A0A5K4F9Y8_SCHMA Loading...

Alpha-taxilin

AlphaFold DB , UniProt , Accession A0A5K4F9Y8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 398 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M52.5Low76Confident190 Ų190121.4 Ų121.494%0.93663%0.634SS**  0-52.30-140.1159.858.100111.9Q3 E4 E5M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.16Å; M1-E4 PolarHBondContact O-N 3.34Å; M1-E5 PolarHBondContact O-N 3.27Å
2N65.2Low76.9Confident132 Ų132118.8 Ų118.871%0.70662%0.62SS**Hα-helixtrans-58.6-30.9178.3-69.44.2000115.6S6N2-S6 VanDerWaalsContact O-CB 3.32Å; N2-S6 WeakPolarHBondContact O-CB 3.41Å; N2-S6 PolarHBondContact O-N 3.39Å; N2-S6 PolarHBondContact O-OG 3.33Å
3Q73.5Confident77.7Confident156 Ų156118.4 Ų118.473%0.72961%0.613SS**Hα-helixtrans-80.5-28.9-174.3-151.9167.3-15.600113M1 S6 L7M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.16Å; Q3-S6 PolarHBondContact O-OG 2.88Å; Q3-L7 WeakPolarHBondContact O-CG 3.19Å; Q3-L7 PolarHBondContact O-N 3.4Å
4E75.4Confident78.5Confident157 Ų157115.4 Ų115.473%0.73460%0.598SS**Hα-helixtrans-83.5-37.5178-161165.2-159.900110.5M1 S8M1-E4 PolarHBondContact O-N 3.34Å; E4-S8 VanDerWaalsContact O-CB 3.24Å; E4-S8 WeakPolarHBondContact O-CB 3.32Å; E4-S8 PolarHBondContact O-N 3.3Å
5E78Confident79.2Confident129 Ų129113.4 Ų113.460%0.60359%0.585SS**Hα-helixtrans-62.8-38167.3-89.2-173.5146.300112.5M1 R9M1-E5 PolarHBondContact O-N 3.27Å; E5-R9 VanDerWaalsContact O-CB 3.31Å; E5-R9 WeakPolarHBondContact O-CB 3.46Å; E5-R9 PolarHBondContact O-N 2.78Å
6S79.3Confident80Confident64 Ų64113.7 Ų113.745%0.44858%0.581SS.*Hα-helixtrans-69.6-40.8178.174.30000112.4N2 Q3 R9 A10N2-S6 VanDerWaalsContact O-CB 3.32Å; N2-S6 WeakPolarHBondContact O-CB 3.41Å; N2-S6 PolarHBondContact O-N 3.39Å; N2-S6 PolarHBondContact O-OG 3.33Å; Q3-S6 PolarHBondContact O-OG 2.88Å; S6-R9 PolarHBondContact O-N 2.95Å; S6-A10 WeakPolarHBondContact O-CB 3.31Å; S6-A10 PolarHBondContact O-N 2.9Å
7L80.5Confident80.5Confident120 Ų120117.6 Ų117.663%0.62859%0.586SS**Hα-helixtrans-65.9-42.3173.8-79.4169.2000111.7Q3 A10 S11Q3-L7 WeakPolarHBondContact O-CG 3.19Å; Q3-L7 PolarHBondContact O-N 3.4Å; L7-A10 PolarHBondContact O-N 3.18Å; L7-S11 WeakPolarHBondContact O-CB 3.35Å; L7-S11 PolarHBondContact O-N 2.88Å
8S83.1Confident81.1Confident64 Ų64117.9 Ų117.945%0.44858%0.58SS.*Hα-helixtrans-63.2-45.2174.6-176.90000111.4E4 A10 S11 I12E4-S8 VanDerWaalsContact O-CB 3.24Å; E4-S8 WeakPolarHBondContact O-CB 3.32Å; E4-S8 PolarHBondContact O-N 3.3Å; S8-A10 VanDerWaalsContact C-N 3.35Å; S8-A10 PolarHBondContact O-N 3.25Å; S8-S11 PolarHBondContact O-N 3Å; S8-I12 WeakPolarHBondContact O-CB 3.33Å; S8-I12 VanDerWaalsContact O-CG1 3.23Å; S8-I12 WeakPolarHBondContact O-CG1 3.46Å; S8-I12 PolarHBondContact O-N 3.38Å
9R81.7Confident81.7Confident183 Ų183118.2 Ų118.269%0.69158%0.58SS**Hα-helixtrans-58.1-44.7172.2-106.8177169.1-102.82.8112.1E5 S6 I12 E13E5-R9 VanDerWaalsContact O-CB 3.31Å; E5-R9 WeakPolarHBondContact O-CB 3.46Å; E5-R9 PolarHBondContact O-N 2.78Å; S6-R9 PolarHBondContact O-N 2.95Å; R9-I12 PolarHBondContact O-N 3.4Å; R9-E13 VanDerWaalsContact O-CB 3.29Å; R9-E13 WeakPolarHBondContact O-CB 3.44Å; R9-E13 PolarHBondContact O-N 2.81Å
10A83.5Confident82.3Confident58 Ų58116.3 Ų116.348%0.47958%0.575SS.*Hα-helixtrans-64.5-41178.600000111.8S6 L7 S8 E13 D14S6-A10 WeakPolarHBondContact O-CB 3.31Å; S6-A10 PolarHBondContact O-N 2.9Å; L7-A10 PolarHBondContact O-N 3.18Å; S8-A10 VanDerWaalsContact C-N 3.35Å; S8-A10 PolarHBondContact O-N 3.25Å; A10-E13 PolarHBondContact O-N 3.32Å; A10-D14 VanDerWaalsContact O-CB 3.31Å; A10-D14 WeakPolarHBondContact O-CB 3.4Å; A10-D14 PolarHBondContact O-N 2.91Å
11S83.2Confident82.8Confident82 Ų82114 Ų11457%0.57357%0.57SS**Hα-helixtrans-64.5-43.5175.2-171.60000111.9L7 S8 D14 E15L7-S11 WeakPolarHBondContact O-CB 3.35Å; L7-S11 PolarHBondContact O-N 2.88Å; S8-S11 PolarHBondContact O-N 3Å; S11-D14 PolarHBondContact O-N 3.25Å; S11-E15 WeakPolarHBondContact O-CB 3.47Å; S11-E15 PolarHBondContact O-N 2.84Å
12I86.4Confident84.7Confident91 Ų91109.2 Ų109.247%0.46755%0.548SS..Hα-helixtrans-65.3-41.2175.8-67.4164.7000111.2S8 R9 E15 K16S8-I12 WeakPolarHBondContact O-CB 3.33Å; S8-I12 VanDerWaalsContact O-CG1 3.23Å; S8-I12 WeakPolarHBondContact O-CG1 3.46Å; S8-I12 PolarHBondContact O-N 3.38Å; R9-I12 PolarHBondContact O-N 3.4Å; I12-E15 PolarHBondContact O-N 3.37Å; I12-K16 WeakPolarHBondContact O-CB 3.36Å; I12-K16 WeakPolarHBondContact O-CG 3.42Å; I12-K16 PolarHBondContact O-N 2.82Å
13E88.1Confident86Confident113 Ų113109 Ų10953%0.52854%0.543SS..Hα-helixtrans-67.2-38.7176.5-163.290.4-130.600111.3R9 A10 K16 R17R9-E13 VanDerWaalsContact O-CB 3.29Å; R9-E13 WeakPolarHBondContact O-CB 3.44Å; R9-E13 PolarHBondContact O-N 2.81Å; A10-E13 PolarHBondContact O-N 3.32Å; E13-K16 PolarHBondContact O-N 3.38Å; E13-R17 PolarHBondContact O-N 2.89Å
14D88.4Confident87Confident76 Ų76107.7 Ų107.741%0.40654%0.535SS..Hα-helixtrans-67.5-40.1174.9-166.161.8000111.6A10 S11 R17 R18A10-D14 VanDerWaalsContact O-CB 3.31Å; A10-D14 WeakPolarHBondContact O-CB 3.4Å; A10-D14 PolarHBondContact O-N 2.91Å; S11-D14 PolarHBondContact O-N 3.25Å; D14-R17 PolarHBondContact O-N 3.23Å; D14-R18 WeakPolarHBondContact O-CB 3.5Å; D14-R18 PolarHBondContact O-N 2.96Å; D14-R18 IonicContact OD2-NH2 3.81Å; D14-R18 PolarHBondContact OD2-NH2 3.25Å
15E89.4Confident87.9Confident86 Ų86105.3 Ų105.340%0.40252%0.524SS..Hα-helixtrans-65.9-40.1173.8-168.661.8-158.900111.4S11 I12 R17 R18 E19S11-E15 WeakPolarHBondContact O-CB 3.47Å; S11-E15 PolarHBondContact O-N 2.84Å; I12-E15 PolarHBondContact O-N 3.37Å; E15-R17 PolarHBondContact O-N 3.36Å; E15-R18 CarbonylContact O-C 3.56Å; E15-R18 WeakPolarHBondContact O-CB 3.46Å; E15-R18 PolarHBondContact O-N 3.02Å; E15-R18 VanDerWaalsContact O-N 3.15Å; E15-R18 IonicContact OE2-CZ 2.64Å; E15-R18 IonicContact OE2-NE 2.63Å; E15-R18 IonicContact OE2-NH1 3.42Å; E15-E19 PolarHBondContact O-N 2.81Å
16K91.5Very high88.7Confident118 Ų118103.8 Ų103.851%0.51352%0.523SS..Hα-helixtrans-62-42.1171.2-77.3178.6-178.4-179.90112I12 E13 R18 V20I12-K16 WeakPolarHBondContact O-CB 3.36Å; I12-K16 WeakPolarHBondContact O-CG 3.42Å; I12-K16 PolarHBondContact O-N 2.82Å; E13-K16 PolarHBondContact O-N 3.38Å; K16-R18 VanDerWaalsContact C-N 3.28Å; K16-R18 PolarHBondContact O-N 3.17Å; K16-V20 WeakPolarHBondContact O-CB 3.48Å; K16-V20 WeakPolarHBondContact O-CG2 3.38Å; K16-V20 PolarHBondContact O-N 3.43Å
17R88.1Confident89.4Confident180 Ų180102.7 Ų102.768%0.67952%0.516SS*.Hα-helixtrans-62.3-39173.4-86.1-17387.6-115.15.4111.1E13 D14 E15 S21E13-R17 PolarHBondContact O-N 2.89Å; D14-R17 PolarHBondContact O-N 3.23Å; E15-R17 PolarHBondContact O-N 3.36Å; R17-S21 WeakPolarHBondContact O-CB 3.49Å; R17-S21 PolarHBondContact O-N 3.29Å
18R91.9Very high90.2Very high123 Ų123101 Ų10146%0.46451%0.507SS..Hα-helixtrans-65.9-50.3177.6-168.8-179.7-55.4-175.67.3111.2D14 E15 K16 V20 S21 D22D14-R18 WeakPolarHBondContact O-CB 3.5Å; D14-R18 PolarHBondContact O-N 2.96Å; D14-R18 IonicContact OD2-NH2 3.81Å; D14-R18 PolarHBondContact OD2-NH2 3.25Å; E15-R18 CarbonylContact O-C 3.56Å; E15-R18 WeakPolarHBondContact O-CB 3.46Å; E15-R18 PolarHBondContact O-N 3.02Å; E15-R18 VanDerWaalsContact O-N 3.15Å; E15-R18 IonicContact OE2-CZ 2.64Å; E15-R18 IonicContact OE2-NE 2.63Å; E15-R18 IonicContact OE2-NH1 3.42Å; K16-R18 VanDerWaalsContact C-N 3.28Å; K16-R18 PolarHBondContact O-N 3.17Å; R18-V20 VanDerWaalsContact C-N 3.33Å; R18-V20 PolarHBondContact O-N 3.01Å; R18-S21 CarbonylContact O-C 3.56Å; R18-S21 PolarHBondContact O-N 3.14Å; R18-S21 VanDerWaalsContact O-N 3.14Å; R18-D22 VanDerWaalsContact O-CB 3.3Å; R18-D22 WeakPolarHBondContact O-CB 3.45Å; R18-D22 PolarHBondContact O-N 2.83Å
19E93.1Very high90.7Very high124 Ų124100.6 Ų100.658%0.57950%0.502SS*.Hα-helixtrans-57.2-44.8174.1-81.6-173.8157.700111.8E15 D22 H23E15-E19 PolarHBondContact O-N 2.81Å; E19-D22 PolarHBondContact O-N 3.43Å; E19-H23 WeakPolarHBondContact O-CB 3.47Å; E19-H23 PolarHBondContact O-N 3.49Å
20V92.7Very high91.4Very high79 Ų7994.4 Ų94.448%0.47949%0.486SS..Hα-helixtrans-63.6-44.3176.6169.90000110.6K16 R18 H23 F24K16-V20 WeakPolarHBondContact O-CB 3.48Å; K16-V20 WeakPolarHBondContact O-CG2 3.38Å; K16-V20 PolarHBondContact O-N 3.43Å; R18-V20 VanDerWaalsContact C-N 3.33Å; R18-V20 PolarHBondContact O-N 3.01Å; V20-H23 PolarHBondContact O-N 2.99Å; V20-F24 HydrophobicContact CG1-CD2 3.6Å; V20-F24 HydrophobicContact CG1-CE2 3.45Å; V20-F24 VanDerWaalsContact CG1-CE2 3.45Å; V20-F24 WeakPolarHBondContact O-CD2 3.35Å; V20-F24 PolarHBondContact O-N 2.75Å
21S92.2Very high92Very high69 Ų6997 Ų9748%0.48349%0.491SS..Hα-helixtrans-64.5-43.6177.6-171.90000111.9R17 R18 H23 F24 Q25R17-S21 WeakPolarHBondContact O-CB 3.49Å; R17-S21 PolarHBondContact O-N 3.29Å; R18-S21 CarbonylContact O-C 3.56Å; R18-S21 PolarHBondContact O-N 3.14Å; R18-S21 VanDerWaalsContact O-N 3.14Å; S21-H23 VanDerWaalsContact C-N 3.35Å; S21-F24 PolarHBondContact O-N 3.44Å; S21-Q25 VanDerWaalsContact O-CB 3.23Å; S21-Q25 WeakPolarHBondContact O-CB 3.37Å; S21-Q25 PolarHBondContact O-N 2.81Å
22D93.4Very high92.6Very high89 Ų8998.6 Ų98.648%0.47649%0.489SS..Hα-helixtrans-68-36.8177.7-75.2-8.6000110.6R18 E19 Q25 T26R18-D22 VanDerWaalsContact O-CB 3.3Å; R18-D22 WeakPolarHBondContact O-CB 3.45Å; R18-D22 PolarHBondContact O-N 2.83Å; E19-D22 PolarHBondContact O-N 3.43Å; D22-Q25 PolarHBondContact O-N 3.34Å; D22-T26 WeakPolarHBondContact O-CB 3.49Å; D22-T26 PolarHBondContact O-N 2.84Å; D22-T26 PolarHBondContact O-OG1 3.5Å
23H93Very high93.1Very high127 Ų12798.6 Ų98.659%0.58849%0.49SS*.Hα-helixtrans-64.6-46172.1-178.7-79.4000111.2E19 V20 S21 S27E19-H23 WeakPolarHBondContact O-CB 3.47Å; E19-H23 PolarHBondContact O-N 3.49Å; V20-H23 PolarHBondContact O-N 2.99Å; S21-H23 VanDerWaalsContact C-N 3.35Å; H23-S27 VanDerWaalsContact O-CB 3.24Å; H23-S27 WeakPolarHBondContact O-CB 3.37Å; H23-S27 PolarHBondContact O-N 3.42Å; H23-S27 PolarHBondContact O-OG 2.95Å
24F93.6Very high93.5Very high129 Ų12998.7 Ų98.757%0.56649%0.491SS*.Hα-helixtrans-62.3-44.4173.8-83.1-63.8000111.6V20 S21 S27 I28V20-F24 HydrophobicContact CG1-CD2 3.6Å; V20-F24 HydrophobicContact CG1-CE2 3.45Å; V20-F24 VanDerWaalsContact CG1-CE2 3.45Å; V20-F24 WeakPolarHBondContact O-CD2 3.35Å; V20-F24 PolarHBondContact O-N 2.75Å; S21-F24 PolarHBondContact O-N 3.44Å; F24-S27 WeakPolarHBondContact O-CB 3.49Å; F24-S27 PolarHBondContact O-N 3.13Å; F24-I28 WeakPolarHBondContact O-CB 3.46Å; F24-I28 WeakPolarHBondContact O-CG1 3.48Å; F24-I28 PolarHBondContact O-N 3.31Å
25Q94.5Very high93.8Very high108 Ų108100 Ų10051%0.50550%0.497SS..Hα-helixtrans-65.1-42.9179.4-173.561.330.300111.5S21 D22 S27 I28 T29S21-Q25 VanDerWaalsContact O-CB 3.23Å; S21-Q25 WeakPolarHBondContact O-CB 3.37Å; S21-Q25 PolarHBondContact O-N 2.81Å; D22-Q25 PolarHBondContact O-N 3.34Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; Q25-I28 PolarHBondContact O-N 2.83Å; Q25-T29 VanDerWaalsContact O-CB 3.29Å; Q25-T29 WeakPolarHBondContact O-CB 3.4Å; Q25-T29 PolarHBondContact O-N 2.93Å; Q25-T29 PolarHBondContact O-OG1 2.94Å
26T94.7Very high94.1Very high96 Ų9699.3 Ų99.359%0.58950%0.501SS*.Hα-helixtrans-63.6-41.5174.1-59.10000110.6D22 T29 S30D22-T26 WeakPolarHBondContact O-CB 3.49Å; D22-T26 PolarHBondContact O-N 2.84Å; D22-T26 PolarHBondContact O-OG1 3.5Å; T26-T29 PolarHBondContact O-N 3.26Å; T26-S30 VanDerWaalsContact O-CB 3.24Å; T26-S30 WeakPolarHBondContact O-CB 3.22Å; T26-S30 PolarHBondContact O-N 2.81Å
27S95.3Very high94.4Very high41 Ų41100.3 Ų100.329%0.28751%0.508SS..Hα-helixtrans-64.6-45.1176.2-61.30000111.9H23 F24 Q25 S30 I31H23-S27 VanDerWaalsContact O-CB 3.24Å; H23-S27 WeakPolarHBondContact O-CB 3.37Å; H23-S27 PolarHBondContact O-N 3.42Å; H23-S27 PolarHBondContact O-OG 2.95Å; F24-S27 WeakPolarHBondContact O-CB 3.49Å; F24-S27 PolarHBondContact O-N 3.13Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; S27-S30 PolarHBondContact O-N 3.46Å; S27-I31 VanDerWaalsContact O-CG1 3.29Å; S27-I31 WeakPolarHBondContact O-CG1 3.27Å; S27-I31 PolarHBondContact O-N 3.38Å
28I96.1Very high94.7Very high85 Ų8599 Ų9944%0.43650%0.504SS..Hα-helixtrans-61.3-47.3175.5-71.2165000110F24 Q25 S30 I31 Q32F24-I28 WeakPolarHBondContact O-CB 3.46Å; F24-I28 WeakPolarHBondContact O-CG1 3.48Å; F24-I28 PolarHBondContact O-N 3.31Å; Q25-I28 PolarHBondContact O-N 2.83Å; I28-S30 VanDerWaalsContact C-N 3.32Å; I28-S30 PolarHBondContact O-N 3.36Å; I28-I31 PolarHBondContact O-N 3.49Å; I28-Q32 VanDerWaalsContact O-CB 3.26Å; I28-Q32 WeakPolarHBondContact O-CB 3.49Å; I28-Q32 PolarHBondContact O-N 2.97Å
29T94.9Very high94.9Very high56 Ų5699.1 Ų99.134%0.34451%0.509SS..Hα-helixtrans-62.4-40.7178.7-55.20000111Q25 T26 Q32 N33Q25-T29 VanDerWaalsContact O-CB 3.29Å; Q25-T29 WeakPolarHBondContact O-CB 3.4Å; Q25-T29 PolarHBondContact O-N 2.93Å; Q25-T29 PolarHBondContact O-OG1 2.94Å; T26-T29 PolarHBondContact O-N 3.26Å; T29-Q32 PolarHBondContact O-N 3.44Å; T29-N33 WeakPolarHBondContact O-CB 3.36Å; T29-N33 PolarHBondContact O-N 3.18Å; T29-N33 PolarHBondContact O-ND2 3.47Å
30S96Very high95.1Very high53 Ų5397.2 Ų97.237%0.37151%0.51SS..Hα-helixtrans-62.8-47.8175.1-178.40000112T26 S27 I28 Q32 N33 Q34T26-S30 VanDerWaalsContact O-CB 3.24Å; T26-S30 WeakPolarHBondContact O-CB 3.22Å; T26-S30 PolarHBondContact O-N 2.81Å; S27-S30 PolarHBondContact O-N 3.46Å; I28-S30 VanDerWaalsContact C-N 3.32Å; I28-S30 PolarHBondContact O-N 3.36Å; S30-Q32 VanDerWaalsContact C-N 3.31Å; S30-Q32 PolarHBondContact O-N 2.79Å; S30-N33 PolarHBondContact O-N 3.45Å; S30-Q34 WeakPolarHBondContact O-CG 3.42Å; S30-Q34 PolarHBondContact O-N 3.08Å
31I96Very high95.3Very high112 Ų112100.1 Ų100.157%0.57452%0.516SS*.Hα-helixtrans-61.6-41.2175.5-68.6165.9000110.7S27 I28 Q34 L35S27-I31 VanDerWaalsContact O-CG1 3.29Å; S27-I31 WeakPolarHBondContact O-CG1 3.27Å; S27-I31 PolarHBondContact O-N 3.38Å; I28-I31 PolarHBondContact O-N 3.49Å; I31-Q34 PolarHBondContact O-N 2.91Å; I31-L35 WeakPolarHBondContact O-CB 3.24Å; I31-L35 PolarHBondContact O-N 3.36Å
32Q95.8Very high95.5Very high115 Ų11599 Ų9954%0.53750%0.504SS..Hα-helixtrans-66.9-40.4179.2-168.2170.3-16.500111.6I28 T29 S30 L35 C36I28-Q32 VanDerWaalsContact O-CB 3.26Å; I28-Q32 WeakPolarHBondContact O-CB 3.49Å; I28-Q32 PolarHBondContact O-N 2.97Å; T29-Q32 PolarHBondContact O-N 3.44Å; S30-Q32 VanDerWaalsContact C-N 3.31Å; S30-Q32 PolarHBondContact O-N 2.79Å; Q32-L35 PolarHBondContact O-N 3.36Å; Q32-C36 WeakPolarHBondContact O-CB 3.16Å; Q32-C36 PolarHBondContact O-N 3.19Å; Q32-C36 PolarHBondContact O-SG 2.99Å
33N95.9Very high95.7Very high91 Ų9199 Ų9949%0.48751%0.507SS..Hα-helixtrans-63-45.8172.8-72.5-15.1000111.3T29 S30 L35 C36 E37T29-N33 WeakPolarHBondContact O-CB 3.36Å; T29-N33 PolarHBondContact O-N 3.18Å; T29-N33 PolarHBondContact O-ND2 3.47Å; S30-N33 PolarHBondContact O-N 3.45Å; N33-L35 VanDerWaalsContact C-N 3.31Å; N33-L35 PolarHBondContact O-N 3.1Å; N33-C36 WeakPolarHBondContact O-CB 3.03Å; N33-C36 PolarHBondContact O-N 2.97Å; N33-E37 WeakPolarHBondContact O-CB 3.41Å; N33-E37 WeakPolarHBondContact O-CG 3.48Å; N33-E37 PolarHBondContact O-N 3.49Å
34Q96.3Very high95.9Very high116 Ų11697.7 Ų97.754%0.54250%0.502SS..Hα-helixtrans-61.4-38.9175.4-72.6177.72400112.2S30 I31 E37 Y38S30-Q34 WeakPolarHBondContact O-CG 3.42Å; S30-Q34 PolarHBondContact O-N 3.08Å; I31-Q34 PolarHBondContact O-N 2.91Å; Q34-E37 PolarHBondContact O-N 2.78Å; Q34-Y38 VanDerWaalsContact O-CB 3.23Å; Q34-Y38 WeakPolarHBondContact O-CB 3.48Å; Q34-Y38 PolarHBondContact O-N 3.41Å
35L96.3Very high96.1Very high104 Ų10495.1 Ų95.155%0.54549%0.493SS..Hα-helixtrans-65.6-44.1175.4-179.362.7000111.3I31 Q32 N33 Y38 Q39I31-L35 WeakPolarHBondContact O-CB 3.24Å; I31-L35 PolarHBondContact O-N 3.36Å; Q32-L35 PolarHBondContact O-N 3.36Å; N33-L35 VanDerWaalsContact C-N 3.31Å; N33-L35 PolarHBondContact O-N 3.1Å; L35-Y38 PolarHBondContact O-N 2.87Å; L35-Q39 VanDerWaalsContact O-CB 3.31Å; L35-Q39 WeakPolarHBondContact O-CB 3.4Å; L35-Q39 PolarHBondContact O-N 3.28Å
36C95.1Very high96.2Very high71 Ų7197.9 Ų97.948%0.4850%0.499SS..Hα-helixtrans-61.5-45.2174.8-750000111.8Q32 N33 Q39 S40Q32-C36 WeakPolarHBondContact O-CB 3.16Å; Q32-C36 PolarHBondContact O-N 3.19Å; Q32-C36 PolarHBondContact O-SG 2.99Å; N33-C36 WeakPolarHBondContact O-CB 3.03Å; N33-C36 PolarHBondContact O-N 2.97Å; C36-Q39 PolarHBondContact O-N 2.88Å; C36-S40 WeakPolarHBondContact O-CB 3.35Å; C36-S40 PolarHBondContact O-N 2.94Å
37E96.5Very high96.4Very high139 Ų13998.3 Ų98.365%0.6549%0.493SS*.Hα-helixtrans-61.6-45.3174.9-75.6178.9-175.600111.6N33 Q34 Q39 S40 K41N33-E37 WeakPolarHBondContact O-CB 3.41Å; N33-E37 WeakPolarHBondContact O-CG 3.48Å; N33-E37 PolarHBondContact O-N 3.49Å; Q34-E37 PolarHBondContact O-N 2.78Å; E37-Q39 VanDerWaalsContact C-N 3.35Å; E37-Q39 PolarHBondContact O-N 3.49Å; E37-S40 PolarHBondContact O-N 2.85Å; E37-K41 WeakPolarHBondContact O-CB 3.5Å; E37-K41 PolarHBondContact O-N 3.44Å
38Y95.9Very high96.5Very high153 Ų153101 Ų10160%0.650%0.501SS*.Hα-helixtrans-59.9-46.3176179.2-93.7000111.1Q34 L35 K41 N42Q34-Y38 VanDerWaalsContact O-CB 3.23Å; Q34-Y38 WeakPolarHBondContact O-CB 3.48Å; Q34-Y38 PolarHBondContact O-N 3.41Å; L35-Y38 PolarHBondContact O-N 2.87Å; Y38-K41 PolarHBondContact O-N 2.84Å; Y38-N42 WeakPolarHBondContact O-CB 3.43Å; Y38-N42 PolarHBondContact O-N 2.92Å
39Q95.7Very high96.5Very high125 Ų125101.9 Ų101.958%0.58451%0.506SS*.Hα-helixtrans-62.6-43.7177.9-173.3173.3-4.700111.3L35 C36 E37 N42 V43L35-Q39 VanDerWaalsContact O-CB 3.31Å; L35-Q39 WeakPolarHBondContact O-CB 3.4Å; L35-Q39 PolarHBondContact O-N 3.28Å; C36-Q39 PolarHBondContact O-N 2.88Å; E37-Q39 VanDerWaalsContact C-N 3.35Å; E37-Q39 PolarHBondContact O-N 3.49Å; Q39-N42 PolarHBondContact O-N 3.28Å; Q39-V43 WeakPolarHBondContact O-CG2 3.27Å; Q39-V43 PolarHBondContact O-N 3.5Å
40S96.4Very high96.6Very high83 Ų83104.3 Ų104.358%0.5851%0.514SS*.Hα-helixtrans-60.3-49.2175.6-172.90000111.9C36 E37 N42 V43 E44C36-S40 WeakPolarHBondContact O-CB 3.35Å; C36-S40 PolarHBondContact O-N 2.94Å; E37-S40 PolarHBondContact O-N 2.85Å; S40-N42 VanDerWaalsContact C-N 3.3Å; S40-N42 PolarHBondContact O-N 3.28Å; S40-V43 WeakPolarHBondContact O-CB 3.37Å; S40-V43 PolarHBondContact O-N 2.92Å; S40-E44 PolarHBondContact O-N 2.92Å
41K96.9Very high96.7Very high141 Ų141106.4 Ų106.461%0.61352%0.518SS*.Hα-helixtrans-61.3-38.1176.1-174.9172.8-176.21740112.3E37 Y38 V43 E44 L45E37-K41 WeakPolarHBondContact O-CB 3.5Å; E37-K41 PolarHBondContact O-N 3.44Å; Y38-K41 PolarHBondContact O-N 2.84Å; K41-V43 VanDerWaalsContact C-N 3.34Å; K41-E44 PolarHBondContact O-N 2.99Å; K41-L45 HydrophobicContact CG-CD1 4.18Å; K41-L45 HydrophobicContact CG-CG 4.44Å; K41-L45 WeakPolarHBondContact O-CB 3.35Å; K41-L45 VanDerWaalsContact O-CG 3.29Å; K41-L45 WeakPolarHBondContact O-CG 3.34Å; K41-L45 PolarHBondContact O-N 3.23Å
42N97.1Very high96.8Very high44 Ų44105.2 Ų105.224%0.23551%0.512CS..Hα-helixtrans-68.4-34.7178.7-163.4-98.8000111.9Y38 Q39 S40 R46Y38-N42 WeakPolarHBondContact O-CB 3.43Å; Y38-N42 PolarHBondContact O-N 2.92Å; Q39-N42 PolarHBondContact O-N 3.28Å; S40-N42 VanDerWaalsContact C-N 3.3Å; S40-N42 PolarHBondContact O-N 3.28Å; N42-R46 WeakPolarHBondContact O-CG 3.31Å; N42-R46 PolarHBondContact O-N 3.21Å; N42-R46 VanDerWaalsContact O-N 3.09Å; N42-R46 PolarHBondContact OD1-NH1 3.4Å
43V97.2Very high96.9Very high90 Ų90102.5 Ų102.555%0.54551%0.509SS..Hα-helixtrans-65.5-47.2170.9171.50000110.8Q39 S40 K41 L45 R46 K47Q39-V43 WeakPolarHBondContact O-CG2 3.27Å; Q39-V43 PolarHBondContact O-N 3.5Å; S40-V43 WeakPolarHBondContact O-CB 3.37Å; S40-V43 PolarHBondContact O-N 2.92Å; K41-V43 VanDerWaalsContact C-N 3.34Å; V43-L45 PolarHBondContact O-N 3.26Å; V43-R46 PolarHBondContact O-N 3.37Å; V43-K47 PolarHBondContact O-N 2.94Å
44E97.2Very high97Very high100 Ų100103.1 Ų103.147%0.46751%0.509SS..Hα-helixtrans-62.7-43177.8-165.264.1-137.400111.8S40 K41 R46 K47 E48S40-E44 PolarHBondContact O-N 2.92Å; K41-E44 PolarHBondContact O-N 2.99Å; E44-R46 VanDerWaalsContact C-N 3.3Å; E44-R46 PolarHBondContact O-N 2.81Å; E44-K47 WeakPolarHBondContact O-CB 3.42Å; E44-K47 PolarHBondContact O-N 3.26Å; E44-K47 VanDerWaalsContact O-N 3.1Å; E44-K47 IonicContact OE1-NZ 3.74Å; E44-K47 PolarHBondContact OE1-NZ 3.42Å; E44-E48 PolarHBondContact O-N 3.38Å
45L97.6Very high97.1Very high75 Ų75103.3 Ų103.339%0.39351%0.508SS..Hα-helixtrans-61.4-36.3175.3-75.9171.6000112.5K41 V43 N49K41-L45 HydrophobicContact CG-CD1 4.18Å; K41-L45 HydrophobicContact CG-CG 4.44Å; K41-L45 WeakPolarHBondContact O-CB 3.35Å; K41-L45 VanDerWaalsContact O-CG 3.29Å; K41-L45 WeakPolarHBondContact O-CG 3.34Å; K41-L45 PolarHBondContact O-N 3.23Å; V43-L45 PolarHBondContact O-N 3.26Å; L45-N49 VanDerWaalsContact O-CB 3.31Å; L45-N49 WeakPolarHBondContact O-CB 3.33Å; L45-N49 VanDerWaalsContact O-CG 3.24Å; L45-N49 PolarHBondContact O-N 2.94Å; L45-N49 PolarHBondContact O-ND2 3.31Å
46R97.6Very high97.2Very high165 Ų165101.5 Ų101.562%0.62350%0.504SS*.Hα-helixtrans-68.1-38.4173.9-79.1-156.8-18082.510.6111.9N42 V43 E44 Q50N42-R46 WeakPolarHBondContact O-CG 3.31Å; N42-R46 PolarHBondContact O-N 3.21Å; N42-R46 VanDerWaalsContact O-N 3.09Å; N42-R46 PolarHBondContact OD1-NH1 3.4Å; V43-R46 PolarHBondContact O-N 3.37Å; E44-R46 VanDerWaalsContact C-N 3.3Å; E44-R46 PolarHBondContact O-N 2.81Å; R46-Q50 WeakPolarHBondContact O-CB 3.35Å; R46-Q50 PolarHBondContact O-N 3.42Å
47K97.5Very high97.3Very high105 Ų10599.3 Ų99.346%0.45749%0.494SS..Hα-helixtrans-65.3-48.2176.4-175.7-175.9165.2-1320111.3V43 E44 N49 Q50 E51V43-K47 PolarHBondContact O-N 2.94Å; E44-K47 WeakPolarHBondContact O-CB 3.42Å; E44-K47 PolarHBondContact O-N 3.26Å; E44-K47 VanDerWaalsContact O-N 3.1Å; E44-K47 IonicContact OE1-NZ 3.74Å; E44-K47 PolarHBondContact OE1-NZ 3.42Å; K47-N49 PolarHBondContact O-N 3.14Å; K47-Q50 WeakPolarHBondContact O-CB 3.32Å; K47-Q50 PolarHBondContact O-N 2.94Å; K47-Q50 VanDerWaalsContact O-N 3.14Å; K47-E51 WeakPolarHBondContact CE-OE1 3.47Å; K47-E51 IonicContact NZ-OE1 3.82Å; K47-E51 WeakPolarHBondContact O-CG 3.32Å; K47-E51 PolarHBondContact O-N 3.48Å
48E97.7Very high97.4Very high97 Ų9799 Ų9945%0.45349%0.493SS..Hα-helixtrans-60.6-43.9175.8-173.6-176.5178.700111.7E44 Q50 E51 L52E44-E48 PolarHBondContact O-N 3.38Å; E48-Q50 VanDerWaalsContact C-N 3.29Å; E48-Q50 PolarHBondContact O-N 2.89Å; E48-E51 PolarHBondContact O-N 3.46Å; E48-L52 HydrophobicContact CG-CD1 4Å; E48-L52 HydrophobicContact CG-CG 4.42Å; E48-L52 WeakPolarHBondContact O-CB 3.34Å; E48-L52 VanDerWaalsContact O-CG 3.27Å; E48-L52 WeakPolarHBondContact O-CG 3.42Å; E48-L52 PolarHBondContact O-N 3.38Å
49N96.7Very high97.5Very high104 Ų10496.7 Ų96.756%0.55649%0.486SS*.Hα-helixtrans-61.1-38175.2-79.5-35.4000112.5L45 K47 A53L45-N49 VanDerWaalsContact O-CB 3.31Å; L45-N49 WeakPolarHBondContact O-CB 3.33Å; L45-N49 VanDerWaalsContact O-CG 3.24Å; L45-N49 PolarHBondContact O-N 2.94Å; L45-N49 PolarHBondContact O-ND2 3.31Å; K47-N49 PolarHBondContact O-N 3.14Å; N49-A53 WeakPolarHBondContact O-CB 3.45Å; N49-A53 PolarHBondContact O-N 2.87Å
50Q97.5Very high97.6Very high108 Ų10895.5 Ų95.551%0.50548%0.483SS..Hα-helixtrans-66.9-46.2175.3-179.461.829.500111.2R46 K47 E48 L52 A53 E54R46-Q50 WeakPolarHBondContact O-CB 3.35Å; R46-Q50 PolarHBondContact O-N 3.42Å; K47-Q50 WeakPolarHBondContact O-CB 3.32Å; K47-Q50 PolarHBondContact O-N 2.94Å; K47-Q50 VanDerWaalsContact O-N 3.14Å; E48-Q50 VanDerWaalsContact C-N 3.29Å; E48-Q50 PolarHBondContact O-N 2.89Å; Q50-L52 VanDerWaalsContact C-N 3.34Å; Q50-L52 PolarHBondContact O-N 3.02Å; Q50-A53 PolarHBondContact O-N 3.28Å; Q50-E54 WeakPolarHBondContact CG-OE1 3.44Å; Q50-E54 PolarHBondContact NE2-OE1 3.43Å; Q50-E54 WeakPolarHBondContact O-CG 3.33Å; Q50-E54 PolarHBondContact O-N 2.87Å
51E97.8Very high97.7Very high96 Ų9698.4 Ų98.445%0.44949%0.485SS..Hα-helixtrans-61.1-41175.8-71.1175.2-170.700111.8K47 E48 E54 K55K47-E51 WeakPolarHBondContact CE-OE1 3.47Å; K47-E51 IonicContact NZ-OE1 3.82Å; K47-E51 WeakPolarHBondContact O-CG 3.32Å; K47-E51 PolarHBondContact O-N 3.48Å; E48-E51 PolarHBondContact O-N 3.46Å; E51-E54 PolarHBondContact O-N 2.95Å; E51-K55 VanDerWaalsContact O-CB 3.24Å; E51-K55 WeakPolarHBondContact O-CB 3.43Å; E51-K55 PolarHBondContact O-N 3.33Å
52L98.2Very high97.7Very high87 Ų8796.7 Ų96.746%0.45548%0.479SS..Hα-helixtrans-64.8-39.9175-75.3167.6000112E48 Q50 S56E48-L52 HydrophobicContact CG-CD1 4Å; E48-L52 HydrophobicContact CG-CG 4.42Å; E48-L52 WeakPolarHBondContact O-CB 3.34Å; E48-L52 VanDerWaalsContact O-CG 3.27Å; E48-L52 WeakPolarHBondContact O-CG 3.42Å; E48-L52 PolarHBondContact O-N 3.38Å; Q50-L52 VanDerWaalsContact C-N 3.34Å; Q50-L52 PolarHBondContact O-N 3.02Å; L52-S56 VanDerWaalsContact O-CB 3.3Å; L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.44Å; L52-S56 PolarHBondContact O-OG 3Å
53A98.1Very high97.8Very high58 Ų5899.8 Ų99.848%0.47949%0.492SS..Hα-helixtrans-66.5-43.3175.900000111.6N49 Q50 S56 G57N49-A53 WeakPolarHBondContact O-CB 3.45Å; N49-A53 PolarHBondContact O-N 2.87Å; Q50-A53 PolarHBondContact O-N 3.28Å; A53-S56 PolarHBondContact O-N 3.22Å; A53-G57 PolarHBondContact O-N 3.49Å
54E98.1Very high97.9Very high104 Ų104101 Ų10149%0.48649%0.491SS..Hα-helixtrans-61-50.2175-74.9171.8-167.400111.2Q50 E51 S56 G57 E58Q50-E54 WeakPolarHBondContact CG-OE1 3.44Å; Q50-E54 PolarHBondContact NE2-OE1 3.43Å; Q50-E54 WeakPolarHBondContact O-CG 3.33Å; Q50-E54 PolarHBondContact O-N 2.87Å; E51-E54 PolarHBondContact O-N 2.95Å; E54-S56 VanDerWaalsContact C-N 3.32Å; E54-S56 PolarHBondContact O-N 3.36Å; E54-G57 CarbonylContact O-C 3.57Å; E54-G57 WeakPolarHBondContact O-CA 3.35Å; E54-G57 PolarHBondContact O-N 2.88Å; E54-G57 VanDerWaalsContact O-N 3.07Å; E54-E58 WeakPolarHBondContact O-CG 3.43Å; E54-E58 PolarHBondContact O-N 2.93Å
55K98Very high97.9Very high120 Ų120103.7 Ų103.752%0.52250%0.502SS..Hα-helixtrans-60.1-41.4177.4-173.1173.7-172.9174.60112.2E51 G57 E58 F59E51-K55 VanDerWaalsContact O-CB 3.24Å; E51-K55 WeakPolarHBondContact O-CB 3.43Å; E51-K55 PolarHBondContact O-N 3.33Å; K55-G57 VanDerWaalsContact C-N 3.34Å; K55-E58 PolarHBondContact O-N 3.04Å; K55-F59 HydrophobicContact CD-CE2 4.12Å; K55-F59 HydrophobicContact CG-CD2 3.9Å; K55-F59 HydrophobicContact CG-CE2 3.62Å; K55-F59 WeakPolarHBondContact O-CD2 3.33Å; K55-F59 PolarHBondContact O-N 3.24Å
56S97.8Very high98Very high66 Ų66105.1 Ų105.146%0.46250%0.502SS..Hα-helixtrans-62.7-41.5174.5-60.70000111.4L52 A53 E54 F59 I60L52-S56 VanDerWaalsContact O-CB 3.3Å; L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.44Å; L52-S56 PolarHBondContact O-OG 3Å; A53-S56 PolarHBondContact O-N 3.22Å; E54-S56 VanDerWaalsContact C-N 3.32Å; E54-S56 PolarHBondContact O-N 3.36Å; S56-F59 PolarHBondContact O-N 3.49Å; S56-I60 WeakPolarHBondContact O-CG1 3.4Å; S56-I60 PolarHBondContact O-N 3.34Å
57G97.9Very high98Very high26 Ų26103.3 Ų103.327%0.26850%0.501SS..Hα-helixtrans-64.4-39.5174.700000113.5A53 E54 K55 I60 K61A53-G57 PolarHBondContact O-N 3.49Å; E54-G57 CarbonylContact O-C 3.57Å; E54-G57 WeakPolarHBondContact O-CA 3.35Å; E54-G57 PolarHBondContact O-N 2.88Å; E54-G57 VanDerWaalsContact O-N 3.07Å; K55-G57 VanDerWaalsContact C-N 3.34Å; G57-I60 PolarHBondContact O-N 3.43Å; G57-K61 WeakPolarHBondContact O-CG 3.45Å; G57-K61 PolarHBondContact O-N 2.97Å; G57-K61 VanDerWaalsContact O-N 3.12Å
58E98Very high98Very high133 Ų133103 Ų10362%0.62150%0.501SS*.Hα-helixtrans-64.8-42.8173.7-72.5-177.8171.700112.2E54 K55 I60 K61 Q62E54-E58 WeakPolarHBondContact O-CG 3.43Å; E54-E58 PolarHBondContact O-N 2.93Å; K55-E58 PolarHBondContact O-N 3.04Å; E58-I60 VanDerWaalsContact C-N 3.33Å; E58-I60 PolarHBondContact O-N 3.06Å; E58-K61 PolarHBondContact O-N 2.86Å; E58-Q62 WeakPolarHBondContact O-CB 3.39Å; E58-Q62 PolarHBondContact O-N 2.97Å
59F98.1Very high98.1Very high104 Ų104104.3 Ų104.346%0.45651%0.506SS..Hα-helixtrans-58.8-45174.7-84.7-59.8000111.6K55 S56 K61 Q62 H63K55-F59 HydrophobicContact CD-CE2 4.12Å; K55-F59 HydrophobicContact CG-CD2 3.9Å; K55-F59 HydrophobicContact CG-CE2 3.62Å; K55-F59 WeakPolarHBondContact O-CD2 3.33Å; K55-F59 PolarHBondContact O-N 3.24Å; S56-F59 PolarHBondContact O-N 3.49Å; F59-K61 PolarHBondContact O-N 3.25Å; F59-Q62 PolarHBondContact O-N 3Å; F59-H63 PolarHBondContact O-CD2 2.97Å; F59-H63 VanDerWaalsContact O-CD2 3.24Å; F59-H63 PolarHBondContact O-N 3.01Å
60I98Very high98.2Very high99 Ų99102.2 Ų102.251%0.50850%0.497SS..Hα-helixtrans-57.6-51.7176.7-69.2164.7000110.3S56 G57 E58 Q62 H63 E64S56-I60 WeakPolarHBondContact O-CG1 3.4Å; S56-I60 PolarHBondContact O-N 3.34Å; G57-I60 PolarHBondContact O-N 3.43Å; E58-I60 VanDerWaalsContact C-N 3.33Å; E58-I60 PolarHBondContact O-N 3.06Å; I60-Q62 VanDerWaalsContact C-N 3.29Å; I60-Q62 PolarHBondContact O-N 3.5Å; I60-H63 WeakPolarHBondContact O-CB 3.45Å; I60-H63 PolarHBondContact O-N 3.28Å; I60-E64 HydrophobicContact CG2-CG 4.42Å; I60-E64 WeakPolarHBondContact O-CG 3.5Å; I60-E64 PolarHBondContact O-N 3.38Å
61K98.4Very high98.2Very high145 Ų145101.5 Ų101.563%0.6350%0.497SS*.Hα-helixtrans-58.9-38.9178.4-70.2174.3-177.1175.40112.9G57 E58 F59 K65G57-K61 WeakPolarHBondContact O-CG 3.45Å; G57-K61 PolarHBondContact O-N 2.97Å; G57-K61 VanDerWaalsContact O-N 3.12Å; E58-K61 PolarHBondContact O-N 2.86Å; F59-K61 PolarHBondContact O-N 3.25Å; K61-K65 WeakPolarHBondContact O-CB 3.37Å; K61-K65 PolarHBondContact O-N 3.47Å
62Q98.3Very high98.2Very high105 Ų105102 Ų10249%0.49150%0.498SS..Hα-helixtrans-67.2-39177-170.2-175.917.800111.7E58 F59 I60 R66E58-Q62 WeakPolarHBondContact O-CB 3.39Å; E58-Q62 PolarHBondContact O-N 2.97Å; F59-Q62 PolarHBondContact O-N 3Å; I60-Q62 VanDerWaalsContact C-N 3.29Å; I60-Q62 PolarHBondContact O-N 3.5Å; Q62-R66 WeakPolarHBondContact O-CB 3.39Å; Q62-R66 PolarHBondContact O-N 2.67Å
63H98.3Very high98.3Very high108 Ų108102.7 Ų102.750%0.550%0.501SS..Hα-helixtrans-65.7-46.4175.6-89-91.6000111.9F59 I60 K65 R66 E67F59-H63 PolarHBondContact O-CD2 2.97Å; F59-H63 VanDerWaalsContact O-CD2 3.24Å; F59-H63 PolarHBondContact O-N 3.01Å; I60-H63 WeakPolarHBondContact O-CB 3.45Å; I60-H63 PolarHBondContact O-N 3.28Å; H63-K65 VanDerWaalsContact C-N 3.35Å; H63-K65 PolarHBondContact O-N 2.93Å; H63-R66 PolarHBondContact CE1-NH1 2.95Å; H63-R66 VanDerWaalsContact CG-NH1 3.3Å; H63-R66 PolarHBondContact ND1-NH1 2.85Å; H63-R66 PolarHBondContact NE2-NH1 3.11Å; H63-R66 WeakPolarHBondContact O-CB 3.46Å; H63-R66 PolarHBondContact O-N 3.44Å; H63-R66 VanDerWaalsContact O-N 3.11Å; H63-E67 WeakPolarHBondContact O-CB 3.44Å; H63-E67 PolarHBondContact O-N 3.01Å
64E98.5Very high98.3Very high115 Ų115105.7 Ų105.754%0.53751%0.507SS..Hα-helixtrans-57.2-47175.4-70.5171.8168.400111.3I60 R66 E67 E68I60-E64 HydrophobicContact CG2-CG 4.42Å; I60-E64 WeakPolarHBondContact O-CG 3.5Å; I60-E64 PolarHBondContact O-N 3.38Å; E64-R66 VanDerWaalsContact C-N 3.3Å; E64-R66 PolarHBondContact O-N 3.16Å; E64-E67 PolarHBondContact O-N 3.5Å; E64-E68 PolarHBondContact O-N 3.32Å
65K98.4Very high98.3Very high157 Ų157106.8 Ų106.868%0.68351%0.512SS*.Hα-helixtrans-62-36.8176.6-176.2178.2179.8179.50112.7K61 H63 H69K61-K65 WeakPolarHBondContact O-CB 3.37Å; K61-K65 PolarHBondContact O-N 3.47Å; H63-K65 VanDerWaalsContact C-N 3.35Å; H63-K65 PolarHBondContact O-N 2.93Å; K65-H69 WeakPolarHBondContact O-CB 3.42Å; K65-H69 PolarHBondContact O-N 3.03Å; K65-H69 VanDerWaalsContact O-N 3.11Å
66R98.3Very high98.3Very high105 Ų105104.2 Ų104.240%0.39651%0.507SS..Hα-helixtrans-70.3-41.8178.5-168.9-172.7-55104.7-2.5111Q62 H63 E64 H69 V70Q62-R66 WeakPolarHBondContact O-CB 3.39Å; Q62-R66 PolarHBondContact O-N 2.67Å; H63-R66 PolarHBondContact CE1-NH1 2.95Å; H63-R66 VanDerWaalsContact CG-NH1 3.3Å; H63-R66 PolarHBondContact ND1-NH1 2.85Å; H63-R66 PolarHBondContact NE2-NH1 3.11Å; H63-R66 WeakPolarHBondContact O-CB 3.46Å; H63-R66 PolarHBondContact O-N 3.44Å; H63-R66 VanDerWaalsContact O-N 3.11Å; E64-R66 VanDerWaalsContact C-N 3.3Å; E64-R66 PolarHBondContact O-N 3.16Å; R66-H69 WeakPolarHBondContact O-CB 3.41Å; R66-H69 PolarHBondContact O-N 3.45Å; R66-V70 WeakPolarHBondContact O-CG2 3.43Å; R66-V70 PolarHBondContact O-N 2.97Å
67E98.5Very high98.4Very high128 Ų128110 Ų11060%0.59852%0.518SS*.Hα-helixtrans-61.7-48.2175.9-172.4169.8-158.400110.8H63 E64 H69 V70 D71H63-E67 WeakPolarHBondContact O-CB 3.44Å; H63-E67 PolarHBondContact O-N 3.01Å; E64-E67 PolarHBondContact O-N 3.5Å; E67-H69 VanDerWaalsContact C-N 3.25Å; E67-H69 PolarHBondContact O-N 2.9Å; E67-V70 WeakPolarHBondContact O-CA 3.42Å; E67-V70 WeakPolarHBondContact O-CB 3.28Å; E67-V70 PolarHBondContact O-N 3.17Å; E67-D71 PolarHBondContact O-N 3.42Å
68E98.5Very high98.4Very high99 Ų99111.1 Ų111.146%0.46352%0.522SS..Hα-helixtrans-56.6-39.4174.3-169.6-163.4169.400112.1E64 K72E64-E68 PolarHBondContact O-N 3.32Å; E68-K72 WeakPolarHBondContact O-CG 3.32Å; E68-K72 PolarHBondContact O-N 3.38Å; E68-K72 VanDerWaalsContact O-N 3.13Å; E68-K72 VanDerWaalsContact OE1-CE 3.28Å; E68-K72 WeakPolarHBondContact OE1-CE 3.41Å; E68-K72 IonicContact OE1-NZ 2.69Å; E68-K72 PolarHBondContact OE1-NZ 3.01Å
69H98.3Very high98.4Very high123 Ų123109.5 Ų109.557%0.56952%0.517SS*.Hα-helixtrans-67.2-40.6175.8-17959.9000112.6K65 R66 E67 D71 K72 L73K65-H69 WeakPolarHBondContact O-CB 3.42Å; K65-H69 PolarHBondContact O-N 3.03Å; K65-H69 VanDerWaalsContact O-N 3.11Å; R66-H69 WeakPolarHBondContact O-CB 3.41Å; R66-H69 PolarHBondContact O-N 3.45Å; E67-H69 VanDerWaalsContact C-N 3.25Å; E67-H69 PolarHBondContact O-N 2.9Å; H69-D71 VanDerWaalsContact C-N 3.35Å; H69-K72 PolarHBondContact O-N 2.87Å; H69-L73 WeakPolarHBondContact O-CB 3.25Å; H69-L73 PolarHBondContact O-N 3.41Å
70V98.6Very high98.5Very high60 Ų60110.3 Ų110.336%0.36452%0.522SS..Hα-helixtrans-62.8-42.9176.3168.80000110.5R66 E67 L73 M74R66-V70 WeakPolarHBondContact O-CG2 3.43Å; R66-V70 PolarHBondContact O-N 2.97Å; E67-V70 WeakPolarHBondContact O-CA 3.42Å; E67-V70 WeakPolarHBondContact O-CB 3.28Å; E67-V70 PolarHBondContact O-N 3.17Å; V70-L73 WeakPolarHBondContact O-CB 3.12Å; V70-L73 PolarHBondContact O-N 3.42Å; V70-M74 HydrophobicContact CG1-CE 3.78Å; V70-M74 WeakPolarHBondContact O-CG 3.18Å; V70-M74 PolarHBondContact O-N 3.48Å
71D98.6Very high98.5Very high93 Ų93111.4 Ų111.450%0.49753%0.529SS..Hα-helixtrans-61.4-47.1177.3-71.9-21.2000111.8E67 H69 L73 M74 E75E67-D71 PolarHBondContact O-N 3.42Å; H69-D71 VanDerWaalsContact C-N 3.35Å; D71-L73 VanDerWaalsContact C-N 3.27Å; D71-L73 PolarHBondContact O-N 3.31Å; D71-M74 PolarHBondContact O-N 2.82Å; D71-M74 VanDerWaalsContact O-N 3.17Å; D71-E75 PolarHBondContact O-N 3.3Å
72K98.4Very high98.5Very high107 Ų107110.5 Ų110.547%0.46553%0.525SS..Hα-helixtrans-59.5-38174.9-72.6174.6-173.4169.70112.3E68 H69 T76E68-K72 WeakPolarHBondContact O-CG 3.32Å; E68-K72 PolarHBondContact O-N 3.38Å; E68-K72 VanDerWaalsContact O-N 3.13Å; E68-K72 VanDerWaalsContact OE1-CE 3.28Å; E68-K72 WeakPolarHBondContact OE1-CE 3.41Å; E68-K72 IonicContact OE1-NZ 2.69Å; E68-K72 PolarHBondContact OE1-NZ 3.01Å; H69-K72 PolarHBondContact O-N 2.87Å; K72-T76 WeakPolarHBondContact O-CB 3.29Å; K72-T76 PolarHBondContact O-N 3.15Å; K72-T76 PolarHBondContact O-OG1 2.9Å
73L98.7Very high98.5Very high101 Ų101110 Ų11053%0.52953%0.525SS..Hα-helixtrans-68.2-40.4177-177.664.1000111.5H69 V70 D71 T76 R77H69-L73 WeakPolarHBondContact O-CB 3.25Å; H69-L73 PolarHBondContact O-N 3.41Å; V70-L73 WeakPolarHBondContact O-CB 3.12Å; V70-L73 PolarHBondContact O-N 3.42Å; D71-L73 VanDerWaalsContact C-N 3.27Å; D71-L73 PolarHBondContact O-N 3.31Å; L73-T76 PolarHBondContact O-N 3.06Å; L73-R77 WeakPolarHBondContact O-CB 3.22Å; L73-R77 PolarHBondContact O-N 3.02Å
74M98.3Very high98.5Very high122 Ų122108.6 Ų108.660%0.60153%0.527SS*.Hα-helixtrans-63.4-43.3174.9-71.4-169.2-176.400111.6V70 D71 R77 S78V70-M74 HydrophobicContact CG1-CE 3.78Å; V70-M74 WeakPolarHBondContact O-CG 3.18Å; V70-M74 PolarHBondContact O-N 3.48Å; D71-M74 PolarHBondContact O-N 2.82Å; D71-M74 VanDerWaalsContact O-N 3.17Å; M74-R77 PolarHBondContact O-N 3.36Å; M74-S78 WeakPolarHBondContact O-CB 3.42Å; M74-S78 PolarHBondContact O-N 2.85Å
75E98.6Very high98.5Very high126 Ų126108.5 Ų108.559%0.58953%0.527SS*.Hα-helixtrans-60.9-47.7174.7-173.4179-176.500111.2D71 R77 S78 L79D71-E75 PolarHBondContact O-N 3.3Å; E75-R77 VanDerWaalsContact C-N 3.35Å; E75-R77 PolarHBondContact O-N 3.48Å; E75-S78 WeakPolarHBondContact O-CB 3.38Å; E75-S78 PolarHBondContact O-N 2.88Å; E75-S78 VanDerWaalsContact O-N 3.13Å; E75-L79 HydrophobicContact CG-CD1 4.28Å; E75-L79 WeakPolarHBondContact O-CG 3.34Å; E75-L79 PolarHBondContact O-N 2.69Å
76T98.6Very high98.5Very high67 Ų67103.8 Ų103.841%0.41152%0.517SS..Hα-helixtrans-56.5-48.4176.7-58.50000111K72 L73 S78 L79 E80K72-T76 WeakPolarHBondContact O-CB 3.29Å; K72-T76 PolarHBondContact O-N 3.15Å; K72-T76 PolarHBondContact O-OG1 2.9Å; L73-T76 PolarHBondContact O-N 3.06Å; T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 2.85Å; T76-L79 PolarHBondContact O-N 2.85Å; T76-E80 WeakPolarHBondContact O-CG 3.38Å; T76-E80 PolarHBondContact O-N 3.36Å
77R98.6Very high98.6Very high186 Ų186105.1 Ų105.170%0.70253%0.526SS*.Hα-helixtrans-62.7-38.8177.1178.3175.1-81.4-158.6-3.7112.4L73 M74 E75 L79 E80 L81L73-R77 WeakPolarHBondContact O-CB 3.22Å; L73-R77 PolarHBondContact O-N 3.02Å; M74-R77 PolarHBondContact O-N 3.36Å; E75-R77 VanDerWaalsContact C-N 3.35Å; E75-R77 PolarHBondContact O-N 3.48Å; R77-L79 VanDerWaalsContact C-N 3.34Å; R77-E80 PolarHBondContact O-N 3.46Å; R77-L81 WeakPolarHBondContact O-CB 3.36Å; R77-L81 PolarHBondContact O-N 3.29Å
78S98.6Very high98.6Very high51 Ų51104.6 Ų104.636%0.35753%0.526SS..Hα-helixtrans-61.9-43.4175.9-173.10000111.4M74 E75 T76 L81 K82M74-S78 WeakPolarHBondContact O-CB 3.42Å; M74-S78 PolarHBondContact O-N 2.85Å; E75-S78 WeakPolarHBondContact O-CB 3.38Å; E75-S78 PolarHBondContact O-N 2.88Å; E75-S78 VanDerWaalsContact O-N 3.13Å; T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 2.85Å; S78-L81 PolarHBondContact O-N 2.91Å; S78-K82 WeakPolarHBondContact O-CG 3.37Å; S78-K82 PolarHBondContact O-N 3.38Å; S78-K82 VanDerWaalsContact O-N 3.07Å
79L98.5Very high98.6Very high99 Ų99104.3 Ų104.352%0.51853%0.528SS..Hα-helixtrans-66.9-41.7176.7-68.5174000112.1E75 T76 R77 L81 K82 L83E75-L79 HydrophobicContact CG-CD1 4.28Å; E75-L79 WeakPolarHBondContact O-CG 3.34Å; E75-L79 PolarHBondContact O-N 2.69Å; T76-L79 PolarHBondContact O-N 2.85Å; R77-L79 VanDerWaalsContact C-N 3.34Å; L79-L81 PolarHBondContact O-N 3.25Å; L79-K82 PolarHBondContact O-N 2.87Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 PolarHBondContact O-N 2.76Å
80E98.6Very high98.6Very high120 Ų120105.3 Ų105.356%0.56153%0.531SS*.Hα-helixtrans-60.9-42.4174.8-74.6175.8177.100112.3T76 R77 L83 S84T76-E80 WeakPolarHBondContact O-CG 3.38Å; T76-E80 PolarHBondContact O-N 3.36Å; R77-E80 PolarHBondContact O-N 3.46Å; E80-L83 PolarHBondContact O-N 2.64Å; E80-S84 WeakPolarHBondContact O-CB 3.34Å; E80-S84 PolarHBondContact O-N 2.86Å
81L98.7Very high98.6Very high122 Ų122105.1 Ų105.164%0.63954%0.535SS*.Hα-helixtrans-61.8-49.2176.1-17476000111.1R77 S78 L79 L83 S84 E85R77-L81 WeakPolarHBondContact O-CB 3.36Å; R77-L81 PolarHBondContact O-N 3.29Å; S78-L81 PolarHBondContact O-N 2.91Å; L79-L81 PolarHBondContact O-N 3.25Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.01Å; L81-S84 WeakPolarHBondContact O-CB 3.43Å; L81-S84 PolarHBondContact O-N 3Å; L81-S84 VanDerWaalsContact O-N 3.14Å; L81-E85 PolarHBondContact O-N 2.99Å
82K98.6Very high98.6Very high126 Ų126104.9 Ų104.955%0.54853%0.531SS..Hα-helixtrans-59.3-40.3176.8-74172.9-178.3170.20111.8S78 L79 E85 A86S78-K82 WeakPolarHBondContact O-CG 3.37Å; S78-K82 PolarHBondContact O-N 3.38Å; S78-K82 VanDerWaalsContact O-N 3.07Å; L79-K82 PolarHBondContact O-N 2.87Å; K82-E85 PolarHBondContact O-N 3.3Å; K82-A86 VanDerWaalsContact O-CB 3.3Å; K82-A86 WeakPolarHBondContact O-CB 3.46Å; K82-A86 PolarHBondContact O-N 2.79Å
83L98.6Very high98.6Very high96 Ų96103.6 Ų103.650%0.50354%0.535SS..Hα-helixtrans-64.9-41.5176.2179.562.6000111.7L79 E80 L81 K87L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 PolarHBondContact O-N 2.76Å; E80-L83 PolarHBondContact O-N 2.64Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.01Å; L83-K87 HydrophobicContact CG-CD 4.48Å; L83-K87 VanDerWaalsContact O-CG 3.31Å; L83-K87 WeakPolarHBondContact O-CG 3.44Å; L83-K87 PolarHBondContact O-N 3.27Å
84S98.4Very high98.6Very high78 Ų78103.1 Ų103.155%0.54553%0.533SS..Hα-helixtrans-63.6-46.1176.3-169.70000111.7E80 L81 K87 L88E80-S84 WeakPolarHBondContact O-CB 3.34Å; E80-S84 PolarHBondContact O-N 2.86Å; L81-S84 WeakPolarHBondContact O-CB 3.43Å; L81-S84 PolarHBondContact O-N 3Å; L81-S84 VanDerWaalsContact O-N 3.14Å; S84-K87 WeakPolarHBondContact O-CB 3.49Å; S84-K87 PolarHBondContact O-N 2.84Å; S84-L88 PolarHBondContact O-N 3.47Å
85E98.7Very high98.6Very high113 Ų113101.3 Ų101.353%0.52853%0.525SS..Hα-helixtrans-62-44.5176.6-173.9178.1-175.800111.8L81 K82 K87 L88 N89L81-E85 PolarHBondContact O-N 2.99Å; K82-E85 PolarHBondContact O-N 3.3Å; E85-K87 VanDerWaalsContact C-N 3.32Å; E85-K87 PolarHBondContact O-N 2.82Å; E85-L88 PolarHBondContact O-N 3.4Å; E85-N89 WeakPolarHBondContact O-CB 3.09Å; E85-N89 PolarHBondContact O-N 3.42Å; E85-N89 PolarHBondContact O-ND2 3.36Å
86A98.7Very high98.6Very high57 Ų5798.8 Ų98.847%0.47152%0.515SS..Hα-helixtrans-61.3-38.7175.400000112.4K82 K90K82-A86 VanDerWaalsContact O-CB 3.3Å; K82-A86 WeakPolarHBondContact O-CB 3.46Å; K82-A86 PolarHBondContact O-N 2.79Å; A86-K90 WeakPolarHBondContact O-CB 3.38Å; A86-K90 PolarHBondContact O-N 2.95Å
87K98.7Very high98.6Very high133 Ų133101.7 Ų101.758%0.57852%0.524SS*.Hα-helixtrans-66-42.5174.9-75.8174.4-179.51780111.9L83 S84 E85 K90 A91L83-K87 HydrophobicContact CG-CD 4.48Å; L83-K87 VanDerWaalsContact O-CG 3.31Å; L83-K87 WeakPolarHBondContact O-CG 3.44Å; L83-K87 PolarHBondContact O-N 3.27Å; S84-K87 WeakPolarHBondContact O-CB 3.49Å; S84-K87 PolarHBondContact O-N 2.84Å; E85-K87 VanDerWaalsContact C-N 3.32Å; E85-K87 PolarHBondContact O-N 2.82Å; K87-K90 PolarHBondContact O-N 2.93Å; K87-A91 PolarHBondContact O-N 2.88Å
88L98.7Very high98.6Very high118 Ų11898.1 Ų98.162%0.61852%0.516SS*.Hα-helixtrans-63.2-47.8176.5-179.762.1000111.3S84 E85 K90 A91 Q92S84-L88 PolarHBondContact O-N 3.47Å; E85-L88 PolarHBondContact O-N 3.4Å; L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 3.28Å; L88-A91 PolarHBondContact O-N 3.2Å; L88-A91 VanDerWaalsContact O-N 3.14Å; L88-Q92 WeakPolarHBondContact O-CB 3.49Å; L88-Q92 PolarHBondContact O-N 2.87Å
89N98.7Very high98.6Very high92 Ų92101.2 Ų101.249%0.49252%0.523SS..Hα-helixtrans-60.5-40.8177.1-73.8-23.5000111.9E85 Q92 C93E85-N89 WeakPolarHBondContact O-CB 3.09Å; E85-N89 PolarHBondContact O-N 3.42Å; E85-N89 PolarHBondContact O-ND2 3.36Å; N89-Q92 PolarHBondContact O-N 2.95Å; N89-C93 WeakPolarHBondContact O-CB 3.31Å; N89-C93 PolarHBondContact O-N 2.82Å
90K98.7Very high98.6Very high144 Ų14498.7 Ų98.763%0.62652%0.516SS*.Hα-helixtrans-60.9-46.7173.5-178.9-180178.1179.40111.7A86 K87 L88 Q92 C93 L94A86-K90 WeakPolarHBondContact O-CB 3.38Å; A86-K90 PolarHBondContact O-N 2.95Å; K87-K90 PolarHBondContact O-N 2.93Å; L88-K90 VanDerWaalsContact C-N 3.31Å; L88-K90 PolarHBondContact O-N 3.28Å; K90-Q92 VanDerWaalsContact C-N 3.34Å; K90-Q92 PolarHBondContact O-N 3.46Å; K90-C93 PolarHBondContact O-N 3.47Å; K90-L94 HydrophobicContact CG-CD1 4.25Å; K90-L94 WeakPolarHBondContact O-CG 3.47Å; K90-L94 PolarHBondContact O-N 3.35Å; K90-L94 VanDerWaalsContact O-N 3.07Å
91A98.6Very high98.6Very high56 Ų5699.4 Ų99.446%0.46352%0.517SS..Hα-helixtrans-62.6-41.7178.900000111.8K87 L88 L94 L95K87-A91 PolarHBondContact O-N 2.88Å; L88-A91 PolarHBondContact O-N 3.2Å; L88-A91 VanDerWaalsContact O-N 3.14Å; A91-L94 PolarHBondContact O-N 3.38Å; A91-L95 WeakPolarHBondContact O-CB 3.27Å; A91-L95 PolarHBondContact O-N 3.15Å
92Q98.7Very high98.6Very high88 Ų8896.3 Ų96.341%0.41151%0.506SS..Hα-helixtrans-63-46.4176.7-175.458.542.300111.8L88 N89 K90 L94 L95 D96L88-Q92 WeakPolarHBondContact O-CB 3.49Å; L88-Q92 PolarHBondContact O-N 2.87Å; N89-Q92 PolarHBondContact O-N 2.95Å; K90-Q92 VanDerWaalsContact C-N 3.34Å; K90-Q92 PolarHBondContact O-N 3.46Å; Q92-L94 VanDerWaalsContact C-N 3.34Å; Q92-L94 PolarHBondContact O-N 3.37Å; Q92-L95 WeakPolarHBondContact O-CB 3.33Å; Q92-L95 PolarHBondContact O-N 2.92Å; Q92-D96 VanDerWaalsContact NE2-CG 3.29Å; Q92-D96 PolarHBondContact NE2-OD1 2.82Å; Q92-D96 VanDerWaalsContact NE2-OD1 3.07Å; Q92-D96 PolarHBondContact NE2-OD2 2.95Å; Q92-D96 PolarHBondContact O-N 3.03Å
93C98.7Very high98.6Very high80 Ų8096.3 Ų96.354%0.54151%0.508SS..Hα-helixtrans-59.9-42.9177.7-178.30000112.3N89 K90 D96 Q97N89-C93 WeakPolarHBondContact O-CB 3.31Å; N89-C93 PolarHBondContact O-N 2.82Å; K90-C93 PolarHBondContact O-N 3.47Å; C93-D96 PolarHBondContact O-N 3.01Å; C93-Q97 WeakPolarHBondContact O-CB 3.42Å; C93-Q97 PolarHBondContact O-N 3.19Å
94L98.6Very high98.5Very high92 Ų9298.3 Ų98.348%0.48252%0.515SS..Hα-helixtrans-64.8-40.1176.3-70.5172.6000112.2K90 A91 Q92 Q97 E98K90-L94 HydrophobicContact CG-CD1 4.25Å; K90-L94 WeakPolarHBondContact O-CG 3.47Å; K90-L94 PolarHBondContact O-N 3.35Å; K90-L94 VanDerWaalsContact O-N 3.07Å; A91-L94 PolarHBondContact O-N 3.38Å; Q92-L94 VanDerWaalsContact C-N 3.34Å; Q92-L94 PolarHBondContact O-N 3.37Å; L94-Q97 PolarHBondContact O-N 3.46Å; L94-E98 PolarHBondContact O-N 2.91Å
95L98.5Very high98.5Very high83 Ų83101.5 Ų101.544%0.43552%0.519SS..Hα-helixtrans-62.9-45176.217862.4000111.5A91 Q92 E98 K99A91-L95 WeakPolarHBondContact O-CB 3.27Å; A91-L95 PolarHBondContact O-N 3.15Å; Q92-L95 WeakPolarHBondContact O-CB 3.33Å; Q92-L95 PolarHBondContact O-N 2.92Å; L95-E98 PolarHBondContact O-N 2.85Å; L95-K99 HydrophobicContact CG-CD 4.35Å; L95-K99 WeakPolarHBondContact O-CB 3.29Å; L95-K99 WeakPolarHBondContact O-CG 3.33Å; L95-K99 PolarHBondContact O-N 3.43Å
96D98.5Very high98.5Very high74 Ų74100.1 Ų100.140%0.39651%0.514SS..Hα-helixtrans-68.3-37.2179.8-67.2-26.7000111.5Q92 C93 K99 A100Q92-D96 VanDerWaalsContact NE2-CG 3.29Å; Q92-D96 PolarHBondContact NE2-OD1 2.82Å; Q92-D96 VanDerWaalsContact NE2-OD1 3.07Å; Q92-D96 PolarHBondContact NE2-OD2 2.95Å; Q92-D96 PolarHBondContact O-N 3.03Å; C93-D96 PolarHBondContact O-N 3.01Å; D96-K99 PolarHBondContact O-N 3.1Å; D96-A100 WeakPolarHBondContact O-CB 3.48Å; D96-A100 PolarHBondContact O-N 3.15Å
97Q98.5Very high98.5Very high127 Ų127102.1 Ų102.159%0.59352%0.516SS*.Hα-helixtrans-61-46.3172.4-175.4-178.718.900112C93 L94 A100 K101C93-Q97 WeakPolarHBondContact O-CB 3.42Å; C93-Q97 PolarHBondContact O-N 3.19Å; L94-Q97 PolarHBondContact O-N 3.46Å; Q97-A100 PolarHBondContact O-N 2.91Å; Q97-K101 WeakPolarHBondContact O-CB 3.44Å; Q97-K101 PolarHBondContact O-N 3.31Å
98E98.5Very high98.5Very high112 Ų11298.5 Ų98.552%0.52351%0.511SS..Hα-helixtrans-67.7-38.9179.4-174.356.9-151.500111.7L94 L95 K101 S102L94-E98 PolarHBondContact O-N 2.91Å; L95-E98 PolarHBondContact O-N 2.85Å; E98-K101 PolarHBondContact O-N 2.92Å; E98-S102 VanDerWaalsContact O-CB 3.3Å; E98-S102 WeakPolarHBondContact O-CB 3.43Å; E98-S102 PolarHBondContact O-N 2.85Å
99K98.6Very high98.5Very high116 Ų11697.7 Ų97.750%0.50451%0.507SS..Hα-helixtrans-60.6-46.6172.7-76.8175.8-179.2172.50111.8L95 D96 K101 S102 Q103L95-K99 HydrophobicContact CG-CD 4.35Å; L95-K99 WeakPolarHBondContact O-CB 3.29Å; L95-K99 WeakPolarHBondContact O-CG 3.33Å; L95-K99 PolarHBondContact O-N 3.43Å; D96-K99 PolarHBondContact O-N 3.1Å; K99-K101 VanDerWaalsContact C-N 3.34Å; K99-K101 PolarHBondContact O-N 3.09Å; K99-S102 PolarHBondContact O-N 2.91Å; K99-Q103 WeakPolarHBondContact O-CB 3.39Å; K99-Q103 PolarHBondContact O-N 3.17Å
100A98.4Very high98.5Very high46 Ų4698.9 Ų98.938%0.3851%0.509SS..Hα-helixtrans-61.6-43.4177.900000111.5D96 Q97 Q103 Q104D96-A100 WeakPolarHBondContact O-CB 3.48Å; D96-A100 PolarHBondContact O-N 3.15Å; Q97-A100 PolarHBondContact O-N 2.91Å; A100-Q103 PolarHBondContact O-N 2.72Å; A100-Q104 WeakPolarHBondContact O-CB 3.25Å; A100-Q104 WeakPolarHBondContact O-CG 3.47Å; A100-Q104 PolarHBondContact O-N 2.92Å
101K98.5Very high98.5Very high134 Ų13499 Ų9958%0.58351%0.512SS*.Hα-helixtrans-63.4-44.1176.4-173.6-177.7179.7-174.20112.3Q97 E98 K99 Q104 K105Q97-K101 WeakPolarHBondContact O-CB 3.44Å; Q97-K101 PolarHBondContact O-N 3.31Å; E98-K101 PolarHBondContact O-N 2.92Å; K99-K101 VanDerWaalsContact C-N 3.34Å; K99-K101 PolarHBondContact O-N 3.09Å; K101-Q104 PolarHBondContact O-N 2.91Å; K101-K105 PolarHBondContact O-N 3.25Å
102S98.3Very high98.5Very high57 Ų57100.8 Ų100.840%0.39951%0.511SS..Hα-helixtrans-62.5-45.1176.3-176.40000111.3E98 K99 Q104 K105 I106E98-S102 VanDerWaalsContact O-CB 3.3Å; E98-S102 WeakPolarHBondContact O-CB 3.43Å; E98-S102 PolarHBondContact O-N 2.85Å; K99-S102 PolarHBondContact O-N 2.91Å; S102-Q104 PolarHBondContact O-N 3.49Å; S102-K105 WeakPolarHBondContact O-CB 3.5Å; S102-K105 PolarHBondContact O-N 2.95Å; S102-I106 WeakPolarHBondContact O-CG1 3.39Å; S102-I106 PolarHBondContact O-N 3.06Å
103Q98.5Very high98.5Very high126 Ų126101.2 Ų101.259%0.58952%0.519SS*.Hα-helixtrans-62.8-42.9177.2-172.1174.912.800112.2K99 A100 K105 I106 L107K99-Q103 WeakPolarHBondContact O-CB 3.39Å; K99-Q103 PolarHBondContact O-N 3.17Å; A100-Q103 PolarHBondContact O-N 2.72Å; Q103-K105 VanDerWaalsContact C-N 3.32Å; Q103-K105 PolarHBondContact O-N 3.47Å; Q103-I106 PolarHBondContact O-N 3.3Å; Q103-L107 HydrophobicContact CG-CD1 4.5Å; Q103-L107 WeakPolarHBondContact O-CG 3.48Å; Q103-L107 PolarHBondContact O-N 2.83Å
104Q98.3Very high98.5Very high139 Ų139105 Ų10565%0.6553%0.527SS*.Hα-helixtrans-59.7-42.5173.8-77.2-178.7-9.700112A100 K101 S102 I106 L107 A108A100-Q104 WeakPolarHBondContact O-CB 3.25Å; A100-Q104 WeakPolarHBondContact O-CG 3.47Å; A100-Q104 PolarHBondContact O-N 2.92Å; K101-Q104 PolarHBondContact O-N 2.91Å; S102-Q104 PolarHBondContact O-N 3.49Å; Q104-I106 PolarHBondContact O-N 3.44Å; Q104-L107 PolarHBondContact O-N 3.41Å; Q104-A108 WeakPolarHBondContact O-CB 3.48Å; Q104-A108 PolarHBondContact O-N 3.3Å
105K98.4Very high98.5Very high145 Ų145107 Ų10763%0.6353%0.528SS*.Hα-helixtrans-63.5-40.7176.9-175.7176.5179.3-179.60112K101 S102 Q103 A108 L109K101-K105 PolarHBondContact O-N 3.25Å; S102-K105 WeakPolarHBondContact O-CB 3.5Å; S102-K105 PolarHBondContact O-N 2.95Å; Q103-K105 VanDerWaalsContact C-N 3.32Å; Q103-K105 PolarHBondContact O-N 3.47Å; K105-A108 PolarHBondContact O-N 3.41Å; K105-L109 HydrophobicContact CG-CD1 4.23Å; K105-L109 VanDerWaalsContact O-CG 3.31Å; K105-L109 WeakPolarHBondContact O-CG 3.28Å; K105-L109 PolarHBondContact O-N 3.25Å
106I98.5Very high98.5Very high84 Ų84106.1 Ų106.143%0.43152%0.524SS..Hα-helixtrans-61.7-50.2176.3-69.9166.6000110.1S102 Q103 Q104 A108 L109 E110S102-I106 WeakPolarHBondContact O-CG1 3.39Å; S102-I106 PolarHBondContact O-N 3.06Å; Q103-I106 PolarHBondContact O-N 3.3Å; Q104-I106 PolarHBondContact O-N 3.44Å; I106-A108 VanDerWaalsContact C-N 3.33Å; I106-A108 PolarHBondContact O-N 3.44Å; I106-L109 PolarHBondContact O-N 3.44Å; I106-L109 VanDerWaalsContact O-N 3.14Å; I106-E110 HydrophobicContact CG2-CG 4.31Å; I106-E110 WeakPolarHBondContact O-CG 3.47Å; I106-E110 PolarHBondContact O-N 3.42Å
107L98.3Very high98.5Very high98 Ų98110.2 Ų110.251%0.51354%0.538SS..Hα-helixtrans-59.5-42.3179.4-69.5173.6000112.3Q103 Q104 L109 E110 E111Q103-L107 HydrophobicContact CG-CD1 4.5Å; Q103-L107 WeakPolarHBondContact O-CG 3.48Å; Q103-L107 PolarHBondContact O-N 2.83Å; Q104-L107 PolarHBondContact O-N 3.41Å; L107-L109 PolarHBondContact O-N 3.44Å; L107-E110 PolarHBondContact O-N 2.93Å; L107-E111 PolarHBondContact O-N 3.41Å
108A98.4Very high98.5Very high57 Ų57108.9 Ų108.947%0.47154%0.535SS..Hα-helixtrans-62.8-40.8176.400000112.3Q104 K105 I106 E111 E112Q104-A108 WeakPolarHBondContact O-CB 3.48Å; Q104-A108 PolarHBondContact O-N 3.3Å; K105-A108 PolarHBondContact O-N 3.41Å; I106-A108 VanDerWaalsContact C-N 3.33Å; I106-A108 PolarHBondContact O-N 3.44Å; A108-E111 PolarHBondContact O-N 2.87Å; A108-E112 PolarHBondContact O-N 3Å; A108-E112 VanDerWaalsContact O-N 3.08Å
109L98.5Very high98.5Very high101 Ų101110.3 Ų110.353%0.52954%0.536SS..Hα-helixtrans-68.2-38.7175.8-72.1172000112.1K105 I106 L107 E111 E112 V113K105-L109 HydrophobicContact CG-CD1 4.23Å; K105-L109 VanDerWaalsContact O-CG 3.31Å; K105-L109 WeakPolarHBondContact O-CG 3.28Å; K105-L109 PolarHBondContact O-N 3.25Å; I106-L109 PolarHBondContact O-N 3.44Å; I106-L109 VanDerWaalsContact O-N 3.14Å; L107-L109 PolarHBondContact O-N 3.44Å; L109-E111 VanDerWaalsContact C-N 3.33Å; L109-E112 PolarHBondContact O-N 3.43Å; L109-V113 WeakPolarHBondContact O-CB 3.36Å; L109-V113 VanDerWaalsContact O-CG2 3.23Å; L109-V113 WeakPolarHBondContact O-CG2 3.47Å; L109-V113 PolarHBondContact O-N 2.93Å
110E98.6Very high98.5Very high117 Ų117110.2 Ų110.255%0.54754%0.54SS..Hα-helixtrans-62.9-40.5175.9-74.2178168.100111.8I106 L107 K114I106-E110 HydrophobicContact CG2-CG 4.31Å; I106-E110 WeakPolarHBondContact O-CG 3.47Å; I106-E110 PolarHBondContact O-N 3.42Å; L107-E110 PolarHBondContact O-N 2.93Å; E110-K114 WeakPolarHBondContact O-CB 3.19Å; E110-K114 PolarHBondContact O-N 3.19Å
111E98.4Very high98.5Very high146 Ų146112.9 Ų112.968%0.68255%0.545SS*.Hα-helixtrans-63.6-46.5174.9-174.3170.1-161.800111.8L107 A108 L109 V113 K114 Y115L107-E111 PolarHBondContact O-N 3.41Å; A108-E111 PolarHBondContact O-N 2.87Å; L109-E111 VanDerWaalsContact C-N 3.33Å; E111-V113 PolarHBondContact O-N 3.22Å; E111-K114 WeakPolarHBondContact O-CB 3.47Å; E111-K114 PolarHBondContact O-N 2.98Å; E111-Y115 WeakPolarHBondContact O-CB 3.49Å; E111-Y115 PolarHBondContact O-N 3.23Å
112E98.4Very high98.5Very high95 Ų95111 Ų11144%0.44454%0.54SS..Hα-helixtrans-62.4-44.2176.6-176.658.9-150.400111.6A108 L109 K114 Y115 L116A108-E112 PolarHBondContact O-N 3Å; A108-E112 VanDerWaalsContact O-N 3.08Å; L109-E112 PolarHBondContact O-N 3.43Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 3.47Å; E112-Y115 WeakPolarHBondContact O-CB 3.4Å; E112-Y115 PolarHBondContact O-N 2.86Å; E112-L116 HydrophobicContact CG-CD1 4.07Å; E112-L116 HydrophobicContact CG-CG 4.39Å; E112-L116 WeakPolarHBondContact O-CB 3.3Å; E112-L116 VanDerWaalsContact O-CG 3.3Å; E112-L116 WeakPolarHBondContact O-CG 3.46Å; E112-L116 PolarHBondContact O-N 3.4Å; E112-L116 WeakPolarHBondContact OE1-CG 3.45Å
113V98.6Very high98.5Very high96 Ų96112.8 Ų112.858%0.58254%0.542SS*.Hα-helixtrans-60.9-41.8176.2167.60000110.9L109 E111 K117L109-V113 WeakPolarHBondContact O-CB 3.36Å; L109-V113 VanDerWaalsContact O-CG2 3.23Å; L109-V113 WeakPolarHBondContact O-CG2 3.47Å; L109-V113 PolarHBondContact O-N 2.93Å; E111-V113 PolarHBondContact O-N 3.22Å; V113-K117 VanDerWaalsContact O-CB 3.26Å; V113-K117 WeakPolarHBondContact O-CB 3.44Å; V113-K117 PolarHBondContact O-N 3.37Å
114K98.6Very high98.5Very high160 Ų160111.5 Ų111.570%0.69654%0.535SS*.Hα-helixtrans-63.6-43.8176.4-176.9-175.7177.6-172.80111.4E110 E111 E112 K117 N118E110-K114 WeakPolarHBondContact O-CB 3.19Å; E110-K114 PolarHBondContact O-N 3.19Å; E111-K114 WeakPolarHBondContact O-CB 3.47Å; E111-K114 PolarHBondContact O-N 2.98Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 3.47Å; K114-K117 PolarHBondContact O-N 2.74Å; K114-N118 PolarHBondContact O-N 3.32Å; K114-N118 VanDerWaalsContact O-N 3.07Å
115Y98.4Very high98.5Very high133 Ų133107.8 Ų107.852%0.52252%0.522SS..Hα-helixtrans-60.6-51.3176.1169.9-107.3000111.6E111 E112 K117 N118 R119E111-Y115 WeakPolarHBondContact O-CB 3.49Å; E111-Y115 PolarHBondContact O-N 3.23Å; E112-Y115 WeakPolarHBondContact O-CB 3.4Å; E112-Y115 PolarHBondContact O-N 2.86Å; Y115-K117 VanDerWaalsContact C-N 3.31Å; Y115-K117 PolarHBondContact O-N 2.92Å; Y115-N118 PolarHBondContact O-N 2.94Å; Y115-R119 PolarHBondContact O-N 3.42Å
116L98.6Very high98.5Very high65 Ų65104.6 Ų104.634%0.3451%0.511SS..Hα-helixtrans-61.1-39.1178.9-69.6175.2000112.4E112 R119 L120E112-L116 HydrophobicContact CG-CD1 4.07Å; E112-L116 HydrophobicContact CG-CG 4.39Å; E112-L116 WeakPolarHBondContact O-CB 3.3Å; E112-L116 VanDerWaalsContact O-CG 3.3Å; E112-L116 WeakPolarHBondContact O-CG 3.46Å; E112-L116 PolarHBondContact O-N 3.4Å; E112-L116 WeakPolarHBondContact OE1-CG 3.45Å; L116-R119 PolarHBondContact O-N 3.31Å; L116-L120 WeakPolarHBondContact O-CB 3.26Å; L116-L120 PolarHBondContact O-N 2.83Å
117K98.7Very high98.5Very high160 Ų160104.6 Ų104.670%0.69651%0.509SS*.Hα-helixtrans-63.1-43.8176-174.6177.1-178.9178.50111.9V113 K114 Y115 L120 E121V113-K117 VanDerWaalsContact O-CB 3.26Å; V113-K117 WeakPolarHBondContact O-CB 3.44Å; V113-K117 PolarHBondContact O-N 3.37Å; K114-K117 PolarHBondContact O-N 2.74Å; Y115-K117 VanDerWaalsContact C-N 3.31Å; Y115-K117 PolarHBondContact O-N 2.92Å; K117-L120 PolarHBondContact O-N 2.95Å; K117-E121 PolarHBondContact O-N 3.27Å; K117-E121 VanDerWaalsContact O-N 3.13Å
118N98.6Very high98.5Very high100 Ų100103.6 Ų103.654%0.53550%0.504SS..Hα-helixtrans-62.3-46.3176-177.4-70.6000111.1K114 Y115 L120 E121 I122K114-N118 PolarHBondContact O-N 3.32Å; K114-N118 VanDerWaalsContact O-N 3.07Å; Y115-N118 PolarHBondContact O-N 2.94Å; N118-L120 VanDerWaalsContact C-N 3.31Å; N118-L120 PolarHBondContact O-N 2.95Å; N118-E121 PolarHBondContact O-N 3.27Å; N118-I122 WeakPolarHBondContact O-CG1 3.33Å; N118-I122 PolarHBondContact O-N 3.44Å; N118-I122 WeakPolarHBondContact OD1-CD1 3.23Å
119R98.6Very high98.5Very high141 Ų141107.2 Ų107.253%0.53251%0.509SS..Hα-helixtrans-58.7-41.3177.3-168.8-17969.1178.21.6112.4Y115 L116 I122 Q123Y115-R119 PolarHBondContact O-N 3.42Å; L116-R119 PolarHBondContact O-N 3.31Å; R119-I122 PolarHBondContact O-N 2.92Å; R119-Q123 WeakPolarHBondContact O-CB 3.4Å; R119-Q123 PolarHBondContact O-N 3.48Å
120L98.5Very high98.5Very high114 Ų114106.8 Ų106.860%0.59751%0.507SS*.Hα-helixtrans-64.2-41.8177.3-170.4155.4000111.6L116 K117 N118 Q123 K124L116-L120 WeakPolarHBondContact O-CB 3.26Å; L116-L120 PolarHBondContact O-N 2.83Å; K117-L120 PolarHBondContact O-N 2.95Å; N118-L120 VanDerWaalsContact C-N 3.31Å; N118-L120 PolarHBondContact O-N 2.95Å; L120-Q123 PolarHBondContact O-N 2.97Å; L120-K124 WeakPolarHBondContact O-CB 3.45Å; L120-K124 PolarHBondContact O-N 2.88Å
121E98.6Very high98.5Very high102 Ų102106.4 Ų106.448%0.47750%0.504SS..Hα-helixtrans-65.4-39.6178.5-168.359.9-146.500112.3K117 N118 K124 T125K117-E121 PolarHBondContact O-N 3.27Å; K117-E121 VanDerWaalsContact O-N 3.13Å; N118-E121 PolarHBondContact O-N 3.27Å; E121-K124 PolarHBondContact O-N 2.97Å; E121-T125 PolarHBondContact O-N 2.91Å; E121-T125 PolarHBondContact O-OG1 3.37Å
122I98.4Very high98.5Very high95 Ų95106.2 Ų106.249%0.48750%0.502SS..Hα-helixtrans-61.3-48.7173.2-67.1171.2000110.1N118 R119 K124 T125 I126N118-I122 WeakPolarHBondContact O-CG1 3.33Å; N118-I122 PolarHBondContact O-N 3.44Å; N118-I122 WeakPolarHBondContact OD1-CD1 3.23Å; R119-I122 PolarHBondContact O-N 2.92Å; I122-K124 VanDerWaalsContact C-N 3.33Å; I122-K124 PolarHBondContact O-N 3.32Å; I122-T125 WeakPolarHBondContact O-CB 3.39Å; I122-T125 PolarHBondContact O-N 3.03Å; I122-I126 HydrophobicContact CG2-CD1 3.98Å; I122-I126 WeakPolarHBondContact O-CG1 3.36Å; I122-I126 PolarHBondContact O-N 3.3Å
123Q98.6Very high98.5Very high95 Ų95106.8 Ų106.844%0.44451%0.505SS..Hα-helixtrans-60.6-42.7179.2179.658.923.200111.8R119 L120 T125 I126 E127R119-Q123 WeakPolarHBondContact O-CB 3.4Å; R119-Q123 PolarHBondContact O-N 3.48Å; L120-Q123 PolarHBondContact O-N 2.97Å; Q123-T125 VanDerWaalsContact C-N 3.35Å; Q123-T125 PolarHBondContact O-N 3.07Å; Q123-I126 WeakPolarHBondContact O-CB 3.31Å; Q123-I126 PolarHBondContact O-N 3.43Å; Q123-E127 PolarHBondContact NE2-OE1 2.9Å; Q123-E127 WeakPolarHBondContact O-CG 3.5Å; Q123-E127 PolarHBondContact O-N 2.97Å
124K98.7Very high98.5Very high99 Ų99107.7 Ų107.743%0.4351%0.506SS..Hα-helixtrans-60.3-44.3175.9-176.6-175.9173.7-165.40111.8L120 E121 I122 I126 E127 D128L120-K124 WeakPolarHBondContact O-CB 3.45Å; L120-K124 PolarHBondContact O-N 2.88Å; E121-K124 PolarHBondContact O-N 2.97Å; I122-K124 VanDerWaalsContact C-N 3.33Å; I122-K124 PolarHBondContact O-N 3.32Å; K124-I126 VanDerWaalsContact C-N 3.3Å; K124-I126 PolarHBondContact O-N 2.93Å; K124-E127 PolarHBondContact O-N 3.12Å; K124-D128 WeakPolarHBondContact O-CB 3.4Å; K124-D128 PolarHBondContact O-N 3.24Å
125T98.4Very high98.5Very high60 Ų60103.5 Ų103.537%0.36849%0.493SS..Hα-helixtrans-61-39.9176.1-59.40000111.7E121 I122 Q123 K129E121-T125 PolarHBondContact O-N 2.91Å; E121-T125 PolarHBondContact O-OG1 3.37Å; I122-T125 WeakPolarHBondContact O-CB 3.39Å; I122-T125 PolarHBondContact O-N 3.03Å; Q123-T125 VanDerWaalsContact C-N 3.35Å; Q123-T125 PolarHBondContact O-N 3.07Å; T125-K129 HydrophobicContact CG2-CD 4.45Å; T125-K129 WeakPolarHBondContact O-CG 3.38Å; T125-K129 PolarHBondContact O-N 3.24Å; T125-K129 VanDerWaalsContact O-N 3.12Å
126I98.3Very high98.5Very high78 Ų78102.6 Ų102.640%0.449%0.492SS..Hα-helixtrans-64.3-47.7175.6-67.5166.9000110.2I122 Q123 K124 D128 K129 L130I122-I126 HydrophobicContact CG2-CD1 3.98Å; I122-I126 WeakPolarHBondContact O-CG1 3.36Å; I122-I126 PolarHBondContact O-N 3.3Å; Q123-I126 WeakPolarHBondContact O-CB 3.31Å; Q123-I126 PolarHBondContact O-N 3.43Å; K124-I126 VanDerWaalsContact C-N 3.3Å; K124-I126 PolarHBondContact O-N 2.93Å; I126-D128 VanDerWaalsContact C-N 3.35Å; I126-D128 PolarHBondContact O-N 3.01Å; I126-K129 PolarHBondContact O-N 3.2Å; I126-L130 HydrophobicContact CG2-CD1 3.9Å; I126-L130 VanDerWaalsContact O-CD1 3.25Å; I126-L130 WeakPolarHBondContact O-CD1 3.37Å; I126-L130 PolarHBondContact O-N 3.4Å
127E98.5Very high98.5Very high84 Ų84104.6 Ų104.639%0.39350%0.496SS..Hα-helixtrans-60.2-42.4178.1-75.7179.8-162.100112.9Q123 K124 L130 K131Q123-E127 PolarHBondContact NE2-OE1 2.9Å; Q123-E127 WeakPolarHBondContact O-CG 3.5Å; Q123-E127 PolarHBondContact O-N 2.97Å; K124-E127 PolarHBondContact O-N 3.12Å; E127-L130 PolarHBondContact O-N 3.21Å; E127-K131 VanDerWaalsContact O-CG 3.28Å; E127-K131 WeakPolarHBondContact O-CG 3.3Å; E127-K131 PolarHBondContact O-N 3.46Å
128D98.6Very high98.5Very high77 Ų77103.1 Ų103.141%0.41249%0.49SS..Hα-helixtrans-65.6-40.3179.2-70.7-17.4000111.1K124 I126 K131 E132K124-D128 WeakPolarHBondContact O-CB 3.4Å; K124-D128 PolarHBondContact O-N 3.24Å; I126-D128 VanDerWaalsContact C-N 3.35Å; I126-D128 PolarHBondContact O-N 3.01Å; D128-K131 PolarHBondContact O-N 2.9Å; D128-K131 IonicContact OD1-NZ 3.54Å; D128-K131 PolarHBondContact OD1-NZ 3Å; D128-E132 WeakPolarHBondContact O-CB 3.48Å; D128-E132 PolarHBondContact O-N 3.28Å
129K98.4Very high98.5Very high133 Ų133103.9 Ų103.958%0.57849%0.49SS*.Hα-helixtrans-63.4-39.9172.1-73.4177.3178.7-176.80112.8T125 I126 E132 Q133T125-K129 HydrophobicContact CG2-CD 4.45Å; T125-K129 WeakPolarHBondContact O-CG 3.38Å; T125-K129 PolarHBondContact O-N 3.24Å; T125-K129 VanDerWaalsContact O-N 3.12Å; I126-K129 PolarHBondContact O-N 3.2Å; K129-E132 PolarHBondContact O-N 3.41Å; K129-Q133 WeakPolarHBondContact O-CB 3.34Å; K129-Q133 PolarHBondContact O-N 3.23Å
130L98.6Very high98.5Very high92 Ų92102.7 Ų102.748%0.48249%0.489SS..Hα-helixtrans-64.8-42.6175.6-97.569.4000111.2I126 E127 Q133 I134I126-L130 HydrophobicContact CG2-CD1 3.9Å; I126-L130 VanDerWaalsContact O-CD1 3.25Å; I126-L130 WeakPolarHBondContact O-CD1 3.37Å; I126-L130 PolarHBondContact O-N 3.4Å; E127-L130 PolarHBondContact O-N 3.21Å; L130-Q133 PolarHBondContact O-N 2.99Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.33Å; L130-I134 PolarHBondContact O-N 3.42Å
131K98.6Very high98.5Very high110 Ų110104.5 Ų104.548%0.47849%0.489SS..Hα-helixtrans-61.8-44.5175.6-71.7167.7-165.3157.90111.3E127 D128 Q133 I134 V135E127-K131 VanDerWaalsContact O-CG 3.28Å; E127-K131 WeakPolarHBondContact O-CG 3.3Å; E127-K131 PolarHBondContact O-N 3.46Å; D128-K131 PolarHBondContact O-N 2.9Å; D128-K131 IonicContact OD1-NZ 3.54Å; D128-K131 PolarHBondContact OD1-NZ 3Å; K131-Q133 VanDerWaalsContact C-N 3.34Å; K131-Q133 PolarHBondContact O-N 3.06Å; K131-I134 PolarHBondContact O-N 3.17Å; K131-V135 WeakPolarHBondContact O-CG2 3.41Å; K131-V135 PolarHBondContact O-N 3.29Å
132E98.6Very high98.5Very high141 Ų141105.1 Ų105.166%0.65949%0.491SS*.Hα-helixtrans-58.4-46.4175.2-175-179.4-176.700111.2D128 K129 I134 V135 F136D128-E132 WeakPolarHBondContact O-CB 3.48Å; D128-E132 PolarHBondContact O-N 3.28Å; K129-E132 PolarHBondContact O-N 3.41Å; E132-I134 VanDerWaalsContact C-N 3.35Å; E132-I134 PolarHBondContact O-N 3.48Å; E132-V135 PolarHBondContact O-N 3.42Å; E132-F136 WeakPolarHBondContact O-CB 3.35Å; E132-F136 PolarHBondContact O-N 3.45Å
133Q98.3Very high98.4Very high107 Ų107103.6 Ų103.650%0.549%0.489SS..Hα-helixtrans-62.1-40.5177.5-171.3177.842.800112.5K129 L130 K131 F136 Y137K129-Q133 WeakPolarHBondContact O-CB 3.34Å; K129-Q133 PolarHBondContact O-N 3.23Å; L130-Q133 PolarHBondContact O-N 2.99Å; K131-Q133 VanDerWaalsContact C-N 3.34Å; K131-Q133 PolarHBondContact O-N 3.06Å; Q133-F136 PolarHBondContact O-N 3.43Å; Q133-Y137 HydrophobicContact CG-CD2 3.82Å; Q133-Y137 HydrophobicContact CG-CE2 3.74Å; Q133-Y137 VanDerWaalsContact O-CD2 3.31Å; Q133-Y137 WeakPolarHBondContact O-CD2 3.36Å; Q133-Y137 PolarHBondContact O-N 2.85Å
134I98.6Very high98.4Very high116 Ų116105.2 Ų105.260%0.59550%0.495SS*.Hα-helixtrans-62.4-45.5175.6-70.7165.3000110.6L130 K131 E132 Y137 K138L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.33Å; L130-I134 PolarHBondContact O-N 3.42Å; K131-I134 PolarHBondContact O-N 3.17Å; E132-I134 VanDerWaalsContact C-N 3.35Å; E132-I134 PolarHBondContact O-N 3.48Å; I134-Y137 PolarHBondContact O-N 3.41Å; I134-K138 VanDerWaalsContact O-CB 3.27Å; I134-K138 WeakPolarHBondContact O-CB 3.48Å; I134-K138 PolarHBondContact O-N 3.19Å
135V98.6Very high98.4Very high71 Ų71105.3 Ų105.343%0.4350%0.5SS..Hα-helixtrans-62-47.1177.2171.20000110.5K131 E132 Y137 K138 E139K131-V135 WeakPolarHBondContact O-CG2 3.41Å; K131-V135 PolarHBondContact O-N 3.29Å; E132-V135 PolarHBondContact O-N 3.42Å; V135-Y137 PolarHBondContact O-N 3.39Å; V135-K138 WeakPolarHBondContact O-CB 3.35Å; V135-K138 PolarHBondContact O-N 3.07Å; V135-E139 HydrophobicContact CG1-CG 4.43Å; V135-E139 WeakPolarHBondContact O-CG 3.16Å; V135-E139 PolarHBondContact O-N 3.36Å
136F98.5Very high98.3Very high114 Ų114109.3 Ų109.350%0.551%0.512SS..Hα-helixtrans-54.9-50.5177.2171.9-99.7000112.3E132 Q133 E139 K140E132-F136 WeakPolarHBondContact O-CB 3.35Å; E132-F136 PolarHBondContact O-N 3.45Å; Q133-F136 PolarHBondContact O-N 3.43Å; F136-E139 PolarHBondContact O-N 2.98Å; F136-K140 HydrophobicContact CE1-CD 4.36Å; F136-K140 HydrophobicContact CZ-CD 4.46Å; F136-K140 WeakPolarHBondContact O-CB 3.49Å; F136-K140 PolarHBondContact O-N 3.13Å
137Y98.4Very high98.3Very high107 Ų107110 Ų11042%0.4252%0.521SS..Hα-helixtrans-67.5-38.7178.8-82.3-66.4000112.1Q133 I134 V135 E139 K140 Y141Q133-Y137 HydrophobicContact CG-CD2 3.82Å; Q133-Y137 HydrophobicContact CG-CE2 3.74Å; Q133-Y137 VanDerWaalsContact O-CD2 3.31Å; Q133-Y137 WeakPolarHBondContact O-CD2 3.36Å; Q133-Y137 PolarHBondContact O-N 2.85Å; I134-Y137 PolarHBondContact O-N 3.41Å; V135-Y137 PolarHBondContact O-N 3.39Å; Y137-E139 VanDerWaalsContact C-N 3.34Å; Y137-E139 PolarHBondContact O-N 3.17Å; Y137-K140 HydrophobicContact CD1-CD 4.48Å; Y137-K140 PolarHBondContact O-N 3.36Å; Y137-Y141 WeakPolarHBondContact O-CB 3.49Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.44Å; Y137-Y141 PolarHBondContact O-N 3.13Å
138K98.6Very high98.3Very high130 Ų130111.6 Ų111.657%0.56553%0.529SS*.Hα-helixtrans-57.1-47.4175.2179.6-177.2177.3-175.80111.4I134 V135 Y141 Q142I134-K138 VanDerWaalsContact O-CB 3.27Å; I134-K138 WeakPolarHBondContact O-CB 3.48Å; I134-K138 PolarHBondContact O-N 3.19Å; V135-K138 WeakPolarHBondContact O-CB 3.35Å; V135-K138 PolarHBondContact O-N 3.07Å; K138-Y141 PolarHBondContact O-N 2.96Å; K138-Q142 WeakPolarHBondContact O-CG 3.33Å; K138-Q142 PolarHBondContact O-N 3.5Å
139E98.5Very high98.3Very high116 Ų116110.6 Ų110.654%0.54253%0.529SS..Hα-helixtrans-64.8-42.7177-71.3177.5-179.500111.7V135 F136 Y137 Y141 Q142 S143V135-E139 HydrophobicContact CG1-CG 4.43Å; V135-E139 WeakPolarHBondContact O-CG 3.16Å; V135-E139 PolarHBondContact O-N 3.36Å; F136-E139 PolarHBondContact O-N 2.98Å; Y137-E139 VanDerWaalsContact C-N 3.34Å; Y137-E139 PolarHBondContact O-N 3.17Å; E139-Y141 PolarHBondContact O-N 3.42Å; E139-Q142 PolarHBondContact O-N 3.24Å; E139-S143 PolarHBondContact O-N 2.95Å
140K98.1Very high98.2Very high116 Ų116107.9 Ų107.950%0.50452%0.52SS..Hα-helixtrans-59-46175.2-169.9175.3-177.61770111.6F136 Y137 S143 F144F136-K140 HydrophobicContact CE1-CD 4.36Å; F136-K140 HydrophobicContact CZ-CD 4.46Å; F136-K140 WeakPolarHBondContact O-CB 3.49Å; F136-K140 PolarHBondContact O-N 3.13Å; Y137-K140 HydrophobicContact CD1-CD 4.48Å; Y137-K140 PolarHBondContact O-N 3.36Å; K140-S143 PolarHBondContact O-N 3.4Å; K140-S143 PolarHBondContact O-OG 2.94Å; K140-F144 WeakPolarHBondContact O-CB 3.49Å; K140-F144 PolarHBondContact O-N 3.16Å
141Y98.3Very high98.2Very high152 Ų152105.2 Ų105.260%0.59651%0.51SS*.Hα-helixtrans-63.3-40.5175.8-83.6-68.2000112.5Y137 K138 E139 F144 N145Y137-Y141 WeakPolarHBondContact O-CB 3.49Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.44Å; Y137-Y141 PolarHBondContact O-N 3.13Å; K138-Y141 PolarHBondContact O-N 2.96Å; E139-Y141 PolarHBondContact O-N 3.42Å; Y141-F144 PolarHBondContact O-N 2.88Å; Y141-N145 WeakPolarHBondContact O-CB 3.26Å; Y141-N145 VanDerWaalsContact O-CG 3.29Å; Y141-N145 PolarHBondContact O-N 3.07Å; Y141-N145 PolarHBondContact O-ND2 3.23Å
142Q98.3Very high98.1Very high114 Ų114108.3 Ų108.353%0.53352%0.518SS..Hα-helixtrans-62.7-43.6174.8-74.1177.6-5.100111.8K138 E139 N145 K146K138-Q142 WeakPolarHBondContact O-CG 3.33Å; K138-Q142 PolarHBondContact O-N 3.5Å; E139-Q142 PolarHBondContact O-N 3.24Å; Q142-N145 PolarHBondContact O-N 3.08Å; Q142-K146 WeakPolarHBondContact O-CB 3.42Å; Q142-K146 PolarHBondContact O-N 3.47Å
143S97.8Very high98.1Very high64 Ų64107.3 Ų107.345%0.44851%0.512SS..Hα-helixtrans-63-44.9176.675.20000111.9E139 K140 N145 K146 T147E139-S143 PolarHBondContact O-N 2.95Å; K140-S143 PolarHBondContact O-N 3.4Å; K140-S143 PolarHBondContact O-OG 2.94Å; S143-N145 PolarHBondContact O-N 3.4Å; S143-K146 WeakPolarHBondContact O-CB 3.43Å; S143-K146 PolarHBondContact O-N 2.85Å; S143-T147 PolarHBondContact O-N 3.48Å; S143-T147 PolarHBondContact O-OG1 3.31Å
144F97.8Very high98Very high128 Ų128108.8 Ų108.856%0.56152%0.52SS*.Hα-helixtrans-60.7-47.1176.6176.8-100.1000111.6K140 Y141 K146 T147 M148K140-F144 WeakPolarHBondContact O-CB 3.49Å; K140-F144 PolarHBondContact O-N 3.16Å; Y141-F144 PolarHBondContact O-N 2.88Å; F144-K146 VanDerWaalsContact C-N 3.31Å; F144-K146 PolarHBondContact O-N 3.4Å; F144-T147 PolarHBondContact O-N 2.95Å; F144-M148 WeakPolarHBondContact O-CB 3.31Å; F144-M148 PolarHBondContact O-N 2.87Å
145N97.9Very high98Very high101 Ų101109.9 Ų109.954%0.5452%0.521SS..Hα-helixtrans-62.8-38.4177.6-77.1-19.2000112.2Y141 Q142 S143 M148 S149Y141-N145 WeakPolarHBondContact O-CB 3.26Å; Y141-N145 VanDerWaalsContact O-CG 3.29Å; Y141-N145 PolarHBondContact O-N 3.07Å; Y141-N145 PolarHBondContact O-ND2 3.23Å; Q142-N145 PolarHBondContact O-N 3.08Å; S143-N145 PolarHBondContact O-N 3.4Å; N145-M148 PolarHBondContact O-N 3.48Å; N145-S149 WeakPolarHBondContact O-CB 3.3Å; N145-S149 PolarHBondContact O-N 3.39Å
146K98Very high98Very high144 Ų144110.5 Ų110.563%0.62652%0.522SS*.Hα-helixtrans-62.4-52174.1-176.1-179.4177.4-176.70110.9Q142 S143 F144 M148 S149 D150Q142-K146 WeakPolarHBondContact O-CB 3.42Å; Q142-K146 PolarHBondContact O-N 3.47Å; S143-K146 WeakPolarHBondContact O-CB 3.43Å; S143-K146 PolarHBondContact O-N 2.85Å; F144-K146 VanDerWaalsContact C-N 3.31Å; F144-K146 PolarHBondContact O-N 3.4Å; K146-M148 VanDerWaalsContact C-N 3.27Å; K146-M148 PolarHBondContact O-N 2.88Å; K146-S149 WeakPolarHBondContact O-CB 3.38Å; K146-S149 PolarHBondContact O-N 3.34Å; K146-D150 PolarHBondContact O-N 3.45Å
147T98Very high98Very high94 Ų94108.2 Ų108.258%0.57752%0.517SS*.Hα-helixtrans-58.1-39.5177.4-60.50000111.8S143 F144 D150 S151S143-T147 PolarHBondContact O-N 3.48Å; S143-T147 PolarHBondContact O-OG1 3.31Å; F144-T147 PolarHBondContact O-N 2.95Å; T147-D150 PolarHBondContact O-N 2.99Å; T147-S151 VanDerWaalsContact O-CB 3.22Å; T147-S151 WeakPolarHBondContact O-CB 3.49Å; T147-S151 PolarHBondContact O-N 2.89Å
148M97.9Very high97.9Very high116 Ų116105.4 Ų105.457%0.57152%0.516SS*.Hα-helixtrans-71.3-36.5179.6-16350.1174.900112.5F144 N145 K146 R152F144-M148 WeakPolarHBondContact O-CB 3.31Å; F144-M148 PolarHBondContact O-N 2.87Å; N145-M148 PolarHBondContact O-N 3.48Å; K146-M148 VanDerWaalsContact C-N 3.27Å; K146-M148 PolarHBondContact O-N 2.88Å; M148-R152 WeakPolarHBondContact O-CB 3.5Å; M148-R152 PolarHBondContact O-N 3.48Å
149S97.7Very high97.9Very high57 Ų57106.3 Ų106.340%0.39952%0.52SS..Hα-helixtrans-63.3-45.4171.5-172.30000111.8N145 K146 R152 K153N145-S149 WeakPolarHBondContact O-CB 3.3Å; N145-S149 PolarHBondContact O-N 3.39Å; K146-S149 WeakPolarHBondContact O-CB 3.38Å; K146-S149 PolarHBondContact O-N 3.34Å; S149-R152 PolarHBondContact O-N 3.5Å; S149-K153 WeakPolarHBondContact O-CG 3.43Å; S149-K153 PolarHBondContact O-N 3.39Å
150D98Very high97.9Very high75 Ų75105.3 Ų105.340%0.40152%0.515SS..Hα-helixtrans-67.5-40.2178.6-67.9-21.1000111.6K146 T147 K153 M154K146-D150 PolarHBondContact O-N 3.45Å; T147-D150 PolarHBondContact O-N 2.99Å; D150-K153 PolarHBondContact O-N 3.14Å; D150-K153 IonicContact OD1-NZ 3.42Å; D150-M154 WeakPolarHBondContact O-CB 3.44Å; D150-M154 PolarHBondContact O-N 3.5Å
151S97.6Very high97.9Very high37 Ų37106.5 Ų106.526%0.25952%0.521SS..Hα-helixtrans-62-44.2173.5-178.20000111.6T147 K153 M154 F155T147-S151 VanDerWaalsContact O-CB 3.22Å; T147-S151 WeakPolarHBondContact O-CB 3.49Å; T147-S151 PolarHBondContact O-N 2.89Å; S151-K153 PolarHBondContact O-N 3.04Å; S151-M154 WeakPolarHBondContact O-CB 3.39Å; S151-M154 PolarHBondContact O-N 3.04Å; S151-M154 VanDerWaalsContact O-N 3.15Å; S151-F155 WeakPolarHBondContact O-CD2 3.46Å; S151-F155 PolarHBondContact O-N 3.44Å; S151-F155 VanDerWaalsContact OG-CE2 3.25Å; S151-F155 WeakPolarHBondContact OG-CE2 3.4Å
152R96.9Very high97.8Very high175 Ų175106 Ų10666%0.6653%0.526SS*.Hα-helixtrans-59.9-46.2175.1-175.8174.4179.5-134.5-2112M148 S149 M154 F155 D156M148-R152 WeakPolarHBondContact O-CB 3.5Å; M148-R152 PolarHBondContact O-N 3.48Å; S149-R152 PolarHBondContact O-N 3.5Å; R152-M154 VanDerWaalsContact C-N 3.28Å; R152-M154 PolarHBondContact O-N 2.99Å; R152-F155 PolarHBondContact O-N 3.02Å; R152-D156 PolarHBondContact O-N 2.92Å
153K97.7Very high97.8Very high119 Ų119105.5 Ų105.552%0.51752%0.523SS..Hα-helixtrans-59.6-39.8174.7-69.8171.2-172.2168.30112S149 D150 S151 D156 T157S149-K153 WeakPolarHBondContact O-CG 3.43Å; S149-K153 PolarHBondContact O-N 3.39Å; D150-K153 PolarHBondContact O-N 3.14Å; D150-K153 IonicContact OD1-NZ 3.42Å; S151-K153 PolarHBondContact O-N 3.04Å; K153-D156 PolarHBondContact O-N 3.48Å; K153-T157 WeakPolarHBondContact O-CB 3.39Å; K153-T157 PolarHBondContact O-N 3.27Å; K153-T157 PolarHBondContact O-OG1 3.37Å
154M97.7Very high97.8Very high138 Ų138108 Ų10868%0.6853%0.526SS*.Hα-helixtrans-63.5-44.5176.3179.6-172.4170.100111.1D150 S151 R152 T157 A158D150-M154 WeakPolarHBondContact O-CB 3.44Å; D150-M154 PolarHBondContact O-N 3.5Å; S151-M154 WeakPolarHBondContact O-CB 3.39Å; S151-M154 PolarHBondContact O-N 3.04Å; S151-M154 VanDerWaalsContact O-N 3.15Å; R152-M154 VanDerWaalsContact C-N 3.28Å; R152-M154 PolarHBondContact O-N 2.99Å; M154-T157 PolarHBondContact O-N 3Å; M154-A158 WeakPolarHBondContact O-CB 3.45Å; M154-A158 PolarHBondContact O-N 3.4Å
155F98.3Very high97.8Very high140 Ų140106.3 Ų106.361%0.61452%0.522SS*.Hα-helixtrans-63.1-44.2175.9-79.6-62.5000112.2S151 R152 T157 A158 K159S151-F155 WeakPolarHBondContact O-CD2 3.46Å; S151-F155 PolarHBondContact O-N 3.44Å; S151-F155 VanDerWaalsContact OG-CE2 3.25Å; S151-F155 WeakPolarHBondContact OG-CE2 3.4Å; R152-F155 PolarHBondContact O-N 3.02Å; F155-T157 VanDerWaalsContact C-N 3.34Å; F155-T157 PolarHBondContact O-N 3.2Å; F155-A158 PolarHBondContact O-N 2.87Å; F155-K159 VanDerWaalsContact O-CB 3.29Å; F155-K159 WeakPolarHBondContact O-CB 3.46Å; F155-K159 PolarHBondContact O-N 3.44Å
156D98.3Very high97.8Very high84 Ų84102.9 Ų102.945%0.44951%0.511SS..Hα-helixtrans-61.5-44.2177.2-69.7-29000110.8R152 K153 K159 E160R152-D156 PolarHBondContact O-N 2.92Å; K153-D156 PolarHBondContact O-N 3.48Å; D156-K159 PolarHBondContact O-N 2.95Å; D156-E160 PolarHBondContact O-N 3.47Å
157T97.6Very high97.8Very high66 Ų66101.6 Ų101.641%0.40551%0.506SS..Hα-helixtrans-63.2-42.9175.3-55.10000111.9K153 M154 F155 E160 K161K153-T157 WeakPolarHBondContact O-CB 3.39Å; K153-T157 PolarHBondContact O-N 3.27Å; K153-T157 PolarHBondContact O-OG1 3.37Å; M154-T157 PolarHBondContact O-N 3Å; F155-T157 VanDerWaalsContact C-N 3.34Å; F155-T157 PolarHBondContact O-N 3.2Å; T157-E160 PolarHBondContact O-N 3.41Å; T157-K161 WeakPolarHBondContact O-CG 3.38Å; T157-K161 PolarHBondContact O-N 3.38Å
158A97.9Very high97.8Very high48 Ų48105.8 Ų105.840%0.39751%0.511SS..Hα-helixtrans-65.1-41.6178.200000111.1M154 F155 K161 M162M154-A158 WeakPolarHBondContact O-CB 3.45Å; M154-A158 PolarHBondContact O-N 3.4Å; F155-A158 PolarHBondContact O-N 2.87Å; A158-K161 PolarHBondContact O-N 2.92Å; A158-M162 WeakPolarHBondContact O-CB 3.46Å; A158-M162 PolarHBondContact O-N 2.85Å
159K97.8Very high97.8Very high148 Ų148104 Ų10464%0.64350%0.503SS*.Hα-helixtrans-60.2-46.7175.1-175.8179.6178.8-178.40111.3F155 D156 K161 M162 E163F155-K159 VanDerWaalsContact O-CB 3.29Å; F155-K159 WeakPolarHBondContact O-CB 3.46Å; F155-K159 PolarHBondContact O-N 3.44Å; D156-K159 PolarHBondContact O-N 2.95Å; K159-K161 PolarHBondContact O-N 2.96Å; K159-M162 PolarHBondContact O-N 3.34Å; K159-E163 PolarHBondContact O-N 2.95Å
160E98Very high97.8Very high95 Ų95107.7 Ų107.744%0.44451%0.514SS..Hα-helixtrans-60.1-44.2176.2-170.2-165.916100111.6D156 T157 E163 K164D156-E160 PolarHBondContact O-N 3.47Å; T157-E160 PolarHBondContact O-N 3.41Å; E160-E163 PolarHBondContact O-N 3.46Å; E160-K164 WeakPolarHBondContact O-CG 3.28Å; E160-K164 PolarHBondContact O-N 3.41Å; E160-K164 WeakPolarHBondContact OE1-CE 3.37Å; E160-K164 IonicContact OE1-NZ 3.54Å; E160-K164 PolarHBondContact OE1-NZ 3.37Å
161K97.8Very high97.7Very high142 Ų142108.8 Ų108.862%0.61752%0.519SS*.Hα-helixtrans-62.9-41.9176.2-75.1179.8179.8-178.90112.1T157 A158 K159 K164 L165T157-K161 WeakPolarHBondContact O-CG 3.38Å; T157-K161 PolarHBondContact O-N 3.38Å; A158-K161 PolarHBondContact O-N 2.92Å; K159-K161 PolarHBondContact O-N 2.96Å; K161-K164 PolarHBondContact O-N 3.45Å; K161-L165 WeakPolarHBondContact O-CB 3.46Å; K161-L165 PolarHBondContact O-N 2.89Å
162M97.3Very high97.7Very high141 Ų141110.5 Ų110.570%0.69553%0.531SS*.Hα-helixtrans-66.3-39178.3-171.6142.466.100111.7A158 K159 L165 G166A158-M162 WeakPolarHBondContact O-CB 3.46Å; A158-M162 PolarHBondContact O-N 2.85Å; K159-M162 PolarHBondContact O-N 3.34Å; M162-L165 PolarHBondContact O-N 3.37Å; M162-G166 PolarHBondContact O-N 3.48Å
163E97.7Very high97.8Very high104 Ų104107.7 Ų107.749%0.48653%0.526SS..Hα-helixtrans-62.8-45.6173.3-170.8-169.7161.300111.7K159 E160 L165 G166 K167K159-E163 PolarHBondContact O-N 2.95Å; E160-E163 PolarHBondContact O-N 3.46Å; E163-L165 VanDerWaalsContact C-N 3.35Å; E163-L165 PolarHBondContact O-N 2.93Å; E163-G166 PolarHBondContact O-N 3.07Å; E163-K167 WeakPolarHBondContact O-CG 3.41Å; E163-K167 PolarHBondContact O-N 3.38Å; E163-K167 VanDerWaalsContact OE1-CE 3.28Å; E163-K167 WeakPolarHBondContact OE1-CE 3.41Å; E163-K167 IonicContact OE1-NZ 3.2Å; E163-K167 PolarHBondContact OE1-NZ 2.98Å
164K98Very high97.7Very high115 Ų115105.2 Ų105.250%0.552%0.523SS..Hα-helixtrans-61.3-42.7175.7-74.2177.9-1751710112E160 K161 K167 R168E160-K164 WeakPolarHBondContact O-CG 3.28Å; E160-K164 PolarHBondContact O-N 3.41Å; E160-K164 WeakPolarHBondContact OE1-CE 3.37Å; E160-K164 IonicContact OE1-NZ 3.54Å; E160-K164 PolarHBondContact OE1-NZ 3.37Å; K161-K164 PolarHBondContact O-N 3.45Å; K164-K167 PolarHBondContact O-N 3.42Å; K164-R168 WeakPolarHBondContact O-CG 3.5Å; K164-R168 PolarHBondContact O-N 3.21Å
165L97.8Very high97.7Very high93 Ų93103.4 Ų103.449%0.48751%0.513SS..Hα-helixtrans-63.6-44.2176.5-177.560.7000111.1K161 M162 E163 K167 R168 I169K161-L165 WeakPolarHBondContact O-CB 3.46Å; K161-L165 PolarHBondContact O-N 2.89Å; M162-L165 PolarHBondContact O-N 3.37Å; E163-L165 VanDerWaalsContact C-N 3.35Å; E163-L165 PolarHBondContact O-N 2.93Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 3.46Å; L165-R168 PolarHBondContact O-N 3.19Å; L165-R168 VanDerWaalsContact O-N 3.15Å; L165-I169 HydrophobicContact CD1-CD1 4.26Å; L165-I169 HydrophobicContact CD1-CG1 4.37Å; L165-I169 HydrophobicContact CG-CD1 3.94Å; L165-I169 HydrophobicContact CG-CG1 4.48Å; L165-I169 WeakPolarHBondContact O-CG1 3.33Å; L165-I169 PolarHBondContact O-N 3.34Å
166G97.6Very high97.7Very high30 Ų3099.5 Ų99.531%0.30951%0.507SS..Hα-helixtrans-57.3-44.3175.500000112.7M162 E163 R168 I169 Q170M162-G166 PolarHBondContact O-N 3.48Å; E163-G166 PolarHBondContact O-N 3.07Å; G166-R168 PolarHBondContact O-N 2.94Å; G166-I169 PolarHBondContact O-N 2.65Å; G166-Q170 WeakPolarHBondContact O-CG 3.49Å; G166-Q170 PolarHBondContact O-N 3.39Å
167K97.7Very high97.7Very high117 Ų117100.1 Ų100.151%0.50951%0.513SS..Hα-helixtrans-62.2-41.3174.8-70.5174.4-174.4168.70112.6E163 K164 L165 Q170 L171E163-K167 WeakPolarHBondContact O-CG 3.41Å; E163-K167 PolarHBondContact O-N 3.38Å; E163-K167 VanDerWaalsContact OE1-CE 3.28Å; E163-K167 WeakPolarHBondContact OE1-CE 3.41Å; E163-K167 IonicContact OE1-NZ 3.2Å; E163-K167 PolarHBondContact OE1-NZ 2.98Å; K164-K167 PolarHBondContact O-N 3.42Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 3.46Å; K167-Q170 PolarHBondContact O-N 2.94Å; K167-L171 WeakPolarHBondContact O-CB 3.5Å; K167-L171 PolarHBondContact O-N 3.41Å
168R97.8Very high97.7Very high181 Ų18199.4 Ų99.468%0.68351%0.514SS*.Hα-helixtrans-66-40.2177-74.5-179.865.3-160.9-1.5112.5K164 L165 G166 L171 S172K164-R168 WeakPolarHBondContact O-CG 3.5Å; K164-R168 PolarHBondContact O-N 3.21Å; L165-R168 PolarHBondContact O-N 3.19Å; L165-R168 VanDerWaalsContact O-N 3.15Å; G166-R168 PolarHBondContact O-N 2.94Å; R168-L171 PolarHBondContact O-N 3.42Å; R168-S172 WeakPolarHBondContact O-CB 3.43Å; R168-S172 PolarHBondContact O-N 3.02Å
169I97.9Very high97.7Very high80 Ų80105.2 Ų105.241%0.4153%0.526SS..Hα-helixtrans-61.8-50.7175.7-70.8168.5000109.6L165 G166 L171 S172 E173L165-I169 HydrophobicContact CD1-CD1 4.26Å; L165-I169 HydrophobicContact CD1-CG1 4.37Å; L165-I169 HydrophobicContact CG-CD1 3.94Å; L165-I169 HydrophobicContact CG-CG1 4.48Å; L165-I169 WeakPolarHBondContact O-CG1 3.33Å; L165-I169 PolarHBondContact O-N 3.34Å; G166-I169 PolarHBondContact O-N 2.65Å; I169-L171 VanDerWaalsContact C-N 3.31Å; I169-L171 PolarHBondContact O-N 3.29Å; I169-S172 PolarHBondContact O-N 3.48Å; I169-E173 HydrophobicContact CG2-CG 4.25Å; I169-E173 WeakPolarHBondContact CG2-OE1 3.42Å; I169-E173 WeakPolarHBondContact O-CB 3.43Å; I169-E173 WeakPolarHBondContact O-CG 3.49Å; I169-E173 PolarHBondContact O-N 3.2Å
170Q97.5Very high97.7Very high133 Ų133103.4 Ų103.462%0.62152%0.52SS*.Hα-helixtrans-57.1-42.9177.8-73.5176.7-8.200112.7G166 K167 S174G166-Q170 WeakPolarHBondContact O-CG 3.49Å; G166-Q170 PolarHBondContact O-N 3.39Å; K167-Q170 PolarHBondContact O-N 2.94Å; Q170-S174 WeakPolarHBondContact O-CB 3.5Å; Q170-S174 PolarHBondContact O-N 3.43Å; Q170-S174 PolarHBondContact O-OG 3.5Å
171L97.8Very high97.6Very high99 Ų99100.3 Ų100.352%0.51851%0.513SS..Hα-helixtrans-63.1-49.7176.6-177.365.4000111.2K167 R168 I169 E173 S174 E175K167-L171 WeakPolarHBondContact O-CB 3.5Å; K167-L171 PolarHBondContact O-N 3.41Å; R168-L171 PolarHBondContact O-N 3.42Å; I169-L171 VanDerWaalsContact C-N 3.31Å; I169-L171 PolarHBondContact O-N 3.29Å; L171-E173 VanDerWaalsContact C-N 3.31Å; L171-E173 PolarHBondContact O-N 3.07Å; L171-S174 PolarHBondContact O-N 3.41Å; L171-S174 VanDerWaalsContact O-N 3.16Å; L171-S174 PolarHBondContact O-OG 2.89Å; L171-E175 WeakPolarHBondContact O-CG 3.48Å; L171-E175 PolarHBondContact O-N 3.22Å
172S97Very high97.6Very high73 Ų7399.4 Ų99.451%0.5151%0.509SS..Hα-helixtrans-61.8-37.5179.1-173.10000112.7R168 I169 A176R168-S172 WeakPolarHBondContact O-CB 3.43Å; R168-S172 PolarHBondContact O-N 3.02Å; I169-S172 PolarHBondContact O-N 3.48Å; S172-A176 WeakPolarHBondContact O-CB 3.46Å; S172-A176 PolarHBondContact O-N 3.43Å
173E97.7Very high97.7Very high116 Ų116100.1 Ų100.154%0.54250%0.504SS..Hα-helixtrans-66.1-42.8174.7-73.8174167.500111.1I169 L171 E175 A176 V177I169-E173 HydrophobicContact CG2-CG 4.25Å; I169-E173 WeakPolarHBondContact CG2-OE1 3.42Å; I169-E173 WeakPolarHBondContact O-CB 3.43Å; I169-E173 WeakPolarHBondContact O-CG 3.49Å; I169-E173 PolarHBondContact O-N 3.2Å; L171-E173 VanDerWaalsContact C-N 3.31Å; L171-E173 PolarHBondContact O-N 3.07Å; E173-E175 VanDerWaalsContact C-N 3.34Å; E173-E175 PolarHBondContact O-N 3.32Å; E173-A176 PolarHBondContact O-N 2.96Å; E173-V177 WeakPolarHBondContact O-CG2 3.32Å; E173-V177 PolarHBondContact O-N 2.97Å
174S97.2Very high97.7Very high67 Ų6798.2 Ų98.247%0.46950%0.495SS..Hα-helixtrans-64-38.5176.975.40000112.6Q170 L171 A178Q170-S174 WeakPolarHBondContact O-CB 3.5Å; Q170-S174 PolarHBondContact O-N 3.43Å; Q170-S174 PolarHBondContact O-OG 3.5Å; L171-S174 PolarHBondContact O-N 3.41Å; L171-S174 VanDerWaalsContact O-N 3.16Å; L171-S174 PolarHBondContact O-OG 2.89Å; S174-A178 WeakPolarHBondContact O-CB 3.46Å; S174-A178 PolarHBondContact O-N 3.38Å
175E97.8Very high97.7Very high99 Ų9996.4 Ų96.446%0.46349%0.493SS..Hα-helixtrans-67-41.9174.1-73.1176.7-176.500111.4L171 E173 A178 W179L171-E175 WeakPolarHBondContact O-CG 3.48Å; L171-E175 PolarHBondContact O-N 3.22Å; E173-E175 VanDerWaalsContact C-N 3.34Å; E173-E175 PolarHBondContact O-N 3.32Å; E175-A178 PolarHBondContact O-N 3.41Å; E175-W179 WeakPolarHBondContact O-CB 3.41Å; E175-W179 PolarHBondContact O-N 3.49Å
176A97.8Very high97.7Very high58 Ų5895.7 Ų95.748%0.47950%0.497SS..Hα-helixtrans-60.3-46.2176.400000111.8S172 E173 A178 W179 Q180S172-A176 WeakPolarHBondContact O-CB 3.46Å; S172-A176 PolarHBondContact O-N 3.43Å; E173-A176 PolarHBondContact O-N 2.96Å; A176-A178 PolarHBondContact O-N 3.39Å; A176-W179 PolarHBondContact O-N 3.42Å; A176-Q180 WeakPolarHBondContact O-CB 3.12Å; A176-Q180 PolarHBondContact O-N 3.4Å
177V97.3Very high97.7Very high98 Ų9898.4 Ų98.459%0.59450%0.501SS*.Hα-helixtrans-63-41.8175.2173.20000111.2E173 W179 Q180 G181E173-V177 WeakPolarHBondContact O-CG2 3.32Å; E173-V177 PolarHBondContact O-N 2.97Å; V177-W179 PolarHBondContact O-N 3.14Å; V177-Q180 PolarHBondContact O-N 2.87Å; V177-G181 PolarHBondContact O-N 3.23Å
178A97.8Very high97.7Very high51 Ų5199.4 Ų99.442%0.42150%0.502SS..Hα-helixtrans-63.5-41177.300000112.3S174 E175 A176 G181 K182S174-A178 WeakPolarHBondContact O-CB 3.46Å; S174-A178 PolarHBondContact O-N 3.38Å; E175-A178 PolarHBondContact O-N 3.41Å; A176-A178 PolarHBondContact O-N 3.39Å; A178-G181 PolarHBondContact O-N 2.94Å; A178-K182 WeakPolarHBondContact O-CG 3.3Å; A178-K182 PolarHBondContact O-N 3.35Å
179W97.8Very high97.6Very high170 Ų17093.9 Ų93.964%0.64449%0.491SS*.Hα-helixtrans-67.8-40.3175.2-82.7114.1000112.5E175 A176 V177 G181 K182 W183E175-W179 WeakPolarHBondContact O-CB 3.41Å; E175-W179 PolarHBondContact O-N 3.49Å; A176-W179 PolarHBondContact O-N 3.42Å; V177-W179 PolarHBondContact O-N 3.14Å; W179-G181 VanDerWaalsContact C-N 3.34Å; W179-G181 PolarHBondContact O-N 2.91Å; W179-K182 HydrophobicContact CE3-CD 4.05Å; W179-K182 HydrophobicContact CZ3-CD 4.25Å; W179-K182 PolarHBondContact O-N 3.38Å; W179-W183 WeakPolarHBondContact O-CB 3.5Å; W179-W183 PolarHBondContact O-N 3.02Å
180Q97.8Very high97.6Very high110 Ų11095.6 Ų95.651%0.51450%0.5SS..Hα-helixtrans-57.9-48.4172.2-175.1-173-22.900110.5A176 V177 K182 W183 E184A176-Q180 WeakPolarHBondContact O-CB 3.12Å; A176-Q180 PolarHBondContact O-N 3.4Å; V177-Q180 PolarHBondContact O-N 2.87Å; Q180-K182 PolarHBondContact O-N 2.91Å; Q180-W183 PolarHBondContact O-N 3.22Å; Q180-E184 PolarHBondContact NE2-OE1 3.38Å; Q180-E184 WeakPolarHBondContact O-CG 3.36Å; Q180-E184 PolarHBondContact O-N 3.01Å
181G97.5Very high97.6Very high29 Ų2994.8 Ų94.830%0.29950%0.499SS..Hα-helixtrans-60.1-43.3177.400000113.3V177 A178 W179 E184 V185V177-G181 PolarHBondContact O-N 3.23Å; A178-G181 PolarHBondContact O-N 2.94Å; W179-G181 VanDerWaalsContact C-N 3.34Å; W179-G181 PolarHBondContact O-N 2.91Å; G181-E184 PolarHBondContact O-N 2.9Å; G181-V185 WeakPolarHBondContact O-CG2 3.24Å; G181-V185 PolarHBondContact O-N 3.49Å
182K97.5Very high97.5Very high123 Ų12396.6 Ų96.654%0.53551%0.505SS..Hα-helixtrans-62.3-43.3174.7-72.9171.8-176.5176.90112.1A178 W179 Q180 V185 S186A178-K182 WeakPolarHBondContact O-CG 3.3Å; A178-K182 PolarHBondContact O-N 3.35Å; W179-K182 HydrophobicContact CE3-CD 4.05Å; W179-K182 HydrophobicContact CZ3-CD 4.25Å; W179-K182 PolarHBondContact O-N 3.38Å; Q180-K182 PolarHBondContact O-N 2.91Å; K182-V185 PolarHBondContact O-N 2.93Å; K182-S186 WeakPolarHBondContact O-CB 3.38Å; K182-S186 PolarHBondContact O-N 3.49Å
183W98Very high97.6Very high156 Ų15698.7 Ų98.759%0.59151%0.51SS*.Hα-helixtrans-64.6-43.3178.4179.484.9000111.4W179 Q180 V185 S186 Q187W179-W183 WeakPolarHBondContact O-CB 3.5Å; W179-W183 PolarHBondContact O-N 3.02Å; Q180-W183 PolarHBondContact O-N 3.22Å; W183-V185 PolarHBondContact O-N 3.24Å; W183-S186 PolarHBondContact O-N 3.39Å; W183-Q187 VanDerWaalsContact CZ3-OE1 3.23Å; W183-Q187 WeakPolarHBondContact O-CB 3.48Å; W183-Q187 PolarHBondContact O-N 3.07Å
184E98.1Very high97.5Very high65 Ų6595.9 Ų95.930%0.30451%0.507SS..Hα-helixtrans-63-39.1175.3-73.4177.8-166.300112.6Q180 G181 Q187 R188Q180-E184 PolarHBondContact NE2-OE1 3.38Å; Q180-E184 WeakPolarHBondContact O-CG 3.36Å; Q180-E184 PolarHBondContact O-N 3.01Å; G181-E184 PolarHBondContact O-N 2.9Å; E184-Q187 PolarHBondContact O-N 3.14Å; E184-R188 WeakPolarHBondContact O-CB 3.43Å; E184-R188 WeakPolarHBondContact O-CG 3.39Å; E184-R188 PolarHBondContact O-N 2.93Å; E184-R188 IonicContact OE2-NH1 2.78Å
185V97.7Very high97.5Very high76 Ų7699.7 Ų99.746%0.46152%0.517SS..Hα-helixtrans-63.5-48.4173.8171.50000110.5G181 K182 W183 Q187 R188 S189G181-V185 WeakPolarHBondContact O-CG2 3.24Å; G181-V185 PolarHBondContact O-N 3.49Å; K182-V185 PolarHBondContact O-N 2.93Å; W183-V185 PolarHBondContact O-N 3.24Å; V185-Q187 VanDerWaalsContact C-N 3.3Å; V185-Q187 PolarHBondContact O-N 3.46Å; V185-R188 VanDerWaalsContact CG2-NH2 3.28Å; V185-R188 PolarHBondContact O-N 3.42Å; V185-S189 PolarHBondContact O-N 2.89Å; V185-S189 PolarHBondContact O-OG 3.4Å
186S97.9Very high97.4Very high79 Ų7999.1 Ų99.155%0.55251%0.514SS*.Hα-helixtrans-57.9-44.2176.7-175.90000111.6K182 W183 S189 L190K182-S186 WeakPolarHBondContact O-CB 3.38Å; K182-S186 PolarHBondContact O-N 3.49Å; W183-S186 PolarHBondContact O-N 3.39Å; S186-S189 PolarHBondContact O-N 3.42Å; S186-L190 WeakPolarHBondContact O-CB 3.31Å; S186-L190 PolarHBondContact O-N 2.94Å
187Q97.7Very high97.4Very high87 Ų87101.8 Ų101.841%0.40752%0.517SS..Hα-helixtrans-64.1-42.1177.2-169.4178.540.600112W183 E184 V185 L190 L191W183-Q187 VanDerWaalsContact CZ3-OE1 3.23Å; W183-Q187 WeakPolarHBondContact O-CB 3.48Å; W183-Q187 PolarHBondContact O-N 3.07Å; E184-Q187 PolarHBondContact O-N 3.14Å; V185-Q187 VanDerWaalsContact C-N 3.3Å; V185-Q187 PolarHBondContact O-N 3.46Å; Q187-L190 PolarHBondContact O-N 2.97Å; Q187-L191 HydrophobicContact CG-CD1 4.49Å; Q187-L191 WeakPolarHBondContact O-CG 3.27Å; Q187-L191 PolarHBondContact O-N 3.4Å
188R97.4Very high97.4Very high137 Ų137105 Ų10552%0.51752%0.523SS..Hα-helixtrans-61.4-47.1174.6-79.2-173-68.6-94.80.6111.9E184 V185 L190 L191 E192E184-R188 WeakPolarHBondContact O-CB 3.43Å; E184-R188 WeakPolarHBondContact O-CG 3.39Å; E184-R188 PolarHBondContact O-N 2.93Å; E184-R188 IonicContact OE2-NH1 2.78Å; V185-R188 VanDerWaalsContact CG2-NH2 3.28Å; V185-R188 PolarHBondContact O-N 3.42Å; R188-L190 VanDerWaalsContact C-N 3.31Å; R188-L190 PolarHBondContact O-N 2.9Å; R188-L191 PolarHBondContact O-N 3.13Å; R188-E192 PolarHBondContact O-N 2.93Å
189S97.4Very high97.3Very high65 Ų65107.9 Ų107.946%0.45553%0.526SS..Hα-helixtrans-63.2-36.6177.5-62.40000112.5V185 S186 E192 L193V185-S189 PolarHBondContact O-N 2.89Å; V185-S189 PolarHBondContact O-OG 3.4Å; S186-S189 PolarHBondContact O-N 3.42Å; S189-E192 PolarHBondContact O-N 2.79Å; S189-L193 VanDerWaalsContact O-CB 3.31Å; S189-L193 WeakPolarHBondContact O-CB 3.35Å; S189-L193 PolarHBondContact O-N 2.91Å
190L97.6Very high97.3Very high117 Ų117105.1 Ų105.161%0.61352%0.52SS*.Hα-helixtrans-66.5-40.7175.1-175.264.2000111.9S186 Q187 R188 A194S186-L190 WeakPolarHBondContact O-CB 3.31Å; S186-L190 PolarHBondContact O-N 2.94Å; Q187-L190 PolarHBondContact O-N 2.97Å; R188-L190 VanDerWaalsContact C-N 3.31Å; R188-L190 PolarHBondContact O-N 2.9Å; L190-A194 WeakPolarHBondContact O-CB 3.45Å; L190-A194 PolarHBondContact O-N 3.19Å
191L97.1Very high97.2Very high115 Ų115105 Ų10560%0.60252%0.521SS*.Hα-helixtrans-65.2-43.4175.3-72.7172000111.9Q187 R188 A194 E195Q187-L191 HydrophobicContact CG-CD1 4.49Å; Q187-L191 WeakPolarHBondContact O-CG 3.27Å; Q187-L191 PolarHBondContact O-N 3.4Å; R188-L191 PolarHBondContact O-N 3.13Å; L191-A194 PolarHBondContact O-N 2.92Å; L191-E195 PolarHBondContact O-N 3.39Å
192E96.6Very high97.1Very high138 Ų138106.7 Ų106.765%0.64553%0.528SS*.Hα-helixtrans-62.5-43.9175.8-174.8177-172.600111.6R188 S189 A194 E195 Q196R188-E192 PolarHBondContact O-N 2.93Å; S189-E192 PolarHBondContact O-N 2.79Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.17Å; E192-E195 PolarHBondContact O-N 3.33Å; E192-Q196 WeakPolarHBondContact O-CB 3.19Å; E192-Q196 PolarHBondContact O-N 3.45Å
193L97.1Very high97.1Very high116 Ų116105.5 Ų105.561%0.60753%0.525SS*.Hα-helixtrans-62.2-39.8174.6-175.766000111.8S189 Q196 H197S189-L193 VanDerWaalsContact O-CB 3.31Å; S189-L193 WeakPolarHBondContact O-CB 3.35Å; S189-L193 PolarHBondContact O-N 2.91Å; L193-Q196 PolarHBondContact O-N 3.13Å; L193-H197 VanDerWaalsContact O-CB 3.27Å; L193-H197 WeakPolarHBondContact O-CB 3.41Å; L193-H197 PolarHBondContact O-N 2.9Å
194A96.8Very high96.9Very high57 Ų57101.7 Ų101.747%0.47152%0.521SS..Hα-helixtrans-66.1-39.6176.500000112.2L190 L191 E192 K198L190-A194 WeakPolarHBondContact O-CB 3.45Å; L190-A194 PolarHBondContact O-N 3.19Å; L191-A194 PolarHBondContact O-N 2.92Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.17Å; A194-K198 WeakPolarHBondContact O-CB 3.29Å; A194-K198 PolarHBondContact O-N 3.23Å
195E96.2Very high96.8Very high147 Ų147102.6 Ų102.669%0.68753%0.528SS*.Hα-helixtrans-65.7-45.5174.9-175.8167.7-155.900111.6L191 E192 K198 K199L191-E195 PolarHBondContact O-N 3.39Å; E192-E195 PolarHBondContact O-N 3.33Å; E195-K198 WeakPolarHBondContact O-CB 3.39Å; E195-K198 PolarHBondContact O-N 3Å; E195-K199 PolarHBondContact O-N 3.11Å
196Q97.1Very high96.7Very high87 Ų87102.7 Ų102.741%0.40753%0.526SS..Hα-helixtrans-62.6-44.7175.9-177.859.424.100111.4E192 L193 K198 K199 E200E192-Q196 WeakPolarHBondContact O-CB 3.19Å; E192-Q196 PolarHBondContact O-N 3.45Å; L193-Q196 PolarHBondContact O-N 3.13Å; Q196-K198 VanDerWaalsContact C-N 3.33Å; Q196-K198 PolarHBondContact O-N 3.28Å; Q196-K199 WeakPolarHBondContact O-CB 3.4Å; Q196-K199 PolarHBondContact O-N 2.94Å; Q196-E200 PolarHBondContact NE2-OE2 2.63Å; Q196-E200 WeakPolarHBondContact O-CB 3.5Å; Q196-E200 PolarHBondContact O-N 2.91Å
197H97Very high96.5Very high115 Ų115101.2 Ų101.253%0.53252%0.519SS..Hα-helixtrans-60.3-41.3175.8177.7-94.1000111.9L193 M201L193-H197 VanDerWaalsContact O-CB 3.27Å; L193-H197 WeakPolarHBondContact O-CB 3.41Å; L193-H197 PolarHBondContact O-N 2.9Å; H197-M201 VanDerWaalsContact O-CB 3.24Å; H197-M201 WeakPolarHBondContact O-CB 3.4Å; H197-M201 PolarHBondContact O-N 2.89Å
198K96.9Very high96.4Very high164 Ų164103.4 Ų103.471%0.71353%0.527SS*.Hα-helixtrans-62.4-42.7175.3-179-176.7176.2-176.20111.7A194 E195 Q196 S202A194-K198 WeakPolarHBondContact O-CB 3.29Å; A194-K198 PolarHBondContact O-N 3.23Å; E195-K198 WeakPolarHBondContact O-CB 3.39Å; E195-K198 PolarHBondContact O-N 3Å; Q196-K198 VanDerWaalsContact C-N 3.33Å; Q196-K198 PolarHBondContact O-N 3.28Å; K198-S202 PolarHBondContact O-N 3.35Å; K198-S202 VanDerWaalsContact O-N 3.08Å
199K96.8Very high96.2Very high113 Ų113102.4 Ų102.449%0.49153%0.526SS..Hα-helixtrans-63.5-51.2176.6-179.5-176.9171.5-172.20111.3E195 Q196 M201 S202 E203E195-K199 PolarHBondContact O-N 3.11Å; Q196-K199 WeakPolarHBondContact O-CB 3.4Å; Q196-K199 PolarHBondContact O-N 2.94Å; K199-M201 VanDerWaalsContact C-N 3.29Å; K199-M201 PolarHBondContact O-N 3.01Å; K199-S202 WeakPolarHBondContact O-CB 3.31Å; K199-S202 PolarHBondContact O-N 2.94Å; K199-S202 VanDerWaalsContact O-N 3.1Å; K199-E203 WeakPolarHBondContact CE-OE1 3.37Å; K199-E203 WeakPolarHBondContact O-CG 3.37Å; K199-E203 PolarHBondContact O-N 3.43Å
200E96.4Very high96.1Very high111 Ų111105.9 Ų105.952%0.51954%0.535SS..Hα-helixtrans-57.5-41.8177.2-163.999.7-153.300111.3Q196 S202 E203 S204Q196-E200 PolarHBondContact NE2-OE2 2.63Å; Q196-E200 WeakPolarHBondContact O-CB 3.5Å; Q196-E200 PolarHBondContact O-N 2.91Å; E200-S202 PolarHBondContact O-N 3.04Å; E200-E203 PolarHBondContact O-N 3.05Å; E200-S204 WeakPolarHBondContact O-CB 3.2Å; E200-S204 PolarHBondContact O-N 3.29Å
201M96.8Very high95.9Very high107 Ų107105 Ų10553%0.52754%0.535SS..Hα-helixtrans-64.4-39.9176.5-174.4133.1-69.400112.1H197 K199 L205H197-M201 VanDerWaalsContact O-CB 3.24Å; H197-M201 WeakPolarHBondContact O-CB 3.4Å; H197-M201 PolarHBondContact O-N 2.89Å; K199-M201 VanDerWaalsContact C-N 3.29Å; K199-M201 PolarHBondContact O-N 3.01Å; M201-L205 WeakPolarHBondContact O-CB 3.37Å; M201-L205 PolarHBondContact O-N 3.12Å
202S95.8Very high95.7Very high65 Ų65105.1 Ų105.146%0.45553%0.532SS..Hα-helixtrans-66-43.7174.8177.60000112K198 K199 E200 L205 N206K198-S202 PolarHBondContact O-N 3.35Å; K198-S202 VanDerWaalsContact O-N 3.08Å; K199-S202 WeakPolarHBondContact O-CB 3.31Å; K199-S202 PolarHBondContact O-N 2.94Å; K199-S202 VanDerWaalsContact O-N 3.1Å; E200-S202 PolarHBondContact O-N 3.04Å; S202-L205 PolarHBondContact O-N 3.11Å; S202-N206 WeakPolarHBondContact O-CB 3.5Å; S202-N206 PolarHBondContact O-N 3.05Å; S202-N206 PolarHBondContact O-ND2 3.26Å
203E96.3Very high95.5Very high99 Ų99106.4 Ų106.446%0.46354%0.536SS..Hα-helixtrans-64.7-45.6176.5-71.9176.2-172.200111.7K199 E200 L205 N206 A207K199-E203 WeakPolarHBondContact CE-OE1 3.37Å; K199-E203 WeakPolarHBondContact O-CG 3.37Å; K199-E203 PolarHBondContact O-N 3.43Å; E200-E203 PolarHBondContact O-N 3.05Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.43Å; E203-N206 CarbonylContact O-C 3.6Å; E203-N206 WeakPolarHBondContact O-CB 3.44Å; E203-N206 PolarHBondContact O-N 3.18Å; E203-A207 WeakPolarHBondContact O-CB 3.23Å; E203-A207 PolarHBondContact O-N 3.31Å
204S94.1Very high95.3Very high75 Ų75106 Ų10652%0.52453%0.534SS..Hα-helixtrans-59.9-42.3174.9179.10000111.9E200 A207 K208E200-S204 WeakPolarHBondContact O-CB 3.2Å; E200-S204 PolarHBondContact O-N 3.29Å; S204-A207 PolarHBondContact O-N 3.24Å; S204-K208 VanDerWaalsContact O-CB 3.27Å; S204-K208 WeakPolarHBondContact O-CB 3.35Å; S204-K208 PolarHBondContact O-N 3.05Å
205L95.8Very high94.9Very high84 Ų84104.3 Ų104.344%0.4452%0.522SS..Hα-helixtrans-65.4-39.9175.7-164.5160.5000111.3M201 S202 E203 K208 K209M201-L205 WeakPolarHBondContact O-CB 3.37Å; M201-L205 PolarHBondContact O-N 3.12Å; S202-L205 PolarHBondContact O-N 3.11Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.43Å; L205-K208 PolarHBondContact O-N 3.5Å; L205-K209 HydrophobicContact CD2-CD 3.74Å; L205-K209 HydrophobicContact CD2-CG 4.22Å; L205-K209 VanDerWaalsContact CD2-NZ 3.28Å; L205-K209 WeakPolarHBondContact O-CG 3.29Å; L205-K209 PolarHBondContact O-N 3.46Å
206N95.2Very high94.6Very high78 Ų7898.8 Ų98.842%0.41750%0.504SS..Hα-helixtrans-66.2-44.2174.1-77.5-27.3000112.4S202 E203 K208 K209 Q210S202-N206 WeakPolarHBondContact O-CB 3.5Å; S202-N206 PolarHBondContact O-N 3.05Å; S202-N206 PolarHBondContact O-ND2 3.26Å; E203-N206 CarbonylContact O-C 3.6Å; E203-N206 WeakPolarHBondContact O-CB 3.44Å; E203-N206 PolarHBondContact O-N 3.18Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 3.07Å; N206-K209 WeakPolarHBondContact O-CB 3.38Å; N206-K209 PolarHBondContact O-N 3.29Å; N206-Q210 WeakPolarHBondContact O-CG 3.24Å; N206-Q210 PolarHBondContact O-N 2.91Å
207A93.7Very high94.3Very high49 Ų49100.2 Ų100.241%0.40551%0.514SS..Hα-helixtrans-61-43.4174.800000110.8E203 S204 K209 Q210 V211E203-A207 WeakPolarHBondContact O-CB 3.23Å; E203-A207 PolarHBondContact O-N 3.31Å; S204-A207 PolarHBondContact O-N 3.24Å; A207-K209 PolarHBondContact O-N 2.84Å; A207-Q210 WeakPolarHBondContact O-CB 3.38Å; A207-Q210 PolarHBondContact O-N 3.36Å; A207-Q210 VanDerWaalsContact O-N 3.13Å; A207-V211 WeakPolarHBondContact O-CG2 3.47Å; A207-V211 PolarHBondContact O-N 2.93Å
208K95.7Very high93.9Very high132 Ų13298 Ų9857%0.57451%0.51SS*.Hα-helixtrans-59-45.6174-172.5178179.1-179.40111.8S204 L205 N206 Q210 V211 E212S204-K208 VanDerWaalsContact O-CB 3.27Å; S204-K208 WeakPolarHBondContact O-CB 3.35Å; S204-K208 PolarHBondContact O-N 3.05Å; L205-K208 PolarHBondContact O-N 3.5Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 3.07Å; K208-Q210 VanDerWaalsContact C-N 3.32Å; K208-Q210 PolarHBondContact O-N 3.44Å; K208-V211 PolarHBondContact O-N 2.92Å; K208-E212 WeakPolarHBondContact O-CB 3.21Å; K208-E212 WeakPolarHBondContact O-CG 3.26Å; K208-E212 PolarHBondContact O-N 2.75Å
209K94.7Very high93.5Very high116 Ų11697.6 Ų97.650%0.50450%0.504SS..Hα-helixtrans-59.8-39.5173.6-76.9171.6173.6165.90112.5L205 N206 A207 K213L205-K209 HydrophobicContact CD2-CD 3.74Å; L205-K209 HydrophobicContact CD2-CG 4.22Å; L205-K209 VanDerWaalsContact CD2-NZ 3.28Å; L205-K209 WeakPolarHBondContact O-CG 3.29Å; L205-K209 PolarHBondContact O-N 3.46Å; N206-K209 WeakPolarHBondContact O-CB 3.38Å; N206-K209 PolarHBondContact O-N 3.29Å; A207-K209 PolarHBondContact O-N 2.84Å; K209-K213 PolarHBondContact O-N 3.39Å
210Q94.9Very high92.9Very high138 Ų13894.3 Ų94.365%0.64550%0.498SS*.Hα-helixtrans-68.5-42.9176.8-71.3-176.222.100111.9N206 A207 K208 K213 L214N206-Q210 WeakPolarHBondContact O-CG 3.24Å; N206-Q210 PolarHBondContact O-N 2.91Å; A207-Q210 WeakPolarHBondContact O-CB 3.38Å; A207-Q210 PolarHBondContact O-N 3.36Å; A207-Q210 VanDerWaalsContact O-N 3.13Å; K208-Q210 VanDerWaalsContact C-N 3.32Å; K208-Q210 PolarHBondContact O-N 3.44Å; Q210-K213 PolarHBondContact O-N 2.94Å; Q210-L214 WeakPolarHBondContact O-CB 3.41Å; Q210-L214 PolarHBondContact O-N 2.89Å
211V93.5Very high92.2Very high100 Ų10094.3 Ų94.361%0.60650%0.501SS*.Hα-helixtrans-64-40175171.30000111A207 K208 L214 G215A207-V211 WeakPolarHBondContact O-CG2 3.47Å; A207-V211 PolarHBondContact O-N 2.93Å; K208-V211 PolarHBondContact O-N 2.92Å; V211-L214 PolarHBondContact O-N 3.44Å; V211-G215 WeakPolarHBondContact O-CA 3.49Å; V211-G215 PolarHBondContact O-N 3.38Å
212E92Very high91.6Very high116 Ų11696.1 Ų96.154%0.54251%0.506SS..Hα-helixtrans-63.2-43.3173.5-81.4175.7-179.300111.9K208 G215 G216K208-E212 WeakPolarHBondContact O-CB 3.21Å; K208-E212 WeakPolarHBondContact O-CG 3.26Å; K208-E212 PolarHBondContact O-N 2.75Å; E212-G215 PolarHBondContact O-N 3.07Å; E212-G216 PolarHBondContact O-N 3.21Å
213K93.6Very high90.7Very high165 Ų16597.8 Ų97.872%0.71751%0.51SS*.Hα-helixtrans-61.2-49.4173.2-89.2-175.3176.8-178.30112.1K209 Q210 G215 G216 L217K209-K213 PolarHBondContact O-N 3.39Å; Q210-K213 PolarHBondContact O-N 2.94Å; K213-G215 VanDerWaalsContact C-N 3.33Å; K213-G215 PolarHBondContact O-N 3.4Å; K213-G216 WeakPolarHBondContact O-CA 3.24Å; K213-G216 PolarHBondContact O-N 2.98Å; K213-G216 VanDerWaalsContact O-N 3.14Å; K213-L217 WeakPolarHBondContact O-CG 3.29Å; K213-L217 PolarHBondContact O-N 3.45Å
214L92.1Very high89.8Confident109 Ų10999 Ų9957%0.57152%0.516SS*.Hα-helixtrans-63.7-42.1179.6-170.668.7000110.7Q210 V211 G216 L217 C218Q210-L214 WeakPolarHBondContact O-CB 3.41Å; Q210-L214 PolarHBondContact O-N 2.89Å; V211-L214 PolarHBondContact O-N 3.44Å; L214-G216 VanDerWaalsContact C-N 3.29Å; L214-G216 PolarHBondContact O-N 2.91Å; L214-L217 PolarHBondContact O-N 2.82Å; L214-C218 WeakPolarHBondContact O-CB 3.15Å; L214-C218 PolarHBondContact O-N 2.88Å; L214-C218 PolarHBondContact O-SG 3.38Å; L214-C218 VanDerWaalsContact O-SG 3.34Å
215G88.7Confident88.8Confident21 Ų21100.4 Ų100.422%0.21652%0.517CS..Hα-helixtrans-60.4-38.4172.500000112.2V211 E212 K213 R219V211-G215 WeakPolarHBondContact O-CA 3.49Å; V211-G215 PolarHBondContact O-N 3.38Å; E212-G215 PolarHBondContact O-N 3.07Å; K213-G215 VanDerWaalsContact C-N 3.33Å; K213-G215 PolarHBondContact O-N 3.4Å; G215-R219 WeakPolarHBondContact O-CB 3.19Å; G215-R219 WeakPolarHBondContact O-CG 3.16Å; G215-R219 PolarHBondContact O-N 3.14Å
216G89.8Confident87.6Confident30 Ų30100.9 Ų100.931%0.30952%0.52SS..Hα-helixtrans-62.4-47.4171.800000112.8E212 K213 L214 R219 A220E212-G216 PolarHBondContact O-N 3.21Å; K213-G216 WeakPolarHBondContact O-CA 3.24Å; K213-G216 PolarHBondContact O-N 2.98Å; K213-G216 VanDerWaalsContact O-N 3.14Å; L214-G216 VanDerWaalsContact C-N 3.29Å; L214-G216 PolarHBondContact O-N 2.91Å; G216-R219 PolarHBondContact O-N 2.88Å; G216-A220 PolarHBondContact O-N 2.82Å
217L91.5Very high86.4Confident118 Ų118102.4 Ų102.462%0.61852%0.524SS*.Hα-helixtrans-64.1-43.8176.5-69.5171.6000112.1K213 L214 R219 A220 L221K213-L217 WeakPolarHBondContact O-CG 3.29Å; K213-L217 PolarHBondContact O-N 3.45Å; L214-L217 PolarHBondContact O-N 2.82Å; L217-R219 VanDerWaalsContact C-N 3.32Å; L217-R219 PolarHBondContact O-N 3.27Å; L217-A220 PolarHBondContact O-N 3Å; L217-L221 WeakPolarHBondContact O-CB 3.18Å; L217-L221 PolarHBondContact O-N 3Å
218C88.5Confident84.8Confident68 Ų68106 Ų10646%0.45954%0.536SS..Hα-helixtrans-62.9-37177-75.40000112.2L214 K222L214-C218 WeakPolarHBondContact O-CB 3.15Å; L214-C218 PolarHBondContact O-N 2.88Å; L214-C218 PolarHBondContact O-SG 3.38Å; L214-C218 VanDerWaalsContact O-SG 3.34Å; C218-K222 WeakPolarHBondContact O-CB 3.11Å; C218-K222 WeakPolarHBondContact O-CG 3.23Å; C218-K222 PolarHBondContact O-N 3.2Å
219R87.9Confident82.9Confident155 Ų155107.2 Ų107.259%0.58554%0.537SS*.Hα-helixtrans-65.7-49171.8-77.4-175.1-68.1-970.6111.1G215 G216 L217 L221 K222 D223G215-R219 WeakPolarHBondContact O-CB 3.19Å; G215-R219 WeakPolarHBondContact O-CG 3.16Å; G215-R219 PolarHBondContact O-N 3.14Å; G216-R219 PolarHBondContact O-N 2.88Å; L217-R219 VanDerWaalsContact C-N 3.32Å; L217-R219 PolarHBondContact O-N 3.27Å; R219-L221 VanDerWaalsContact C-N 3.3Å; R219-L221 PolarHBondContact O-N 3.03Å; R219-K222 WeakPolarHBondContact O-CB 3.34Å; R219-K222 PolarHBondContact O-N 3.09Å; R219-K222 VanDerWaalsContact O-N 3.17Å; R219-D223 VanDerWaalsContact O-CG 3.24Å; R219-D223 PolarHBondContact O-N 3.35Å
220A84.2Confident80.9Confident44 Ų44107.6 Ų107.636%0.36454%0.539SS..Hα-helixtrans-59.5-38.7177.100000113.1G216 L217 D223 Q224G216-A220 PolarHBondContact O-N 2.82Å; L217-A220 PolarHBondContact O-N 3Å; A220-D223 PolarHBondContact O-N 3.45Å; A220-Q224 WeakPolarHBondContact O-CG 3.39Å; A220-Q224 PolarHBondContact O-N 2.98Å
221L82.4Confident78.7Confident111 Ų111104.9 Ų104.958%0.58153%0.533SS*.Hα-helixtrans-69.3-41177.3-155.280.8000111.3L217 R219 D223 Q224 L225L217-L221 WeakPolarHBondContact O-CB 3.18Å; L217-L221 PolarHBondContact O-N 3Å; R219-L221 VanDerWaalsContact C-N 3.3Å; R219-L221 PolarHBondContact O-N 3.03Å; L221-D223 VanDerWaalsContact C-N 3.33Å; L221-Q224 PolarHBondContact O-N 2.88Å; L221-L225 WeakPolarHBondContact O-CB 3.37Å; L221-L225 PolarHBondContact O-N 3.01Å
222K82.4Confident76.2Confident145 Ų145110.2 Ų110.263%0.6354%0.542SS*.Hα-helixtrans-62.2-40.4171.8-85.5179.3176.8175.60111.7C218 R219 L225 N226C218-K222 WeakPolarHBondContact O-CB 3.11Å; C218-K222 WeakPolarHBondContact O-CG 3.23Å; C218-K222 PolarHBondContact O-N 3.2Å; R219-K222 WeakPolarHBondContact O-CB 3.34Å; R219-K222 PolarHBondContact O-N 3.09Å; R219-K222 VanDerWaalsContact O-N 3.17Å; K222-L225 PolarHBondContact O-N 3.38Å; K222-N226 WeakPolarHBondContact O-CB 3.34Å; K222-N226 VanDerWaalsContact O-CG 3.25Å; K222-N226 PolarHBondContact O-N 3.18Å; K222-N226 PolarHBondContact O-ND2 3.42Å
223D78.6Confident73.6Confident100 Ų100110.7 Ų110.754%0.53555%0.545SS..Hα-helixtrans-62.8-43.5177-67.1-24000110.7R219 A220 L221 N226 E227R219-D223 VanDerWaalsContact O-CG 3.24Å; R219-D223 PolarHBondContact O-N 3.35Å; A220-D223 PolarHBondContact O-N 3.45Å; L221-D223 VanDerWaalsContact C-N 3.33Å; D223-N226 PolarHBondContact O-N 2.82Å; D223-E227 WeakPolarHBondContact O-CB 3.3Å; D223-E227 PolarHBondContact O-N 3.1Å
224Q77.2Confident71.2Confident125 Ų125107.8 Ų107.858%0.58454%0.544SS*.Hα-helixtrans-64-39.8172.9-71-178.121.100113.2A220 L221 E227 L228A220-Q224 WeakPolarHBondContact O-CG 3.39Å; A220-Q224 PolarHBondContact O-N 2.98Å; L221-Q224 PolarHBondContact O-N 2.88Å; Q224-E227 PolarHBondContact O-N 2.6Å; Q224-L228 WeakPolarHBondContact O-CB 3.29Å; Q224-L228 VanDerWaalsContact O-CG 3.32Å; Q224-L228 WeakPolarHBondContact O-CG 3.33Å; Q224-L228 PolarHBondContact O-N 2.84Å
225L72.1Confident68.5Low104 Ų104110.6 Ų110.655%0.54555%0.554SS.*Hα-helixtrans-66.8-39.5177.3-117.1157.1000111.9L221 K222 E227 L228 R229L221-L225 WeakPolarHBondContact O-CB 3.37Å; L221-L225 PolarHBondContact O-N 3.01Å; K222-L225 PolarHBondContact O-N 3.38Å; L225-E227 VanDerWaalsContact C-N 3.33Å; L225-L228 PolarHBondContact O-N 3.48Å; L225-R229 WeakPolarHBondContact O-CB 3.36Å; L225-R229 PolarHBondContact O-N 3.48Å
226N72Confident65.7Low95 Ų95118.6 Ų118.651%0.50858%0.583SS.*Hα-helixtrans-65.7-38.6173.4-73.9-22.9000110.9K222 D223 R229 K230K222-N226 WeakPolarHBondContact O-CB 3.34Å; K222-N226 VanDerWaalsContact O-CG 3.25Å; K222-N226 PolarHBondContact O-N 3.18Å; K222-N226 PolarHBondContact O-ND2 3.42Å; D223-N226 PolarHBondContact O-N 2.82Å; N226-R229 PolarHBondContact O-N 2.99Å; N226-K230 PolarHBondContact O-N 3.35Å
227E68.2Low62.9Low110 Ų110125.1 Ų125.151%0.51461%0.605SS.*Hα-helixtrans-68.2-35.4175.9-14858.4-156.800112.3D223 Q224 L225 K230 P231D223-E227 WeakPolarHBondContact O-CB 3.3Å; D223-E227 PolarHBondContact O-N 3.1Å; Q224-E227 PolarHBondContact O-N 2.6Å; L225-E227 VanDerWaalsContact C-N 3.33Å; E227-K230 IonicContact OE1-NZ 3.67Å; E227-K230 PolarHBondContact OE1-NZ 2.86Å; E227-K230 IonicContact OE2-NZ 3.42Å; E227-K230 PolarHBondContact OE2-NZ 3.3Å; E227-P231 WeakPolarHBondContact O-CD 3.47Å
228L60.8Low60.1Low123 Ų123124.5 Ų124.564%0.64461%0.611SS**Hα-helixtrans-74.8-23.3172-71.4171.2000113.7Q224 L225 P231Q224-L228 WeakPolarHBondContact O-CB 3.29Å; Q224-L228 VanDerWaalsContact O-CG 3.32Å; Q224-L228 WeakPolarHBondContact O-CG 3.33Å; Q224-L228 PolarHBondContact O-N 2.84Å; L225-L228 PolarHBondContact O-N 3.48Å; L228-P231 VanDerWaalsContact O-CD 3.31Å; L228-P231 WeakPolarHBondContact O-CD 3.31Å; L228-P231 WeakPolarHBondContact O-CG 3.39Å
229R56.5Low57.2Low158 Ų158130.1 Ų130.160%0.59663%0.63SS**Hα-helixtrans-78-31177.2-165176.5-168.5119.2-0.6112.2L225 N226 P231 R232 Q233L225-R229 WeakPolarHBondContact O-CB 3.36Å; L225-R229 PolarHBondContact O-N 3.48Å; N226-R229 PolarHBondContact O-N 2.99Å; R229-P231 VanDerWaalsContact C-N 3.34Å; R229-R232 PolarHBondContact O-N 3.37Å; R229-Q233 PolarHBondContact O-N 3.38Å
230K53.1Low54.2Low125 Ų125130 Ų13054%0.54364%0.641SS.*Hα-helixtrans-50.3-44.7175.5-80.6175.5-177.71610113.2N226 E227 R232N226-K230 PolarHBondContact O-N 3.35Å; E227-K230 IonicContact OE1-NZ 3.67Å; E227-K230 PolarHBondContact OE1-NZ 2.86Å; E227-K230 IonicContact OE2-NZ 3.42Å; E227-K230 PolarHBondContact OE2-NZ 3.3Å; K230-R232 VanDerWaalsContact C-N 3.35Å; K230-R232 PolarHBondContact O-N 3.4Å
231P47Very low51.5Low81 Ų81135.4 Ų135.453%0.52666%0.663SS.*Hα-helixtrans-75.8-10.1176.423.5-30.9000115.8E227 L228 R229E227-P231 WeakPolarHBondContact O-CD 3.47Å; L228-P231 VanDerWaalsContact O-CD 3.31Å; L228-P231 WeakPolarHBondContact O-CD 3.31Å; L228-P231 WeakPolarHBondContact O-CG 3.39Å; R229-P231 VanDerWaalsContact C-N 3.34Å
232R41.9Very low49Very low212 Ų212136.5 Ų136.580%0.867%0.674SS**Hα-helixtrans-90.9-20.6174.8-81.9-168-177.5-171.62.3114.5R229 K230R229-R232 PolarHBondContact O-N 3.37Å; K230-R232 VanDerWaalsContact C-N 3.35Å; K230-R232 PolarHBondContact O-N 3.4Å
233Q38.2Very low46.5Very low126 Ų126133.8 Ų133.859%0.58968%0.679SS**Hα-helixtrans-77.5-30.3176.8-138118.7-5.200111.5R229 Q235R229-Q233 PolarHBondContact O-N 3.38Å; Q233-Q235 PolarHBondContact O-N 2.83Å; Q233-Q235 VanDerWaalsContact O-N 3.16Å
234C42.1Very low44.2Very low104 Ų104138.7 Ų138.770%0.70370%0.695SS**THydrogen-bonded Turntrans-72.8-0.9178.5-67.50000115.9
235Q34.8Very low41.7Very low167 Ų167141.9 Ų141.978%0.7871%0.71SS**THydrogen-bonded Turntrans-115.31.3-179.4-85.3-171.6-2800115.7Q233Q233-Q235 PolarHBondContact O-N 2.83Å; Q233-Q235 VanDerWaalsContact O-N 3.16Å
236K31.6Very low39.5Very low190 Ų190143.3 Ų143.383%0.82672%0.718SS**SBendtrans-109.75.6173.5-72.6-170.3177-173.30114.7S238K236-S238 PolarHBondContact O-N 2.86Å
237E30.9Very low37.5Very low167 Ų167146.8 Ų146.878%0.7873%0.731SS**SBendtrans-84.117.3171.5-79.7178.7162.600113.8
238S31.2Very low35.5Very low105 Ų105149.4 Ų149.473%0.73474%0.744SS**SBendtrans-13961.3175.5-64.70000111.8K236K236-S238 PolarHBondContact O-N 2.86Å
239Q28Very low33.8Very low186 Ų186151 Ų15187%0.86975%0.748SS**SBendtrans-176.7122.9140-100161.7400110.5
240N25.8Very low32.5Very low152 Ų152150.1 Ų150.181%0.81375%0.754SS**  trans74.987.8170-118.7-59.2000114.6
241L27.3Very low31.4Very low157 Ų157150 Ų15082%0.82276%0.764SS**  cis49.191.743.5-77.3179.5000115.4
242V28.5Very low30.6Very low134 Ų134151.8 Ų151.881%0.81278%0.779SS**  trans90.289.3142.1-165.60000116.9
243A30.2Very low29.9Very low88 Ų88147.6 Ų147.673%0.72778%0.777SS**  trans-157.4124.8139.200000111.5
244K31.7Very low29.6Very low203 Ų203146 Ų14688%0.88379%0.785SS**  trans80.481.3158.4-59.2-175.6-179.5-174.40117.1
245Q24.8Very low29.3Very low192 Ų192145.6 Ų145.690%0.89778%0.783SS**  -38.6139.2128.8-64.4165.6-36.500111.4
246N25.8Very low29.3Very low134 Ų134142.1 Ų142.172%0.71778%0.778SS**  trans136.8145.8135.9-151.629.2000112.2
247E29Very low29.3Very low168 Ų168139 Ų13979%0.78578%0.775SS**  trans74.891.5173.6-63.3170.3163.600113.6
248Q26.2Very low29.5Very low166 Ų166135.5 Ų135.578%0.77677%0.769SS**  56116.154.4-150.1175.4-21.200112.3
249E26.1Very low29.4Very low156 Ų156135.7 Ų135.773%0.72977%0.769SS**  trans86.7143.2153.5-125.6176.7156.300119
250L27.7Very low29.6Very low139 Ų139131.6 Ų131.673%0.72876%0.759SS**  trans80.8107.9163-58.1133000116.2
251T31.6Very low29.9Very low122 Ų122129.1 Ų129.175%0.74875%0.753SS**  -176.11168932.40000109.9
252S28.6Very low30.3Very low119 Ų119129.3 Ų129.383%0.83275%0.749SS**  trans-48.5134.2151-39.70000109.7
253T27.6Very low31.2Very low124 Ų124131.7 Ų131.776%0.76175%0.751SS**  trans-162128.1153.6-70000111.2
254A31.4Very low31.7Very low93 Ų93136.4 Ų136.477%0.76976%0.758SS**  trans67.1142.2146.100000115.9
255S36.9Very low32.6Very low95 Ų95131.4 Ų131.466%0.66475%0.746SS**  cis-159.41293.3-1420000102.2
256S34.1Very low32.9Very low95 Ų95125 Ų12566%0.66473%0.732SS**  65.1101.6103.3-520000111.5
257T33Very low33.7Very low125 Ų125125.9 Ų125.977%0.76774%0.736SS**  99.89595-650000106.9
258S35Very low34.3Very low93 Ų93125.4 Ų125.465%0.6574%0.739SS**  56.910081.8179.80000111
259C29.1Very low35.3Very low109 Ų109123 Ų12374%0.73674%0.736SS**  173.5110.1119.3-110.60000105.4
260C31.9Very low36Very low99 Ų99121.7 Ų121.767%0.66973%0.734SS**  69.5132.976.3-68.20000111.7
261C32.2Very low36.5Very low100 Ų100121.1 Ų121.168%0.67673%0.731SS**  trans91100151.7-53.10000115.6
262H35.9Very low37.2Very low161 Ų161124 Ų12475%0.74574%0.736SS**  8711184.9-80.8100.6000107
263H45.6Very low37.7Very low184 Ų184124.4 Ų124.485%0.85273%0.725SS**  -159.790.8129.4-87.597.7000104.9P265H263-P265 WeakPolarHBondContact O-CD 3.31Å
264H41.1Very low38.1Very low188 Ų188126 Ų12687%0.8772%0.723SS**  trans-86.3108.5147.8-121.1-74.6000104.5
265P50.1Low38.7Very low98 Ų98128 Ų12864%0.63672%0.72SS**  trans-83.9105.7150.95.914.4000105.6H263H263-P265 WeakPolarHBondContact O-CD 3.31Å
266G32.6Very low38.8Very low58 Ų58132.8 Ų132.860%0.59873%0.731SS**  trans-74.5122.3145.600000106.5
267D42.7Very low39.1Very low151 Ų151135.6 Ų135.681%0.80773%0.734SS**  trans-104.176.7150.8-76-39.8000105.9
268D41.3Very low39.4Very low158 Ų158133.9 Ų133.985%0.84573%0.733SS**  trans-92.9102.3148.5-82.1-55000105.5
269V46Very low39.6Very low117 Ų117137.2 Ų137.271%0.70974%0.738SS**  trans-163.9142155.5-103.50000111.2
270D42.5Very low40.1Very low128 Ų128140.9 Ų140.968%0.68474%0.742SS**  trans88.962158.4-53.8-28.2000118.3H272D270-H272 PolarHBondContact O-N 3.31Å; D270-H272 VanDerWaalsContact O-N 3.14Å
271D37.5Very low40.5Very low126 Ų126141.9 Ų141.967%0.67475%0.745SS**  -22.796116.5-170.921.7000114.2H273D271-H273 IonicContact OD1-CD2 3.73Å; D271-H273 PolarHBondContact OD1-N 2.88Å; D271-H273 IonicContact OD2-CD2 3.27Å; D271-H273 PolarHBondContact OD2-CD2 3.31Å
272H45.1Very low40.7Very low183 Ų183146.2 Ų146.285%0.84775%0.752SS**  trans-107.479.8152.3-97.3-56.4000109.5D270D270-H272 PolarHBondContact O-N 3.31Å; D270-H272 VanDerWaalsContact O-N 3.14Å
273H40.3Very low40.7Very low128 Ų128146.5 Ų146.559%0.59375%0.754SS**  trans-9.4131.1141.1-109.5-79.6000116.8D271D271-H273 IonicContact OD1-CD2 3.73Å; D271-H273 PolarHBondContact OD1-N 2.88Å; D271-H273 IonicContact OD2-CD2 3.27Å; D271-H273 PolarHBondContact OD2-CD2 3.31Å
274H35.9Very low40.6Very low158 Ų158145.8 Ų145.873%0.73175%0.748SS**  trans33.5130.3136.2-81.724.4000117.9
275L43.1Very low40.5Very low135 Ų135143.5 Ų143.571%0.70775%0.748SS**  -163.6125.574-81.8163.8000109.8
276H40.5Very low40.3Very low194 Ų194143.7 Ų143.790%0.89875%0.747SS**  trans-95.176.6161.6-151.3-88.6000106.4A278H276-A278 PolarHBondContact O-N 2.85Å
277E40.1Very low40.8Very low155 Ų155147.3 Ų147.372%0.72475%0.752SS**  trans-78106171-92.4-172.4156.600109.2E279E277-E279 VanDerWaalsContact C-N 3.34Å; E277-E279 PolarHBondContact O-N 3.37Å
278A38.7Very low40.8Very low89 Ų89146.3 Ų146.374%0.73675%0.747SS**  trans-68.490.3166.200000109.1H276 K280H276-A278 PolarHBondContact O-N 2.85Å; A278-K280 PolarHBondContact O-N 3.23Å
279E39.5Very low40.9Very low162 Ų162142.2 Ų142.276%0.75773%0.731SS**  trans-71.1102.5164-81.1-162.7148.100109.8E277 T281E277-E279 VanDerWaalsContact C-N 3.34Å; E277-E279 PolarHBondContact O-N 3.37Å; E279-T281 PolarHBondContact O-N 3.41Å
280K39.4Very low40.9Very low187 Ų187144.1 Ų144.181%0.81373%0.734SS**  trans-7473.3169.5-162.1178.5-168.5175.10108.7A278 K282A278-K280 PolarHBondContact O-N 3.23Å; K280-K282 VanDerWaalsContact C-N 3.32Å; K280-K282 PolarHBondContact O-N 2.9Å
281T40.3Very low41.2Very low120 Ų120146.2 Ų146.274%0.73674%0.737SS**  trans-74.589.6168.4340000109.5E279 E283E279-T281 PolarHBondContact O-N 3.41Å; T281-E283 VanDerWaalsContact C-N 3.33Å; T281-E283 PolarHBondContact O-N 3.34Å; T281-E283 VanDerWaalsContact O-N 3.11Å
282K36.6Very low41.5Very low190 Ų190146.4 Ų146.483%0.82674%0.738SS**  trans-63.694.6153.1-83.5179.1171.2-179.20107.6K280K280-K282 VanDerWaalsContact C-N 3.32Å; K280-K282 PolarHBondContact O-N 2.9Å
283E35.8Very low41.5Very low168 Ų168142.8 Ų142.879%0.78573%0.733SS**  trans-145.899.2157.2-151.1159.2-169.400112.4T281T281-E283 VanDerWaalsContact C-N 3.33Å; T281-E283 PolarHBondContact O-N 3.34Å; T281-E283 VanDerWaalsContact O-N 3.11Å
284K43.5Very low41.7Very low169 Ų169143.3 Ų143.374%0.73574%0.74SS**  trans64.294.5136-142.8167.5-173.4177.20115.8V286K284-V286 VanDerWaalsContact C-N 3.28Å; K284-V286 PolarHBondContact O-N 3.49Å
285T39.1Very low41.9Very low140 Ų140143.7 Ų143.786%0.85975%0.747SS**  trans-4595.9146.5-51.30000108.7D287T285-D287 PolarHBondContact O-N 2.83Å
286V46.4Very low41.8Very low101 Ų101143.3 Ų143.361%0.61274%0.744SS**  trans-81.5102162.3178.20000104.6K284 N288K284-V286 VanDerWaalsContact C-N 3.28Å; K284-V286 PolarHBondContact O-N 3.49Å; V286-N288 WeakPolarHBondContact CG1-OD1 3.23Å; V286-N288 PolarHBondContact O-N 2.83Å
287D43.5Very low42.2Very low135 Ų135142.8 Ų142.872%0.72274%0.742SS**  trans-57.291.1164.8-172.23.2000107.8T285 S289T285-D287 PolarHBondContact O-N 2.83Å; D287-S289 PolarHBondContact O-N 3.43Å; D287-S289 PolarHBondContact OD1-N 2.91Å
288N41.6Very low42.5Very low130 Ų130143 Ų14370%0.69574%0.743SS**  trans-73.368165.6-81-2.2000107.6V286 M290V286-N288 WeakPolarHBondContact CG1-OD1 3.23Å; V286-N288 PolarHBondContact O-N 2.83Å; N288-M290 PolarHBondContact O-N 3.36Å
289S44.1Very low42.6Very low72 Ų72145.8 Ų145.850%0.50375%0.745SS.*  trans-65.587.1159.7165.70000106.7D287 K291D287-S289 PolarHBondContact O-N 3.43Å; D287-S289 PolarHBondContact OD1-N 2.91Å; S289-K291 PolarHBondContact O-N 3.43Å
290M44.6Very low42.9Very low156 Ų156143.5 Ų143.577%0.76874%0.738SS**  trans-54.987.5161-76174.8167.400107.9N288 D292N288-M290 PolarHBondContact O-N 3.36Å; M290-D292 PolarHBondContact O-N 3.3Å
291K50.5Low43.2Very low173 Ų173140.7 Ų140.775%0.75273%0.732SS**  trans-76.873.8157.1-78.1179.5178.7176.70106S289 S293S289-K291 PolarHBondContact O-N 3.43Å; K291-S293 PolarHBondContact O-N 3.32Å; K291-S293 PolarHBondContact O-OG 2.84Å
292D42.9Very low43.4Very low129 Ų129140.9 Ų140.969%0.6973%0.729SS**  trans-5896.5161.7-82-27.7000106.7M290 N294M290-D292 PolarHBondContact O-N 3.3Å; D292-N294 PolarHBondContact O-N 2.91Å
293S45.9Very low43.6Very low107 Ų107138.7 Ų138.775%0.74873%0.726SS**  trans-72.576.3171.1-60.20000106.6K291 L295K291-S293 PolarHBondContact O-N 3.32Å; K291-S293 PolarHBondContact O-OG 2.84Å; S293-L295 PolarHBondContact O-N 2.82Å
294N43Very low43.9Very low139 Ų139136 Ų13674%0.74372%0.721SS**  trans-67.472.8158.2-96.6-25.6000107.4D292 I296D292-N294 PolarHBondContact O-N 2.91Å; N294-I296 HydrophobicContact CB-CG1 4.5Å; N294-I296 PolarHBondContact O-N 3.34Å
295L40.4Very low43.4Very low167 Ų167135 Ų13587%0.87472%0.724SS**  trans-80.278.6164.6-150.976.5000106.6S293 H297S293-L295 PolarHBondContact O-N 2.82Å; L295-H297 PolarHBondContact O-N 3.44Å
296I41.8Very low43.4Very low126 Ų126135.4 Ų135.465%0.64672%0.72SS**  trans-57.2123.4172.5-70.6170.6000107.6N294 Q298N294-I296 HydrophobicContact CB-CG1 4.5Å; N294-I296 PolarHBondContact O-N 3.34Å; I296-Q298 PolarHBondContact O-N 2.7Å
297H47.8Very low42.8Very low183 Ų183137.1 Ų137.185%0.84773%0.726SS**  trans-45.299.9164.9-87.4-75.4000111L295L295-H297 PolarHBondContact O-N 3.44Å
298Q48.2Very low42.4Very low161 Ų161135.9 Ų135.975%0.75273%0.728SS**  trans-96.886.2158.7-77175.6-7.100107.4I296 N300I296-Q298 PolarHBondContact O-N 2.7Å; Q298-N300 PolarHBondContact O-N 3.42Å; Q298-N300 VanDerWaalsContact O-N 3.1Å
299N40.7Very low42.1Very low146 Ų146134.9 Ų134.978%0.78173%0.731SS**  trans-77.579.9166.7-168.720.1000107.3N301N299-N301 VanDerWaalsContact C-N 3.33Å; N299-N301 PolarHBondContact O-N 2.85Å
300N45.7Very low41.5Very low114 Ų114137.3 Ų137.361%0.6174%0.743SS**  trans-76.491.7174.6-71.5-9.8000108.2Q298 D302Q298-N300 PolarHBondContact O-N 3.42Å; Q298-N300 VanDerWaalsContact O-N 3.1Å; N300-D302 VanDerWaalsContact C-N 3.26Å; N300-D302 PolarHBondContact O-N 3.43Å; N300-D302 VanDerWaalsContact O-N 3.17Å
301N45.8Very low41Very low128 Ų128135.6 Ų135.668%0.68474%0.741SS**  trans-8081.2165-159.629.6000106.9N299 N303N299-N301 VanDerWaalsContact C-N 3.33Å; N299-N301 PolarHBondContact O-N 2.85Å; N301-N303 PolarHBondContact O-N 3.26Å
302D44.4Very low40.2Very low125 Ų125134.4 Ų134.467%0.66874%0.743SS**  trans-71.280.5176.6-74-30.4000109.8N300 T304N300-D302 VanDerWaalsContact C-N 3.26Å; N300-D302 PolarHBondContact O-N 3.43Å; N300-D302 VanDerWaalsContact O-N 3.17Å; D302-T304 PolarHBondContact O-N 2.79Å
303N39.6Very low39.9Very low143 Ų143136.7 Ų136.777%0.76575%0.75SS**  trans-66.881.5161.1-91.9-12.5000108.5N301 N305N301-N303 PolarHBondContact O-N 3.26Å; N303-N305 PolarHBondContact O-N 2.85Å; N303-N305 VanDerWaalsContact O-N 3.09Å
304T41.8Very low39.3Very low111 Ų111137.3 Ų137.368%0.68175%0.754SS**  trans-80.488.4171.141.80000109.5D302 L306D302-T304 PolarHBondContact O-N 2.79Å; T304-L306 VanDerWaalsContact C-N 3.34Å; T304-L306 PolarHBondContact O-N 2.76Å
305N34.2Very low38.9Very low148 Ų148134 Ų13479%0.79175%0.753SS**  trans-68.589.2163.2-179.13.8000108.8N303 N307N303-N305 PolarHBondContact O-N 2.85Å; N303-N305 VanDerWaalsContact O-N 3.09Å; N305-N307 PolarHBondContact O-N 2.72Å
306L39.4Very low38.5Very low150 Ų150131 Ų13179%0.78575%0.746SS**  trans-95.886.6172.6-73.7170.6000109.7T304T304-L306 VanDerWaalsContact C-N 3.34Å; T304-L306 PolarHBondContact O-N 2.76Å
307N33.5Very low38.2Very low137 Ų137133.7 Ų133.773%0.73376%0.755SS**  trans-73.8115.4156179.120.1000108N305N305-N307 PolarHBondContact O-N 2.72Å
308S35.5Very low37.7Very low109 Ų109130.6 Ų130.676%0.76275%0.754SS**  trans-152.2120165.3-74.20000111.6
309S33.6Very low37Very low109 Ų109130.4 Ų130.476%0.76276%0.758SS**  trans-43.6134.9-177.5-51.80000117.2
310T32.2Very low36.8Very low122 Ų122130.4 Ų130.475%0.74876%0.758SS**  trans-58.2122.4167.4-35.70000111.4
311T33.3Very low36.1Very low121 Ų121130.9 Ų130.974%0.74277%0.766SS**  trans-112.8106.3161.8-61.70000108.2Q313T311-Q313 PolarHBondContact O-N 2.88Å
312N34.2Very low35.6Very low147 Ų147132.3 Ų132.379%0.78677%0.768SS**  trans-70.4114.1175.2-65.8-38.6000109.3
313Q37.1Very low35.1Very low178 Ų178134.9 Ų134.983%0.83277%0.773SS**  trans-118108.5160.1-70.9-166.124.300109.1T311 G315T311-Q313 PolarHBondContact O-N 2.88Å; Q313-G315 PolarHBondContact O-N 3.33Å
314S33.5Very low35.3Very low119 Ų119134.3 Ų134.383%0.83278%0.775SS**  trans-71.1110.4169.9-175.90000108.3
315G33.5Very low35.1Very low70 Ų70136.3 Ų136.372%0.72278%0.781SS**  trans-114.889.6173.700000110.1Q313 H317Q313-G315 PolarHBondContact O-N 3.33Å; G315-H317 PolarHBondContact O-N 2.83Å
316S32.3Very low34.9Very low104 Ų104133.1 Ų133.173%0.72778%0.783SS**  trans-70.1116.3165.4-58.70000108.8
317H35.8Very low35Very low183 Ų183132.2 Ų132.285%0.84778%0.779SS**  trans-121.7114164.3-94.836.5000109.5G315G315-H317 PolarHBondContact O-N 2.83Å
318S37.7Very low35Very low118 Ų118132.3 Ų132.383%0.82579%0.785SS**  trans-65.8134.9-179.1-52.30000111.3N320S318-N320 PolarHBondContact O-N 3.14Å
319N32.5Very low35.2Very low156 Ų156134 Ų13483%0.83478%0.78SS**  trans-67.2121.3172.5-64.5-29.7000109.8
320N36.6Very low35.1Very low146 Ų146136.7 Ų136.778%0.78179%0.785SS**  trans-107102.3168.4-149.112.8000108.9S318 H322S318-N320 PolarHBondContact O-N 3.14Å; N320-H322 PolarHBondContact O-N 3.44Å
321T30.9Very low35.4Very low125 Ų125140.5 Ų140.577%0.76779%0.787SS**  trans-84.899.9177.2-55.30000108.8
322H37Very low35.4Very low157 Ų157140.6 Ų140.673%0.72779%0.788SS**  trans-93.2108.7167-106.9-72.4000109.9N320N320-H322 PolarHBondContact O-N 3.44Å
323K33.6Very low35.4Very low179 Ų179138.8 Ų138.878%0.77879%0.794SS**  trans-65.1131.1157.8-81.8177.4170.9-179.40108.3
324T44Very low35.5Very low131 Ų131136.2 Ų136.280%0.80479%0.79SS**  trans-129.6116.5158.850.70000108.2
325D35.8Very low35.6Very low153 Ų153140 Ų14082%0.81879%0.792SS**  trans-62.8155.8174.1-65.4-58.3000111.7
326G31.3Very low35.8Very low81 Ų81141.5 Ų141.584%0.83579%0.787SS**  trans-64.8157.1-167.200000116
327N40.3Very low35.9Very low132 Ų132142.8 Ų142.871%0.70679%0.79SS**  trans-141.1125.4145.1-162.422.2000108.5E329N327-E329 PolarHBondContact ND2-OE1 2.72Å; N327-E329 PolarHBondContact O-N 2.76Å
328V33.6Very low35.8Very low139 Ų139141 Ų14184%0.84279%0.786SS**  trans-83.999.1175.5171.10000106.2
329E39.7Very low35.6Very low143 Ų143138.2 Ų138.267%0.66878%0.776SS**  trans-116.1108169.2-85.3-176.7-175.100110.7N327 Y331N327-E329 PolarHBondContact ND2-OE1 2.72Å; N327-E329 PolarHBondContact O-N 2.76Å; E329-Y331 HydrophobicContact CB-CD2 4.46Å; E329-Y331 PolarHBondContact O-N 2.69Å
330L32Very low35.4Very low166 Ų166141.4 Ų141.487%0.86978%0.782SS**  trans-78.9101.6170.8-169.188000107.7
331Y39.6Very low35.4Very low202 Ų202139.9 Ų139.979%0.79278%0.783SS**  trans-132143.9167.9-87-77000113.4E329E329-Y331 HydrophobicContact CB-CD2 4.46Å; E329-Y331 PolarHBondContact O-N 2.69Å
332T33.5Very low35.4Very low124 Ų124139 Ų13976%0.76178%0.782SS**  trans-68.5146.2-161.1210000115.6T334T332-T334 PolarHBondContact O-N 3.46Å; T332-T334 VanDerWaalsContact O-N 3.16Å
333A33.8Very low35.1Very low109 Ų109136.4 Ų136.490%0.90178%0.781SS**  trans-51.8109.9175.600000112.8
334T39.3Very low35.2Very low123 Ų123134 Ų13476%0.75578%0.782SS**  trans-101.2112.4163.8-57.40000108.7T332 T336T332-T334 PolarHBondContact O-N 3.46Å; T332-T334 VanDerWaalsContact O-N 3.16Å; T334-T336 PolarHBondContact O-N 3.41Å
335K34.1Very low34.7Very low200 Ų200135.5 Ų135.587%0.8778%0.779SS**  trans-77.290.8178.7-174.3-178.1179.1-177.90108.8
336T38.3Very low34.6Very low100 Ų100134.8 Ų134.861%0.61378%0.776SS**  trans-102.9105.3173.3-44.20000110T334 I338T334-T336 PolarHBondContact O-N 3.41Å; T336-I338 HydrophobicContact CG2-CD1 3.93Å; T336-I338 HydrophobicContact CG2-CG1 3.69Å; T336-I338 PolarHBondContact O-N 2.78Å
337T33.8Very low34.6Very low131 Ų131138.2 Ų138.280%0.80477%0.77SS**  trans-71.8103.8166.5-54.10000108
338I35.3Very low34.3Very low147 Ų147140.9 Ų140.975%0.75478%0.776SS**  trans-114.5129.1168.7-61.1-177000108.4T336T336-I338 HydrophobicContact CG2-CD1 3.93Å; T336-I338 HydrophobicContact CG2-CG1 3.69Å; T336-I338 PolarHBondContact O-N 2.78Å
339G32.9Very low34.5Very low59 Ų59141.3 Ų141.361%0.60877%0.773SS**  trans-70.9166-165.400000115.4S341G339-S341 PolarHBondContact O-N 2.92Å; G339-S341 VanDerWaalsContact O-N 3.07Å
340K29.1Very low34.3Very low222 Ų222140.1 Ų140.197%0.96578%0.779SS**  trans-46.7104.4168.4-80.2163.4166.4171.20111.2
341S35.1Very low34.7Very low114 Ų114136.6 Ų136.680%0.79777%0.768SS**  trans-101.3123.1154.4530000108.7G339G339-S341 PolarHBondContact O-N 2.92Å; G339-S341 VanDerWaalsContact O-N 3.07Å
342S31.8Very low34.8Very low108 Ų108131.9 Ų131.976%0.75577%0.765SS**  trans-54.9133.1178.944.10000114.3
343S29.4Very low35.2Very low101 Ų101132.3 Ų132.371%0.70676%0.763SS**  trans24.8105.3133.8-168.20000117.2
344T36.3Very low35.8Very low130 Ų130132.1 Ų132.180%0.79876%0.755SS**  trans-124.1104.4145.851.20000107.4N346T344-N346 PolarHBondContact O-N 3.39Å
345H33.6Very low35.7Very low161 Ų161132.8 Ų132.875%0.74575%0.753SS**  trans-45.6105.5161-111.5-101.8000108.4
346N35.1Very low36.2Very low139 Ų139129.8 Ų129.874%0.74375%0.745SS**  trans-103.188.9164-13214.7000105.6T344 F348T344-N346 PolarHBondContact O-N 3.39Å; N346-F348 VanDerWaalsContact C-N 3.32Å; N346-F348 PolarHBondContact O-N 3.48Å
347E31.1Very low36.5Very low152 Ų152133.1 Ų133.171%0.7175%0.753SS**  trans-58.798.2169.4-84.3178144.200108.1N349E347-N349 VanDerWaalsContact C-N 3.27Å; E347-N349 PolarHBondContact O-N 3.15Å
348F33.9Very low36.8Very low189 Ų189130.8 Ų130.883%0.82974%0.741SS**  trans-69.593.1164.8-108.6-94.6000107.2N346 C350N346-F348 VanDerWaalsContact C-N 3.32Å; N346-F348 PolarHBondContact O-N 3.48Å; F348-C350 PolarHBondContact O-N 2.81Å
349N36.9Very low37.3Very low147 Ų147127.8 Ų127.879%0.78673%0.73SS**  trans-61.488.3165.3-85.6-22.6000108.5E347 S351E347-N349 VanDerWaalsContact C-N 3.27Å; E347-N349 PolarHBondContact O-N 3.15Å; N349-S351 PolarHBondContact O-N 3.48Å
350C35.9Very low37.8Very low119 Ų119131.6 Ų131.680%0.80474%0.736SS**  trans-73.185.3168.6-162.10000107.3F348 S352F348-C350 PolarHBondContact O-N 2.81Å; C350-S352 PolarHBondContact O-N 2.9Å
351S39.7Very low38.7Very low91 Ų91125.3 Ų125.364%0.63672%0.721SS**  trans-57.9126.4176.6-160.20000108.9N349 N353N349-S351 PolarHBondContact O-N 3.48Å; S351-N353 PolarHBondContact O-N 3.25Å
352S42.4Very low39.1Very low104 Ų104126.5 Ų126.573%0.72772%0.715SS**SBendtrans-65.729.4-166.3-49.50000116.6C350C350-S352 PolarHBondContact O-N 2.9Å
353N41.1Very low39.9Very low133 Ų133128.4 Ų128.471%0.71172%0.717SS**THydrogen-bonded Turntrans-87.7-1.3-171.4-70.6-6.4000114.6S351S351-N353 PolarHBondContact O-N 3.25Å
354S47.5Very low40.5Very low104 Ų104131.7 Ų131.773%0.72772%0.721SS**THydrogen-bonded Turntrans-82.3-12.3176.7810000114.1
355L37.5Very low40.8Very low137 Ų137132.3 Ų132.372%0.71772%0.718SS**SBendtrans-87.2-17.4-169-160.262.1000114.6
356I44.2Very low41.2Very low138 Ų138134 Ų13471%0.70872%0.724SS**G310 helixtrans-83.6-18.2-177.5-59.7178.9000112.3C358I356-C358 PolarHBondContact O-N 2.77Å
357H44.9Very low41.6Very low170 Ų170134 Ų13479%0.78772%0.723SS**G310 helixtrans-80.73.1-179.1-151.9-75.2000114.4
358C40Very low42.2Very low81 Ų81133.4 Ų133.455%0.54773%0.725SS.*G310 helixtrans-100.7-6.9-178-72.30000115I356I356-C358 PolarHBondContact O-N 2.77Å
359T45.7Very low42.7Very low84 Ų84129.6 Ų129.652%0.51572%0.72SS.*SBendtrans-87-25.8-177.251.70000114.2
360D43.8Very low43.2Very low139 Ų139127.2 Ų127.274%0.74372%0.715SS**G310 helixtrans-81.4-20.1-177.4-69.3-11.3000113.1M362D360-M362 VanDerWaalsContact C-N 3.34Å; D360-M362 PolarHBondContact O-N 3.2Å
361S46.7Very low43.7Very low91 Ų91128.1 Ų128.164%0.63671%0.71SS**G310 helixtrans-83.7-5.4179.3-142.50000114.2
362M44.6Very low43.9Very low139 Ų139129.8 Ų129.869%0.68571%0.711SS**G310 helixtrans-84.2-13.7179-89.7-172.5-79.800114.1D360D360-M362 VanDerWaalsContact C-N 3.34Å; D360-M362 PolarHBondContact O-N 3.2Å
363N47.3Very low44.1Very low147 Ų147132.5 Ų132.579%0.78671%0.712SS**G310 helixtrans-87.3-3-178.7-77.3-23.8000114.7
364E42.8Very low44.4Very low171 Ų171132.8 Ų132.880%0.79971%0.714SS**SBendtrans-100.2-4.4-176.9-123.5178.6-176.300115K366E364-K366 VanDerWaalsContact C-N 3.28Å; E364-K366 PolarHBondContact O-N 3.43Å; E364-K366 VanDerWaalsContact O-N 3.13Å
365L41.9Very low44.4Very low142 Ų142132.9 Ų132.974%0.74371%0.71SS**  trans-9163.1173.5-63.7179.7000111.2L367L365-L367 HydrophobicContact CB-CD1 4.29Å; L365-L367 PolarHBondContact O-N 3.43Å
366K42.6Very low44.8Very low196 Ų196133.8 Ų133.885%0.85272%0.715SS**  trans-6986.5153.2-110.2174.7176.4175.80106.6E364 D368E364-K366 VanDerWaalsContact C-N 3.28Å; E364-K366 PolarHBondContact O-N 3.43Å; E364-K366 VanDerWaalsContact O-N 3.13Å; K366-D368 PolarHBondContact O-N 2.85Å; K366-D368 VanDerWaalsContact O-N 3.07Å
367L43.3Very low44.9Very low139 Ų139132.2 Ų132.273%0.72871%0.711SS**  trans-58.5111.1168-109.576.2000107.6L365 C369L365-L367 HydrophobicContact CB-CD1 4.29Å; L365-L367 PolarHBondContact O-N 3.43Å; L367-C369 PolarHBondContact O-N 2.9Å
368D44.5Very low44.9Very low141 Ų141129.9 Ų129.975%0.75470%0.704SS**  trans-56.5109.3167.3-85-40000108.6K366 S370K366-D368 PolarHBondContact O-N 2.85Å; K366-D368 VanDerWaalsContact O-N 3.07Å; D368-S370 PolarHBondContact O-N 3.49Å
369C44.1Very low45.3Very low109 Ų109130.2 Ų130.274%0.73671%0.705SS**G310 helixtrans-66.914.8-178.2-76.10000114.8L367 I371L367-C369 PolarHBondContact O-N 2.9Å; C369-I371 PolarHBondContact O-N 2.85Å
370S46.6Very low45.6Very low96 Ų96130.8 Ų130.867%0.67171%0.712SS**G310 helixtrans-84.2-7.3-172.2-44.90000114.5D368D368-S370 PolarHBondContact O-N 3.49Å
371I46.2Very low46Very low138 Ų138132.4 Ų132.471%0.70871%0.713SS**G310 helixtrans-92.5-9.6-175.5-58.3176.8000112.6C369C369-I371 PolarHBondContact O-N 2.85Å
372I43.6Very low46.2Very low126 Ų126133.7 Ų133.765%0.64671%0.712SS**SBendtrans-83.5-18.3-174.4-61.8178.9000113
373E47.4Very low46.6Very low162 Ų162132.2 Ų132.276%0.75771%0.71SS**SBendtrans-78.4-25.2-178.7-70.7-167.3159.200114.3V375E373-V375 VanDerWaalsContact C-N 3.34Å; E373-V375 PolarHBondContact O-N 3.37Å
374D47.4Very low47Very low139 Ų139131.9 Ų131.974%0.74370%0.704SS**THydrogen-bonded Turntrans-77.6-17.7-178-80-17000113.9
375V47.1Very low47.4Very low106 Ų106129 Ų12964%0.64269%0.693SS**THydrogen-bonded Turntrans-83.4-19.2-179.7-177.70000112.4E373 T377E373-V375 VanDerWaalsContact C-N 3.34Å; E373-V375 PolarHBondContact O-N 3.37Å; V375-T377 VanDerWaalsContact C-N 3.33Å
376L46.8Very low47.8Very low156 Ų156130.8 Ų130.882%0.81769%0.691SS**SBendtrans-84.4-6.5177.6-80.8165.2000113.8I378L376-I378 PolarHBondContact O-N 2.84Å
377T45.5Very low48.3Very low104 Ų104124.8 Ų124.864%0.63867%0.674SS**  trans-102.752.8177.3-39.10000110.7V375 P379V375-T377 VanDerWaalsContact C-N 3.33Å; T377-P379 WeakPolarHBondContact O-CD 3.46Å
378I45.5Very low48.9Very low122 Ų122123.1 Ų123.163%0.62667%0.669SS**  trans-72.3107.3166.6-61.5175.5000106.6L376L376-I378 PolarHBondContact O-N 2.84Å
379P47.3Very low49.3Very low88 Ų88122.1 Ų122.157%0.57166%0.662SS**  trans-72.2151.2-172.420-12.5000109.8T377 K381T377-P379 WeakPolarHBondContact O-CD 3.46Å; P379-K381 PolarHBondContact O-N 3.31Å
380S52.3Low49.7Very low96 Ų96121.9 Ų121.967%0.67166%0.66SS**THydrogen-bonded Turntrans-44.43.2-179.661.50000118.5T383S380-T383 PolarHBondContact O-OG1 2.87Å
381K53.5Low50Low173 Ų173125.1 Ų125.175%0.75267%0.665SS**Hα-helixtrans-71.3-27.6175.8-69.1-165.3175.2-174.70113.4P379 H384 L385P379-K381 PolarHBondContact O-N 3.31Å; K381-H384 PolarHBondContact O-N 2.87Å; K381-L385 PolarHBondContact O-N 3.43Å
382L49.9Very low50Low118 Ų118121.2 Ų121.262%0.61865%0.65SS**Hα-helixtrans-71.6-32.7176.9-116.979.1000112.6H384 L385 Y386L382-H384 VanDerWaalsContact C-N 3.29Å; L382-H384 PolarHBondContact O-N 3.18Å; L382-L385 PolarHBondContact O-N 2.86Å; L382-Y386 PolarHBondContact O-N 3.28Å
383T53.9Low50.3Low107 Ų107120.7 Ų120.766%0.65666%0.655SS**Hα-helixtrans-66.4-33.4177-10.70000111.7S380 C387S380-T383 PolarHBondContact O-OG1 2.87Å; T383-C387 PolarHBondContact O-N 3.4Å
384H56Low50.4Low141 Ų141121.7 Ų121.765%0.65366%0.657SS**Hα-helixtrans-71.8-32.8174-105.3-39.2000113.3K381 L382 Y386 C387 V388K381-H384 PolarHBondContact O-N 2.87Å; L382-H384 VanDerWaalsContact C-N 3.29Å; L382-H384 PolarHBondContact O-N 3.18Å; H384-Y386 VanDerWaalsContact C-N 3.34Å; H384-C387 PolarHBondContact O-N 3.47Å; H384-V388 WeakPolarHBondContact O-CG2 3.32Å; H384-V388 PolarHBondContact O-N 2.83Å
385L50.6Low50.3Low109 Ų109124.4 Ų124.457%0.57166%0.662SS**Hα-helixtrans-69.2-35.1177.8-161.368000111.8K381 L382 I389K381-L385 PolarHBondContact O-N 3.43Å; L382-L385 PolarHBondContact O-N 2.86Å; L385-I389 WeakPolarHBondContact O-CG1 3.24Å; L385-I389 PolarHBondContact O-N 3.04Å
386Y50.5Low50.1Low180 Ų180127.3 Ų127.371%0.70667%0.673SS**Hα-helixtrans-67.3-35.7174.1-116.6-89.5000112.6L382 H384 I389 C390L382-Y386 PolarHBondContact O-N 3.28Å; H384-Y386 VanDerWaalsContact C-N 3.34Å; Y386-I389 PolarHBondContact O-N 2.89Å; Y386-C390 PolarHBondContact O-N 3.01Å
387C52.5Low49.8Very low71 Ų71123.7 Ų123.748%0.4867%0.665SS.*Hα-helixtrans-69.4-35.9179.5-152.40000112.6T383 H384 I389 E391T383-C387 PolarHBondContact O-N 3.4Å; H384-C387 PolarHBondContact O-N 3.47Å; C387-I389 VanDerWaalsContact C-N 3.34Å; C387-I389 PolarHBondContact O-N 3.23Å; C387-E391 PolarHBondContact O-N 3.41Å
388V55.8Low49.6Very low104 Ų104133.4 Ų133.463%0.6369%0.692SS**Hα-helixtrans-72.1-29179.8176.10000112.1H384H384-V388 WeakPolarHBondContact O-CG2 3.32Å; H384-V388 PolarHBondContact O-N 2.83Å
389I54.1Low49.8Very low120 Ų120134 Ų13462%0.61570%0.695SS**Hα-helixtrans-77.5-30.8179.7-63.8172.4000111.4L385 Y386 C387L385-I389 WeakPolarHBondContact O-CG1 3.24Å; L385-I389 PolarHBondContact O-N 3.04Å; Y386-I389 PolarHBondContact O-N 2.89Å; C387-I389 VanDerWaalsContact C-N 3.34Å; C387-I389 PolarHBondContact O-N 3.23Å
390C52.4Low50Low103 Ų103136.4 Ų136.470%0.69670%0.702SS**Hα-helixtrans-83.6-22.7-178.6-71.30000115.2Y386Y386-C390 PolarHBondContact O-N 3.01Å
391E51Low49.8Very low165 Ų165138.6 Ų138.677%0.77170%0.704SS**SBendtrans-93.97178.9-70.5-153.7161.300114.7C387 P393C387-E391 PolarHBondContact O-N 3.41Å; E391-P393 VanDerWaalsContact O-CD 3.26Å; E391-P393 WeakPolarHBondContact O-CD 3.4Å
392S46.5Very low49.6Very low55 Ų55136.6 Ų136.639%0.38570%0.701SS.*  trans-73.6115.7172.7168.90000110.8F394S392-F394 PolarHBondContact O-N 3.36Å
393P49.7Very low49.6Very low115 Ų115137.8 Ų137.875%0.74771%0.706SS**G310 helixtrans-70.10.5179.8-13.829.1000113.7E391 F395E391-P393 VanDerWaalsContact O-CD 3.26Å; E391-P393 WeakPolarHBondContact O-CD 3.4Å; P393-F395 VanDerWaalsContact C-N 3.29Å; P393-F395 PolarHBondContact O-N 3.18Å
394F50.1Low49.3Very low184 Ų184139.8 Ų139.881%0.80771%0.709SS**G310 helixtrans-77.9-8.2-175.1-103.8-86.7000114.6S392S392-F394 PolarHBondContact O-N 3.36Å
395F44.8Very low48.8Very low196 Ų196139.7 Ų139.786%0.8671%0.713SS**G310 helixtrans-95.54.6-176.4-112.3-86.1000115.8P393P393-F395 VanDerWaalsContact C-N 3.29Å; P393-F395 PolarHBondContact O-N 3.18Å
396I44Very low48.7Very low167 Ų167142.1 Ų142.186%0.85672%0.724SS**SBendtrans-97.34.4178.6-62.6178.7000113
397A39.6Very low48.6Very low79 Ų79138.9 Ų138.965%0.65373%0.726SS**  trans-132.780.2179.500000111.8
398Y42.3Very low48.2Very low308 Ų308145.1 Ų145.1100%1.20875%0.748SS**  trans-166.30142.8-109.3-72000112

Retrieved 398 of 398 residues in 68.9 ms (Link to these results)