5 54.2 3QH2 DNR GLU B 187 182 -> GLU B 184 179 3.0 128.6 118.5 54.0 76.3 3QH2 ACC GLU B 187 182 -> ARG B 190 185 3.0 109.0 123.6 59.8 87.7 3QH2 ACC GLU B 187 182 -> ARG B 191 186 3.0 162.9 110.7 15.3 53.8 3QH2 DNR ALA B 188 183 -> GLU B 184 179 3.0 163.9 117.6 5.4 22.7 3QH2 ACC ALA B 188 183 -> ARG B 191 186 3.2 112.4 119.4 54.9 86.2 3QH2 ACC ALA B 188 183 -> TYR B 192 187 3.5 153.2 107.8 22.1 44.1 3QH2 DNR ALA B 189 184 -> PRO B 185 180 3.0 155.5 120.6 12.4 73.5 3QH2 ACC ALA B 189 184 -> TYR B 192 187 3.2 109.2 127.5 47.3 78.5 3QH2 ACC ALA B 189 184 -> SER B 193 188 3.2 153.7 115.6 17.6 38.9 3QH2 DNR ARG B 190 185 -> LEU B 186 181 3.0 150.5 119.9 24.5 54.2 3QH2 DNR ARG B 190 185 -> GLU B 187 182 3.0 109.0 123.6 59.8 87.7 3QH2 ACC ARG B 190 185 -> SER B 193 188 3.2 111.7 111.8 56.4 87.5 3QH2 ACC ARG B 190 185 -> ARG B 194 189 3.0 165.8 124.5 11.0 85.7 3QH2 DNR ARG B 191 186 -> GLU B 187 182 3.0 162.9 110.7 15.3 53.8 3QH2 DNR ARG B 191 186 -> ALA B 188 183 3.2 112.4 119.4 54.9 86.2 3QH2 ACC ARG B 191 186 -> LYS B 195 190 3.2 145.1 126.8 13.3 76.3 3QH2 DNR TYR B 192 187 -> ALA B 188 183 3.5 153.2 107.8 22.1 44.1 3QH2 DNR TYR B 192 187 -> ALA B 189 184 3.2 109.2 127.5 47.3 78.5 3QH2 ACC TYR B 192 187 -> LEU B 196 191 3.0 151.2 120.3 22.5 55.0 3QH2 DNR SER B 193 188 -> ALA B 189 184 3.2 153.7 115.6 17.6 38.9 3QH2 DNR SER B 193 188 -> ARG B 190 185 3.2 111.7 111.8 56.4 87.5 3QH2 ACC SER B 193 188 -> LYS B 197 192 3.1 143.3 119.2 26.9 73.2 3QH2 DNR ARG B 194 189 -> ARG B 190 185 3.0 165.8 124.5 11.0 85.7 3QH2 ACC ARG B 194 189 -> LYS B 197 192 3.2 108.5 122.4 52.5 85.2 3QH2 ACC ARG B 194 189 -> GLU B 198 193 3.0 161.1 121.8 5.7 59.3 3QH2 DNR LYS B 195 190 -> ARG B 191 186 3.2 145.1 126.8 13.3 76.3 3QH2 ACC LYS B 195 190 -> MET B 199 194 3.2 148.1 112.5 35.0 69.3 3QH2 DNR LEU B 196 191 -> TYR B 192 187 3.0 151.2 120.3 22.5 55.0 3QH2 ACC LEU B 196 191 -> MET B 199 194 3.5 97.5 134.4 41.7 77.3 3QH2 DNR LYS B 197 192 -> SER B 193 188 3.1 143.3 119.2 26.9 73.2 3QH2 DNR LYS B 197 192 -> ARG B 194 189 3.2 108.5 122.4 52.5 85.2 3QH2 DNR GLU B 198 193 -> ARG B 194 189 3.0 161.1 121.8 5.7 59.3 3QH2 DNR MET B 199 194 -> LYS B 195 190 3.2 148.1 112.5 35.0 69.3 3QH2 DNR MET B 199 194 -> LEU B 196 191 3.5 97.5 134.4 41.7 77.3 3QH2 DNR GLU C 2 2 -> ASP C 171 166 3.2 137.0 109.2 15.6 11.0 3QH2 ACC GLU C 2 2 -> ILE C 173 168 3.0 160.0 104.8 5.7 89.3 3QH2 ACC LEU C 3 3 -> ASP C 28 28 3.0 155.9 127.6 23.5 8.2 3QH2 ACC LEU C 3 3 -> PHE C 29 29 3.4 148.7 107.9 15.4 37.1 3QH2 DNR HIS C 4 4 -> ILE C 173 168 3.0 162.9 121.7 13.1 26.4 3QH2 ACC HIS C 4 4 -> VAL C 175 170 3.0 173.4 107.8 18.1 30.0 3QH2 DNR ALA C 5 5 -> PHE C 29 29 3.0 158.8 113.1 18.3 62.3 3QH2 ACC ALA C 5 5 -> HIS C 31 31 3.0 167.1 112.7 2.1 19.8 3QH2 DNR ILE C 6 6 -> VAL C 175 170 3.0 152.4 115.2 22.5 74.8 3QH2 DNR THR C 7 7 -> HIS C 31 31 3.1 169.6 120.0 0.8 6.0 3QH2 ACC PRO C 12 12 -> GLU C 15 15 3.1 128.5 120.7 48.0 71.2 3QH2 ACC PRO C 12 12 -> LEU C 16 16 3.1 162.6 117.7 3.0 21.3 3QH2 ACC VAL C 13 13 -> ALA C 17 17 3.0 155.9 126.4 14.5 87.8 3QH2 ACC GLU C 14 14 -> ARG C 18 18 3.4 143.0 117.3 18.4 65.8 3QH2 DNR GLU C 15 15 -> PRO C 12 12 3.1 128.5 120.7 48.0 71.2 3QH2 ACC GLU C 15 15 -> ARG C 18 18 3.3 111.9 117.8 53.9 83.2 3QH2 ACC GLU C 15 15 -> ILE C 19 19 3.3 156.5 115.7 17.8 45.2 3QH2 DNR LEU C 16 16 -> PRO C 12 12 3.1 162.6 117.7 3.0 21.3 3QH2 ACC LEU C 16 16 -> ILE C 19 19 3.1 115.7 123.3 53.5 80.2 3QH2 ACC LEU C 16 16 -> ILE C 20 20 3.1 162.5 116.2 10.0 31.0 3QH2 DNR ALA C 17 17 -> VAL C 13 13 3.0 155.9 126.4 14.5 87.8 3QH2 ACC ALA C 17 17 -> ILE C 21 21 3.2 152.7 118.6 14.3 65.2 3QH2 DNR ARG C 18 18 -> GLU C 14 14 3.4 143.0 117.3 18.4 65.8 3QH2 DNR ARG C 18 18 -> GLU C 15 15 3.3 111.9 117.8 53.9 83.2 3QH2 ACC ARG C 18 18 -> THR C 22 22 3.2 148.5 124.3 17.3 69.4 3QH2 DNR ILE C 19 19 -> GLU C 15 15 3.3 156.5 115.7 17.8 45.2 3QH2 DNR ILE C 19 19 -> LEU C 16 16 3.1 115.7 123.3 53.5 80.2 3QH2 ACC ILE C 19 19 -> THR C 22 22 3.3 110.1 117.9 58.6 85.7 3QH2 ACC ILE C 19 19 -> ILE C 23 23 3.2 161.1 112.4 32.3 62.6 3QH2 DNR ILE C 20 20 -> LEU C 16 16 3.1 162.5 116.2 10.0 31.0 3QH2 ACC ILE C 20 20 -> ILE C 23 23 3.5 107.2 120.8 36.6 82.7 3QH2 ACC ILE C 20 20 -> GLN C 24 24 3.4 153.1 116.7 58.5 73.7 3QH2 DNR ILE C 21 21 -> ALA C 17 17 3.2 152.7 118.6 14.3 65.2 3QH2 DNR THR C 22 22 -> ARG C 18 18 3.2 148.5 124.3 17.3 69.4 3QH2 DNR THR C 22 22 -> ILE C 19 19 3.3 110.1 117.9 58.6 85.7 3QH2 DNR ILE C 23 23 -> ILE C 19 19 3.2 161.1 112.4 32.3 62.6 3QH2 DNR ILE C 23 23 -> ILE C 20 20 3.5 107.2 120.8 36.6 82.7 3QH2 ACC ILE C 23 23 -> GLU C 26 26 3.0 135.2 127.1 19.7 72.9 3QH2 DNR GLN C 24 24 -> ILE C 20 20 3.4 153.1 116.7 58.5 73.7 3QH2 DNR GLU C 26 26 -> ILE C 23 23 3.0 135.2 127.1 19.7 72.9 3QH2 DNR ASP C 28 28 -> LEU C 3 3 3.0 155.9 127.6 23.5 8.2 3QH2 DNR PHE C 29 29 -> LEU C 3 3 3.4 148.7 107.9 15.4 37.1 3QH2 ACC PHE C 29 29 -> ALA C 5 5 3.0 158.8 113.1 18.3 62.3 3QH2 DNR ILE C 30 30 -> LYS C 58 58 3.0 155.5 113.1 2.1 82.0 3QH2 ACC ILE C 30 30 -> VAL C 60 60 3.0 148.5 113.0 19.8 66.8 3QH2 DNR HIS C 31 31 -> ALA C 5 5 3.0 167.1 112.7 2.1 19.8 3QH2 ACC HIS C 31 31 -> THR C 7 7 3.1 169.6 120.0 0.8 6.0 3QH2 DNR ILE C 32 32 -> VAL C 60 60 3.0 178.4 111.2 9.9 1.9 3QH2 ACC ILE C 32 32 -> ASN C 62 62 3.0 148.4 135.5 3.9 61.1 3QH2 ACC GLU C 34 34 -> LYS C 37 37 3.1 126.9 130.0 5.4 71.0 3QH2 DNR LYS C 37 37 -> GLU C 34 34 3.1 126.9 130.0 5.4 71.0 3QH2 ACC SER C 38 38 -> ASP C 41 41 3.1 119.9 115.5 56.0 89.6 3QH2 ACC SER C 38 38 -> ILE C 42 42 3.0 166.2 117.1 6.3 24.6 3QH2 ACC ALA C 39 39 -> LEU C 43 43 3.0 158.6 122.0 12.9 73.8 3QH2 ACC ALA C 40 40 -> LYS C 44 44 3.1 144.0 118.3 23.0 57.2 3QH2 DNR ASP C 41 41 -> SER C 38 38 3.1 119.9 115.5 56.0 89.6 3QH2 ACC ASP C 41 41 -> LEU C 45 45 3.0 153.1 113.9 16.4 49.9 3QH2 DNR ILE C 42 42 -> SER C 38 38 3.0 166.2 117.1 6.3 24.6 3QH2 ACC ILE C 42 42 -> LEU C 46 46 3.0 159.7 115.1 9.5 56.7 3QH2 DNR LEU C 43 43 -> ALA C 39 39 3.0 158.6 122.0 12.9 73.8 3QH2 ACC LEU C 43 43 -> ASP C 47 47 3.1 142.8 126.2 22.2 74.9 3QH2 DNR LYS C 44 44 -> ALA C 40 40 3.1 144.0 118.3 23.0 57.2 3QH2 ACC LYS C 44 44 -> LEU C 48 48 3.0 157.5 114.3 13.6 55.6 3QH2 DNR LEU C 45 45 -> ASP C 41 41 3.0 153.1 113.9 16.4 49.9 3QH2 ACC LEU C 45 45 -> LEU C 48 48 3.1 114.1 117.0 59.2 87.3 3QH2 ACC LEU C 45 45 -> ILE C 49 49 3.0 164.1 115.0 8.2 38.3 3QH2 DNR LEU C 46 46 -> ILE C 42 42 3.0 159.7 115.1 9.5 56.7 3QH2 ACC LEU C 46 46 -> PHE C 50 50 3.0 159.7 125.1 13.2 78.6 3QH2 DNR ASP C 47 47 -> LEU C 43 43 3.1 142.8 126.2 22.2 74.9 3QH2 ACC ASP C 47 47 -> GLU C 51 51 3.0 150.2 126.0 17.7 79.2 3QH2 DNR LEU C 48 48 -> LYS C 44 44 3.0 157.5 114.3 13.6 55.6 3QH2 DNR LEU C 48 48 -> LEU C 45 45 3.1 114.1 117.0 59.2 87.3 3QH2 ACC LEU C 48 48 -> GLY C 52 52 3.0 148.8 115.7 45.3 58.1 3QH2 DNR ILE C 49 49 -> LEU C 45 45 3.0 164.1 115.0 8.2 38.3 3QH2 ACC ILE C 49 49 -> GLY C 52 52 3.2 99.3 132.5 42.6 88.0 3QH2 ACC ILE C 49 49 -> GLY C 53 53 3.2 146.3 96.2 50.8 70.4 3QH2 ACC ILE C 49 49 -> ILE C 54 54 3.1 157.5 127.2 13.0 71.6 3QH2 DNR PHE C 50 50 -> LEU C 46 46 3.0 159.7 125.1 13.2 78.6 3QH2 ACC PHE C 50 50 -> GLY C 53 53 3.2 108.1 133.2 10.8 82.3 3QH2 DNR GLU C 51 51 -> ASP C 47 47 3.0 150.2 126.0 17.7 79.2 3QH2 DNR GLY C 52 52 -> LEU C 48 48 3.0 148.8 115.7 45.3 58.1 3QH2 DNR GLY C 52 52 -> ILE C 49 49 3.2 99.3 132.5 42.6 88.0 3QH2 DNR GLY C 53 53 -> ILE C 49 49 3.2 146.3 96.2 50.8 70.4 3QH2 DNR GLY C 53 53 -> PHE C 50 50 3.2 108.1 133.2 10.8 82.3 3QH2 DNR ILE C 54 54 -> ILE C 49 49 3.1 157.5 127.2 13.0 71.6 3QH2 ACC ASP C 55 55 -> LYS C 58 58 3.1 127.8 131.5 3.5 59.3 3QH2 ACC LYS C 56 56 -> LEU C 59 59 3.1 118.8 128.1 4.2 82.7 3QH2 DNR LYS C 58 58 -> ASP C 55 55 3.1 127.8 131.5 3.5 59.3 3QH2 ACC LYS C 58 58 -> ILE C 30 30 3.0 155.5 113.1 2.1 82.0 3QH2 DNR LEU C 59 59 -> LYS C 56 56 3.1 118.8 128.1 4.2 82.7 3QH2 DNR VAL C 60 60 -> ILE C 30 30 3.0 148.5 113.0 19.8 66.8 3QH2 ACC VAL C 60 60 -> ILE C 32 32 3.0 178.4 111.2 9.9 1.9 3QH2 DNR MET C 61 61 -> ARG C 75 75 3.0 140.8 115.7 1.8 59.6 3QH2 ACC MET C 61 61 -> GLN C 77 77 3.0 146.3 109.3 0.5 68.6 3QH2 DNR ASN C 62 62 -> ILE C 32 32 3.0 148.4 135.5 3.9 61.1 3QH2 ACC ASN C 62 62 -> ARG C 64 64 3.0 90.8 94.8 13.5 36.2 3QH2 DNR GLY C 63 63 -> GLN C 77 77 3.0 163.2 117.3 32.3 54.4 3QH2 DNR ARG C 64 64 -> ASN C 62 62 3.0 90.8 94.8 13.5 36.2 3QH2 ACC ARG C 64 64 -> ILE C 67 67 3.4 109.0 115.9 59.7 83.6 3QH2 ACC ARG C 64 64 -> ALA C 68 68 3.3 153.8 116.6 12.3 48.3 3QH2 ACC VAL C 65 65 -> LEU C 69 69 3.1 156.4 119.1 7.5 66.9 3QH2 ACC ASP C 66 66 -> PHE C 70 70 3.1 161.4 120.5 17.2 68.1 3QH2 DNR ILE C 67 67 -> ARG C 64 64 3.4 109.0 115.9 59.7 83.6 3QH2 ACC ILE C 67 67 -> PHE C 70 70 3.5 105.4 118.7 54.9 83.0 3QH2 DNR ALA C 68 68 -> ARG C 64 64 3.3 153.8 116.6 12.3 48.3 3QH2 ACC ALA C 68 68 -> SER C 71 71 3.1 110.4 133.8 11.9 81.4 3QH2 ACC ALA C 68 68 -> THR C 72 72 3.1 161.8 107.0 56.8 81.8 3QH2 ACC ALA C 68 68 -> ILE C 73 73 3.2 140.0 119.7 21.3 32.7 3QH2 DNR LEU C 69 69 -> VAL C 65 65 3.1 156.4 119.1 7.5 66.9 3QH2 DNR PHE C 70 70 -> ASP C 66 66 3.1 161.4 120.5 17.2 68.1 3QH2 DNR PHE C 70 70 -> ILE C 67 67 3.5 105.4 118.7 54.9 83.0 3QH2 DNR SER C 71 71 -> ALA C 68 68 3.1 110.4 133.8 11.9 81.4 3QH2 DNR THR C 72 72 -> ALA C 68 68 3.1 161.8 107.0 56.8 81.8 3QH2 DNR ILE C 73 73 -> ALA C 68 68 3.2 140.0 119.7 21.3 32.7 3QH2 ACC HIS C 74 74 -> HIS C 96 96 3.0 164.1 114.4 7.5 38.3 3QH2 ACC ARG C 75 75 -> MET C 61 61 3.0 140.8 115.7 1.8 59.6 3QH2 DNR VAL C 76 76 -> HIS C 96 96 3.1 174.9 111.1 1.6 48.0 3QH2 ACC VAL C 76 76 -> GLY C 98 98 3.0 165.1 118.4 9.2 0.9 3QH2 DNR GLN C 77 77 -> MET C 61 61 3.0 146.3 109.3 0.5 68.6 3QH2 ACC GLN C 77 77 -> GLY C 63 63 3.0 163.2 117.3 32.3 54.4 3QH2 DNR LEU C 78 78 -> GLY C 98 98 3.0 148.4 119.9 3.1 78.1 3QH2 ACC LEU C 78 78 -> SER C 100 100 3.1 147.8 117.0 3.1 88.7 3QH2 ACC PRO C 79 79 -> SER C 82 82 3.2 133.1 134.5 9.9 64.9 3QH2 DNR SER C 82 82 -> PRO C 79 79 3.2 133.1 134.5 9.9 64.9 3QH2 ACC SER C 84 84 -> GLN C 87 87 3.3 115.1 117.2 49.3 82.6 3QH2 ACC SER C 84 84 -> ILE C 88 88 3.3 157.5 119.5 8.5 37.2 3QH2 ACC PRO C 85 85 -> ARG C 89 89 3.0 163.2 122.6 20.7 58.7 3QH2 ACC LYS C 86 86 -> ALA C 90 90 3.2 147.6 123.2 24.7 77.3 3QH2 DNR GLN C 87 87 -> SER C 84 84 3.3 115.1 117.2 49.3 82.6 3QH2 DNR ILE C 88 88 -> SER C 84 84 3.3 157.5 119.5 8.5 37.2 3QH2 ACC ILE C 88 88 -> ARG C 91 91 3.3 114.5 125.0 46.3 71.9 3QH2 ACC ILE C 88 88 -> PHE C 92 92 3.0 160.7 125.9 26.2 25.0 3QH2 DNR ARG C 89 89 -> PRO C 85 85 3.0 163.2 122.6 20.7 58.7 3QH2 ACC ARG C 89 89 -> PHE C 92 92 3.5 95.4 111.1 55.2 87.4 3QH2 DNR ALA C 90 90 -> LYS C 86 86 3.2 147.6 123.2 24.7 77.3 3QH2 DNR ARG C 91 91 -> ILE C 88 88 3.3 114.5 125.0 46.3 71.9 3QH2 DNR PHE C 92 92 -> ILE C 88 88 3.0 160.7 125.9 26.2 25.0 3QH2 DNR PHE C 92 92 -> ARG C 89 89 3.5 95.4 111.1 55.2 87.4 3QH2 ACC PHE C 92 92 -> LEU C 95 95 3.3 128.0 126.6 0.8 61.8 3QH2 DNR LEU C 95 95 -> PHE C 92 92 3.3 128.0 126.6 0.8 61.8 3QH2 DNR HIS C 96 96 -> HIS C 74 74 3.0 164.1 114.4 7.5 38.3 3QH2 ACC HIS C 96 96 -> VAL C 76 76 3.1 174.9 111.1 1.6 48.0 3QH2 ACC ILE C 97 97 -> ASP C 116 116 3.0 164.3 128.0 20.6 10.1 3QH2 DNR GLY C 98 98 -> VAL C 76 76 3.0 165.1 118.4 9.2 0.9 3QH2 ACC GLY C 98 98 -> LEU C 78 78 3.0 148.4 119.9 3.1 78.1 3QH2 DNR ARG C 99 99 -> TYR C 117 117 3.1 150.4 107.0 11.4 34.6 3QH2 ACC ARG C 99 99 -> LEU C 119 119 3.0 144.7 104.5 6.5 66.5 3QH2 DNR SER C 100 100 -> LEU C 78 78 3.1 147.8 117.0 3.1 88.7 3QH2 DNR VAL C 101 101 -> LEU C 119 119 3.0 177.6 116.7 4.3 81.3 3QH2 ACC SER C 103 103 -> ALA C 107 107 3.0 149.9 120.5 27.5 55.1 3QH2 ACC LEU C 104 104 -> ALA C 107 107 3.2 101.7 124.3 57.2 83.2 3QH2 ACC LEU C 104 104 -> VAL C 108 108 3.0 154.4 117.9 15.7 65.4 3QH2 ACC GLU C 105 105 -> VAL C 108 108 3.3 108.1 114.9 58.7 89.4 3QH2 ACC GLU C 105 105 -> GLN C 109 109 3.0 157.3 121.9 12.2 66.1 3QH2 ACC GLU C 106 106 -> ALA C 110 110 3.0 152.3 117.7 23.2 60.0 3QH2 DNR ALA C 107 107 -> SER C 103 103 3.0 149.9 120.5 27.5 55.1 3QH2 DNR ALA C 107 107 -> LEU C 104 104 3.2 101.7 124.3 57.2 83.2 3QH2 ACC ALA C 107 107 -> ALA C 110 110 3.3 106.4 118.9 54.7 87.1 3QH2 ACC ALA C 107 107 -> GLU C 111 111 3.3 152.7 114.6 18.9 61.9 3QH2 DNR VAL C 108 108 -> LEU C 104 104 3.0 154.4 117.9 15.7 65.4 3QH2 DNR VAL C 108 108 -> GLU C 105 105 3.3 108.1 114.9 58.7 89.4 3QH2 ACC VAL C 108 108 -> GLU C 111 111 3.2 111.4 126.9 52.8 77.7 3QH2 ACC VAL C 108 108 -> LYS C 112 112 3.1 153.7 113.9 15.6 29.7 3QH2 DNR GLN C 109 109 -> GLU C 105 105 3.0 157.3 121.9 12.2 66.1 3QH2 ACC GLN C 109 109 -> GLU C 113 113 3.0 154.1 111.9 36.7 59.6 3QH2 DNR ALA C 110 110 -> GLU C 106 106 3.0 152.3 117.7 23.2 60.0 3QH2 DNR ALA C 110 110 -> ALA C 107 107 3.3 106.4 118.9 54.7 87.1 3QH2 ACC ALA C 110 110 -> GLU C 113 113 3.2 104.4 133.7 40.6 79.9 3QH2 ACC ALA C 110 110 -> ALA C 115 115 3.1 152.1 130.5 2.1 73.7 3QH2 DNR GLU C 111 111 -> ALA C 107 107 3.3 152.7 114.6 18.9 61.9 3QH2 DNR GLU C 111 111 -> VAL C 108 108 3.2 111.4 126.9 52.8 77.7 3QH2 ACC GLU C 111 111 -> ASP C 114 114 3.1 112.7 132.3 5.0 87.1 3QH2 DNR LYS C 112 112 -> VAL C 108 108 3.1 153.7 113.9 15.6 29.7 3QH2 DNR GLU C 113 113 -> GLN C 109 109 3.0 154.1 111.9 36.7 59.6 3QH2 DNR GLU C 113 113 -> ALA C 110 110 3.2 104.4 133.7 40.6 79.9 3QH2 DNR ASP C 114 114 -> GLU C 111 111 3.1 112.7 132.3 5.0 87.1 3QH2 DNR ALA C 115 115 -> ALA C 110 110 3.1 152.1 130.5 2.1 73.7 3QH2 DNR ASP C 116 116 -> ILE C 97 97 3.0 164.3 128.0 20.6 10.1 3QH2 ACC TYR C 117 117 -> ARG C 99 99 3.1 150.4 107.0 11.4 34.6 3QH2 DNR VAL C 118 118 -> PRO C 150 145 3.2 160.3 110.0 4.7 62.2 3QH2 ACC VAL C 118 118 -> ILE C 152 147 3.0 152.9 121.7 14.0 54.4 3QH2 DNR LEU C 119 119 -> ARG C 99 99 3.0 144.7 104.5 6.5 66.5 3QH2 ACC LEU C 119 119 -> VAL C 101 101 3.0 177.6 116.7 4.3 81.3 3QH2 DNR PHE C 120 120 -> ILE C 152 147 3.0 164.0 108.0 1.8 81.3 3QH2 ACC PHE C 120 120 -> ILE C 154 149 3.0 149.4 115.5 23.7 74.2 3QH2 DNR VAL C 123 123 -> ILE C 154 149 3.0 146.8 118.4 16.4 33.0 3QH2 ACC VAL C 123 123 -> GLY C 136 131 3.0 139.9 133.1 12.2 38.8 3QH2 DNR PHE C 124 124 -> GLY C 155 150 3.1 132.3 129.3 21.3 67.3 3QH2 ACC GLY C 134 129 -> VAL C 137 132 3.3 127.8 123.1 2.4 77.5 3QH2 DNR GLY C 136 131 -> VAL C 123 123 3.0 139.9 133.1 12.2 38.8 3QH2 ACC GLY C 136 131 -> LEU C 140 135 3.0 161.8 122.9 10.8 60.1 3QH2 DNR VAL C 137 132 -> GLY C 134 129 3.3 127.8 123.1 2.4 77.5 3QH2 ACC VAL C 137 132 -> SER C 141 136 3.0 147.0 116.4 25.6 60.5 3QH2 ACC SER C 138 133 -> SER C 141 136 3.1 104.7 124.0 58.2 88.9 3QH2 ACC SER C 138 133 -> ASP C 142 137 3.0 157.4 117.0 12.1 57.3 3QH2 ACC LEU C 139 134 -> ILE C 143 138 3.0 169.3 116.1 11.1 69.0 3QH2 DNR LEU C 140 135 -> GLY C 136 131 3.0 161.8 122.9 10.8 60.1 3QH2 ACC LEU C 140 135 -> ILE C 143 138 3.4 103.3 117.5 58.8 81.8 3QH2 ACC LEU C 140 135 -> LYS C 144 139 3.2 151.4 122.7 11.5 62.9 3QH2 DNR SER C 141 136 -> VAL C 137 132 3.0 147.0 116.4 25.6 60.5 3QH2 DNR SER C 141 136 -> SER C 138 133 3.1 104.7 124.0 58.2 88.9 3QH2 ACC SER C 141 136 -> GLN C 145 140 3.1 152.4 118.1 22.9 58.0 3QH2 DNR ASP C 142 137 -> SER C 138 133 3.0 157.4 117.0 12.1 57.3 3QH2 ACC ASP C 142 137 -> GLN C 145 140 3.2 107.8 122.2 55.6 84.1 3QH2 ACC ASP C 142 137 -> ARG C 146 141 3.0 157.0 118.2 27.6 54.2 3QH2 DNR ILE C 143 138 -> LEU C 139 134 3.0 169.3 116.1 11.1 69.0 3QH2 DNR ILE C 143 138 -> LEU C 140 135 3.4 103.3 117.5 58.8 81.8 3QH2 ACC ILE C 143 138 -> ARG C 146 141 3.1 109.4 120.9 50.8 86.6 3QH2 ACC ILE C 143 138 -> ILE C 147 142 3.0 166.6 116.5 8.5 81.3 3QH2 DNR LYS C 144 139 -> LEU C 140 135 3.2 151.4 122.7 11.5 62.9 3QH2 DNR GLN C 145 140 -> SER C 141 136 3.1 152.4 118.1 22.9 58.0 3QH2 DNR GLN C 145 140 -> ASP C 142 137 3.2 107.8 122.2 55.6 84.1 3QH2 DNR ARG C 146 141 -> ASP C 142 137 3.0 157.0 118.2 27.6 54.2 3QH2 DNR ARG C 146 141 -> ILE C 143 138 3.1 109.4 120.9 50.8 86.6 3QH2 DNR ILE C 147 142 -> ILE C 143 138 3.0 166.6 116.5 8.5 81.3 3QH2 ACC PRO C 150 145 -> VAL C 118 118 3.2 160.3 110.0 4.7 62.2 3QH2 ACC VAL C 151 146 -> ASP C 171 166 3.0 159.8 124.8 27.6 33.4 3QH2 DNR ILE C 152 147 -> VAL C 118 118 3.0 152.9 121.7 14.0 54.4 3QH2 ACC ILE C 152 147 -> PHE C 120 120 3.0 164.0 108.0 1.8 81.3 3QH2 DNR ALA C 153 148 -> GLY C 172 167 3.0 140.8 114.3 0.5 57.2 3QH2 ACC ALA C 153 148 -> ALA C 174 169 3.0 164.2 108.3 26.8 72.9 3QH2 DNR ILE C 154 149 -> PHE C 120 120 3.0 149.4 115.5 23.7 74.2 3QH2 ACC ILE C 154 149 -> VAL C 123 123 3.0 146.8 118.4 16.4 33.0 3QH2 ACC GLY C 155 150 -> PHE C 124 124 3.1 132.3 129.3 21.3 67.3 3QH2 ACC THR C 158 153 -> ARG C 161 156 3.1 124.7 117.8 44.0 82.7 3QH2 ACC THR C 158 153 -> LEU C 162 157 3.4 162.2 100.3 54.9 20.7 3QH2 ACC PRO C 159 154 -> LEU C 162 157 3.4 107.5 134.8 3.8 78.3 3QH2 DNR ARG C 161 156 -> THR C 158 153 3.1 124.7 117.8 44.0 82.7 3QH2 ACC ARG C 161 156 -> ASP C 164 159 3.3 118.0 118.5 55.3 74.1 3QH2 ACC ARG C 161 156 -> VAL C 165 160 3.3 157.7 114.7 12.4 18.6 3QH2 DNR LEU C 162 157 -> THR C 158 153 3.4 162.2 100.3 54.9 20.7 3QH2 DNR LEU C 162 157 -> PRO C 159 154 3.4 107.5 134.8 3.8 78.3 3QH2 ACC LEU C 162 157 -> LYS C 166 161 3.0 158.6 122.8 16.4 72.8 3QH2 ACC ARG C 163 158 -> LYS C 166 161 3.2 108.8 121.8 59.3 81.8 3QH2 ACC ARG C 163 158 -> GLN C 167 162 3.0 158.3 122.0 17.9 50.7 3QH2 DNR ASP C 164 159 -> ARG C 161 156 3.3 118.0 118.5 55.3 74.1 3QH2 ACC ASP C 164 159 -> ALA C 168 163 3.0 152.6 113.2 22.2 55.9 3QH2 DNR VAL C 165 160 -> ARG C 161 156 3.3 157.7 114.7 12.4 18.6 3QH2 ACC VAL C 165 160 -> ALA C 168 163 3.3 101.2 122.5 56.5 83.9 3QH2 ACC VAL C 165 160 -> GLY C 169 164 3.3 143.3 105.2 35.4 53.4 3QH2 ACC VAL C 165 160 -> ALA C 170 165 3.4 153.2 127.6 12.5 50.4 3QH2 DNR LYS C 166 161 -> LEU C 162 157 3.0 158.6 122.8 16.4 72.8 3QH2 DNR LYS C 166 161 -> ARG C 163 158 3.2 108.8 121.8 59.3 81.8 3QH2 ACC LYS C 166 161 -> GLY C 169 164 3.0 110.1 132.6 39.0 86.0 3QH2 DNR GLN C 167 162 -> ARG C 163 158 3.0 158.3 122.0 17.9 50.7 3QH2 DNR ALA C 168 163 -> ASP C 164 159 3.0 152.6 113.2 22.2 55.9 3QH2 DNR ALA C 168 163 -> VAL C 165 160 3.3 101.2 122.5 56.5 83.9 3QH2 DNR GLY C 169 164 -> VAL C 165 160 3.3 143.3 105.2 35.4 53.4 3QH2 DNR GLY C 169 164 -> LYS C 166 161 3.0 110.1 132.6 39.0 86.0 3QH2 DNR ALA C 170 165 -> VAL C 165 160 3.4 153.2 127.6 12.5 50.4 3QH2 DNR ASP C 171 166 -> VAL C 151 146 3.0 159.8 124.8 27.6 33.4 3QH2 ACC ASP C 171 166 -> GLU C 2 2 3.2 137.0 109.2 15.6 11.0 3QH2 ACC GLY C 172 167 -> ALA C 153 148 3.0 140.8 114.3 0.5 57.2 3QH2 DNR ILE C 173 168 -> GLU C 2 2 3.0 160.0 104.8 5.7 89.3 3QH2 ACC ILE C 173 168 -> HIS C 4 4 3.0 162.9 121.7 13.1 26.4 3QH2 DNR ALA C 174 169 -> ALA C 153 148 3.0 164.2 108.3 26.8 72.9 3QH2 DNR VAL C 175 170 -> HIS C 4 4 3.0 173.4 107.8 18.1 30.0 3QH2 ACC VAL C 175 170 -> ILE C 6 6 3.0 152.4 115.2 22.5 74.8 3QH2 ACC MET C 176 171 -> ILE C 179 174 3.1 131.2 128.7 8.8 63.7 3QH2 ACC MET C 176 171 -> PHE C 180 175 3.0 160.6 120.8 10.4 40.3 3QH2 ACC SER C 177 172 -> SER C 181 176 3.1 128.8 140.2 6.5 38.9 3QH2 DNR ILE C 179 174 -> MET C 176 171 3.1 131.2 128.7 8.8 63.7 3QH2 ACC ILE C 179 174 -> SER C 182 177 3.2 116.8 132.6 12.2 75.0 3QH2 DNR PHE C 180 175 -> MET C 176 171 3.0 160.6 120.8 10.4 40.3 3QH2 DNR SER C 181 176 -> SER C 177 172 3.1 128.8 140.2 6.5 38.9 3QH2 DNR SER C 182 177 -> ILE C 179 174 3.2 116.8 132.6 12.2 75.0 3QH2 ACC GLU C 184 179 -> GLU C 187 182 3.0 127.3 117.8 58.4 79.3 3QH2 ACC GLU C 184 179 -> ALA C 188 183 3.0 164.4 114.9 5.5 17.9 3QH2 ACC PRO C 185 180 -> ALA C 189 184 3.0 155.0 119.6 16.0 61.8 3QH2 ACC LEU C 186 181 -> ARG C 190 185 3.1 150.9 119.8 18.8 69.7 3QH2 DNR GLU C 187 182 -> GLU C 184 179 3.0 127.3 117.8 58.4 79.3 3QH2 ACC GLU C 187 182 -> ARG C 190 185 3.1 113.4 121.7 57.2 84.4 3QH2 ACC GLU C 187 182 -> ARG C 191 186 3.0 162.8 114.7 7.4 39.8 3QH2 DNR ALA C 188 183 -> GLU C 184 179 3.0 164.4 114.9 5.5 17.9 3QH2 ACC ALA C 188 183 -> TYR C 192 187 3.3 155.0 107.4 20.7 42.6 3QH2 DNR ALA C 189 184 -> PRO C 185 180 3.0 155.0 119.6 16.0 61.8 3QH2 ACC ALA C 189 184 -> TYR C 192 187 3.1 108.5 128.4 50.8 79.3 3QH2 ACC ALA C 189 184 -> SER C 193 188 3.1 154.1 113.9 18.0 33.6 3QH2 DNR ARG C 190 185 -> LEU C 186 181 3.1 150.9 119.8 18.8 69.7 3QH2 DNR ARG C 190 185 -> GLU C 187 182 3.1 113.4 121.7 57.2 84.4 3QH2 ACC ARG C 190 185 -> SER C 193 188 3.1 111.5 109.4 57.0 82.7 3QH2 ACC ARG C 190 185 -> ARG C 194 189 3.0 165.9 125.1 18.2 65.8 3QH2 DNR ARG C 191 186 -> GLU C 187 182 3.0 162.8 114.7 7.4 39.8 3QH2 ACC ARG C 191 186 -> LYS C 195 190 3.3 140.8 132.0 2.6 80.7 3QH2 DNR TYR C 192 187 -> ALA C 188 183 3.3 155.0 107.4 20.7 42.6 3QH2 DNR TYR C 192 187 -> ALA C 189 184 3.1 108.5 128.4 50.8 79.3 3QH2 ACC TYR C 192 187 -> LEU C 196 191 3.0 151.7 121.7 17.0 52.2 3QH2 DNR SER C 193 188 -> ALA C 189 184 3.1 154.1 113.9 18.0 33.6 3QH2 DNR SER C 193 188 -> ARG C 190 185 3.1 111.5 109.4 57.0 82.7 3QH2 ACC SER C 193 188 -> LYS C 197 192 3.0 140.0 123.9 21.8 72.3 3QH2 DNR ARG C 194 189 -> ARG C 190 185 3.0 165.9 125.1 18.2 65.8 3QH2 ACC ARG C 194 189 -> GLU C 198 193 3.0 161.5 119.1 14.8 64.7 3QH2 DNR LYS C 195 190 -> ARG C 191 186 3.3 140.8 132.0 2.6 80.7 3QH2 ACC LYS C 195 190 -> MET C 199 194 3.3 156.5 113.7 9.0 61.3 3QH2 DNR LEU C 196 191 -> TYR C 192 187 3.0 151.7 121.7 17.0 52.2 3QH2 ACC LEU C 196 191 -> MET C 199 194 3.4 109.3 113.9 58.5 81.2 3QH2 ACC LEU C 196 191 -> ARG C 200 195 3.4 152.5 114.8 28.4 47.1 3QH2 DNR LYS C 197 192 -> SER C 193 188 3.0 140.0 123.9 21.8 72.3 3QH2 ACC LYS C 197 192 -> ARG C 200 195 3.1 113.7 125.2 45.3 82.9 3QH2 DNR GLU C 198 193 -> ARG C 194 189 3.0 161.5 119.1 14.8 64.7 3QH2 DNR MET C 199 194 -> LYS C 195 190 3.3 156.5 113.7 9.0 61.3 3QH2 DNR MET C 199 194 -> LEU C 196 191 3.4 109.3 113.9 58.5 81.2 3QH2 DNR ARG C 200 195 -> LEU C 196 191 3.4 152.5 114.8 28.4 47.1 3QH2 DNR ARG C 200 195 -> LYS C 197 192 3.1 113.7 125.2 45.3 82.9 3QH2 DNR GLU D 2 3 -> ASP D 171 164 3.2 137.8 113.4 10.0 19.2 3QH2 ACC GLU D 2 3 -> ILE D 173 166 3.0 159.3 104.7 8.5 89.5 3QH2 ACC LEU D 3 4 -> ASP D 28 29 3.0 154.5 127.8 25.0 3.0 3QH2 ACC LEU D 3 4 -> PHE D 29 30 3.3 146.2 108.7 9.6 42.8 3QH2 DNR HIS D 4 5 -> ILE D 173 166 3.0 161.6 119.3 2.6 6.0 3QH2 ACC HIS D 4 5 -> VAL D 175 168 3.0 172.0 108.4 14.4 36.5 3QH2 DNR ALA D 5 6 -> PHE D 29 30 3.0 158.6 114.9 4.0 64.1 3QH2 ACC ALA D 5 6 -> HIS D 31 32 3.0 165.8 111.5 5.7 35.7 3QH2 DNR ILE D 6 7 -> VAL D 175 168 3.0 148.2 116.2 12.5 75.2 3QH2 DNR THR D 7 8 -> HIS D 31 32 3.1 167.6 121.9 0.9 1.4 3QH2 ACC PRO D 12 13 -> GLU D 15 16 3.1 124.8 122.8 52.4 71.7 3QH2 ACC PRO D 12 13 -> LEU D 16 17 3.0 165.1 116.3 5.1 16.5 3QH2 ACC VAL D 13 14 -> ALA D 17 18 3.0 160.6 124.0 10.3 78.5 3QH2 ACC GLU D 14 15 -> ARG D 18 19 3.4 144.8 119.4 18.8 68.5 3QH2 DNR GLU D 15 16 -> PRO D 12 13 3.1 124.8 122.8 52.4 71.7 3QH2 ACC GLU D 15 16 -> ARG D 18 19 3.2 112.1 120.1 55.7 82.5 3QH2 ACC GLU D 15 16 -> ILE D 19 20 3.2 157.4 114.7 12.6 40.4 3QH2 DNR LEU D 16 17 -> PRO D 12 13 3.0 165.1 116.3 5.1 16.5 3QH2 ACC LEU D 16 17 -> ILE D 20 21 3.0 166.1 118.3 5.4 57.1 3QH2 DNR ALA D 17 18 -> VAL D 13 14 3.0 160.6 124.0 10.3 78.5 3QH2 ACC ALA D 17 18 -> ILE D 21 22 3.1 156.3 119.6 9.3 69.2 3QH2 DNR ARG D 18 19 -> GLU D 14 15 3.4 144.8 119.4 18.8 68.5 3QH2 DNR ARG D 18 19 -> GLU D 15 16 3.2 112.1 120.1 55.7 82.5 3QH2 ACC ARG D 18 19 -> THR D 22 23 3.1 149.4 123.2 26.7 60.9 3QH2 DNR ILE D 19 20 -> GLU D 15 16 3.2 157.4 114.7 12.6 40.4 3QH2 ACC ILE D 19 20 -> THR D 22 23 3.1 110.9 121.6 55.3 86.3 3QH2 ACC ILE D 19 20 -> ILE D 23 24 3.1 166.1 111.9 21.8 69.2 3QH2 DNR ILE D 20 21 -> LEU D 16 17 3.0 166.1 118.3 5.4 57.1 3QH2 DNR ILE D 21 22 -> ALA D 17 18 3.1 156.3 119.6 9.3 69.2 3QH2 DNR THR D 22 23 -> ARG D 18 19 3.1 149.4 123.2 26.7 60.9 3QH2 DNR THR D 22 23 -> ILE D 19 20 3.1 110.9 121.6 55.3 86.3 3QH2 DNR ILE D 23 24 -> ILE D 19 20 3.1 166.1 111.9 21.8 69.2 3QH2 ACC ILE D 23 24 -> GLU D 26 27 3.0 129.8 129.6 12.7 74.0 3QH2 DNR GLU D 26 27 -> ILE D 23 24 3.0 129.8 129.6 12.7 74.0 3QH2 DNR ASP D 28 29 -> LEU D 3 4 3.0 154.5 127.8 25.0 3.0 3QH2 DNR PHE D 29 30 -> LEU D 3 4 3.3 146.2 108.7 9.6 42.8 3QH2 ACC PHE D 29 30 -> ALA D 5 6 3.0 158.6 114.9 4.0 64.1 3QH2 DNR ILE D 30 31 -> LYS D 58 59 3.0 154.9 108.0 4.4 89.1 3QH2 ACC ILE D 30 31 -> VAL D 60 61 3.0 150.2 117.5 15.4 73.0 3QH2 DNR HIS D 31 32 -> ALA D 5 6 3.0 165.8 111.5 5.7 35.7 3QH2 ACC HIS D 31 32 -> THR D 7 8 3.1 167.6 121.9 0.9 1.4 3QH2 DNR ILE D 32 33 -> VAL D 60 61 3.0 177.8 111.0 8.4 21.2 3QH2 ACC ILE D 32 33 -> ASN D 62 63 3.1 146.4 134.3 5.9 63.6 3QH2 ACC GLU D 34 35 -> LYS D 37 38 3.1 124.8 131.5 7.4 73.3 3QH2 DNR LYS D 37 38 -> GLU D 34 35 3.1 124.8 131.5 7.4 73.3 3QH2 ACC SER D 38 39 -> ASP D 41 42 3.2 109.9 123.1 53.4 85.8 3QH2 ACC SER D 38 39 -> ILE D 42 43 3.0 155.5 116.8 19.7 44.4 3QH2 ACC ALA D 39 40 -> ILE D 42 43 3.1 107.1 117.6 58.7 88.2 3QH2 ACC ALA D 39 40 -> LEU D 43 44 3.0 162.6 122.6 7.3 76.8 3QH2 ACC ALA D 40 41 -> LYS D 44 45 3.1 141.9 119.7 31.6 66.8 3QH2 DNR ASP D 41 42 -> SER D 38 39 3.2 109.9 123.1 53.4 85.8 3QH2 ACC ASP D 41 42 -> LYS D 44 45 3.2 102.1 128.7 53.6 82.7 3QH2 ACC ASP D 41 42 -> LEU D 45 46 3.0 151.3 115.7 16.3 53.9 3QH2 DNR ILE D 42 43 -> SER D 38 39 3.0 155.5 116.8 19.7 44.4 3QH2 DNR ILE D 42 43 -> ALA D 39 40 3.1 107.1 117.6 58.7 88.2 3QH2 ACC ILE D 42 43 -> LEU D 46 47 3.0 161.4 115.1 15.3 55.9 3QH2 DNR LEU D 43 44 -> ALA D 39 40 3.0 162.6 122.6 7.3 76.8 3QH2 ACC LEU D 43 44 -> ASP D 47 48 3.0 141.4 126.5 13.5 74.7 3QH2 DNR LYS D 44 45 -> ALA D 40 41 3.1 141.9 119.7 31.6 66.8 3QH2 DNR LYS D 44 45 -> ASP D 41 42 3.2 102.1 128.7 53.6 82.7 3QH2 ACC LYS D 44 45 -> LEU D 48 49 3.0 152.3 116.6 16.5 64.6 3QH2 DNR LEU D 45 46 -> ASP D 41 42 3.0 151.3 115.7 16.3 53.9 3QH2 ACC LEU D 45 46 -> LEU D 48 49 3.1 109.6 120.6 59.1 80.7 3QH2 ACC LEU D 45 46 -> ILE D 49 50 3.1 157.9 113.2 17.1 36.7 3QH2 DNR LEU D 46 47 -> ILE D 42 43 3.0 161.4 115.1 15.3 55.9 3QH2 ACC LEU D 46 47 -> ILE D 49 50 3.2 111.5 115.2 56.0 88.3 3QH2 ACC LEU D 46 47 -> PHE D 50 51 3.0 166.4 125.4 10.6 86.4 3QH2 DNR ASP D 47 48 -> LEU D 43 44 3.0 141.4 126.5 13.5 74.7 3QH2 ACC ASP D 47 48 -> GLU D 51 52 3.1 150.2 126.2 4.1 86.7 3QH2 DNR LEU D 48 49 -> LYS D 44 45 3.0 152.3 116.6 16.5 64.6 3QH2 DNR LEU D 48 49 -> LEU D 45 46 3.1 109.6 120.6 59.1 80.7 3QH2 ACC LEU D 48 49 -> GLY D 52 53 3.0 144.2 125.1 40.4 64.6 3QH2 DNR ILE D 49 50 -> LEU D 45 46 3.1 157.9 113.2 17.1 36.7 3QH2 DNR ILE D 49 50 -> LEU D 46 47 3.2 111.5 115.2 56.0 88.3 3QH2 ACC ILE D 49 50 -> GLY D 52 53 3.3 97.0 129.7 55.2 89.1 3QH2 ACC ILE D 49 50 -> GLY D 53 54 3.1 145.4 98.7 46.7 73.1 3QH2 ACC ILE D 49 50 -> ILE D 54 55 3.1 157.3 125.8 10.3 71.7 3QH2 DNR PHE D 50 51 -> LEU D 46 47 3.0 166.4 125.4 10.6 86.4 3QH2 ACC PHE D 50 51 -> GLY D 53 54 3.0 110.0 138.0 18.0 80.9 3QH2 DNR GLU D 51 52 -> ASP D 47 48 3.1 150.2 126.2 4.1 86.7 3QH2 DNR GLY D 52 53 -> LEU D 48 49 3.0 144.2 125.1 40.4 64.6 3QH2 DNR GLY D 52 53 -> ILE D 49 50 3.3 97.0 129.7 55.2 89.1 3QH2 DNR GLY D 53 54 -> ILE D 49 50 3.1 145.4 98.7 46.7 73.1 3QH2 DNR GLY D 53 54 -> PHE D 50 51 3.0 110.0 138.0 18.0 80.9 3QH2 DNR ILE D 54 55 -> ILE D 49 50 3.1 157.3 125.8 10.3 71.7 3QH2 ACC ASP D 55 56 -> LYS D 58 59 3.1 128.6 128.9 10.0 62.6 3QH2 ACC LYS D 56 57 -> LEU D 59 60 3.1 116.3 132.1 4.0 79.1 3QH2 DNR LYS D 58 59 -> ASP D 55 56 3.1 128.6 128.9 10.0 62.6 3QH2 ACC LYS D 58 59 -> ILE D 30 31 3.0 154.9 108.0 4.4 89.1 3QH2 DNR LEU D 59 60 -> LYS D 56 57 3.1 116.3 132.1 4.0 79.1 3QH2 DNR VAL D 60 61 -> ILE D 30 31 3.0 150.2 117.5 15.4 73.0 3QH2 ACC VAL D 60 61 -> ILE D 32 33 3.0 177.8 111.0 8.4 21.2 3QH2 DNR MET D 61 62 -> ARG D 75 76 3.0 147.5 112.6 13.0 53.5 3QH2 ACC MET D 61 62 -> GLN D 77 78 3.0 144.5 105.8 0.7 63.9 3QH2 DNR ASN D 62 63 -> ILE D 32 33 3.1 146.4 134.3 5.9 63.6 3QH2 ACC ASN D 62 63 -> ARG D 64 65 3.0 93.6 94.6 4.1 35.8 3QH2 DNR GLY D 63 64 -> GLN D 77 78 3.0 162.3 113.7 23.5 60.6 3QH2 ACC GLY D 63 64 -> VAL D 65 66 3.0 96.8 91.1 23.2 33.6 3QH2 DNR ARG D 64 65 -> ASN D 62 63 3.0 93.6 94.6 4.1 35.8 3QH2 ACC ARG D 64 65 -> ILE D 67 68 3.1 114.4 119.0 54.7 88.2 3QH2 ACC ARG D 64 65 -> ALA D 68 69 3.2 159.4 114.6 10.7 39.9 3QH2 DNR VAL D 65 66 -> GLY D 63 64 3.0 96.8 91.1 23.2 33.6 3QH2 ACC VAL D 65 66 -> LEU D 69 70 3.0 162.5 115.0 8.4 44.2 3QH2 ACC ASP D 66 67 -> PHE D 70 71 3.3 156.8 118.0 12.6 73.5 3QH2 DNR ILE D 67 68 -> ARG D 64 65 3.1 114.4 119.0 54.7 88.2 3QH2 DNR ALA D 68 69 -> ARG D 64 65 3.2 159.4 114.6 10.7 39.9 3QH2 ACC ALA D 68 69 -> SER D 71 72 3.2 114.3 137.5 1.6 74.9 3QH2 ACC ALA D 68 69 -> ILE D 73 74 3.2 145.6 127.3 25.9 36.2 3QH2 DNR LEU D 69 70 -> VAL D 65 66 3.0 162.5 115.0 8.4 44.2 3QH2 DNR PHE D 70 71 -> ASP D 66 67 3.3 156.8 118.0 12.6 73.5 3QH2 DNR SER D 71 72 -> ALA D 68 69 3.2 114.3 137.5 1.6 74.9 3QH2 DNR ILE D 73 74 -> ALA D 68 69 3.2 145.6 127.3 25.9 36.2 3QH2 ACC HIS D 74 75 -> HIS D 96 97 3.0 163.2 116.1 5.8 45.2 3QH2 ACC ARG D 75 76 -> MET D 61 62 3.0 147.5 112.6 13.0 53.5 3QH2 DNR VAL D 76 77 -> HIS D 96 97 3.1 173.2 107.8 2.1 17.9 3QH2 ACC VAL D 76 77 -> GLY D 98 99 3.0 162.7 118.5 2.6 16.3 3QH2 DNR GLN D 77 78 -> MET D 61 62 3.0 144.5 105.8 0.7 63.9 3QH2 ACC GLN D 77 78 -> GLY D 63 64 3.0 162.3 113.7 23.5 60.6 3QH2 DNR LEU D 78 79 -> GLY D 98 99 3.0 145.0 120.9 14.5 78.5 3QH2 ACC LEU D 78 79 -> SER D 100 101 3.1 153.2 116.8 2.3 75.8 3QH2 ACC PRO D 79 80 -> SER D 82 83 3.2 131.2 129.0 6.8 72.1 3QH2 DNR SER D 82 83 -> PRO D 79 80 3.2 131.2 129.0 6.8 72.1 3QH2 ACC SER D 84 85 -> GLN D 87 88 3.2 118.3 118.6 57.6 82.9 3QH2 ACC SER D 84 85 -> ILE D 88 89 3.3 157.3 114.4 12.5 25.6 3QH2 ACC PRO D 85 86 -> ARG D 89 90 3.0 153.4 124.2 15.9 68.4 3QH2 ACC LYS D 86 87 -> ALA D 90 91 3.1 149.1 124.1 28.5 83.3 3QH2 DNR GLN D 87 88 -> SER D 84 85 3.2 118.3 118.6 57.6 82.9 3QH2 ACC GLN D 87 88 -> ALA D 90 91 3.3 106.8 125.1 48.0 76.6 3QH2 DNR ILE D 88 89 -> SER D 84 85 3.3 157.3 114.4 12.5 25.6 3QH2 ACC ILE D 88 89 -> ARG D 91 92 3.3 116.2 124.3 41.0 75.2 3QH2 ACC ILE D 88 89 -> PHE D 92 93 3.0 162.9 127.0 26.9 26.2 3QH2 DNR ARG D 89 90 -> PRO D 85 86 3.0 153.4 124.2 15.9 68.4 3QH2 DNR ALA D 90 91 -> LYS D 86 87 3.1 149.1 124.1 28.5 83.3 3QH2 DNR ALA D 90 91 -> GLN D 87 88 3.3 106.8 125.1 48.0 76.6 3QH2 DNR ARG D 91 92 -> ILE D 88 89 3.3 116.2 124.3 41.0 75.2 3QH2 DNR PHE D 92 93 -> ILE D 88 89 3.0 162.9 127.0 26.9 26.2 3QH2 ACC PHE D 92 93 -> LEU D 95 96 3.1 133.3 126.2 11.7 60.3 3QH2 DNR LEU D 95 96 -> PHE D 92 93 3.1 133.3 126.2 11.7 60.3 3QH2 DNR HIS D 96 97 -> HIS D 74 75 3.0 163.2 116.1 5.8 45.2 3QH2 ACC HIS D 96 97 -> VAL D 76 77 3.1 173.2 107.8 2.1 17.9 3QH2 ACC ILE D 97 98 -> ASP D 116 117 3.0 163.7 127.2 18.4 22.7 3QH2 DNR GLY D 98 99 -> VAL D 76 77 3.0 162.7 118.5 2.6 16.3 3QH2 ACC GLY D 98 99 -> LEU D 78 79 3.0 145.0 120.9 14.5 78.5 3QH2 DNR ARG D 99 100 -> TYR D 117 118 3.1 150.8 108.4 7.7 40.6 3QH2 ACC ARG D 99 100 -> LEU D 119 120 3.0 147.2 106.0 9.9 63.5 3QH2 DNR SER D 100 101 -> LEU D 78 79 3.1 153.2 116.8 2.3 75.8 3QH2 DNR VAL D 101 102 -> LEU D 119 120 3.0 162.7 114.6 1.1 87.9 3QH2 ACC VAL D 101 102 -> GLY D 121 122 3.4 166.7 103.1 0.3 1.4 3QH2 ACC SER D 103 104 -> ALA D 107 108 3.1 152.1 121.6 26.0 63.6 3QH2 ACC LEU D 104 105 -> ALA D 107 108 3.2 109.2 126.8 55.0 80.8 3QH2 ACC LEU D 104 105 -> VAL D 108 109 3.0 158.8 116.3 15.8 45.2 3QH2 ACC GLU D 105 106 -> GLN D 109 110 3.0 152.8 121.6 15.3 68.4 3QH2 ACC GLU D 106 107 -> ALA D 110 111 3.0 148.0 120.7 20.7 68.7 3QH2 DNR ALA D 107 108 -> SER D 103 104 3.1 152.1 121.6 26.0 63.6 3QH2 DNR ALA D 107 108 -> LEU D 104 105 3.2 109.2 126.8 55.0 80.8 3QH2 ACC ALA D 107 108 -> GLU D 111 112 3.2 152.5 115.1 16.1 66.8 3QH2 DNR VAL D 108 109 -> LEU D 104 105 3.0 158.8 116.3 15.8 45.2 3QH2 ACC VAL D 108 109 -> GLU D 111 112 3.3 108.3 123.1 55.9 79.8 3QH2 ACC VAL D 108 109 -> LYS D 112 113 3.2 149.9 116.3 24.8 40.1 3QH2 DNR GLN D 109 110 -> GLU D 105 106 3.0 152.8 121.6 15.3 68.4 3QH2 ACC GLN D 109 110 -> LYS D 112 113 3.1 107.6 122.3 57.7 89.1 3QH2 ACC GLN D 109 110 -> GLU D 113 114 3.0 158.4 114.1 25.6 59.8 3QH2 DNR ALA D 110 111 -> GLU D 106 107 3.0 148.0 120.7 20.7 68.7 3QH2 ACC ALA D 110 111 -> GLU D 113 114 3.3 102.2 125.1 52.4 84.6 3QH2 ACC ALA D 110 111 -> ASP D 114 115 3.3 145.7 91.9 59.6 57.8 3QH2 ACC ALA D 110 111 -> ALA D 115 116 3.1 153.7 128.6 4.7 70.5 3QH2 DNR GLU D 111 112 -> ALA D 107 108 3.2 152.5 115.1 16.1 66.8 3QH2 DNR GLU D 111 112 -> VAL D 108 109 3.3 108.3 123.1 55.9 79.8 3QH2 ACC GLU D 111 112 -> ASP D 114 115 3.1 106.6 137.8 1.6 82.4 3QH2 DNR LYS D 112 113 -> VAL D 108 109 3.2 149.9 116.3 24.8 40.1 3QH2 DNR LYS D 112 113 -> GLN D 109 110 3.1 107.6 122.3 57.7 89.1 3QH2 DNR GLU D 113 114 -> GLN D 109 110 3.0 158.4 114.1 25.6 59.8 3QH2 DNR GLU D 113 114 -> ALA D 110 111 3.3 102.2 125.1 52.4 84.6 3QH2 DNR ASP D 114 115 -> ALA D 110 111 3.3 145.7 91.9 59.6 57.8 3QH2 DNR ASP D 114 115 -> GLU D 111 112 3.1 106.6 137.8 1.6 82.4 3QH2 DNR ALA D 115 116 -> ALA D 110 111 3.1 153.7 128.6 4.7 70.5 3QH2 DNR ASP D 116 117 -> ILE D 97 98 3.0 163.7 127.2 18.4 22.7 3QH2 ACC TYR D 117 118 -> ARG D 99 100 3.1 150.8 108.4 7.7 40.6 3QH2 DNR VAL D 118 119 -> PRO D 150 143 3.1 160.4 112.2 5.8 66.6 3QH2 ACC VAL D 118 119 -> ILE D 152 145 3.0 157.5 119.9 9.6 42.7 3QH2 DNR LEU D 119 120 -> ARG D 99 100 3.0 147.2 106.0 9.9 63.5 3QH2 ACC LEU D 119 120 -> VAL D 101 102 3.0 162.7 114.6 1.1 87.9 3QH2 DNR PHE D 120 121 -> ILE D 152 145 3.0 160.3 108.0 14.2 82.7 3QH2 ACC PHE D 120 121 -> ILE D 154 147 3.0 150.1 115.4 19.2 73.4 3QH2 DNR GLY D 121 122 -> VAL D 101 102 3.4 166.7 103.1 0.3 1.4 3QH2 ACC HIS D 122 123 -> ARG D 135 128 3.0 162.2 125.5 2.1 1.0 3QH2 DNR VAL D 123 124 -> ILE D 154 147 3.0 147.7 108.9 10.7 41.3 3QH2 ACC VAL D 123 124 -> ARG D 135 128 3.3 116.6 92.2 59.0 65.3 3QH2 ACC VAL D 123 124 -> GLY D 136 129 3.0 137.2 129.8 3.4 1.5 3QH2 DNR PHE D 124 125 -> GLY D 155 148 3.1 142.6 134.7 2.1 69.5 3QH2 DNR ARG D 135 128 -> HIS D 122 123 3.0 162.2 125.5 2.1 1.0 3QH2 DNR ARG D 135 128 -> VAL D 123 124 3.3 116.6 92.2 59.0 65.3 3QH2 DNR GLY D 136 129 -> VAL D 123 124 3.0 137.2 129.8 3.4 1.5 3QH2 ACC VAL D 137 130 -> SER D 141 134 3.0 154.7 117.9 14.3 78.6 3QH2 ACC SER D 138 131 -> SER D 141 134 3.4 105.0 119.3 59.4 84.3 3QH2 ACC SER D 138 131 -> ASP D 142 135 3.1 151.3 117.0 20.7 54.3 3QH2 ACC LEU D 139 132 -> ASP D 142 135 3.3 103.6 121.2 59.3 88.4 3QH2 ACC LEU D 139 132 -> ILE D 143 136 3.0 157.7 121.6 5.9 75.2 3QH2 ACC LEU D 140 133 -> LYS D 144 137 3.0 153.1 123.0 22.2 61.8 3QH2 DNR SER D 141 134 -> VAL D 137 130 3.0 154.7 117.9 14.3 78.6 3QH2 DNR SER D 141 134 -> SER D 138 131 3.4 105.0 119.3 59.4 84.3 3QH2 ACC SER D 141 134 -> GLN D 145 138 3.3 143.7 111.9 24.6 63.3 3QH2 DNR ASP D 142 135 -> SER D 138 131 3.1 151.3 117.0 20.7 54.3 3QH2 DNR ASP D 142 135 -> LEU D 139 132 3.3 103.6 121.2 59.3 88.4 3QH2 ACC ASP D 142 135 -> GLN D 145 138 3.2 113.8 120.4 48.9 85.7 3QH2 ACC ASP D 142 135 -> ARG D 146 139 3.0 160.3 119.2 27.7 40.8 3QH2 DNR ILE D 143 136 -> LEU D 139 132 3.0 157.7 121.6 5.9 75.2 3QH2 ACC ILE D 143 136 -> ARG D 146 139 3.0 112.5 122.0 50.4 87.6 3QH2 ACC ILE D 143 136 -> ILE D 147 140 3.1 168.3 112.0 17.2 78.7 3QH2 DNR LYS D 144 137 -> LEU D 140 133 3.0 153.1 123.0 22.2 61.8 3QH2 DNR GLN D 145 138 -> SER D 141 134 3.3 143.7 111.9 24.6 63.3 3QH2 DNR GLN D 145 138 -> ASP D 142 135 3.2 113.8 120.4 48.9 85.7 3QH2 DNR ARG D 146 139 -> ASP D 142 135 3.0 160.3 119.2 27.7 40.8 3QH2 DNR ARG D 146 139 -> ILE D 143 136 3.0 112.5 122.0 50.4 87.6 3QH2 DNR ILE D 147 140 -> ILE D 143 136 3.1 168.3 112.0 17.2 78.7 3QH2 ACC PRO D 150 143 -> VAL D 118 119 3.1 160.4 112.2 5.8 66.6 3QH2 ACC VAL D 151 144 -> ASP D 171 164 3.0 160.2 125.1 27.7 37.1 3QH2 DNR ILE D 152 145 -> VAL D 118 119 3.0 157.5 119.9 9.6 42.7 3QH2 ACC ILE D 152 145 -> PHE D 120 121 3.0 160.3 108.0 14.2 82.7 3QH2 DNR ALA D 153 146 -> GLY D 172 165 3.0 145.1 114.2 10.6 55.6 3QH2 ACC ALA D 153 146 -> ALA D 174 167 3.0 161.7 108.7 20.9 72.5 3QH2 DNR ILE D 154 147 -> PHE D 120 121 3.0 150.1 115.4 19.2 73.4 3QH2 ACC ILE D 154 147 -> VAL D 123 124 3.0 147.7 108.9 10.7 41.3 3QH2 ACC GLY D 155 148 -> PHE D 124 125 3.1 142.6 134.7 2.1 69.5 3QH2 ACC THR D 158 151 -> ARG D 161 154 3.0 123.6 132.5 8.0 79.5 3QH2 ACC PRO D 159 152 -> LEU D 162 155 3.4 109.8 130.1 3.7 78.6 3QH2 DNR ARG D 161 154 -> THR D 158 151 3.0 123.6 132.5 8.0 79.5 3QH2 ACC ARG D 161 154 -> ASP D 164 157 3.3 114.7 119.4 54.3 73.3 3QH2 ACC ARG D 161 154 -> VAL D 165 158 3.3 156.5 117.8 23.4 31.2 3QH2 DNR LEU D 162 155 -> PRO D 159 152 3.4 109.8 130.1 3.7 78.6 3QH2 ACC LEU D 162 155 -> VAL D 165 158 3.3 104.3 123.1 54.6 81.9 3QH2 ACC LEU D 162 155 -> LYS D 166 159 3.0 156.2 120.3 18.8 65.4 3QH2 ACC ARG D 163 156 -> LYS D 166 159 3.4 103.4 116.1 56.9 87.0 3QH2 ACC ARG D 163 156 -> GLN D 167 160 3.0 156.0 127.9 7.2 83.5 3QH2 DNR ASP D 164 157 -> ARG D 161 154 3.3 114.7 119.4 54.3 73.3 3QH2 ACC ASP D 164 157 -> ALA D 168 161 3.2 140.8 122.7 28.7 69.4 3QH2 DNR VAL D 165 158 -> ARG D 161 154 3.3 156.5 117.8 23.4 31.2 3QH2 DNR VAL D 165 158 -> LEU D 162 155 3.3 104.3 123.1 54.6 81.9 3QH2 ACC VAL D 165 158 -> ALA D 168 161 3.4 101.2 126.2 53.6 79.8 3QH2 ACC VAL D 165 158 -> GLY D 169 162 3.5 142.1 96.9 48.8 51.7 3QH2 ACC VAL D 165 158 -> ALA D 170 163 3.3 150.8 130.4 12.7 47.5 3QH2 DNR LYS D 166 159 -> LEU D 162 155 3.0 156.2 120.3 18.8 65.4 3QH2 DNR LYS D 166 159 -> ARG D 163 156 3.4 103.4 116.1 56.9 87.0 3QH2 ACC LYS D 166 159 -> GLY D 169 162 3.0 112.1 135.3 16.6 87.1 3QH2 DNR GLN D 167 160 -> ARG D 163 156 3.0 156.0 127.9 7.2 83.5 3QH2 DNR ALA D 168 161 -> ASP D 164 157 3.2 140.8 122.7 28.7 69.4 3QH2 DNR ALA D 168 161 -> VAL D 165 158 3.4 101.2 126.2 53.6 79.8 3QH2 DNR GLY D 169 162 -> VAL D 165 158 3.5 142.1 96.9 48.8 51.7 3QH2 DNR GLY D 169 162 -> LYS D 166 159 3.0 112.1 135.3 16.6 87.1 3QH2 DNR ALA D 170 163 -> VAL D 165 158 3.3 150.8 130.4 12.7 47.5 3QH2 DNR ASP D 171 164 -> VAL D 151 144 3.0 160.2 125.1 27.7 37.1 3QH2 ACC ASP D 171 164 -> GLU D 2 3 3.2 137.8 113.4 10.0 19.2 3QH2 ACC GLY D 172 165 -> ALA D 153 146 3.0 145.1 114.2 10.6 55.6 3QH2 DNR ILE D 173 166 -> GLU D 2 3 3.0 159.3 104.7 8.5 89.5 3QH2 ACC ILE D 173 166 -> HIS D 4 5 3.0 161.6 119.3 2.6 6.0 3QH2 DNR ALA D 174 167 -> ALA D 153 146 3.0 161.7 108.7 20.9 72.5 3QH2 DNR VAL D 175 168 -> HIS D 4 5 3.0 172.0 108.4 14.4 36.5 3QH2 ACC VAL D 175 168 -> ILE D 6 7 3.0 148.2 116.2 12.5 75.2 3QH2 ACC MET D 176 169 -> ILE D 179 172 3.2 126.3 130.8 16.0 63.2 3QH2 ACC MET D 176 169 -> PHE D 180 173 3.0 163.2 122.6 11.6 31.2 3QH2 ACC SER D 177 170 -> SER D 181 174 3.0 128.6 142.0 0.5 33.9 3QH2 DNR ILE D 179 172 -> MET D 176 169 3.2 126.3 130.8 16.0 63.2 3QH2 ACC ILE D 179 172 -> SER D 182 175 3.3 113.2 135.0 5.0 73.4 3QH2 DNR PHE D 180 173 -> MET D 176 169 3.0 163.2 122.6 11.6 31.2 3QH2 DNR SER D 181 174 -> SER D 177 170 3.0 128.6 142.0 0.5 33.9 3QH2 DNR SER D 182 175 -> ILE D 179 172 3.3 113.2 135.0 5.0 73.4 3QH2 ACC GLU D 184 177 -> GLU D 187 180 3.2 128.3 114.0 57.2 74.8 3QH2 ACC GLU D 184 177 -> ALA D 188 181 3.0 163.4 120.1 13.0 14.7 3QH2 ACC PRO D 185 178 -> ALA D 189 182 3.0 151.8 123.9 11.1 80.0 3QH2 ACC LEU D 186 179 -> ARG D 190 183 3.0 152.8 122.5 12.5 59.3 3QH2 DNR GLU D 187 180 -> GLU D 184 177 3.2 128.3 114.0 57.2 74.8 3QH2 ACC GLU D 187 180 -> ARG D 191 184 3.0 158.4 114.2 17.1 74.4 3QH2 DNR ALA D 188 181 -> GLU D 184 177 3.0 163.4 120.1 13.0 14.7 3QH2 ACC ALA D 188 181 -> ARG D 191 184 3.2 112.7 123.0 53.7 84.3 3QH2 DNR ALA D 189 182 -> PRO D 185 178 3.0 151.8 123.9 11.1 80.0 3QH2 ACC ALA D 189 182 -> TYR D 192 185 3.0 117.3 126.8 50.4 80.5 3QH2 ACC ALA D 189 182 -> SER D 193 186 3.0 159.9 114.4 0.9 10.3 3QH2 DNR ARG D 190 183 -> LEU D 186 179 3.0 152.8 122.5 12.5 59.3 3QH2 ACC ARG D 190 183 -> ARG D 194 187 3.0 153.8 130.7 10.5 69.6 3QH2 DNR ARG D 191 184 -> GLU D 187 180 3.0 158.4 114.2 17.1 74.4 3QH2 DNR ARG D 191 184 -> ALA D 188 181 3.2 112.7 123.0 53.7 84.3 3QH2 ACC ARG D 191 184 -> LYS D 195 188 3.4 132.3 131.5 16.2 76.0 3QH2 DNR TYR D 192 185 -> ALA D 189 182 3.0 117.3 126.8 50.4 80.5 3QH2 ACC TYR D 192 185 -> LEU D 196 189 3.0 161.7 116.3 12.9 32.6 3QH2 DNR SER D 193 186 -> ALA D 189 182 3.0 159.9 114.4 0.9 10.3 3QH2 ACC SER D 193 186 -> LYS D 197 190 3.0 152.5 119.5 12.7 68.4 3QH2 DNR ARG D 194 187 -> ARG D 190 183 3.0 153.8 130.7 10.5 69.6 3QH2 ACC ARG D 194 187 -> GLU D 198 191 3.0 159.3 122.3 4.0 68.5 3QH2 DNR LYS D 195 188 -> ARG D 191 184 3.4 132.3 131.5 16.2 76.0 3QH2 ACC LYS D 195 188 -> MET D 199 192 3.1 156.4 117.2 17.3 58.9 3QH2 DNR LEU D 196 189 -> TYR D 192 185 3.0 161.7 116.3 12.9 32.6 3QH2 ACC LEU D 196 189 -> MET D 199 192 3.3 108.0 118.5 57.3 84.0 3QH2 ACC LEU D 196 189 -> ARG D 200 193 3.2 153.3 114.2 17.8 51.8 3QH2 DNR LYS D 197 190 -> SER D 193 186 3.0 152.5 119.5 12.7 68.4 3QH2 ACC LYS D 197 190 -> ARG D 200 193 3.0 115.5 123.6 56.0 84.5 3QH2 ACC LYS D 197 190 -> TYR D 201 194 3.1 162.3 112.4 22.6 27.6 3QH2 DNR GLU D 198 191 -> ARG D 194 187 3.0 159.3 122.3 4.0 68.5 3QH2 ACC GLU D 198 191 -> TYR D 201 194 3.1 113.0 116.5 48.6 85.9 3QH2 ACC GLU D 198 191 -> GLU D 202 195 3.1 164.3 112.1 36.0 66.9 3QH2 DNR MET D 199 192 -> LYS D 195 188 3.1 156.4 117.2 17.3 58.9 3QH2 DNR MET D 199 192 -> LEU D 196 189 3.3 108.0 118.5 57.3 84.0 3QH2 DNR ARG D 200 193 -> LEU D 196 189 3.2 153.3 114.2 17.8 51.8 3QH2 DNR ARG D 200 193 -> LYS D 197 190 3.0 115.5 123.6 56.0 84.5 3QH2 DNR TYR D 201 194 -> LYS D 197 190 3.1 162.3 112.4 22.6 27.6 3QH2 DNR TYR D 201 194 -> GLU D 198 191 3.1 113.0 116.5 48.6 85.9 3QH2 DNR GLU D 202 195 -> GLU D 198 191 3.1 164.3 112.1 36.0 66.9 3QH2