A0A024R5K5_HUMAN Loading...

Alpha-1,3-glucosyltransferase

AlphaFold DB (Q9BVK2), UniProt , Accession A0A024R5K5, Species HUMAN (Homo sapiens, Human), Gene ALG8, Length 526 aa.

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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
1M37Very low43.1Very low203 Ų20396.8 Ų96.8100%161%0.613SS**  0-43.90-70.7-155.1-151.300113.6A3 L4 T5M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 3.32Å; M1-L4 PolarHBondContact O-N 3.43Å; M1-T5 PolarHBondContact O-N 2.82Å; M1-T5 PolarHBondContact O-OG1 3.15Å
2A40.6Very low46.3Very low73 Ų7394.1 Ų94.160%0.60359%0.59SS**Hα-helixtrans-55.8-34.7179.700000114.9L4 T5 I6A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 2.81Å; A2-T5 PolarHBondContact O-OG1 3.08Å; A2-I6 WeakPolarHBondContact O-CD1 2.98Å; A2-I6 WeakPolarHBondContact O-CG1 3.4Å; A2-I6 PolarHBondContact O-N 2.9Å
3A39.9Very low49.9Very low77 Ų7790.2 Ų90.264%0.63656%0.558SS**Hα-helixtrans-68.6-23.9175.600000114M1M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 3.32Å
4L35.3Very low53.1Low138 Ų13885 Ų8572%0.72352%0.523SS*.Hα-helixtrans-86.9-38.1-179.3-80.5157.6000111.8M1 A2 I6 A7M1-L4 PolarHBondContact O-N 3.43Å; A2-L4 VanDerWaalsContact C-N 3.29Å; A2-L4 PolarHBondContact O-N 2.81Å; L4-I6 PolarHBondContact O-N 3.23Å; L4-A7 WeakPolarHBondContact O-CB 3.44Å; L4-A7 PolarHBondContact O-N 3.16Å; L4-A7 VanDerWaalsContact O-N 3.11Å
5T38.7Very low55.9Low109 Ų10983.9 Ų83.967%0.66952%0.52SS*.Hα-helixtrans-67-25176.119.20000113M1 A2 A7M1-T5 PolarHBondContact O-N 2.82Å; M1-T5 PolarHBondContact O-OG1 3.15Å; A2-T5 PolarHBondContact O-OG1 3.08Å; T5-A7 VanDerWaalsContact C-N 3.25Å; T5-A7 PolarHBondContact O-N 3.32Å
6I41.3Very low58.4Low80 Ų8080.9 Ų80.941%0.4151%0.506SS..G310 helixtrans-66.5-26.7173.6-69.5163.3000110.6A2 L4 T8 N12A2-I6 WeakPolarHBondContact O-CD1 2.98Å; A2-I6 WeakPolarHBondContact O-CG1 3.4Å; A2-I6 PolarHBondContact O-N 2.9Å; L4-I6 PolarHBondContact O-N 3.23Å; I6-T8 PolarHBondContact O-N 3.28Å; I6-N12 HydrophobicContact CG2-CB 3.89Å; I6-N12 WeakPolarHBondContact O-CB 3.38Å; I6-N12 PolarHBondContact O-ND2 2.83Å
7A40.5Very low60.7Low46 Ų4677.7 Ų77.738%0.3849%0.485SS..G310 helixtrans-69.6-7.8-16400000118.7L4 T5L4-A7 WeakPolarHBondContact O-CB 3.44Å; L4-A7 PolarHBondContact O-N 3.16Å; L4-A7 VanDerWaalsContact O-N 3.11Å; T5-A7 VanDerWaalsContact C-N 3.25Å; T5-A7 PolarHBondContact O-N 3.32Å
8T39.5Very low62.7Low135 Ų13573.9 Ų73.983%0.82846%0.462SS*.G310 helixtrans-91.5-6.9-167.354.90000116.6I6I6-T8 PolarHBondContact O-N 3.28Å
9G38.4Very low64.5Low26 Ų2675.1 Ų75.127%0.26847%0.465SS..SBendtrans-84.5146.4171.200000112.8G11 N12G9-G11 PolarHBondContact O-N 3.33Å; G9-N12 PolarHBondContact N-ND2 3.41Å; G9-N12 PolarHBondContact O-N 2.93Å
10T57.8Low66.2Low146 Ų14672.6 Ų72.690%0.89645%0.454SS*.THydrogen-bonded Turntrans-56.2-17-177.151.30000115.1W13T10-W13 PolarHBondContact O-NE1 2.85Å
11G64.9Low67.7Low32 Ų3269.1 Ų69.133%0.3343%0.432SS..THydrogen-bonded Turntrans-109.8-8.3172.800000115.9G9 W13 F14G9-G11 PolarHBondContact O-N 3.33Å; G11-W13 PolarHBondContact O-N 3.13Å; G11-F14 PolarHBondContact O-N 2.87Å
12N82.6Confident70.6Confident64 Ų6461.5 Ų61.534%0.34240%0.397SS..Hα-helixtrans-77.2-28.5-166-65.2-1.6000113.5I6 G9 F14 S15 A16I6-N12 HydrophobicContact CG2-CB 3.89Å; I6-N12 WeakPolarHBondContact O-CB 3.38Å; I6-N12 PolarHBondContact O-ND2 2.83Å; G9-N12 PolarHBondContact N-ND2 3.41Å; G9-N12 PolarHBondContact O-N 2.93Å; N12-F14 VanDerWaalsContact C-N 3.28Å; N12-F14 PolarHBondContact O-N 3.35Å; N12-S15 PolarHBondContact O-N 3.38Å; N12-A16 WeakPolarHBondContact O-CB 3.21Å; N12-A16 PolarHBondContact O-N 3.06Å
13W92.7Very high73.4Confident43 Ų4362.9 Ų62.916%0.16339%0.394CS..Hα-helixtrans-62.2-34.7175.262-91.9000112.5T10 G11 A16 L17 L137 K142 F143T10-W13 PolarHBondContact O-NE1 2.85Å; G11-W13 PolarHBondContact O-N 3.13Å; W13-A16 PolarHBondContact O-N 3.41Å; W13-L17 HydrophobicContact CE3-CD1 3.94Å; W13-L17 HydrophobicContact CZ3-CD1 4.07Å; W13-L17 WeakPolarHBondContact O-CG 3.5Å; W13-L17 PolarHBondContact O-N 2.92Å; W13-L137 HydrophobicContact CB-CD2 3.66Å; W13-L137 HydrophobicContact CD2-CD1 4.21Å; W13-L137 HydrophobicContact CD2-CD2 4.43Å; W13-L137 HydrophobicContact CG-CD1 4.19Å; W13-L137 HydrophobicContact CG-CD2 3.76Å; W13-K142 HydrophobicContact CH2-CB 4.43Å; W13-F143 HydrophobicContact CD2-CD2 4.15Å; W13-F143 AromaticContact CE3-CD2 3.49Å; W13-F143 HydrophobicContact CE3-CD2 3.49Å; W13-F143 VanDerWaalsContact CE3-CD2 3.49Å; W13-F143 HydrophobicContact CE3-CE2 4.06Å; W13-F143 HydrophobicContact CE3-CG 4.47Å; W13-F143 HydrophobicContact CZ3-CB 4.33Å; W13-F143 AromaticContact CZ3-CD2 3.91Å; W13-F143 HydrophobicContact CZ3-CD2 3.91Å; W13-F143 HydrophobicContact CZ3-CG 4.49Å
14F95Very high76.1Confident18 Ų1861 Ų618%0.07937%0.373CS..Hα-helixtrans-68.8-45.4179.4-176.9-88.7000110.3G11 N12 A16 L17 A18 V118 V121 R122 L150G11-F14 PolarHBondContact O-N 2.87Å; N12-F14 VanDerWaalsContact C-N 3.28Å; N12-F14 PolarHBondContact O-N 3.35Å; F14-A16 VanDerWaalsContact C-N 3.28Å; F14-A16 PolarHBondContact O-N 3.19Å; F14-L17 PolarHBondContact O-N 3.23Å; F14-A18 WeakPolarHBondContact O-CB 3.42Å; F14-A18 PolarHBondContact O-N 3.47Å; F14-V118 HydrophobicContact CE1-CG1 3.86Å; F14-V118 HydrophobicContact CZ-CG1 4.31Å; F14-V121 HydrophobicContact CE2-CG1 4.03Å; F14-V121 HydrophobicContact CZ-CB 4.38Å; F14-V121 HydrophobicContact CZ-CG1 4.23Å; F14-R122 HydrophobicContact CE1-CB 3.79Å; F14-R122 HydrophobicContact CE1-CG 4.2Å; F14-R122 HydrophobicContact CE2-CB 4.31Å; F14-R122 HydrophobicContact CZ-CB 3.64Å; F14-R122 HydrophobicContact CZ-CG 4.35Å; F14-L150 HydrophobicContact CE2-CD1 4.05Å; F14-L150 HydrophobicContact CZ-CD1 4.05Å
15S95.1Very high79.1Confident68 Ų6854.8 Ų54.848%0.47634%0.34SS..Hα-helixtrans-60.7-38.7174.1-56.60000111.6N12 A18 L19N12-S15 PolarHBondContact O-N 3.38Å; S15-A18 PolarHBondContact O-N 2.84Å; S15-L19 VanDerWaalsContact O-CB 3.23Å; S15-L19 WeakPolarHBondContact O-CB 3.3Å; S15-L19 PolarHBondContact O-N 2.8Å
16A95.9Very high81.9Confident36 Ų3651.9 Ų51.930%0.29832%0.324SS..Hα-helixtrans-64.4-42.5175.300000112.4N12 W13 F14 G20N12-A16 WeakPolarHBondContact O-CB 3.21Å; N12-A16 PolarHBondContact O-N 3.06Å; W13-A16 PolarHBondContact O-N 3.41Å; F14-A16 VanDerWaalsContact C-N 3.28Å; F14-A16 PolarHBondContact O-N 3.19Å; A16-G20 PolarHBondContact O-N 3.23Å
17L96.7Very high84.6Confident27 Ų2754.3 Ų54.314%0.14134%0.337CS..Hα-helixtrans-62.9-43.8174.8-74.2178.2000112.2W13 F14 V21 F143 V147 L150 W151W13-L17 HydrophobicContact CE3-CD1 3.94Å; W13-L17 HydrophobicContact CZ3-CD1 4.07Å; W13-L17 WeakPolarHBondContact O-CG 3.5Å; W13-L17 PolarHBondContact O-N 2.92Å; F14-L17 PolarHBondContact O-N 3.23Å; L17-V21 PolarHBondContact O-N 2.81Å; L17-V21 VanDerWaalsContact O-N 3.13Å; L17-F143 HydrophobicContact CD1-CD2 4.1Å; L17-F143 HydrophobicContact CD1-CE2 3.8Å; L17-F143 HydrophobicContact CD1-CZ 4.15Å; L17-F143 HydrophobicContact CD2-CE2 4.39Å; L17-F143 HydrophobicContact CD2-CZ 4.17Å; L17-F143 HydrophobicContact CG-CE2 4.27Å; L17-V147 HydrophobicContact CD1-CG2 3.75Å; L17-V147 HydrophobicContact CD2-CG2 3.92Å; L17-L150 HydrophobicContact CB-CD1 4.3Å; L17-W151 PolarHBondContact O-NE1 2.94Å; L17-W151 VanDerWaalsContact O-NE1 3.12Å
18A97.6Very high87.2Confident10 Ų1052.6 Ų52.68%0.08332%0.321CS..Hα-helixtrans-65.9-45.9178.500000111.4F14 S15 G20 V21 T22 V118 L150F14-A18 WeakPolarHBondContact O-CB 3.42Å; F14-A18 PolarHBondContact O-N 3.47Å; S15-A18 PolarHBondContact O-N 2.84Å; A18-G20 PolarHBondContact O-N 3.49Å; A18-V21 VanDerWaalsContact O-CG1 3.3Å; A18-V21 WeakPolarHBondContact O-CG1 3.47Å; A18-V21 PolarHBondContact O-N 3.47Å; A18-T22 WeakPolarHBondContact O-CB 3.46Å; A18-T22 PolarHBondContact O-N 2.87Å; A18-T22 PolarHBondContact O-OG1 3.39Å; A18-T22 VanDerWaalsContact O-OG1 3.07Å; A18-V118 HydrophobicContact CB-CG1 3.76Å; A18-V118 HydrophobicContact CB-CG2 4.34Å; A18-L150 HydrophobicContact CB-CD1 4.28Å
19L97Very high90Very high96 Ų9647.3 Ų47.350%0.50329%0.288SS..Hα-helixtrans-62.7-43.8176.4-177.165000111.3S15 V21 T22 L23S15-L19 VanDerWaalsContact O-CB 3.23Å; S15-L19 WeakPolarHBondContact O-CB 3.3Å; S15-L19 PolarHBondContact O-N 2.8Å; L19-V21 PolarHBondContact O-N 3.21Å; L19-T22 PolarHBondContact O-N 3.18Å; L19-L23 HydrophobicContact CG-CD1 4.3Å; L19-L23 WeakPolarHBondContact O-CG 3.02Å; L19-L23 PolarHBondContact O-N 3.32Å
20G97.8Very high92.7Very high24 Ų2451 Ų5125%0.24731%0.307CS..Hα-helixtrans-58.8-45.317900000112.7A16 A18 L23 L24 W151A16-G20 PolarHBondContact O-N 3.23Å; A18-G20 PolarHBondContact O-N 3.49Å; G20-L23 PolarHBondContact O-N 3.23Å; G20-L24 PolarHBondContact O-N 2.89Å; G20-L24 VanDerWaalsContact O-N 3.09Å; G20-W151 VanDerWaalsContact C-CZ2 3.49Å
21V97.8Very high94.5Very high0 Ų044.7 Ų44.70%027%0.268CS..Hα-helixtrans-71.1-33.617773.70000112L17 A18 L19 L23 L24 K25 L150 W151 L156L17-V21 PolarHBondContact O-N 2.81Å; L17-V21 VanDerWaalsContact O-N 3.13Å; A18-V21 VanDerWaalsContact O-CG1 3.3Å; A18-V21 WeakPolarHBondContact O-CG1 3.47Å; A18-V21 PolarHBondContact O-N 3.47Å; L19-V21 PolarHBondContact O-N 3.21Å; V21-L23 VanDerWaalsContact C-N 3.35Å; V21-L24 WeakPolarHBondContact O-CB 3.48Å; V21-L24 PolarHBondContact O-N 2.8Å; V21-K25 VanDerWaalsContact O-CG 3.29Å; V21-K25 WeakPolarHBondContact O-CG 3.43Å; V21-K25 PolarHBondContact O-N 2.79Å; V21-L150 HydrophobicContact CG1-CB 4.35Å; V21-L150 WeakPolarHBondContact CG2-O 3.33Å; V21-W151 HydrophobicContact CB-CD2 3.94Å; V21-W151 HydrophobicContact CB-CG 4.26Å; V21-W151 HydrophobicContact CB-CH2 4.5Å; V21-W151 HydrophobicContact CB-CZ2 3.92Å; V21-W151 HydrophobicContact CG2-CD2 4.01Å; V21-W151 HydrophobicContact CG2-CE3 4.31Å; V21-W151 HydrophobicContact CG2-CG 4.24Å; V21-W151 VanDerWaalsContact N-CZ2 3.28Å; V21-L156 HydrophobicContact CG2-CD1 4.36Å; V21-L156 HydrophobicContact CG2-CD2 3.81Å
22T98Very high96Very high44 Ų4445.8 Ų45.827%0.2726%0.263SS..Hα-helixtrans-63.3-40.8173.8-65.10000111.8A18 L19 L24 K25 C26 I111A18-T22 WeakPolarHBondContact O-CB 3.46Å; A18-T22 PolarHBondContact O-N 2.87Å; A18-T22 PolarHBondContact O-OG1 3.39Å; A18-T22 VanDerWaalsContact O-OG1 3.07Å; L19-T22 PolarHBondContact O-N 3.18Å; T22-L24 VanDerWaalsContact C-N 3.33Å; T22-L24 PolarHBondContact O-N 3.09Å; T22-K25 WeakPolarHBondContact O-CB 3.31Å; T22-K25 PolarHBondContact O-N 3.44Å; T22-C26 PolarHBondContact O-N 3.32Å; T22-C26 PolarHBondContact O-SG 3.28Å; T22-C26 VanDerWaalsContact O-SG 3.37Å; T22-I111 HydrophobicContact CG2-CG2 3.95Å
23L98.1Very high96.5Very high102 Ų10245.6 Ų45.653%0.53426%0.26SS..Hα-helixtrans-63-40.7173.6-68.8172.8000111.6L19 G20 V21 K25 C26 L27L19-L23 HydrophobicContact CG-CD1 4.3Å; L19-L23 WeakPolarHBondContact O-CG 3.02Å; L19-L23 PolarHBondContact O-N 3.32Å; G20-L23 PolarHBondContact O-N 3.23Å; V21-L23 VanDerWaalsContact C-N 3.35Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 2.77Å; L23-C26 WeakPolarHBondContact O-CB 3.46Å; L23-C26 PolarHBondContact O-N 3.42Å; L23-L27 WeakPolarHBondContact O-CG 3.28Å; L23-L27 PolarHBondContact O-N 3.05Å; L23-L27 VanDerWaalsContact O-N 3.11Å
24L97.8Very high96.7Very high36 Ų3644 Ų4419%0.18826%0.255CS..Hα-helixtrans-59.4-44.4172.7178.661.7000111.5G20 V21 T22 C26 L27 L28 W151 L156 L433G20-L24 PolarHBondContact O-N 2.89Å; G20-L24 VanDerWaalsContact O-N 3.09Å; V21-L24 WeakPolarHBondContact O-CB 3.48Å; V21-L24 PolarHBondContact O-N 2.8Å; T22-L24 VanDerWaalsContact C-N 3.33Å; T22-L24 PolarHBondContact O-N 3.09Å; L24-C26 VanDerWaalsContact C-N 3.28Å; L24-C26 PolarHBondContact O-N 2.89Å; L24-L27 WeakPolarHBondContact O-CB 3.4Å; L24-L27 PolarHBondContact O-N 2.8Å; L24-L28 WeakPolarHBondContact O-CG 3.21Å; L24-L28 PolarHBondContact O-N 3.44Å; L24-W151 HydrophobicContact CD2-CE3 4.15Å; L24-W151 HydrophobicContact CD2-CZ3 3.73Å; L24-L156 HydrophobicContact CD2-CD1 4.3Å; L24-L433 HydrophobicContact CD2-CD2 3.96Å
25K98.1Very high96.6Very high8 Ų847.2 Ų47.24%0.03528%0.276CS..Hα-helixtrans-59.1-39.7175.9-67165.5179.3-177.80111.9V21 T22 L23 L27 L28 I29 I111 D114 L156 H160V21-K25 VanDerWaalsContact O-CG 3.29Å; V21-K25 WeakPolarHBondContact O-CG 3.43Å; V21-K25 PolarHBondContact O-N 2.79Å; T22-K25 WeakPolarHBondContact O-CB 3.31Å; T22-K25 PolarHBondContact O-N 3.44Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 2.77Å; K25-L27 VanDerWaalsContact C-N 3.3Å; K25-L27 PolarHBondContact O-N 3.44Å; K25-L28 PolarHBondContact O-N 3.17Å; K25-I29 PolarHBondContact O-N 2.84Å; K25-I111 HydrophobicContact CB-CD1 3.95Å; K25-I111 HydrophobicContact CB-CG1 3.94Å; K25-D114 WeakPolarHBondContact CE-OD2 3.45Å; K25-D114 IonicContact NZ-OD2 2.7Å; K25-D114 PolarHBondContact NZ-OD2 3.22Å; K25-L156 HydrophobicContact CG-CD2 3.94Å; K25-H160 VanDerWaalsContact CD-CE1 3.49Å; K25-H160 WeakPolarHBondContact CD-CE1 3.5Å; K25-H160 WeakPolarHBondContact CE-NE2 3.49Å
26C97.7Very high96.6Very high49 Ų4945.3 Ų45.333%0.33126%0.261SS..Hα-helixtrans-61.9-36.5173.7-65.50000112.7T22 L23 L24 L28 I29T22-C26 PolarHBondContact O-N 3.32Å; T22-C26 PolarHBondContact O-SG 3.28Å; T22-C26 VanDerWaalsContact O-SG 3.37Å; L23-C26 WeakPolarHBondContact O-CB 3.46Å; L23-C26 PolarHBondContact O-N 3.42Å; L24-C26 VanDerWaalsContact C-N 3.28Å; L24-C26 PolarHBondContact O-N 2.89Å; C26-L28 PolarHBondContact O-N 3.1Å; C26-I29 HydrophobicContact CB-CD1 4.34Å; C26-I29 WeakPolarHBondContact O-CB 3.39Å; C26-I29 WeakPolarHBondContact O-CD1 3.49Å; C26-I29 VanDerWaalsContact O-CG1 3.27Å; C26-I29 WeakPolarHBondContact O-CG1 3.14Å; C26-I29 PolarHBondContact O-N 3.24Å
27L97Very high96.6Very high131 Ų13143.8 Ų43.869%0.68625%0.247SC*.Hα-helixtrans-68.4-22174.7-63.3175.5000112.9L23 L24 K25 P30L23-L27 WeakPolarHBondContact O-CG 3.28Å; L23-L27 PolarHBondContact O-N 3.05Å; L23-L27 VanDerWaalsContact O-N 3.11Å; L24-L27 WeakPolarHBondContact O-CB 3.4Å; L24-L27 PolarHBondContact O-N 2.8Å; K25-L27 VanDerWaalsContact C-N 3.3Å; K25-L27 PolarHBondContact O-N 3.44Å; L27-P30 WeakPolarHBondContact O-CD 3.28Å
28L97Very high96.7Very high9 Ų943.1 Ų43.15%0.04724%0.244CC..THydrogen-bonded Turntrans-85.8-6.9178.1-62.9174.4000113.6L24 K25 C26 P30 T31 H160 I161 I429L24-L28 WeakPolarHBondContact O-CG 3.21Å; L24-L28 PolarHBondContact O-N 3.44Å; K25-L28 PolarHBondContact O-N 3.17Å; C26-L28 PolarHBondContact O-N 3.1Å; L28-P30 VanDerWaalsContact C-CD 3.42Å; L28-T31 HydrophobicContact CB-CG2 4.41Å; L28-T31 HydrophobicContact CD2-CG2 4.03Å; L28-T31 WeakPolarHBondContact O-CB 3.44Å; L28-T31 WeakPolarHBondContact O-CG2 3.42Å; L28-T31 PolarHBondContact O-N 2.83Å; L28-T31 PolarHBondContact O-OG1 3.42Å; L28-H160 HydrophobicContact CB-CB 4.48Å; L28-H160 HydrophobicContact CD1-CB 4.1Å; L28-I161 HydrophobicContact CD1-CG1 4.27Å; L28-I161 HydrophobicContact CD2-CD1 4.18Å; L28-I161 HydrophobicContact CD2-CG1 4.35Å; L28-I429 HydrophobicContact CD2-CG2 4.05Å
29I97.3Very high96.7Very high24 Ų2443.2 Ų43.212%0.12324%0.243CC..THydrogen-bonded Turntrans-48.5-47.3179.3-70172.7000113.9K25 C26 T31 L104 R107 F108 I111K25-I29 PolarHBondContact O-N 2.84Å; C26-I29 HydrophobicContact CB-CD1 4.34Å; C26-I29 WeakPolarHBondContact O-CB 3.39Å; C26-I29 WeakPolarHBondContact O-CD1 3.49Å; C26-I29 VanDerWaalsContact O-CG1 3.27Å; C26-I29 WeakPolarHBondContact O-CG1 3.14Å; C26-I29 PolarHBondContact O-N 3.24Å; I29-T31 VanDerWaalsContact C-N 3.26Å; I29-T31 PolarHBondContact O-N 3.5Å; I29-L104 HydrophobicContact CD1-CD1 4.46Å; I29-L104 HydrophobicContact CG2-CD1 4.28Å; I29-R107 HydrophobicContact CG1-CB 4.06Å; I29-R107 HydrophobicContact CG2-CB 4.42Å; I29-R107 HydrophobicContact CG2-CG 4.32Å; I29-F108 HydrophobicContact CD1-CD1 4.37Å; I29-F108 HydrophobicContact CD1-CE1 3.77Å; I29-F108 HydrophobicContact CD1-CZ 4.1Å; I29-I111 HydrophobicContact CG1-CD1 4.47Å
30P95.4Very high96.7Very high104 Ų10438.8 Ų38.868%0.67522%0.22SC*.THydrogen-bonded Turntrans-80.6-1.5-176.434-36.9000114L27 L28L27-P30 WeakPolarHBondContact O-CD 3.28Å; L28-P30 VanDerWaalsContact C-CD 3.42Å
31T95.7Very high96.7Very high14 Ų1437.6 Ų37.69%0.08621%0.208CC..SBendtrans-71.5163.1-178.764.80000112L28 I29 R107 I429L28-T31 HydrophobicContact CB-CG2 4.41Å; L28-T31 HydrophobicContact CD2-CG2 4.03Å; L28-T31 WeakPolarHBondContact O-CB 3.44Å; L28-T31 WeakPolarHBondContact O-CG2 3.42Å; L28-T31 PolarHBondContact O-N 2.83Å; L28-T31 PolarHBondContact O-OG1 3.42Å; I29-T31 VanDerWaalsContact C-N 3.26Å; I29-T31 PolarHBondContact O-N 3.5Å; T31-R107 PolarHBondContact O-NH2 3.33Å; T31-R107 VanDerWaalsContact O-NH2 3.08Å; T31-I429 HydrophobicContact CG2-CD1 4.21Å
32Y94.9Very high96.7Very high55 Ų5537.7 Ų37.722%0.21621%0.209CC..  trans-38.4144171.2168.1-101.6000113.3S34 R107 I161 L421 F422 T423 E426Y32-S34 WeakPolarHBondContact OH-CA 3.3Å; Y32-R107 PolarHBondContact O-NH2 3.14Å; Y32-I161 HydrophobicContact CD1-CG2 4.3Å; Y32-I161 CarbonylContact O-C 3.58Å; Y32-I161 VanDerWaalsContact O-C 3.26Å; Y32-I161 WeakPolarHBondContact O-CG2 2.78Å; Y32-L421 HydrophobicContact CD1-CD2 3.89Å; Y32-L421 HydrophobicContact CE1-CD2 4.15Å; Y32-F422 HydrophobicContact CE2-CE1 4.32Å; Y32-F422 HydrophobicContact CE2-CZ 4.18Å; Y32-F422 AromaticContact CZ-CE1 3.86Å; Y32-F422 WeakPolarHBondContact OH-CE1 3.24Å; Y32-T423 HydrophobicContact CD2-CG2 3.65Å; Y32-T423 HydrophobicContact CE2-CG2 4.09Å; Y32-T423 HydrophobicContact CG-CG2 4.01Å; Y32-E426 VanDerWaalsContact CB-CD 3.47Å; Y32-E426 WeakPolarHBondContact CB-OE1 3.19Å; Y32-E426 PolarHBondContact N-OE1 3.25Å
33H94.8Very high96.7Very high59 Ų5935.8 Ų35.827%0.27320%0.196SC..  trans-132.4149.216758.675.2000110.4F37 I161 F163H33-F37 HydrophobicContact CB-CB 4Å; H33-F37 HydrophobicContact CB-CD2 4.13Å; H33-F37 HydrophobicContact CB-CG 4.21Å; H33-F37 AromaticContact CE1-CD1 3.81Å; H33-F37 AromaticContact CG-CD2 3.98Å; H33-F37 AromaticContact CG-CG 3.81Å; H33-F37 AromaticContact ND1-CD1 3.8Å; H33-F37 AromaticContact ND1-CG 3.58Å; H33-I161 WeakPolarHBondContact CA-O 3.47Å; H33-F163 HydrophobicContact CB-CB 4.14Å
34S95.1Very high96.8Very high10 Ų1031 Ų317%0.0717%0.171CC..  trans-86.6-174.9179.675.40000113.8Y32 D36 F37 H162Y32-S34 WeakPolarHBondContact OH-CA 3.3Å; S34-D36 PolarHBondContact O-N 2.84Å; S34-D36 WeakPolarHBondContact OG-CB 3.32Å; S34-D36 PolarHBondContact OG-N 3.21Å; S34-F37 WeakPolarHBondContact O-CB 3.45Å; S34-F37 PolarHBondContact O-N 3.24Å; S34-F37 VanDerWaalsContact O-N 3.08Å; S34-H162 WeakPolarHBondContact CB-CE1 3.41Å; S34-H162 WeakPolarHBondContact CB-ND1 3.31Å; S34-H162 VanDerWaalsContact CB-O 3.3Å; S34-H162 WeakPolarHBondContact CB-O 3.35Å; S34-H162 PolarHBondContact N-O 2.98Å; S34-H162 PolarHBondContact OG-CE1 2.94Å; S34-H162 PolarHBondContact OG-ND1 3.08Å; S34-H162 PolarHBondContact OG-O 3.18Å
35T94Very high96.8Very high85 Ų8529.2 Ų29.252%0.52116%0.162SC..THydrogen-bonded Turntrans-57.9-24.2168.952.80000113.3F37 E38 V39 W63T35-F37 PolarHBondContact O-N 3.29Å; T35-F37 VanDerWaalsContact O-N 3.13Å; T35-E38 WeakPolarHBondContact O-CB 3.2Å; T35-E38 PolarHBondContact O-N 2.95Å; T35-V39 WeakPolarHBondContact O-CG2 3.18Å; T35-V39 PolarHBondContact O-N 3.27Å; T35-W63 HydrophobicContact CG2-CZ2 4.48Å
36D94.7Very high96.8Very high28 Ų2828.9 Ų28.915%0.1516%0.161CC..Hα-helixtrans-59.7-24.9174.7-74.7-16.6000111.8S34 V39 H40 H162 F163 Q164 K383S34-D36 PolarHBondContact O-N 2.84Å; S34-D36 WeakPolarHBondContact OG-CB 3.32Å; S34-D36 PolarHBondContact OG-N 3.21Å; D36-V39 WeakPolarHBondContact O-CB 3.18Å; D36-V39 PolarHBondContact O-N 3.39Å; D36-H40 PolarHBondContact O-CD2 3.44Å; D36-H40 PolarHBondContact O-N 3.17Å; D36-H162 IonicContact OD2-CE1 3.77Å; D36-H162 IonicContact OD2-NE2 2.82Å; D36-F163 VanDerWaalsContact CB-O 3.29Å; D36-F163 WeakPolarHBondContact CB-O 3.1Å; D36-Q164 HydrophobicContact CB-CG 4.22Å; D36-Q164 WeakPolarHBondContact OD2-CG 3.24Å; D36-Q164 PolarHBondContact OD2-NE2 3.5Å; D36-K383 IonicContact OD2-NZ 2.67Å; D36-K383 PolarHBondContact OD2-NZ 3.01Å; D36-K383 VanDerWaalsContact OD2-NZ 3.1Å
37F97.2Very high96.8Very high4 Ų426.6 Ų26.62%0.01815%0.145CC..Hα-helixtrans-63.6-41.9172.1-174.9-89.6000112.8H33 S34 T35 R41 T102 L103 Q106 F163H33-F37 HydrophobicContact CB-CB 4Å; H33-F37 HydrophobicContact CB-CD2 4.13Å; H33-F37 HydrophobicContact CB-CG 4.21Å; H33-F37 AromaticContact CE1-CD1 3.81Å; H33-F37 AromaticContact CG-CD2 3.98Å; H33-F37 AromaticContact CG-CG 3.81Å; H33-F37 AromaticContact ND1-CD1 3.8Å; H33-F37 AromaticContact ND1-CG 3.58Å; S34-F37 WeakPolarHBondContact O-CB 3.45Å; S34-F37 PolarHBondContact O-N 3.24Å; S34-F37 VanDerWaalsContact O-N 3.08Å; T35-F37 PolarHBondContact O-N 3.29Å; T35-F37 VanDerWaalsContact O-N 3.13Å; F37-R41 WeakPolarHBondContact O-CB 3.37Å; F37-R41 PolarHBondContact O-N 2.96Å; F37-T102 HydrophobicContact CE1-CG2 4.07Å; F37-T102 HydrophobicContact CZ-CG2 3.98Å; F37-L103 HydrophobicContact CE2-CD1 3.86Å; F37-L103 HydrophobicContact CZ-CB 4.28Å; F37-L103 HydrophobicContact CZ-CD1 4.18Å; F37-Q106 HydrophobicContact CD2-CB 4.36Å; F37-Q106 VanDerWaalsContact CE1-NE2 3.25Å; F37-Q106 HydrophobicContact CE2-CB 3.64Å; F37-Q106 HydrophobicContact CE2-CG 4.16Å; F37-Q106 HydrophobicContact CZ-CB 4.2Å; F37-Q106 HydrophobicContact CZ-CG 4.34Å; F37-Q106 PolarHBondContact O-NE2 2.97Å; F37-Q106 PolarHBondContact O-OE1 2.92Å; F37-F163 VanDerWaalsContact CA-CD1 3.41Å; F37-F163 HydrophobicContact CB-CB 4.3Å; F37-F163 HydrophobicContact CB-CD1 3.94Å; F37-F163 HydrophobicContact CB-CG 4.13Å; F37-F163 HydrophobicContact CD2-CB 4.4Å; F37-F163 AromaticContact CD2-CD1 4Å; F37-F163 HydrophobicContact CD2-CD1 4Å; F37-F163 AromaticContact CD2-CD2 3.77Å; F37-F163 HydrophobicContact CD2-CD2 3.77Å; F37-F163 HydrophobicContact CD2-CE1 4.26Å; F37-F163 HydrophobicContact CD2-CE2 4.05Å; F37-F163 AromaticContact CD2-CG 3.75Å; F37-F163 HydrophobicContact CD2-CG 3.75Å; F37-F163 HydrophobicContact CD2-CZ 4.29Å; F37-F163 HydrophobicContact CE2-CD2 4.39Å; F37-F163 HydrophobicContact CE2-CE2 4.38Å; F37-F163 HydrophobicContact CG-CD1 4.4Å; F37-F163 HydrophobicContact CG-CG 4.43Å
38E97.4Very high96.9Very high13 Ų1323.2 Ų23.26%0.06113%0.126CC..Hα-helixtrans-72.2-35.7175.2170.957.9-166.700111.2T35 R41 N42 N96T35-E38 WeakPolarHBondContact O-CB 3.2Å; T35-E38 PolarHBondContact O-N 2.95Å; E38-R41 VanDerWaalsContact CD-NE 3.3Å; E38-R41 PolarHBondContact O-N 3.1Å; E38-R41 IonicContact OE1-CZ 2.97Å; E38-R41 IonicContact OE1-NE 3.83Å; E38-R41 PolarHBondContact OE1-NE 3.07Å; E38-R41 IonicContact OE1-NH2 2.95Å; E38-R41 PolarHBondContact OE1-NH2 2.92Å; E38-R41 WeakPolarHBondContact OE2-CD 3.13Å; E38-R41 IonicContact OE2-CZ 3.37Å; E38-R41 IonicContact OE2-NE 3.2Å; E38-R41 PolarHBondContact OE2-NE 3.14Å; E38-R41 IonicContact OE2-NH2 3.66Å; E38-N42 WeakPolarHBondContact O-CB 3.3Å; E38-N42 PolarHBondContact O-N 2.95Å; E38-N96 VanDerWaalsContact CD-CA 3.43Å; E38-N96 VanDerWaalsContact CD-N 3.25Å; E38-N96 PolarHBondContact OE1-N 3.37Å; E38-N96 WeakPolarHBondContact OE2-CA 3.12Å; E38-N96 PolarHBondContact OE2-N 3.31Å
39V97.4Very high96.9Very high12 Ų1225.8 Ų25.87%0.07314%0.144CC..Hα-helixtrans-57-52.7174.9174.10000110.7T35 D36 N42 W43 W63T35-V39 WeakPolarHBondContact O-CG2 3.18Å; T35-V39 PolarHBondContact O-N 3.27Å; D36-V39 WeakPolarHBondContact O-CB 3.18Å; D36-V39 PolarHBondContact O-N 3.39Å; V39-N42 WeakPolarHBondContact O-CB 3.32Å; V39-N42 PolarHBondContact O-N 3.41Å; V39-W43 HydrophobicContact CG1-CD2 4.05Å; V39-W43 HydrophobicContact CG1-CH2 3.8Å; V39-W43 HydrophobicContact CG1-CZ2 3.22Å; V39-W43 HydrophobicContact CG1-CZ3 4.43Å; V39-W43 VanDerWaalsContact O-CD1 3.22Å; V39-W43 VanDerWaalsContact O-CG 3.27Å; V39-W43 PolarHBondContact O-N 2.91Å; V39-W63 HydrophobicContact CB-CB 4.39Å; V39-W63 HydrophobicContact CG2-CB 3.93Å; V39-W63 HydrophobicContact CG2-CD2 3.62Å; V39-W63 HydrophobicContact CG2-CE3 3.65Å; V39-W63 HydrophobicContact CG2-CG 3.74Å; V39-W63 HydrophobicContact CG2-CZ3 4.44Å
40H97.8Very high97Very high3 Ų326.8 Ų26.81%0.01415%0.15CC..Hα-helixtrans-68.2-38.6179.6-77.9-70.1000112.5D36 N42 W43 L44 F71 E75 F163 Y165D36-H40 PolarHBondContact O-CD2 3.44Å; D36-H40 PolarHBondContact O-N 3.17Å; H40-N42 VanDerWaalsContact C-N 3.26Å; H40-N42 PolarHBondContact O-N 3.19Å; H40-W43 AromaticContact CE1-CE3 3.93Å; H40-W43 AromaticContact CE1-CZ3 3.63Å; H40-W43 AromaticContact ND1-CE3 3.71Å; H40-W43 AromaticContact ND1-CZ3 3.9Å; H40-W43 PolarHBondContact O-N 2.99Å; H40-L44 WeakPolarHBondContact O-CG 3.44Å; H40-L44 PolarHBondContact O-N 3.15Å; H40-F71 AromaticContact CE1-CE1 3.62Å; H40-F71 AromaticContact CE1-CZ 3.63Å; H40-F71 AromaticContact ND1-CE1 3.89Å; H40-E75 IonicContact CE1-OE1 3.1Å; H40-E75 IonicContact CG-OE1 3.56Å; H40-E75 IonicContact ND1-OE1 3.85Å; H40-E75 PolarHBondContact ND1-OE1 2.83Å; H40-F163 HydrophobicContact CB-CE1 3.74Å; H40-F163 AromaticContact CD2-CE1 3.7Å; H40-F163 AromaticContact CG-CE1 3.92Å; H40-Y165 HydrophobicContact CB-CE2 4.44Å; H40-Y165 AromaticContact CE1-CD2 3.64Å; H40-Y165 AromaticContact CG-CE2 3.94Å; H40-Y165 AromaticContact ND1-CD2 3.77Å; H40-Y165 AromaticContact ND1-CE2 3.7Å; H40-Y165 AromaticContact NE2-CD2 3.95Å
41R98Very high97.1Very high0 Ų025.6 Ų25.60%014%0.142CC..Hα-helixtrans-55.8-43.9169.8-175.3-126.343.787.4-8.7111.2F37 E38 W43 L44 A45 M89 Y97 T102F37-R41 WeakPolarHBondContact O-CB 3.37Å; F37-R41 PolarHBondContact O-N 2.96Å; E38-R41 VanDerWaalsContact CD-NE 3.3Å; E38-R41 PolarHBondContact O-N 3.1Å; E38-R41 IonicContact OE1-CZ 2.97Å; E38-R41 IonicContact OE1-NE 3.83Å; E38-R41 PolarHBondContact OE1-NE 3.07Å; E38-R41 IonicContact OE1-NH2 2.95Å; E38-R41 PolarHBondContact OE1-NH2 2.92Å; E38-R41 WeakPolarHBondContact OE2-CD 3.13Å; E38-R41 IonicContact OE2-CZ 3.37Å; E38-R41 IonicContact OE2-NE 3.2Å; E38-R41 PolarHBondContact OE2-NE 3.14Å; E38-R41 IonicContact OE2-NH2 3.66Å; R41-W43 VanDerWaalsContact C-N 3.33Å; R41-W43 PolarHBondContact O-N 3.38Å; R41-L44 WeakPolarHBondContact O-CB 3.23Å; R41-L44 PolarHBondContact O-N 3.44Å; R41-A45 VanDerWaalsContact NH1-CB 3.33Å; R41-A45 PolarHBondContact O-N 2.8Å; R41-M89 HydrophobicContact CG-CB 4.26Å; R41-M89 PolarHBondContact NH1-O 3.32Å; R41-Y97 WeakPolarHBondContact CD-O 3.46Å; R41-T102 HydrophobicContact CG-CG2 4.31Å
42N98.1Very high97.1Very high2 Ų227.6 Ų27.61%0.01115%0.152CC..Hα-helixtrans-63-40.6178.3-161.851.3000112.4E38 V39 H40 A45 I46 S61 W63E38-N42 WeakPolarHBondContact O-CB 3.3Å; E38-N42 PolarHBondContact O-N 2.95Å; V39-N42 WeakPolarHBondContact O-CB 3.32Å; V39-N42 PolarHBondContact O-N 3.41Å; H40-N42 VanDerWaalsContact C-N 3.26Å; H40-N42 PolarHBondContact O-N 3.19Å; N42-A45 PolarHBondContact O-N 2.87Å; N42-I46 WeakPolarHBondContact ND2-CD1 3.37Å; N42-I46 WeakPolarHBondContact O-CB 3.4Å; N42-I46 VanDerWaalsContact O-CG1 3.26Å; N42-I46 WeakPolarHBondContact O-CG1 3.36Å; N42-I46 PolarHBondContact O-N 3.39Å; N42-S61 WeakPolarHBondContact ND2-CB 3.3Å; N42-W63 HydrophobicContact CB-CB 4.44Å; N42-W63 PolarHBondContact ND2-O 3.09Å
43W98.4Very high97.2Very high4 Ų426.9 Ų26.92%0.01515%0.154CC..Hα-helixtrans-68.3-37.1178.2-61.7-5.8000112.5V39 H40 R41 A45 T47 W63 T64 L65 D66 Y67 F71 E75V39-W43 HydrophobicContact CG1-CD2 4.05Å; V39-W43 HydrophobicContact CG1-CH2 3.8Å; V39-W43 HydrophobicContact CG1-CZ2 3.22Å; V39-W43 HydrophobicContact CG1-CZ3 4.43Å; V39-W43 VanDerWaalsContact O-CD1 3.22Å; V39-W43 VanDerWaalsContact O-CG 3.27Å; V39-W43 PolarHBondContact O-N 2.91Å; H40-W43 AromaticContact CE1-CE3 3.93Å; H40-W43 AromaticContact CE1-CZ3 3.63Å; H40-W43 AromaticContact ND1-CE3 3.71Å; H40-W43 AromaticContact ND1-CZ3 3.9Å; H40-W43 PolarHBondContact O-N 2.99Å; R41-W43 VanDerWaalsContact C-N 3.33Å; R41-W43 PolarHBondContact O-N 3.38Å; W43-A45 VanDerWaalsContact C-N 3.34Å; W43-T47 WeakPolarHBondContact O-CB 3.42Å; W43-T47 VanDerWaalsContact O-CG2 3.3Å; W43-T47 WeakPolarHBondContact O-CG2 3.43Å; W43-T47 PolarHBondContact O-N 3.09Å; W43-T47 PolarHBondContact O-OG1 2.98Å; W43-W63 PolarHBondContact NE1-O 3.03Å; W43-T64 PolarHBondContact NE1-O 3.2Å; W43-T64 VanDerWaalsContact NE1-O 3.14Å; W43-L65 HydrophobicContact CB-CD1 4.05Å; W43-L65 HydrophobicContact CD2-CD1 3.7Å; W43-L65 HydrophobicContact CE3-CD1 4.16Å; W43-L65 HydrophobicContact CG-CD1 3.64Å; W43-D66 VanDerWaalsContact CH2-OD1 3.28Å; W43-D66 WeakPolarHBondContact CH2-OD1 3.37Å; W43-D66 WeakPolarHBondContact CZ2-OD1 3.38Å; W43-Y67 AromaticContact CH2-CD1 3.35Å; W43-Y67 HydrophobicContact CH2-CD1 3.35Å; W43-Y67 HydrophobicContact CH2-CD2 4.28Å; W43-Y67 AromaticContact CH2-CE1 3.51Å; W43-Y67 HydrophobicContact CH2-CE1 3.51Å; W43-Y67 HydrophobicContact CH2-CE2 4.4Å; W43-Y67 AromaticContact CH2-CG 3.74Å; W43-Y67 HydrophobicContact CH2-CG 3.74Å; W43-Y67 HydrophobicContact CZ2-CD1 4.28Å; W43-Y67 AromaticContact CZ3-CD1 3.89Å; W43-Y67 HydrophobicContact CZ3-CD1 3.89Å; W43-Y67 AromaticContact CZ3-CD2 3.98Å; W43-Y67 HydrophobicContact CZ3-CD2 3.98Å; W43-Y67 HydrophobicContact CZ3-CE1 4.13Å; W43-Y67 HydrophobicContact CZ3-CE2 4.21Å; W43-Y67 AromaticContact CZ3-CG 3.77Å; W43-Y67 HydrophobicContact CZ3-CG 3.77Å; W43-F71 HydrophobicContact CE3-CD1 4.04Å; W43-F71 AromaticContact CE3-CE1 3.8Å; W43-F71 HydrophobicContact CE3-CE1 3.8Å; W43-F71 AromaticContact CZ3-CD1 3.94Å; W43-F71 HydrophobicContact CZ3-CD1 3.94Å; W43-F71 AromaticContact CZ3-CE1 3.67Å; W43-F71 HydrophobicContact CZ3-CE1 3.67Å; W43-E75 HydrophobicContact CB-CB 4.41Å; W43-E75 HydrophobicContact CB-CG 3.97Å; W43-E75 HydrophobicContact CE3-CG 4.38Å
44L98.5Very high97.4Very high0 Ų028 Ų280%016%0.16CC..Hα-helixtrans-57.1-48.2169.4-69.5169.1000110.7H40 R41 T47 H48 E75 L78 M89 L90 F105 Q106H40-L44 WeakPolarHBondContact O-CG 3.44Å; H40-L44 PolarHBondContact O-N 3.15Å; R41-L44 WeakPolarHBondContact O-CB 3.23Å; R41-L44 PolarHBondContact O-N 3.44Å; L44-T47 PolarHBondContact O-OG1 3.46Å; L44-H48 WeakPolarHBondContact O-CB 3.29Å; L44-H48 PolarHBondContact O-N 3.32Å; L44-E75 HydrophobicContact CD2-CB 4.49Å; L44-E75 WeakPolarHBondContact CD2-O 3.2Å; L44-E75 WeakPolarHBondContact CD2-OE2 3.44Å; L44-E75 VanDerWaalsContact CG-OE2 3.31Å; L44-E75 WeakPolarHBondContact CG-OE2 3.34Å; L44-L78 HydrophobicContact CD2-CB 3.64Å; L44-M89 HydrophobicContact CD1-SD 4.44Å; L44-L90 HydrophobicContact CB-CD2 3.93Å; L44-F105 HydrophobicContact CD1-CD1 4.38Å; L44-F105 HydrophobicContact CD1-CE1 3.9Å; L44-F105 HydrophobicContact CD2-CE1 4.49Å; L44-Q106 HydrophobicContact CD1-CG 4.34Å
45A98.4Very high97.5Very high0 Ų027.6 Ų27.60%016%0.157CC..Hα-helixtrans-63.7-47.3179.200000113.1R41 N42 W43 T47 H48 S49 L90 V92R41-A45 VanDerWaalsContact NH1-CB 3.33Å; R41-A45 PolarHBondContact O-N 2.8Å; N42-A45 PolarHBondContact O-N 2.87Å; W43-A45 VanDerWaalsContact C-N 3.34Å; A45-T47 PolarHBondContact O-N 3.26Å; A45-H48 PolarHBondContact O-N 3.45Å; A45-S49 VanDerWaalsContact O-CB 3.25Å; A45-S49 WeakPolarHBondContact O-CB 3.44Å; A45-S49 PolarHBondContact O-N 2.92Å; A45-S49 PolarHBondContact O-OG 2.75Å; A45-L90 WeakPolarHBondContact CA-O 3.46Å; A45-L90 VanDerWaalsContact CB-C 3.5Å; A45-L90 WeakPolarHBondContact CB-O 3.15Å; A45-V92 HydrophobicContact CB-CG2 4.08Å
46I98.5Very high97.7Very high1 Ų123.6 Ų23.61%0.00513%0.132CC..Hα-helixtrans-57.4-52.2178.2-72.1170000110N42 H48 L50 W55 E58N42-I46 WeakPolarHBondContact ND2-CD1 3.37Å; N42-I46 WeakPolarHBondContact O-CB 3.4Å; N42-I46 VanDerWaalsContact O-CG1 3.26Å; N42-I46 WeakPolarHBondContact O-CG1 3.36Å; N42-I46 PolarHBondContact O-N 3.39Å; I46-H48 VanDerWaalsContact C-N 3.33Å; I46-H48 PolarHBondContact O-N 3.48Å; I46-L50 HydrophobicContact CG2-CD1 4.43Å; I46-L50 WeakPolarHBondContact O-CB 3.13Å; I46-L50 PolarHBondContact O-N 3.35Å; I46-W55 HydrophobicContact CG2-CB 4.4Å; I46-E58 HydrophobicContact CD1-CB 4.44Å; I46-E58 HydrophobicContact CD1-CG 4.21Å; I46-E58 HydrophobicContact CG1-CB 4.34Å; I46-E58 HydrophobicContact CG1-CG 3.89Å; I46-E58 HydrophobicContact CG2-CB 4.4Å
47T98.3Very high97.8Very high0 Ų027.2 Ų27.20%014%0.144CC..Hα-helixtrans-70.2-33.3-173.4560000111.9W43 L44 A45 W55 L65 A72 E75 Y76W43-T47 WeakPolarHBondContact O-CB 3.42Å; W43-T47 VanDerWaalsContact O-CG2 3.3Å; W43-T47 WeakPolarHBondContact O-CG2 3.43Å; W43-T47 PolarHBondContact O-N 3.09Å; W43-T47 PolarHBondContact O-OG1 2.98Å; L44-T47 PolarHBondContact O-OG1 3.46Å; A45-T47 PolarHBondContact O-N 3.26Å; T47-W55 HydrophobicContact CG2-CD2 4.06Å; T47-W55 HydrophobicContact CG2-CE3 4.26Å; T47-W55 HydrophobicContact CG2-CH2 4.46Å; T47-W55 HydrophobicContact CG2-CZ2 4.28Å; T47-W55 HydrophobicContact CG2-CZ3 4.46Å; T47-W55 PolarHBondContact O-NE1 3.33Å; T47-L65 HydrophobicContact CG2-CD2 4.46Å; T47-A72 HydrophobicContact CG2-CB 4.43Å; T47-A72 WeakPolarHBondContact CG2-O 3.46Å; T47-E75 HydrophobicContact CG2-CB 4.22Å; T47-Y76 VanDerWaalsContact O-CD2 3.27Å; T47-Y76 WeakPolarHBondContact O-CD2 3.35Å; T47-Y76 WeakPolarHBondContact OG1-CA 3.19Å; T47-Y76 PolarHBondContact OG1-N 3.08Å
48H98.1Very high97.8Very high61 Ų6128.7 Ų28.728%0.28215%0.152SC..Hα-helixtrans-71.3-48.9177-165.572.5000113.8L44 A45 I46 S79 L90L44-H48 WeakPolarHBondContact O-CB 3.29Å; L44-H48 PolarHBondContact O-N 3.32Å; A45-H48 PolarHBondContact O-N 3.45Å; I46-H48 VanDerWaalsContact C-N 3.33Å; I46-H48 PolarHBondContact O-N 3.48Å; H48-S79 WeakPolarHBondContact CB-OG 3.39Å; H48-S79 PolarHBondContact ND1-OG 3.01Å; H48-L90 HydrophobicContact CB-CB 4.41Å; H48-L90 HydrophobicContact CB-CD1 4.47Å; H48-L90 HydrophobicContact CB-CD2 4.17Å
49S97.9Very high97.7Very high63 Ų6331 Ų3144%0.44117%0.173SC..Hα-helixtrans-93.9-15.2-162.6-630000113A45 L90A45-S49 VanDerWaalsContact O-CB 3.25Å; A45-S49 WeakPolarHBondContact O-CB 3.44Å; A45-S49 PolarHBondContact O-N 2.92Å; A45-S49 PolarHBondContact O-OG 2.75Å; S49-L90 PolarHBondContact OG-O 3.2Å
50L97.9Very high97.7Very high44 Ų4433.4 Ų33.423%0.2319%0.188CC..SBendtrans-118.4148.6-176.2-58.4177.1000112.3I46 Q54 W55 E58 V92I46-L50 HydrophobicContact CG2-CD1 4.43Å; I46-L50 WeakPolarHBondContact O-CB 3.13Å; I46-L50 PolarHBondContact O-N 3.35Å; L50-Q54 HydrophobicContact CB-CB 4.1Å; L50-Q54 HydrophobicContact CD1-CB 4.31Å; L50-W55 PolarHBondContact O-NE1 3.32Å; L50-E58 HydrophobicContact CD1-CB 3.65Å; L50-E58 HydrophobicContact CD1-CG 3.56Å; L50-V92 HydrophobicContact CD1-CG2 4.43Å; L50-V92 HydrophobicContact CG-CG2 4.42Å
51P97.3Very high97.5Very high79 Ų7933.7 Ų33.751%0.51319%0.19SC..  trans-64.7154.8171.529.6-35.3000110.7S53 Q54 W55P51-S53 PolarHBondContact O-N 2.74Å; P51-Q54 HydrophobicContact CG-CB 4.42Å; P51-Q54 HydrophobicContact CG-CG 3.97Å; P51-Q54 PolarHBondContact O-N 2.88Å; P51-W55 VanDerWaalsContact O-CD1 3.28Å
52I97.1Very high97.2Very high57 Ų5740.9 Ų40.929%0.29222%0.224SC..G310 helixtrans-51.2-35.2-177.6-61.1162.9000112.3Q54 W55 W73 F256 L259I52-Q54 PolarHBondContact O-N 3.37Å; I52-Q54 VanDerWaalsContact O-N 3.15Å; I52-W55 HydrophobicContact CG1-CH2 4.22Å; I52-W55 HydrophobicContact CG1-CZ2 3.9Å; I52-W55 HydrophobicContact CG2-CE3 4.45Å; I52-W55 PolarHBondContact O-N 2.88Å; I52-W73 HydrophobicContact CD1-CH2 3.42Å; I52-W73 VanDerWaalsContact CD1-CH2 3.42Å; I52-W73 HydrophobicContact CD1-CZ2 3.78Å; I52-W73 HydrophobicContact CD1-CZ3 4.4Å; I52-W73 HydrophobicContact CG1-CH2 4.2Å; I52-W73 HydrophobicContact CG1-CZ2 4.46Å; I52-F256 HydrophobicContact CG2-CE1 3.91Å; I52-F256 HydrophobicContact CG2-CE2 4.49Å; I52-F256 HydrophobicContact CG2-CZ 3.72Å; I52-L259 HydrophobicContact CG2-CD1 4.43Å
53S97.3Very high97Very high39 Ų3944.3 Ų44.327%0.27324%0.236SC..G310 helixtrans-64-15.1178.460.80000114.5P51 Y57 Q261P51-S53 PolarHBondContact O-N 2.74Å; S53-Y57 WeakPolarHBondContact O-CD2 3.36Å; S53-Q261 PolarHBondContact O-NE2 3.07Å; S53-Q261 PolarHBondContact O-OE1 2.96Å
54Q97.6Very high96.9Very high84 Ų8445.1 Ų45.139%0.39324%0.242SC..G310 helixtrans-106.8-9.8179.4-64.7-60.5-20.100113.3L50 P51 I52 Y56 Y57 E58L50-Q54 HydrophobicContact CB-CB 4.1Å; L50-Q54 HydrophobicContact CD1-CB 4.31Å; P51-Q54 HydrophobicContact CG-CB 4.42Å; P51-Q54 HydrophobicContact CG-CG 3.97Å; P51-Q54 PolarHBondContact O-N 2.88Å; I52-Q54 PolarHBondContact O-N 3.37Å; I52-Q54 VanDerWaalsContact O-N 3.15Å; Q54-Y56 VanDerWaalsContact C-N 3.27Å; Q54-Y56 PolarHBondContact O-N 3.46Å; Q54-Y56 VanDerWaalsContact O-N 3.14Å; Q54-Y57 PolarHBondContact O-N 3.42Å; Q54-E58 PolarHBondContact O-N 3.42Å
55W98.2Very high96.8Very high1 Ų145.1 Ų45.10%0.00424%0.242CC..THydrogen-bonded Turntrans-54.9-38.6-173.7-73.55.3000114.2I46 T47 L50 P51 I52 L65 A72 W73 Y76 F256I46-W55 HydrophobicContact CG2-CB 4.4Å; T47-W55 HydrophobicContact CG2-CD2 4.06Å; T47-W55 HydrophobicContact CG2-CE3 4.26Å; T47-W55 HydrophobicContact CG2-CH2 4.46Å; T47-W55 HydrophobicContact CG2-CZ2 4.28Å; T47-W55 HydrophobicContact CG2-CZ3 4.46Å; T47-W55 PolarHBondContact O-NE1 3.33Å; L50-W55 PolarHBondContact O-NE1 3.32Å; P51-W55 VanDerWaalsContact O-CD1 3.28Å; I52-W55 HydrophobicContact CG1-CH2 4.22Å; I52-W55 HydrophobicContact CG1-CZ2 3.9Å; I52-W55 HydrophobicContact CG2-CE3 4.45Å; I52-W55 PolarHBondContact O-N 2.88Å; W55-L65 HydrophobicContact CB-CD2 3.99Å; W55-A72 HydrophobicContact CE3-CB 3.64Å; W55-A72 HydrophobicContact CZ3-CB 3.67Å; W55-W73 AromaticContact CH2-CD2 3.95Å; W55-W73 HydrophobicContact CH2-CD2 3.95Å; W55-W73 AromaticContact CH2-CE3 3.8Å; W55-W73 HydrophobicContact CH2-CE3 3.8Å; W55-W73 HydrophobicContact CH2-CH2 4.44Å; W55-W73 HydrophobicContact CH2-CZ3 4.06Å; W55-W73 HydrophobicContact CZ3-CD2 4.08Å; W55-W73 HydrophobicContact CZ3-CE3 4.4Å; W55-W73 HydrophobicContact CZ3-CG 4.35Å; W55-Y76 HydrophobicContact CH2-CD2 4.2Å; W55-Y76 HydrophobicContact CH2-CG 4.06Å; W55-Y76 AromaticContact CZ2-CD2 3.72Å; W55-Y76 HydrophobicContact CZ2-CD2 3.72Å; W55-Y76 HydrophobicContact CZ2-CE2 4.43Å; W55-Y76 HydrophobicContact CZ2-CG 4.06Å; W55-F256 HydrophobicContact CE3-CZ 4.18Å
56Y97.8Very high96.6Very high0 Ų047.1 Ų47.10%025%0.252CS..THydrogen-bonded Turntrans-100.3-0.7179.4-69.2-82.7000114Q54 L65 Y67 P69 F256 Q264 V265 R268Q54-Y56 VanDerWaalsContact C-N 3.27Å; Q54-Y56 PolarHBondContact O-N 3.46Å; Q54-Y56 VanDerWaalsContact O-N 3.14Å; Y56-L65 HydrophobicContact CD1-CB 4.46Å; Y56-L65 HydrophobicContact CD1-CD2 4.33Å; Y56-L65 HydrophobicContact CD1-CG 4.32Å; Y56-L65 WeakPolarHBondContact CD1-O 3.34Å; Y56-L65 HydrophobicContact CE1-CB 4.46Å; Y56-L65 HydrophobicContact CE1-CD2 3.97Å; Y56-L65 HydrophobicContact CE1-CG 3.88Å; Y56-L65 HydrophobicContact CE2-CD2 4.16Å; Y56-Y67 WeakPolarHBondContact CE1-O 3.42Å; Y56-Y67 PolarHBondContact OH-O 3.48Å; Y56-P69 WeakPolarHBondContact OH-CA 3.45Å; Y56-F256 HydrophobicContact CD2-CD1 4.01Å; Y56-F256 AromaticContact CD2-CE1 3.46Å; Y56-F256 HydrophobicContact CD2-CE1 3.46Å; Y56-F256 VanDerWaalsContact CD2-CE1 3.46Å; Y56-F256 AromaticContact CD2-CZ 3.96Å; Y56-F256 HydrophobicContact CD2-CZ 3.96Å; Y56-F256 HydrophobicContact CE2-CD1 4.24Å; Y56-F256 AromaticContact CE2-CE1 3.58Å; Y56-F256 HydrophobicContact CE2-CE1 3.58Å; Y56-F256 HydrophobicContact CE2-CE2 4.23Å; Y56-F256 AromaticContact CE2-CZ 3.57Å; Y56-F256 HydrophobicContact CE2-CZ 3.57Å; Y56-Q264 PolarHBondContact O-NE2 2.82Å; Y56-V265 HydrophobicContact CD2-CG2 3.76Å; Y56-V265 HydrophobicContact CE1-CG1 4.34Å; Y56-V265 HydrophobicContact CE2-CG2 4.04Å; Y56-V265 HydrophobicContact CG-CG2 4Å; Y56-R268 HydrophobicContact CD1-CB 4.12Å; Y56-R268 HydrophobicContact CD1-CG 4.1Å; Y56-R268 PolarHBondContact O-NE 3.35Å; Y56-R268 PolarHBondContact O-NH2 2.93Å
57Y97.3Very high96.6Very high104 Ų10448.3 Ų48.341%0.40826%0.257SS..THydrogen-bonded Turntrans-98.5-33176-78.7-86.2000112.3S53 Q54 A59 Q261 Q264S53-Y57 WeakPolarHBondContact O-CD2 3.36Å; Q54-Y57 PolarHBondContact O-N 3.42Å; Y57-A59 PolarHBondContact O-N 3.04Å; Y57-Q261 HydrophobicContact CE2-CB 4.35Å; Y57-Q261 HydrophobicContact CE2-CG 3.81Å; Y57-Q261 VanDerWaalsContact CE2-NE2 3.33Å; Y57-Q264 HydrophobicContact CD1-CG 4.37Å; Y57-Q264 HydrophobicContact CD2-CG 4.17Å; Y57-Q264 HydrophobicContact CE1-CG 4.01Å; Y57-Q264 HydrophobicContact CE2-CB 4.14Å; Y57-Q264 HydrophobicContact CE2-CG 3.76Å; Y57-Q264 HydrophobicContact CG-CG 4.45Å
58E96.8Very high96.6Very high36 Ų3648.6 Ų48.617%0.16826%0.259CS..  trans-52.9130.5177.9-175.849.1-119.800111.5I46 L50 Q54 T60 V92 R268I46-E58 HydrophobicContact CD1-CB 4.44Å; I46-E58 HydrophobicContact CD1-CG 4.21Å; I46-E58 HydrophobicContact CG1-CB 4.34Å; I46-E58 HydrophobicContact CG1-CG 3.89Å; I46-E58 HydrophobicContact CG2-CB 4.4Å; L50-E58 HydrophobicContact CD1-CB 3.65Å; L50-E58 HydrophobicContact CD1-CG 3.56Å; Q54-E58 PolarHBondContact O-N 3.42Å; E58-T60 WeakPolarHBondContact OE1-CB 3.45Å; E58-T60 PolarHBondContact OE1-N 3.21Å; E58-T60 PolarHBondContact OE1-OG1 2.95Å; E58-V92 HydrophobicContact CG-CG1 3.88Å; E58-R268 PolarHBondContact O-NH2 3.47Å
59A95.7Very high96.6Very high61 Ų6145.7 Ų45.750%0.50425%0.245SC..  trans-14917.3-170.400000113.4Y57 S61 T64Y57-A59 PolarHBondContact O-N 3.04Å; A59-S61 CarbonylContact C-O 3.59Å; A59-S61 PolarHBondContact O-N 3.22Å; A59-T64 HydrophobicContact CB-CG2 4.18Å
60T95.9Very high96.6Very high63 Ų6344.2 Ų44.239%0.38723%0.231SC..SBendtrans-56.9-40.5174.6-62.80000111.3E58 L95E58-T60 WeakPolarHBondContact OE1-CB 3.45Å; E58-T60 PolarHBondContact OE1-N 3.21Å; E58-T60 PolarHBondContact OE1-OG1 2.95Å; T60-L95 HydrophobicContact CG2-CD2 4.39Å
61S94Very high96.6Very high9 Ų942.1 Ų42.16%0.06322%0.22CC..SBendtrans-95.5149.6171-174.60000110.6N42 A59 W63 T64N42-S61 WeakPolarHBondContact ND2-CB 3.3Å; A59-S61 CarbonylContact C-O 3.59Å; A59-S61 PolarHBondContact O-N 3.22Å; S61-W63 PolarHBondContact O-N 2.97Å; S61-W63 PolarHBondContact OG-N 3.44Å; S61-T64 WeakPolarHBondContact O-CG2 3.19Å
62E92.1Very high96.7Very high151 Ų15138.4 Ų38.471%0.70620%0.196SC*.SBendtrans-62.1-24.7167.865.5-177.4166.700112.2T64E62-T64 PolarHBondContact O-N 3.08Å
63W93.9Very high96.8Very high74 Ų7439.2 Ų39.228%0.2820%0.195SC..SBendtrans-82.758.8179.8-51.7122.2000112.6T35 V39 N42 W43 S61T35-W63 HydrophobicContact CG2-CZ2 4.48Å; V39-W63 HydrophobicContact CB-CB 4.39Å; V39-W63 HydrophobicContact CG2-CB 3.93Å; V39-W63 HydrophobicContact CG2-CD2 3.62Å; V39-W63 HydrophobicContact CG2-CE3 3.65Å; V39-W63 HydrophobicContact CG2-CG 3.74Å; V39-W63 HydrophobicContact CG2-CZ3 4.44Å; N42-W63 HydrophobicContact CB-CB 4.44Å; N42-W63 PolarHBondContact ND2-O 3.09Å; W43-W63 PolarHBondContact NE1-O 3.03Å; S61-W63 PolarHBondContact O-N 2.97Å; S61-W63 PolarHBondContact OG-N 3.44Å
64T95.8Very high96.8Very high21 Ų2138 Ų3813%0.12919%0.185CC..  trans-66156.9179.863.90000112.4W43 A59 S61 E62 D66 R268W43-T64 PolarHBondContact NE1-O 3.2Å; W43-T64 VanDerWaalsContact NE1-O 3.14Å; A59-T64 HydrophobicContact CB-CG2 4.18Å; S61-T64 WeakPolarHBondContact O-CG2 3.19Å; E62-T64 PolarHBondContact O-N 3.08Å; T64-D66 PolarHBondContact O-N 2.95Å; T64-D66 VanDerWaalsContact O-N 3.14Å; T64-R268 PolarHBondContact OG1-NH1 2.94Å
65L97.2Very high96.8Very high0 Ų034 Ų340%017%0.167CC..  trans-65.1112.1176.3-173.665.1000110.9W43 T47 W55 Y56 A72W43-L65 HydrophobicContact CB-CD1 4.05Å; W43-L65 HydrophobicContact CD2-CD1 3.7Å; W43-L65 HydrophobicContact CE3-CD1 4.16Å; W43-L65 HydrophobicContact CG-CD1 3.64Å; T47-L65 HydrophobicContact CG2-CD2 4.46Å; W55-L65 HydrophobicContact CB-CD2 3.99Å; Y56-L65 HydrophobicContact CD1-CB 4.46Å; Y56-L65 HydrophobicContact CD1-CD2 4.33Å; Y56-L65 HydrophobicContact CD1-CG 4.32Å; Y56-L65 WeakPolarHBondContact CD1-O 3.34Å; Y56-L65 HydrophobicContact CE1-CB 4.46Å; Y56-L65 HydrophobicContact CE1-CD2 3.97Å; Y56-L65 HydrophobicContact CE1-CG 3.88Å; Y56-L65 HydrophobicContact CE2-CD2 4.16Å; L65-A72 HydrophobicContact CD1-CB 4.46Å; L65-A72 HydrophobicContact CD2-CB 3.72Å
66D94.8Very high96.9Very high41 Ų4137.9 Ų37.922%0.21918%0.181CC..  trans-123.88.3-174.774.3-8.4000113.9W43 T64 L269 R274W43-D66 VanDerWaalsContact CH2-OD1 3.28Å; W43-D66 WeakPolarHBondContact CH2-OD1 3.37Å; W43-D66 WeakPolarHBondContact CZ2-OD1 3.38Å; T64-D66 PolarHBondContact O-N 2.95Å; T64-D66 VanDerWaalsContact O-N 3.14Å; D66-L269 WeakPolarHBondContact O-CD2 3.32Å; D66-R274 IonicContact OD2-NH2 3.06Å
67Y97.2Very high96.9Very high27 Ų2743.1 Ų43.111%0.10621%0.208CC..SBendtrans-96.7158.7173.3-84.533.8000111.8W43 Y56 F71 K199W43-Y67 AromaticContact CH2-CD1 3.35Å; W43-Y67 HydrophobicContact CH2-CD1 3.35Å; W43-Y67 HydrophobicContact CH2-CD2 4.28Å; W43-Y67 AromaticContact CH2-CE1 3.51Å; W43-Y67 HydrophobicContact CH2-CE1 3.51Å; W43-Y67 HydrophobicContact CH2-CE2 4.4Å; W43-Y67 AromaticContact CH2-CG 3.74Å; W43-Y67 HydrophobicContact CH2-CG 3.74Å; W43-Y67 HydrophobicContact CZ2-CD1 4.28Å; W43-Y67 AromaticContact CZ3-CD1 3.89Å; W43-Y67 HydrophobicContact CZ3-CD1 3.89Å; W43-Y67 AromaticContact CZ3-CD2 3.98Å; W43-Y67 HydrophobicContact CZ3-CD2 3.98Å; W43-Y67 HydrophobicContact CZ3-CE1 4.13Å; W43-Y67 HydrophobicContact CZ3-CE2 4.21Å; W43-Y67 AromaticContact CZ3-CG 3.77Å; W43-Y67 HydrophobicContact CZ3-CG 3.77Å; Y56-Y67 WeakPolarHBondContact CE1-O 3.42Å; Y56-Y67 PolarHBondContact OH-O 3.48Å; Y67-F71 HydrophobicContact CD2-CB 4.05Å; Y67-F71 AromaticContact CD2-CD1 3.64Å; Y67-F71 HydrophobicContact CD2-CD1 3.64Å; Y67-F71 AromaticContact CD2-CD2 3.6Å; Y67-F71 HydrophobicContact CD2-CD2 3.6Å; Y67-F71 AromaticContact CD2-CE1 3.95Å; Y67-F71 HydrophobicContact CD2-CE1 3.95Å; Y67-F71 AromaticContact CD2-CE2 3.95Å; Y67-F71 HydrophobicContact CD2-CE2 3.95Å; Y67-F71 AromaticContact CD2-CG 3.47Å; Y67-F71 HydrophobicContact CD2-CG 3.47Å; Y67-F71 VanDerWaalsContact CD2-CG 3.47Å; Y67-F71 HydrophobicContact CD2-CZ 4.13Å; Y67-F71 HydrophobicContact CE2-CD1 4.44Å; Y67-F71 HydrophobicContact CE2-CD2 4.16Å; Y67-F71 HydrophobicContact CE2-CE1 4.33Å; Y67-F71 HydrophobicContact CE2-CE2 4.08Å; Y67-F71 HydrophobicContact CE2-CG 4.38Å; Y67-F71 HydrophobicContact CE2-CZ 4.17Å; Y67-F71 HydrophobicContact CG-CB 4.43Å; Y67-F71 HydrophobicContact CG-CD1 4.19Å; Y67-F71 HydrophobicContact CG-CG 4.19Å; Y67-K199 HydrophobicContact CD2-CG 4.31Å; Y67-K199 HydrophobicContact CE2-CD 3.72Å; Y67-K199 HydrophobicContact CE2-CG 3.96Å; Y67-K199 WeakPolarHBondContact OH-CE 3.35Å; Y67-K199 PolarHBondContact OH-NZ 3.33Å
68P98.1Very high96.9Very high5 Ų538.9 Ų38.93%0.03219%0.193CC..  trans-71.5164.1-177.33.88000112.3F70 F71 A72 H197 F198 H200 L269P68-F70 VanDerWaalsContact C-N 3.34Å; P68-F70 PolarHBondContact O-N 3.03Å; P68-F70 VanDerWaalsContact O-N 3.11Å; P68-F71 WeakPolarHBondContact O-CB 3.48Å; P68-F71 PolarHBondContact O-N 2.9Å; P68-A72 PolarHBondContact O-N 2.68Å; P68-H197 CarbonylContact C-O 3.58Å; P68-H197 VanDerWaalsContact CB-O 3.27Å; P68-H197 WeakPolarHBondContact CB-O 3.3Å; P68-F198 WeakPolarHBondContact CD-O 3.36Å; P68-H200 HydrophobicContact CG-CB 4.39Å; P68-L269 HydrophobicContact CB-CD1 4.48Å; P68-L269 HydrophobicContact CB-CD2 3.93Å; P68-L269 HydrophobicContact CG-CD2 3.82Å
69P98.3Very high97Very high0 Ų037.1 Ų37.10%019%0.185CC..Hα-helixtrans-57.8-32.3-163.4-34.439.9000117.3Y56 F71 A72 W73 S252 L253 F256 V265Y56-P69 WeakPolarHBondContact OH-CA 3.45Å; P69-F71 PolarHBondContact O-N 2.92Å; P69-A72 WeakPolarHBondContact O-CB 3.48Å; P69-A72 PolarHBondContact O-N 2.72Å; P69-A72 VanDerWaalsContact O-N 3.11Å; P69-W73 PolarHBondContact O-N 2.93Å; P69-S252 WeakPolarHBondContact CB-O 3.36Å; P69-L253 HydrophobicContact CG-CD2 4.06Å; P69-F256 HydrophobicContact CB-CD2 4.13Å; P69-F256 HydrophobicContact CB-CE2 3.66Å; P69-F256 HydrophobicContact CG-CD2 3.78Å; P69-F256 HydrophobicContact CG-CE2 3.73Å; P69-V265 HydrophobicContact CG-CG1 4.45Å
70F98.6Very high97.1Very high32 Ų3237.5 Ų37.514%0.1418%0.176CC..Hα-helixtrans-66.4-28.4176.7-69.7-17.9000112.8P68 F74 V194 H197 F198 V248 L251 S252P68-F70 VanDerWaalsContact C-N 3.34Å; P68-F70 PolarHBondContact O-N 3.03Å; P68-F70 VanDerWaalsContact O-N 3.11Å; F70-F74 WeakPolarHBondContact O-CB 3.35Å; F70-F74 PolarHBondContact O-N 3.47Å; F70-V194 HydrophobicContact CD2-CG1 4.17Å; F70-V194 HydrophobicContact CE2-CB 4.46Å; F70-V194 HydrophobicContact CE2-CG1 4.35Å; F70-V194 HydrophobicContact CE2-CG2 4.26Å; F70-H197 HydrophobicContact CB-CB 4.29Å; F70-H197 WeakPolarHBondContact CB-O 3.33Å; F70-H197 HydrophobicContact CD2-CB 3.32Å; F70-H197 HydrophobicContact CE2-CB 3.74Å; F70-H197 HydrophobicContact CG-CB 3.83Å; F70-H197 PolarHBondContact N-O 3.14Å; F70-H197 VanDerWaalsContact N-O 3.15Å; F70-F198 HydrophobicContact CB-CD1 4.35Å; F70-F198 HydrophobicContact CB-CD2 3.88Å; F70-F198 HydrophobicContact CB-CE1 4.37Å; F70-F198 HydrophobicContact CB-CE2 3.88Å; F70-F198 HydrophobicContact CB-CG 4.11Å; F70-F198 HydrophobicContact CB-CZ 4.13Å; F70-F198 HydrophobicContact CD2-CD2 4.27Å; F70-F198 HydrophobicContact CD2-CE2 4.29Å; F70-F198 WeakPolarHBondContact O-CE1 3.42Å; F70-V248 HydrophobicContact CE2-CG1 3.58Å; F70-V248 HydrophobicContact CZ-CG1 3.98Å; F70-V248 WeakPolarHBondContact CZ-O 3.4Å; F70-L251 HydrophobicContact CE1-CB 4.12Å; F70-L251 HydrophobicContact CZ-CB 4.06Å; F70-S252 VanDerWaalsContact CE1-CB 3.45Å
71F98.5Very high97.2Very high1 Ų138 Ų380%0.00418%0.179CC..Hα-helixtrans-70.8-37.9171.5-154.6-85.9000111.5H40 W43 Y67 P68 P69 W73 F74 E75 Y165 L169 F198H40-F71 AromaticContact CE1-CE1 3.62Å; H40-F71 AromaticContact CE1-CZ 3.63Å; H40-F71 AromaticContact ND1-CE1 3.89Å; W43-F71 HydrophobicContact CE3-CD1 4.04Å; W43-F71 AromaticContact CE3-CE1 3.8Å; W43-F71 HydrophobicContact CE3-CE1 3.8Å; W43-F71 AromaticContact CZ3-CD1 3.94Å; W43-F71 HydrophobicContact CZ3-CD1 3.94Å; W43-F71 AromaticContact CZ3-CE1 3.67Å; W43-F71 HydrophobicContact CZ3-CE1 3.67Å; Y67-F71 HydrophobicContact CD2-CB 4.05Å; Y67-F71 AromaticContact CD2-CD1 3.64Å; Y67-F71 HydrophobicContact CD2-CD1 3.64Å; Y67-F71 AromaticContact CD2-CD2 3.6Å; Y67-F71 HydrophobicContact CD2-CD2 3.6Å; Y67-F71 AromaticContact CD2-CE1 3.95Å; Y67-F71 HydrophobicContact CD2-CE1 3.95Å; Y67-F71 AromaticContact CD2-CE2 3.95Å; Y67-F71 HydrophobicContact CD2-CE2 3.95Å; Y67-F71 AromaticContact CD2-CG 3.47Å; Y67-F71 HydrophobicContact CD2-CG 3.47Å; Y67-F71 VanDerWaalsContact CD2-CG 3.47Å; Y67-F71 HydrophobicContact CD2-CZ 4.13Å; Y67-F71 HydrophobicContact CE2-CD1 4.44Å; Y67-F71 HydrophobicContact CE2-CD2 4.16Å; Y67-F71 HydrophobicContact CE2-CE1 4.33Å; Y67-F71 HydrophobicContact CE2-CE2 4.08Å; Y67-F71 HydrophobicContact CE2-CG 4.38Å; Y67-F71 HydrophobicContact CE2-CZ 4.17Å; Y67-F71 HydrophobicContact CG-CB 4.43Å; Y67-F71 HydrophobicContact CG-CD1 4.19Å; Y67-F71 HydrophobicContact CG-CG 4.19Å; P68-F71 WeakPolarHBondContact O-CB 3.48Å; P68-F71 PolarHBondContact O-N 2.9Å; P69-F71 PolarHBondContact O-N 2.92Å; F71-W73 PolarHBondContact O-N 3.48Å; F71-F74 HydrophobicContact CD1-CD1 4.39Å; F71-F74 HydrophobicContact CD2-CD1 4.33Å; F71-F74 HydrophobicContact CE1-CD1 4.16Å; F71-F74 HydrophobicContact CE1-CE1 4.44Å; F71-F74 HydrophobicContact CE2-CD1 4.08Å; F71-F74 HydrophobicContact CE2-CE1 4.23Å; F71-F74 HydrophobicContact CG-CD1 4.44Å; F71-F74 AromaticContact CZ-CD1 3.98Å; F71-F74 HydrophobicContact CZ-CD1 3.98Å; F71-F74 AromaticContact CZ-CE1 3.97Å; F71-F74 HydrophobicContact CZ-CE1 3.97Å; F71-F74 WeakPolarHBondContact O-CB 3.49Å; F71-F74 PolarHBondContact O-N 3.45Å; F71-F74 VanDerWaalsContact O-N 3.14Å; F71-E75 HydrophobicContact CD1-CG 3.93Å; F71-E75 HydrophobicContact CE1-CG 3.86Å; F71-E75 VanDerWaalsContact CE1-OE1 3.26Å; F71-E75 WeakPolarHBondContact CE1-OE1 3.42Å; F71-E75 WeakPolarHBondContact O-CG 3.34Å; F71-E75 PolarHBondContact O-N 2.78Å; F71-Y165 HydrophobicContact CZ-CD2 4.17Å; F71-Y165 HydrophobicContact CZ-CG 4.46Å; F71-L169 HydrophobicContact CD2-CD2 4.45Å; F71-L169 HydrophobicContact CE2-CD1 4.31Å; F71-L169 HydrophobicContact CE2-CD2 4.42Å; F71-F198 HydrophobicContact CB-CD1 4.28Å; F71-F198 WeakPolarHBondContact CB-O 3.34Å; F71-F198 AromaticContact CD2-CD1 3.86Å; F71-F198 HydrophobicContact CD2-CD1 3.86Å; F71-F198 WeakPolarHBondContact CD2-O 3.12Å; F71-F198 HydrophobicContact CG-CD1 4.47Å
72A98.4Very high97.4Very high0 Ų037.6 Ų37.60%018%0.176CC..Hα-helixtrans-60.5-44.7172.800000111.8T47 W55 L65 P68 P69 F74 E75 Y76T47-A72 HydrophobicContact CG2-CB 4.43Å; T47-A72 WeakPolarHBondContact CG2-O 3.46Å; W55-A72 HydrophobicContact CE3-CB 3.64Å; W55-A72 HydrophobicContact CZ3-CB 3.67Å; L65-A72 HydrophobicContact CD1-CB 4.46Å; L65-A72 HydrophobicContact CD2-CB 3.72Å; P68-A72 PolarHBondContact O-N 2.68Å; P69-A72 WeakPolarHBondContact O-CB 3.48Å; P69-A72 PolarHBondContact O-N 2.72Å; P69-A72 VanDerWaalsContact O-N 3.11Å; A72-F74 VanDerWaalsContact C-N 3.28Å; A72-F74 PolarHBondContact O-N 3.27Å; A72-E75 PolarHBondContact O-N 3.24Å; A72-Y76 WeakPolarHBondContact O-CB 3.31Å; A72-Y76 PolarHBondContact O-N 2.86Å
73W98.3Very high97.7Very high74 Ų7433.5 Ų33.528%0.2816%0.156SC..Hα-helixtrans-63.3-33.8173.2-76.5112.9000112.9I52 W55 P69 F71 Y76 I77I52-W73 HydrophobicContact CD1-CH2 3.42Å; I52-W73 VanDerWaalsContact CD1-CH2 3.42Å; I52-W73 HydrophobicContact CD1-CZ2 3.78Å; I52-W73 HydrophobicContact CD1-CZ3 4.4Å; I52-W73 HydrophobicContact CG1-CH2 4.2Å; I52-W73 HydrophobicContact CG1-CZ2 4.46Å; W55-W73 AromaticContact CH2-CD2 3.95Å; W55-W73 HydrophobicContact CH2-CD2 3.95Å; W55-W73 AromaticContact CH2-CE3 3.8Å; W55-W73 HydrophobicContact CH2-CE3 3.8Å; W55-W73 HydrophobicContact CH2-CH2 4.44Å; W55-W73 HydrophobicContact CH2-CZ3 4.06Å; W55-W73 HydrophobicContact CZ3-CD2 4.08Å; W55-W73 HydrophobicContact CZ3-CE3 4.4Å; W55-W73 HydrophobicContact CZ3-CG 4.35Å; P69-W73 PolarHBondContact O-N 2.93Å; F71-W73 PolarHBondContact O-N 3.48Å; W73-Y76 AromaticContact CE3-CD1 3.94Å; W73-Y76 HydrophobicContact CE3-CD1 3.94Å; W73-Y76 HydrophobicContact CE3-CG 4.35Å; W73-Y76 HydrophobicContact CZ3-CD1 4.08Å; W73-Y76 HydrophobicContact CZ3-CE1 4.24Å; W73-Y76 WeakPolarHBondContact O-CB 3.5Å; W73-Y76 PolarHBondContact O-N 2.93Å; W73-I77 WeakPolarHBondContact O-CD1 3.39Å; W73-I77 VanDerWaalsContact O-CG1 3.25Å; W73-I77 WeakPolarHBondContact O-CG1 3.39Å; W73-I77 PolarHBondContact O-N 3.39Å
74F98.4Very high97.8Very high15 Ų1538.5 Ų38.57%0.06618%0.176CC..Hα-helixtrans-66.9-46.3174.2162.8-104.9000112.2F70 F71 A72 Y76 I77 L78 M113 Y165 F168 F198F70-F74 WeakPolarHBondContact O-CB 3.35Å; F70-F74 PolarHBondContact O-N 3.47Å; F71-F74 HydrophobicContact CD1-CD1 4.39Å; F71-F74 HydrophobicContact CD2-CD1 4.33Å; F71-F74 HydrophobicContact CE1-CD1 4.16Å; F71-F74 HydrophobicContact CE1-CE1 4.44Å; F71-F74 HydrophobicContact CE2-CD1 4.08Å; F71-F74 HydrophobicContact CE2-CE1 4.23Å; F71-F74 HydrophobicContact CG-CD1 4.44Å; F71-F74 AromaticContact CZ-CD1 3.98Å; F71-F74 HydrophobicContact CZ-CD1 3.98Å; F71-F74 AromaticContact CZ-CE1 3.97Å; F71-F74 HydrophobicContact CZ-CE1 3.97Å; F71-F74 WeakPolarHBondContact O-CB 3.49Å; F71-F74 PolarHBondContact O-N 3.45Å; F71-F74 VanDerWaalsContact O-N 3.14Å; A72-F74 VanDerWaalsContact C-N 3.28Å; A72-F74 PolarHBondContact O-N 3.27Å; F74-Y76 VanDerWaalsContact C-N 3.3Å; F74-Y76 PolarHBondContact O-N 3.17Å; F74-I77 PolarHBondContact O-N 3.23Å; F74-L78 HydrophobicContact CD1-CD1 4.43Å; F74-L78 HydrophobicContact CD2-CG 4.34Å; F74-L78 HydrophobicContact CE1-CD1 3.71Å; F74-L78 HydrophobicContact CE1-CG 4.48Å; F74-L78 HydrophobicContact CE2-CD1 3.8Å; F74-L78 HydrophobicContact CE2-CD2 4.19Å; F74-L78 HydrophobicContact CE2-CG 3.88Å; F74-L78 HydrophobicContact CZ-CD1 3.36Å; F74-L78 HydrophobicContact CZ-CD2 4.48Å; F74-L78 HydrophobicContact CZ-CG 3.98Å; F74-L78 WeakPolarHBondContact O-CG 3.45Å; F74-L78 PolarHBondContact O-N 3.09Å; F74-M113 HydrophobicContact CE2-CG 3.8Å; F74-M113 HydrophobicContact CE2-SD 3.58Å; F74-M113 VanDerWaalsContact CE2-SD 3.58Å; F74-M113 HydrophobicContact CZ-CG 3.8Å; F74-M113 HydrophobicContact CZ-SD 4.21Å; F74-Y165 HydrophobicContact CE1-CD1 4.01Å; F74-Y165 HydrophobicContact CE1-CD2 4.44Å; F74-Y165 HydrophobicContact CE1-CE1 4.12Å; F74-Y165 HydrophobicContact CE1-CG 4.16Å; F74-Y165 AromaticContact CZ-CD1 3.78Å; F74-Y165 HydrophobicContact CZ-CD1 3.78Å; F74-Y165 AromaticContact CZ-CE1 3.8Å; F74-Y165 HydrophobicContact CZ-CE1 3.8Å; F74-Y165 HydrophobicContact CZ-CG 4.39Å; F74-F168 HydrophobicContact CD2-CE1 4.43Å; F74-F168 HydrophobicContact CE2-CE1 4.42Å; F74-F168 HydrophobicContact CZ-CD1 4.5Å; F74-F198 HydrophobicContact CB-CE1 3.67Å; F74-F198 HydrophobicContact CB-CZ 4.46Å; F74-F198 HydrophobicContact CG-CE1 4.12Å
75E98.5Very high97.9Very high0 Ų040.8 Ų40.80%018%0.184CC..Hα-helixtrans-60.9-40.5172.6-67.1-69.9-175.400111.1H40 W43 L44 T47 F71 A72 I77 L78 S79H40-E75 IonicContact CE1-OE1 3.1Å; H40-E75 IonicContact CG-OE1 3.56Å; H40-E75 IonicContact ND1-OE1 3.85Å; H40-E75 PolarHBondContact ND1-OE1 2.83Å; W43-E75 HydrophobicContact CB-CB 4.41Å; W43-E75 HydrophobicContact CB-CG 3.97Å; W43-E75 HydrophobicContact CE3-CG 4.38Å; L44-E75 HydrophobicContact CD2-CB 4.49Å; L44-E75 WeakPolarHBondContact CD2-O 3.2Å; L44-E75 WeakPolarHBondContact CD2-OE2 3.44Å; L44-E75 VanDerWaalsContact CG-OE2 3.31Å; L44-E75 WeakPolarHBondContact CG-OE2 3.34Å; T47-E75 HydrophobicContact CG2-CB 4.22Å; F71-E75 HydrophobicContact CD1-CG 3.93Å; F71-E75 HydrophobicContact CE1-CG 3.86Å; F71-E75 VanDerWaalsContact CE1-OE1 3.26Å; F71-E75 WeakPolarHBondContact CE1-OE1 3.42Å; F71-E75 WeakPolarHBondContact O-CG 3.34Å; F71-E75 PolarHBondContact O-N 2.78Å; A72-E75 PolarHBondContact O-N 3.24Å; E75-I77 PolarHBondContact O-N 2.96Å; E75-L78 PolarHBondContact O-N 2.66Å; E75-S79 WeakPolarHBondContact O-CB 3.23Å; E75-S79 PolarHBondContact O-N 2.92Å
76Y98.5Very high97.9Very high81 Ų8141.6 Ų41.632%0.31819%0.188SC..Hα-helixtrans-55.9-48.4172.6175.4-100.8000112T47 W55 A72 W73 F74 S79 H80T47-Y76 VanDerWaalsContact O-CD2 3.27Å; T47-Y76 WeakPolarHBondContact O-CD2 3.35Å; T47-Y76 WeakPolarHBondContact OG1-CA 3.19Å; T47-Y76 PolarHBondContact OG1-N 3.08Å; W55-Y76 HydrophobicContact CH2-CD2 4.2Å; W55-Y76 HydrophobicContact CH2-CG 4.06Å; W55-Y76 AromaticContact CZ2-CD2 3.72Å; W55-Y76 HydrophobicContact CZ2-CD2 3.72Å; W55-Y76 HydrophobicContact CZ2-CE2 4.43Å; W55-Y76 HydrophobicContact CZ2-CG 4.06Å; A72-Y76 WeakPolarHBondContact O-CB 3.31Å; A72-Y76 PolarHBondContact O-N 2.86Å; W73-Y76 AromaticContact CE3-CD1 3.94Å; W73-Y76 HydrophobicContact CE3-CD1 3.94Å; W73-Y76 HydrophobicContact CE3-CG 4.35Å; W73-Y76 HydrophobicContact CZ3-CD1 4.08Å; W73-Y76 HydrophobicContact CZ3-CE1 4.24Å; W73-Y76 WeakPolarHBondContact O-CB 3.5Å; W73-Y76 PolarHBondContact O-N 2.93Å; F74-Y76 VanDerWaalsContact C-N 3.3Å; F74-Y76 PolarHBondContact O-N 3.17Å; Y76-S79 PolarHBondContact O-N 3.44Å; Y76-S79 PolarHBondContact O-OG 3.49Å; Y76-H80 AromaticContact CD2-CE1 3.91Å; Y76-H80 AromaticContact CE1-CE1 3.61Å; Y76-H80 AromaticContact CE2-CE1 3.4Å; Y76-H80 WeakPolarHBondContact CE2-CE1 3.49Å; Y76-H80 AromaticContact CZ-CE1 3.21Å; Y76-H80 AromaticContact CZ-NE2 3.85Å; Y76-H80 PolarHBondContact O-ND1 3.17Å; Y76-H80 PolarHBondContact OH-CE1 3.18Å
77I98.3Very high98.1Very high110 Ų11046.7 Ų46.756%0.56421%0.211SC*.Hα-helixtrans-63.4-45.1178.4-70163.2000110.8W73 F74 E75 S79 H80W73-I77 WeakPolarHBondContact O-CD1 3.39Å; W73-I77 VanDerWaalsContact O-CG1 3.25Å; W73-I77 WeakPolarHBondContact O-CG1 3.39Å; W73-I77 PolarHBondContact O-N 3.39Å; F74-I77 PolarHBondContact O-N 3.23Å; E75-I77 PolarHBondContact O-N 2.96Å; I77-S79 VanDerWaalsContact C-N 3.29Å; I77-S79 PolarHBondContact O-N 3.16Å; I77-H80 PolarHBondContact O-N 3.46Å
78L98.4Very high98.1Very high15 Ų1549.8 Ų49.88%0.07923%0.226CC..Hα-helixtrans-60.7-39.4177-73.1-172.1000111.9L44 F74 E75 H80 V81 A82 F105 Y165L44-L78 HydrophobicContact CD2-CB 3.64Å; F74-L78 HydrophobicContact CD1-CD1 4.43Å; F74-L78 HydrophobicContact CD2-CG 4.34Å; F74-L78 HydrophobicContact CE1-CD1 3.71Å; F74-L78 HydrophobicContact CE1-CG 4.48Å; F74-L78 HydrophobicContact CE2-CD1 3.8Å; F74-L78 HydrophobicContact CE2-CD2 4.19Å; F74-L78 HydrophobicContact CE2-CG 3.88Å; F74-L78 HydrophobicContact CZ-CD1 3.36Å; F74-L78 HydrophobicContact CZ-CD2 4.48Å; F74-L78 HydrophobicContact CZ-CG 3.98Å; F74-L78 WeakPolarHBondContact O-CG 3.45Å; F74-L78 PolarHBondContact O-N 3.09Å; E75-L78 PolarHBondContact O-N 2.66Å; L78-H80 PolarHBondContact O-N 3.15Å; L78-H80 VanDerWaalsContact O-N 3.15Å; L78-V81 PolarHBondContact O-N 2.78Å; L78-A82 PolarHBondContact O-N 3.17Å; L78-F105 HydrophobicContact CB-CZ 4.33Å; L78-F105 WeakPolarHBondContact O-CZ 3.06Å; L78-Y165 HydrophobicContact CD1-CE1 4.01Å; L78-Y165 WeakPolarHBondContact CD1-OH 3.33Å
79S98.3Very high98.1Very high0 Ų049.6 Ų49.60%023%0.225CC..Hα-helixtrans-58.7-29.9-179.480.30000113.3H48 E75 Y76 I77 V81 A82 K83H48-S79 WeakPolarHBondContact CB-OG 3.39Å; H48-S79 PolarHBondContact ND1-OG 3.01Å; E75-S79 WeakPolarHBondContact O-CB 3.23Å; E75-S79 PolarHBondContact O-N 2.92Å; Y76-S79 PolarHBondContact O-N 3.44Å; Y76-S79 PolarHBondContact O-OG 3.49Å; I77-S79 VanDerWaalsContact C-N 3.29Å; I77-S79 PolarHBondContact O-N 3.16Å; S79-V81 VanDerWaalsContact C-N 3.25Å; S79-V81 PolarHBondContact O-N 3.14Å; S79-A82 WeakPolarHBondContact O-CB 3.37Å; S79-A82 PolarHBondContact O-N 3.31Å; S79-K83 PolarHBondContact O-N 3.47Å; S79-K83 VanDerWaalsContact O-N 3.12Å
80H98.1Very high98Very high68 Ų6849.9 Ų49.932%0.31523%0.226SC..Hα-helixtrans-70.1-23.5177.5-74.268.4000113.1Y76 I77 L78 K83 Y84Y76-H80 AromaticContact CD2-CE1 3.91Å; Y76-H80 AromaticContact CE1-CE1 3.61Å; Y76-H80 AromaticContact CE2-CE1 3.4Å; Y76-H80 WeakPolarHBondContact CE2-CE1 3.49Å; Y76-H80 AromaticContact CZ-CE1 3.21Å; Y76-H80 AromaticContact CZ-NE2 3.85Å; Y76-H80 PolarHBondContact O-ND1 3.17Å; Y76-H80 PolarHBondContact OH-CE1 3.18Å; I77-H80 PolarHBondContact O-N 3.46Å; L78-H80 PolarHBondContact O-N 3.15Å; L78-H80 VanDerWaalsContact O-N 3.15Å; H80-K83 VanDerWaalsContact O-CE 3.26Å; H80-K83 WeakPolarHBondContact O-CE 3.46Å; H80-K83 WeakPolarHBondContact O-CG 3.43Å; H80-Y84 WeakPolarHBondContact O-CD2 3.38Å; H80-Y84 VanDerWaalsContact O-CE2 3.23Å; H80-Y84 WeakPolarHBondContact O-CE2 3.37Å
81V98.1Very high98Very high74 Ų7451 Ų5145%0.44823%0.234SC..Hα-helixtrans-87.9-39.9170.3-174.20000109.8L78 S79 K83 Y84 F85 F105L78-V81 PolarHBondContact O-N 2.78Å; S79-V81 VanDerWaalsContact C-N 3.25Å; S79-V81 PolarHBondContact O-N 3.14Å; V81-K83 PolarHBondContact O-N 3.46Å; V81-Y84 PolarHBondContact O-N 2.97Å; V81-F85 HydrophobicContact CG1-CE2 4.17Å; V81-F105 HydrophobicContact CB-CE2 4Å; V81-F105 HydrophobicContact CB-CZ 4.45Å; V81-F105 HydrophobicContact CG1-CE2 3.9Å
82A98Very high97.9Very high0 Ų051.4 Ų51.40%024%0.236CC..Hα-helixtrans-52.6-39.9-179.800000113L78 S79 Y84 F85 D86 M89 L90 F105L78-A82 PolarHBondContact O-N 3.17Å; S79-A82 WeakPolarHBondContact O-CB 3.37Å; S79-A82 PolarHBondContact O-N 3.31Å; A82-Y84 PolarHBondContact O-N 3.37Å; A82-F85 WeakPolarHBondContact O-CA 3.36Å; A82-F85 WeakPolarHBondContact O-CB 3.33Å; A82-F85 PolarHBondContact O-N 3.41Å; A82-D86 PolarHBondContact O-N 2.97Å; A82-M89 HydrophobicContact CB-SD 3.81Å; A82-L90 HydrophobicContact CB-CD1 4.37Å; A82-L90 HydrophobicContact CB-CD2 4.01Å; A82-F105 HydrophobicContact CB-CD1 3.82Å; A82-F105 HydrophobicContact CB-CD2 4.47Å; A82-F105 HydrophobicContact CB-CE1 3.33Å; A82-F105 HydrophobicContact CB-CE2 4.04Å; A82-F105 HydrophobicContact CB-CG 4.38Å; A82-F105 HydrophobicContact CB-CZ 3.46Å; A82-F105 VanDerWaalsContact CB-CZ 3.46Å
83K97.2Very high97.8Very high66 Ų6657.7 Ų57.729%0.28727%0.265SS..THydrogen-bonded Turntrans-56.7-24.218076.6-174.8-176.5177.40114.2S79 H80 V81 Q87 L90S79-K83 PolarHBondContact O-N 3.47Å; S79-K83 VanDerWaalsContact O-N 3.12Å; H80-K83 VanDerWaalsContact O-CE 3.26Å; H80-K83 WeakPolarHBondContact O-CE 3.46Å; H80-K83 WeakPolarHBondContact O-CG 3.43Å; V81-K83 PolarHBondContact O-N 3.46Å; K83-Q87 WeakPolarHBondContact O-CG 3.19Å; K83-L90 HydrophobicContact CB-CD1 3.6Å
84Y97.6Very high97.7Very high178 Ų17856 Ų5670%0.69826%0.262SS*.THydrogen-bonded Turntrans-85.9-17.7177.7-61.6-72.3000112.8H80 V81 A82H80-Y84 WeakPolarHBondContact O-CD2 3.38Å; H80-Y84 VanDerWaalsContact O-CE2 3.23Å; H80-Y84 WeakPolarHBondContact O-CE2 3.37Å; V81-Y84 PolarHBondContact O-N 2.97Å; A82-Y84 PolarHBondContact O-N 3.37Å
85F97.7Very high97.5Very high70 Ų7059.1 Ų59.131%0.30728%0.279SS..THydrogen-bonded Turntrans-88.8-51.2174.3-77.9-107000110.8V81 A82 M89 R101 F105 F108V81-F85 HydrophobicContact CG1-CE2 4.17Å; A82-F85 WeakPolarHBondContact O-CA 3.36Å; A82-F85 WeakPolarHBondContact O-CB 3.33Å; A82-F85 PolarHBondContact O-N 3.41Å; F85-M89 HydrophobicContact CB-CE 4.16Å; F85-R101 WeakPolarHBondContact O-CD 3.3Å; F85-F105 HydrophobicContact CB-CB 3.86Å; F85-F105 HydrophobicContact CB-CD2 4.25Å; F85-F105 HydrophobicContact CB-CG 4.25Å; F85-F105 HydrophobicContact CD1-CB 3.78Å; F85-F105 HydrophobicContact CD1-CD2 4.22Å; F85-F105 HydrophobicContact CD1-CG 4.48Å; F85-F105 HydrophobicContact CD2-CB 4.43Å; F85-F105 AromaticContact CD2-CD2 3.5Å; F85-F105 HydrophobicContact CD2-CD2 3.5Å; F85-F105 VanDerWaalsContact CD2-CD2 3.5Å; F85-F105 HydrophobicContact CD2-CE2 4.22Å; F85-F105 HydrophobicContact CD2-CG 4.31Å; F85-F105 HydrophobicContact CE1-CB 4.43Å; F85-F105 HydrophobicContact CE1-CD2 4.48Å; F85-F105 AromaticContact CE2-CD2 3.8Å; F85-F105 HydrophobicContact CE2-CD2 3.8Å; F85-F105 HydrophobicContact CE2-CE2 4.4Å; F85-F105 HydrophobicContact CG-CB 3.78Å; F85-F105 AromaticContact CG-CD2 3.73Å; F85-F105 HydrophobicContact CG-CD2 3.73Å; F85-F105 HydrophobicContact CG-CG 4.11Å; F85-F105 HydrophobicContact CZ-CD2 4.28Å; F85-F108 HydrophobicContact CE1-CD2 4.48Å
86D97.7Very high97.3Very high17 Ų1764.9 Ų64.99%0.09131%0.309CS..  trans-154.4124.4179.9-159.1-20.7000109.5A82 E88 M89 Y97 S99 R101 T102A82-D86 PolarHBondContact O-N 2.97Å; D86-E88 PolarHBondContact OD1-N 2.91Å; D86-E88 VanDerWaalsContact OD1-N 3.09Å; D86-M89 HydrophobicContact CB-CB 4.29Å; D86-M89 HydrophobicContact CB-CE 3.27Å; D86-M89 HydrophobicContact CB-CG 4.32Å; D86-M89 WeakPolarHBondContact O-CG 3.47Å; D86-Y97 PolarHBondContact OD2-OH 3.33Å; D86-S99 WeakPolarHBondContact OD2-CB 3.27Å; D86-S99 PolarHBondContact OD2-OG 2.72Å; D86-R101 HydrophobicContact CB-CB 4.13Å; D86-T102 PolarHBondContact OD2-OG1 3.09Å
87Q97.1Very high97.1Very high147 Ų14764.1 Ų64.169%0.68731%0.307SS*.SBendtrans-80.2-30.2176.4-70-176-1500111.5K83 M89 L90K83-Q87 WeakPolarHBondContact O-CG 3.19Å; Q87-M89 PolarHBondContact O-N 3.01Å; Q87-L90 WeakPolarHBondContact O-CB 3.05Å; Q87-L90 PolarHBondContact O-N 2.9Å; Q87-L90 VanDerWaalsContact O-N 3.09Å
88E97.9Very high96.8Very high93 Ų9361.9 Ų61.944%0.43530%0.301SS..G310 helixtrans-69.7-22.7-177-67.9-56.8135.600112.4D86 L90 N91 N94 Y97D86-E88 PolarHBondContact OD1-N 2.91Å; D86-E88 VanDerWaalsContact OD1-N 3.09Å; E88-L90 PolarHBondContact O-N 3.43Å; E88-N91 PolarHBondContact O-N 3.21Å; E88-N94 PolarHBondContact O-ND2 3.39Å; E88-N94 PolarHBondContact OE2-ND2 2.98Å; E88-Y97 HydrophobicContact CB-CE1 3.87Å; E88-Y97 HydrophobicContact CB-CE2 4.03Å; E88-Y97 WeakPolarHBondContact CB-OH 3.43Å
89M97.4Very high96.7Very high0 Ų062.4 Ų62.40%031%0.305CS..G310 helixtrans-66-21.8174.386.3169.975.600112.8R41 L44 A82 F85 D86 Q87 Y97 T102 F105R41-M89 HydrophobicContact CG-CB 4.26Å; R41-M89 PolarHBondContact NH1-O 3.32Å; L44-M89 HydrophobicContact CD1-SD 4.44Å; A82-M89 HydrophobicContact CB-SD 3.81Å; F85-M89 HydrophobicContact CB-CE 4.16Å; D86-M89 HydrophobicContact CB-CB 4.29Å; D86-M89 HydrophobicContact CB-CE 3.27Å; D86-M89 HydrophobicContact CB-CG 4.32Å; D86-M89 WeakPolarHBondContact O-CG 3.47Å; Q87-M89 PolarHBondContact O-N 3.01Å; M89-Y97 HydrophobicContact CB-CD1 4.35Å; M89-Y97 HydrophobicContact CB-CE1 4.36Å; M89-T102 HydrophobicContact CB-CG2 3.96Å; M89-T102 WeakPolarHBondContact CB-OG1 3.14Å; M89-T102 HydrophobicContact CE-CG2 4.28Å; M89-T102 HydrophobicContact SD-CG2 4.23Å; M89-F105 HydrophobicContact CE-CB 3.89Å; M89-F105 HydrophobicContact CE-CD1 4.07Å; M89-F105 HydrophobicContact CE-CG 4.15Å; M89-F105 HydrophobicContact SD-CD1 3.75Å; M89-F105 HydrophobicContact SD-CE1 4.39Å; M89-F105 HydrophobicContact SD-CG 4.41Å
90L98.2Very high96.6Very high6 Ų667.4 Ų67.43%0.03134%0.341CS..G310 helixtrans-94.1-1.3-176.7-57.7177.8000113L44 A45 H48 S49 A82 K83 Q87 E88 V92L44-L90 HydrophobicContact CB-CD2 3.93Å; A45-L90 WeakPolarHBondContact CA-O 3.46Å; A45-L90 VanDerWaalsContact CB-C 3.5Å; A45-L90 WeakPolarHBondContact CB-O 3.15Å; H48-L90 HydrophobicContact CB-CB 4.41Å; H48-L90 HydrophobicContact CB-CD1 4.47Å; H48-L90 HydrophobicContact CB-CD2 4.17Å; S49-L90 PolarHBondContact OG-O 3.2Å; A82-L90 HydrophobicContact CB-CD1 4.37Å; A82-L90 HydrophobicContact CB-CD2 4.01Å; K83-L90 HydrophobicContact CB-CD1 3.6Å; Q87-L90 WeakPolarHBondContact O-CB 3.05Å; Q87-L90 PolarHBondContact O-N 2.9Å; Q87-L90 VanDerWaalsContact O-N 3.09Å; E88-L90 PolarHBondContact O-N 3.43Å; L90-V92 PolarHBondContact O-N 2.86Å
91N97.6Very high96.6Very high56 Ų5672.2 Ų72.230%0.29936%0.356SS..  trans-78.4120.3172.7-177.5-4.2000110.1E88 H93 N94E88-N91 PolarHBondContact O-N 3.21Å; N91-H93 PolarHBondContact O-N 2.84Å; N91-H93 PolarHBondContact OD1-N 3.14Å; N91-N94 HydrophobicContact CB-CB 4Å; N91-N94 PolarHBondContact ND2-OD1 3.05Å; N91-N94 PolarHBondContact O-N 3.35Å
92V97.1Very high96.6Very high9 Ų968.7 Ų68.76%0.05534%0.335CS..THydrogen-bonded Turntrans-63.4-28.1-178.5179.70000112A45 L50 E58 L90A45-V92 HydrophobicContact CB-CG2 4.08Å; L50-V92 HydrophobicContact CD1-CG2 4.43Å; L50-V92 HydrophobicContact CG-CG2 4.42Å; E58-V92 HydrophobicContact CG-CG1 3.88Å; L90-V92 PolarHBondContact O-N 2.86Å
93H96.6Very high96.6Very high133 Ų13370.3 Ų70.362%0.61634%0.343SS*.THydrogen-bonded Turntrans-85.2-10-180-60.4-66.7000113.9N91 L95N91-H93 PolarHBondContact O-N 2.84Å; N91-H93 PolarHBondContact OD1-N 3.14Å; H93-L95 PolarHBondContact O-N 2.8Å
94N94.9Very high96.6Very high39 Ų3970.3 Ų70.321%0.20935%0.346CS..  trans-8068.8177.5-81-1.7000110.3E88 N91 Y97E88-N94 PolarHBondContact O-ND2 3.39Å; E88-N94 PolarHBondContact OE2-ND2 2.98Å; N91-N94 HydrophobicContact CB-CB 4Å; N91-N94 PolarHBondContact ND2-OD1 3.05Å; N91-N94 PolarHBondContact O-N 3.35Å; N94-Y97 HydrophobicContact CB-CD2 4.44Å; N94-Y97 HydrophobicContact CB-CG 4.19Å; N94-Y97 WeakPolarHBondContact O-CB 3.42Å; N94-Y97 PolarHBondContact O-N 3.39Å
95L94.4Very high96.6Very high79 Ų7962.1 Ų62.141%0.41431%0.314SS..THydrogen-bonded Turntrans-66.3135.9-178.7-57.5-177.8000111.4T60 H93 Y97T60-L95 HydrophobicContact CG2-CD2 4.39Å; H93-L95 PolarHBondContact O-N 2.8Å; L95-Y97 PolarHBondContact O-N 3.48Å
96N93.6Very high96.7Very high121 Ų12158.8 Ų58.865%0.64730%0.299SS*.THydrogen-bonded Turntrans56.724.5-176.8-56.7-64.4000113.6E38 S98E38-N96 VanDerWaalsContact CD-CA 3.43Å; E38-N96 VanDerWaalsContact CD-N 3.25Å; E38-N96 PolarHBondContact OE1-N 3.37Å; E38-N96 WeakPolarHBondContact OE2-CA 3.12Å; E38-N96 PolarHBondContact OE2-N 3.31Å; N96-S98 PolarHBondContact O-N 2.92Å
97Y94.2Very high96.7Very high66 Ų6658.1 Ų58.126%0.25930%0.295SS..  trans-71.5124.3-179.5179.9-94000111.1R41 D86 E88 M89 N94 L95R41-Y97 WeakPolarHBondContact CD-O 3.46Å; D86-Y97 PolarHBondContact OD2-OH 3.33Å; E88-Y97 HydrophobicContact CB-CE1 3.87Å; E88-Y97 HydrophobicContact CB-CE2 4.03Å; E88-Y97 WeakPolarHBondContact CB-OH 3.43Å; M89-Y97 HydrophobicContact CB-CD1 4.35Å; M89-Y97 HydrophobicContact CB-CE1 4.36Å; N94-Y97 HydrophobicContact CB-CD2 4.44Å; N94-Y97 HydrophobicContact CB-CG 4.19Å; N94-Y97 WeakPolarHBondContact O-CB 3.42Å; N94-Y97 PolarHBondContact O-N 3.39Å; L95-Y97 PolarHBondContact O-N 3.48Å
98S92.2Very high96.7Very high63 Ų6355.1 Ų55.144%0.44128%0.28SS..  trans-139.7124.3173.5-173.80000109.7N96N96-S98 PolarHBondContact O-N 2.92Å
99S96.2Very high96.7Very high25 Ų2551 Ų5118%0.17526%0.262CS..  trans-122.2160.9172.2790000109.1D86 R101 T102 L103D86-S99 WeakPolarHBondContact OD2-CB 3.27Å; D86-S99 PolarHBondContact OD2-OG 2.72Å; S99-R101 PolarHBondContact O-N 3.45Å; S99-R101 VanDerWaalsContact O-N 3.15Å; S99-R101 PolarHBondContact OG-N 3.38Å; S99-T102 WeakPolarHBondContact O-CB 3.39Å; S99-T102 PolarHBondContact O-N 3.24Å; S99-T102 PolarHBondContact OG-N 3Å; S99-T102 PolarHBondContact OG-OG1 2.97Å; S99-L103 PolarHBondContact O-N 3.03Å
100S96.9Very high96.8Very high106 Ų10651.1 Ų51.174%0.74126%0.262SS*.Hα-helixtrans-57.8-30.2174.6-50.60000112.5L104S100-L104 VanDerWaalsContact O-CB 3.31Å; S100-L104 WeakPolarHBondContact O-CB 3.02Å; S100-L104 PolarHBondContact O-N 2.71Å
101R97.8Very high96.8Very high169 Ų16951.7 Ų51.764%0.63827%0.265SS*.Hα-helixtrans-74.3-38.6176.7-61.6-172.8-174.9173.5-1.6111.8F85 D86 S99 L104 F105F85-R101 WeakPolarHBondContact O-CD 3.3Å; D86-R101 HydrophobicContact CB-CB 4.13Å; S99-R101 PolarHBondContact O-N 3.45Å; S99-R101 VanDerWaalsContact O-N 3.15Å; S99-R101 PolarHBondContact OG-N 3.38Å; R101-L104 PolarHBondContact O-N 3.22Å; R101-F105 WeakPolarHBondContact O-CB 3.49Å; R101-F105 PolarHBondContact O-N 2.91Å
102T97.7Very high96.8Very high0 Ų055.6 Ų55.60%028%0.28CS..Hα-helixtrans-62.8-46.5173-58.90000111.4F37 R41 D86 M89 S99 L104 F105 Q106F37-T102 HydrophobicContact CE1-CG2 4.07Å; F37-T102 HydrophobicContact CZ-CG2 3.98Å; R41-T102 HydrophobicContact CG-CG2 4.31Å; D86-T102 PolarHBondContact OD2-OG1 3.09Å; M89-T102 HydrophobicContact CB-CG2 3.96Å; M89-T102 WeakPolarHBondContact CB-OG1 3.14Å; M89-T102 HydrophobicContact CE-CG2 4.28Å; M89-T102 HydrophobicContact SD-CG2 4.23Å; S99-T102 WeakPolarHBondContact O-CB 3.39Å; S99-T102 PolarHBondContact O-N 3.24Å; S99-T102 PolarHBondContact OG-N 3Å; S99-T102 PolarHBondContact OG-OG1 2.97Å; T102-L104 PolarHBondContact O-N 3.34Å; T102-F105 PolarHBondContact O-N 3.47Å; T102-Q106 WeakPolarHBondContact O-CB 3.31Å; T102-Q106 PolarHBondContact O-N 3.25Å
103L97.9Very high96.9Very high34 Ų3456.7 Ų56.718%0.17829%0.285CS..Hα-helixtrans-56.3-50.1173.8179.765.9000111.2F37 S99 F105 R107F37-L103 HydrophobicContact CE2-CD1 3.86Å; F37-L103 HydrophobicContact CZ-CB 4.28Å; F37-L103 HydrophobicContact CZ-CD1 4.18Å; S99-L103 PolarHBondContact O-N 3.03Å; L103-F105 PolarHBondContact O-N 3.33Å; L103-R107 HydrophobicContact CD1-CG 3.99Å; L103-R107 HydrophobicContact CG-CG 4.41Å; L103-R107 WeakPolarHBondContact O-CB 3.42Å; L103-R107 WeakPolarHBondContact O-CG 3.4Å; L103-R107 PolarHBondContact O-N 3.45Å
104L97.8Very high96.9Very high65 Ų6550.7 Ų50.734%0.3426%0.257SS..Hα-helixtrans-61.5-46.7-178-168.865.4000112I29 S100 R101 T102 F108I29-L104 HydrophobicContact CD1-CD1 4.46Å; I29-L104 HydrophobicContact CG2-CD1 4.28Å; S100-L104 VanDerWaalsContact O-CB 3.31Å; S100-L104 WeakPolarHBondContact O-CB 3.02Å; S100-L104 PolarHBondContact O-N 2.71Å; R101-L104 PolarHBondContact O-N 3.22Å; T102-L104 PolarHBondContact O-N 3.34Å; L104-F108 HydrophobicContact CD1-CD2 3.79Å; L104-F108 HydrophobicContact CD1-CE2 3.19Å; L104-F108 HydrophobicContact CD1-CZ 3.69Å; L104-F108 HydrophobicContact CD2-CD2 4.47Å; L104-F108 HydrophobicContact CD2-CE2 3.92Å; L104-F108 HydrophobicContact CG-CD2 3.63Å; L104-F108 HydrophobicContact CG-CE2 3.35Å; L104-F108 HydrophobicContact CG-CZ 4.34Å; L104-F108 WeakPolarHBondContact O-CB 3.31Å; L104-F108 WeakPolarHBondContact O-CD2 3.48Å; L104-F108 WeakPolarHBondContact O-CG 3.44Å; L104-F108 PolarHBondContact O-N 3.26Å
105F98.5Very high97Very high7 Ų753.2 Ų53.23%0.03127%0.274CS..Hα-helixtrans-60.2-54178.4174.6-104.9000111.8L44 L78 V81 A82 F85 M89 R101 T102 L103 R107 F108 S109L44-F105 HydrophobicContact CD1-CD1 4.38Å; L44-F105 HydrophobicContact CD1-CE1 3.9Å; L44-F105 HydrophobicContact CD2-CE1 4.49Å; L78-F105 HydrophobicContact CB-CZ 4.33Å; L78-F105 WeakPolarHBondContact O-CZ 3.06Å; V81-F105 HydrophobicContact CB-CE2 4Å; V81-F105 HydrophobicContact CB-CZ 4.45Å; V81-F105 HydrophobicContact CG1-CE2 3.9Å; A82-F105 HydrophobicContact CB-CD1 3.82Å; A82-F105 HydrophobicContact CB-CD2 4.47Å; A82-F105 HydrophobicContact CB-CE1 3.33Å; A82-F105 HydrophobicContact CB-CE2 4.04Å; A82-F105 HydrophobicContact CB-CG 4.38Å; A82-F105 HydrophobicContact CB-CZ 3.46Å; A82-F105 VanDerWaalsContact CB-CZ 3.46Å; F85-F105 HydrophobicContact CB-CB 3.86Å; F85-F105 HydrophobicContact CB-CD2 4.25Å; F85-F105 HydrophobicContact CB-CG 4.25Å; F85-F105 HydrophobicContact CD1-CB 3.78Å; F85-F105 HydrophobicContact CD1-CD2 4.22Å; F85-F105 HydrophobicContact CD1-CG 4.48Å; F85-F105 HydrophobicContact CD2-CB 4.43Å; F85-F105 AromaticContact CD2-CD2 3.5Å; F85-F105 HydrophobicContact CD2-CD2 3.5Å; F85-F105 VanDerWaalsContact CD2-CD2 3.5Å; F85-F105 HydrophobicContact CD2-CE2 4.22Å; F85-F105 HydrophobicContact CD2-CG 4.31Å; F85-F105 HydrophobicContact CE1-CB 4.43Å; F85-F105 HydrophobicContact CE1-CD2 4.48Å; F85-F105 AromaticContact CE2-CD2 3.8Å; F85-F105 HydrophobicContact CE2-CD2 3.8Å; F85-F105 HydrophobicContact CE2-CE2 4.4Å; F85-F105 HydrophobicContact CG-CB 3.78Å; F85-F105 AromaticContact CG-CD2 3.73Å; F85-F105 HydrophobicContact CG-CD2 3.73Å; F85-F105 HydrophobicContact CG-CG 4.11Å; F85-F105 HydrophobicContact CZ-CD2 4.28Å; M89-F105 HydrophobicContact CE-CB 3.89Å; M89-F105 HydrophobicContact CE-CD1 4.07Å; M89-F105 HydrophobicContact CE-CG 4.15Å; M89-F105 HydrophobicContact SD-CD1 3.75Å; M89-F105 HydrophobicContact SD-CE1 4.39Å; M89-F105 HydrophobicContact SD-CG 4.41Å; R101-F105 WeakPolarHBondContact O-CB 3.49Å; R101-F105 PolarHBondContact O-N 2.91Å; T102-F105 PolarHBondContact O-N 3.47Å; L103-F105 PolarHBondContact O-N 3.33Å; F105-R107 VanDerWaalsContact C-N 3.33Å; F105-R107 PolarHBondContact O-N 2.83Å; F105-F108 PolarHBondContact O-N 2.92Å; F105-S109 PolarHBondContact O-N 2.88Å; F105-S109 PolarHBondContact O-OG 3.29Å
106Q98.4Very high97.2Very high0 Ų051.6 Ų51.60%027%0.265CS..Hα-helixtrans-63-38.6-177-77.4-156.576.600111.9F37 L44 T102 S109 V110 F163F37-Q106 HydrophobicContact CD2-CB 4.36Å; F37-Q106 VanDerWaalsContact CE1-NE2 3.25Å; F37-Q106 HydrophobicContact CE2-CB 3.64Å; F37-Q106 HydrophobicContact CE2-CG 4.16Å; F37-Q106 HydrophobicContact CZ-CB 4.2Å; F37-Q106 HydrophobicContact CZ-CG 4.34Å; F37-Q106 PolarHBondContact O-NE2 2.97Å; F37-Q106 PolarHBondContact O-OE1 2.92Å; L44-Q106 HydrophobicContact CD1-CG 4.34Å; T102-Q106 WeakPolarHBondContact O-CB 3.31Å; T102-Q106 PolarHBondContact O-N 3.25Å; Q106-S109 WeakPolarHBondContact CA-OG 3.43Å; Q106-S109 PolarHBondContact O-OG 2.92Å; Q106-V110 WeakPolarHBondContact O-CG2 3.45Å; Q106-V110 PolarHBondContact O-N 3.42Å; Q106-F163 HydrophobicContact CB-CE2 3.64Å; Q106-F163 HydrophobicContact CB-CZ 3.61Å; Q106-F163 HydrophobicContact CG-CZ 4.17Å; Q106-F163 WeakPolarHBondContact O-CE2 2.97Å; Q106-F163 VanDerWaalsContact OE1-CE1 3.24Å
107R98.1Very high97.5Very high3 Ų346.1 Ų46.11%0.01124%0.236CC..Hα-helixtrans-66.8-43.1174.4-67.3-69-165.4-162.54.3111.6I29 T31 Y32 L103 F105 V110 I111 H160 I161I29-R107 HydrophobicContact CG1-CB 4.06Å; I29-R107 HydrophobicContact CG2-CB 4.42Å; I29-R107 HydrophobicContact CG2-CG 4.32Å; T31-R107 PolarHBondContact O-NH2 3.33Å; T31-R107 VanDerWaalsContact O-NH2 3.08Å; Y32-R107 PolarHBondContact O-NH2 3.14Å; L103-R107 HydrophobicContact CD1-CG 3.99Å; L103-R107 HydrophobicContact CG-CG 4.41Å; L103-R107 WeakPolarHBondContact O-CB 3.42Å; L103-R107 WeakPolarHBondContact O-CG 3.4Å; L103-R107 PolarHBondContact O-N 3.45Å; F105-R107 VanDerWaalsContact C-N 3.33Å; F105-R107 PolarHBondContact O-N 2.83Å; R107-V110 PolarHBondContact O-N 3.25Å; R107-I111 WeakPolarHBondContact O-CG1 3.06Å; R107-I111 PolarHBondContact O-N 3.2Å; R107-I111 VanDerWaalsContact O-N 3.09Å; R107-H160 VanDerWaalsContact NH1-C 3.27Å; R107-H160 PolarHBondContact NH1-O 3.35Å; R107-H160 VanDerWaalsContact NH1-O 3.12Å; R107-I161 PolarHBondContact NH1-O 3.06Å; R107-I161 PolarHBondContact NH2-O 3.05Å
108F98.1Very high97.7Very high84 Ų8444.2 Ų44.237%0.36823%0.231SC..Hα-helixtrans-67.8-34178.1-77.9-42.5000113.5I29 F85 L104 F105 I111 F112I29-F108 HydrophobicContact CD1-CD1 4.37Å; I29-F108 HydrophobicContact CD1-CE1 3.77Å; I29-F108 HydrophobicContact CD1-CZ 4.1Å; F85-F108 HydrophobicContact CE1-CD2 4.48Å; L104-F108 HydrophobicContact CD1-CD2 3.79Å; L104-F108 HydrophobicContact CD1-CE2 3.19Å; L104-F108 HydrophobicContact CD1-CZ 3.69Å; L104-F108 HydrophobicContact CD2-CD2 4.47Å; L104-F108 HydrophobicContact CD2-CE2 3.92Å; L104-F108 HydrophobicContact CG-CD2 3.63Å; L104-F108 HydrophobicContact CG-CE2 3.35Å; L104-F108 HydrophobicContact CG-CZ 4.34Å; L104-F108 WeakPolarHBondContact O-CB 3.31Å; L104-F108 WeakPolarHBondContact O-CD2 3.48Å; L104-F108 WeakPolarHBondContact O-CG 3.44Å; L104-F108 PolarHBondContact O-N 3.26Å; F105-F108 PolarHBondContact O-N 2.92Å; F108-I111 HydrophobicContact CD1-CD1 4.38Å; F108-I111 PolarHBondContact O-N 3.24Å; F108-F112 WeakPolarHBondContact O-CB 3.36Å; F108-F112 PolarHBondContact O-N 3.27Å
109S98.3Very high98Very high7 Ų745.9 Ų45.95%0.04923%0.228CC..Hα-helixtrans-63.5-42.1175.759.20000111.1F105 Q106 F112 M113 Y165F105-S109 PolarHBondContact O-N 2.88Å; F105-S109 PolarHBondContact O-OG 3.29Å; Q106-S109 WeakPolarHBondContact CA-OG 3.43Å; Q106-S109 PolarHBondContact O-OG 2.92Å; S109-F112 PolarHBondContact O-N 3.43Å; S109-M113 WeakPolarHBondContact O-CB 3.36Å; S109-M113 VanDerWaalsContact O-CG 3.3Å; S109-M113 WeakPolarHBondContact O-CG 3.47Å; S109-M113 PolarHBondContact O-N 3.35Å; S109-Y165 PolarHBondContact OG-OH 3.03Å
110V98.3Very high98.1Very high1 Ų144.7 Ų44.71%0.00622%0.22CC..Hα-helixtrans-62.2-48.7174.3179.40000110.9Q106 R107 F112 M113 D114 D159 F163 Q164 Y165Q106-V110 WeakPolarHBondContact O-CG2 3.45Å; Q106-V110 PolarHBondContact O-N 3.42Å; R107-V110 PolarHBondContact O-N 3.25Å; V110-F112 VanDerWaalsContact C-N 3.32Å; V110-F112 PolarHBondContact O-N 2.9Å; V110-M113 PolarHBondContact O-N 3.22Å; V110-D114 PolarHBondContact O-N 2.88Å; V110-D159 HydrophobicContact CG1-CB 4Å; V110-F163 HydrophobicContact CG2-CD2 4.45Å; V110-F163 HydrophobicContact CG2-CE2 3.72Å; V110-F163 HydrophobicContact CG2-CZ 4Å; V110-Q164 WeakPolarHBondContact CG1-O 3.21Å; V110-Y165 HydrophobicContact CB-CD1 4.41Å; V110-Y165 HydrophobicContact CB-CE1 4.31Å; V110-Y165 HydrophobicContact CG2-CD1 3.79Å; V110-Y165 HydrophobicContact CG2-CD2 4.38Å; V110-Y165 HydrophobicContact CG2-CE1 3.57Å; V110-Y165 HydrophobicContact CG2-CE2 4.21Å; V110-Y165 HydrophobicContact CG2-CG 4.2Å
111I98.4Very high98.1Very high18 Ų1839.7 Ų39.79%0.09219%0.185CC..Hα-helixtrans-60.5-40.8177.9-67.2169.6000111.8T22 K25 I29 R107 F108 D114T22-I111 HydrophobicContact CG2-CG2 3.95Å; K25-I111 HydrophobicContact CB-CD1 3.95Å; K25-I111 HydrophobicContact CB-CG1 3.94Å; I29-I111 HydrophobicContact CG1-CD1 4.47Å; R107-I111 WeakPolarHBondContact O-CG1 3.06Å; R107-I111 PolarHBondContact O-N 3.2Å; R107-I111 VanDerWaalsContact O-N 3.09Å; F108-I111 HydrophobicContact CD1-CD1 4.38Å; F108-I111 PolarHBondContact O-N 3.24Å; I111-D114 WeakPolarHBondContact O-CB 3.49Å; I111-D114 PolarHBondContact O-N 3.33Å
112F98.1Very high98.1Very high139 Ų13937.9 Ų37.961%0.6118%0.178SC*.Hα-helixtrans-66.7-41.8178.3178.6-118.6000111.2F108 S109 V110 D114 V115F108-F112 WeakPolarHBondContact O-CB 3.36Å; F108-F112 PolarHBondContact O-N 3.27Å; S109-F112 PolarHBondContact O-N 3.43Å; V110-F112 VanDerWaalsContact C-N 3.32Å; V110-F112 PolarHBondContact O-N 2.9Å; F112-D114 VanDerWaalsContact C-N 3.26Å; F112-D114 PolarHBondContact O-N 3.42Å; F112-V115 WeakPolarHBondContact O-CB 3.1Å; F112-V115 VanDerWaalsContact O-CG2 3.24Å; F112-V115 WeakPolarHBondContact O-CG2 3.15Å; F112-V115 PolarHBondContact O-N 3.44Å; F112-V115 VanDerWaalsContact O-N 3.16Å
113M97.7Very high98.1Very high32 Ų3238.1 Ų38.116%0.15818%0.179CC..Hα-helixtrans-67.2-26.2177.3-71-57.191.700113.5F74 S109 V110 V115 L116 Y165 F168F74-M113 HydrophobicContact CE2-CG 3.8Å; F74-M113 HydrophobicContact CE2-SD 3.58Å; F74-M113 VanDerWaalsContact CE2-SD 3.58Å; F74-M113 HydrophobicContact CZ-CG 3.8Å; F74-M113 HydrophobicContact CZ-SD 4.21Å; S109-M113 WeakPolarHBondContact O-CB 3.36Å; S109-M113 VanDerWaalsContact O-CG 3.3Å; S109-M113 WeakPolarHBondContact O-CG 3.47Å; S109-M113 PolarHBondContact O-N 3.35Å; V110-M113 PolarHBondContact O-N 3.22Å; M113-V115 PolarHBondContact O-N 3.18Å; M113-V115 VanDerWaalsContact O-N 3.11Å; M113-L116 WeakPolarHBondContact O-CB 3.5Å; M113-L116 PolarHBondContact O-N 3.01Å; M113-L116 VanDerWaalsContact O-N 3.09Å; M113-Y165 HydrophobicContact CG-CD1 4.35Å; M113-Y165 HydrophobicContact CG-CE1 4.46Å; M113-F168 HydrophobicContact CB-CB 3.9Å; M113-F168 HydrophobicContact CB-CD2 4.18Å; M113-F168 HydrophobicContact CB-CG 4.13Å; M113-F168 HydrophobicContact SD-CD2 4.26Å; M113-F168 HydrophobicContact SD-CE2 4.36Å
114D97.5Very high98.1Very high6 Ų636.7 Ų36.73%0.03217%0.172CC..Hα-helixtrans-63.2-13173.3-81.1-19.8000113.9K25 V110 I111 F112 L116 F117 V118 H160K25-D114 WeakPolarHBondContact CE-OD2 3.45Å; K25-D114 IonicContact NZ-OD2 2.7Å; K25-D114 PolarHBondContact NZ-OD2 3.22Å; V110-D114 PolarHBondContact O-N 2.88Å; I111-D114 WeakPolarHBondContact O-CB 3.49Å; I111-D114 PolarHBondContact O-N 3.33Å; F112-D114 VanDerWaalsContact C-N 3.26Å; F112-D114 PolarHBondContact O-N 3.42Å; D114-L116 PolarHBondContact O-N 3.38Å; D114-F117 WeakPolarHBondContact O-CA 3.02Å; D114-F117 WeakPolarHBondContact O-CB 3.36Å; D114-F117 PolarHBondContact O-N 2.7Å; D114-V118 WeakPolarHBondContact O-CG2 3.48Å; D114-V118 PolarHBondContact O-N 3.28Å; D114-H160 IonicContact OD2-CE1 3.84Å; D114-H160 PolarHBondContact OD2-CE1 2.97Å; D114-H160 VanDerWaalsContact OD2-CE1 3.24Å; D114-H160 IonicContact OD2-NE2 3.31Å; D114-H160 PolarHBondContact OD2-NE2 3.2Å
115V97.9Very high98Very high92 Ų9234 Ų3456%0.55816%0.159SC*.Hα-helixtrans-57.2-37.2170.2173.70000111F112 M113 V118 Y119F112-V115 WeakPolarHBondContact O-CB 3.1Å; F112-V115 VanDerWaalsContact O-CG2 3.24Å; F112-V115 WeakPolarHBondContact O-CG2 3.15Å; F112-V115 PolarHBondContact O-N 3.44Å; F112-V115 VanDerWaalsContact O-N 3.16Å; M113-V115 PolarHBondContact O-N 3.18Å; M113-V115 VanDerWaalsContact O-N 3.11Å; V115-V118 PolarHBondContact O-N 2.89Å; V115-Y119 PolarHBondContact O-N 3.31Å
116L98.3Very high97.7Very high46 Ų4639.3 Ų39.324%0.24118%0.182CC..Hα-helixtrans-64.5-41.4174.2-179.663.8000111.4M113 D114 Y119 A120 F168 L172 L175M113-L116 WeakPolarHBondContact O-CB 3.5Å; M113-L116 PolarHBondContact O-N 3.01Å; M113-L116 VanDerWaalsContact O-N 3.09Å; D114-L116 PolarHBondContact O-N 3.38Å; L116-Y119 PolarHBondContact O-N 2.91Å; L116-A120 WeakPolarHBondContact O-CB 3.5Å; L116-A120 PolarHBondContact O-N 2.99Å; L116-F168 HydrophobicContact CB-CD2 4.43Å; L116-F168 HydrophobicContact CD2-CD2 3.62Å; L116-F168 HydrophobicContact CD2-CE2 3.51Å; L116-L172 HydrophobicContact CD2-CD2 3.69Å; L116-L172 HydrophobicContact CD2-CG 3.72Å; L116-L175 HydrophobicContact CD1-CD2 4.27Å
117F98.6Very high97.5Very high5 Ų541 Ų412%0.02219%0.193CC..Hα-helixtrans-61.6-46.6175.3-174.9-104.9000111.3D114 Y119 A120 V121 L149 L150 L155 G167 F170 L174D114-F117 WeakPolarHBondContact O-CA 3.02Å; D114-F117 WeakPolarHBondContact O-CB 3.36Å; D114-F117 PolarHBondContact O-N 2.7Å; F117-Y119 VanDerWaalsContact C-N 3.31Å; F117-Y119 PolarHBondContact O-N 3.39Å; F117-A120 WeakPolarHBondContact O-CB 3.47Å; F117-A120 PolarHBondContact O-N 3.3Å; F117-A120 VanDerWaalsContact O-N 3.15Å; F117-V121 HydrophobicContact CD1-CG2 4.19Å; F117-V121 HydrophobicContact CE1-CG2 3.87Å; F117-V121 HydrophobicContact CE2-CG2 4.46Å; F117-V121 HydrophobicContact CZ-CG2 4.01Å; F117-V121 WeakPolarHBondContact O-CG2 3.35Å; F117-V121 PolarHBondContact O-N 3Å; F117-L149 WeakPolarHBondContact CE1-O 3.49Å; F117-L149 HydrophobicContact CZ-CB 4.38Å; F117-L150 HydrophobicContact CD1-CD2 4.32Å; F117-L150 HydrophobicContact CE1-CD2 4.35Å; F117-L155 HydrophobicContact CE1-CD1 4Å; F117-L155 HydrophobicContact CE2-CD1 3.82Å; F117-L155 HydrophobicContact CZ-CD1 3.41Å; F117-L155 VanDerWaalsContact CZ-CD1 3.41Å; F117-G167 WeakPolarHBondContact CB-O 3.34Å; F117-G167 VanDerWaalsContact CD2-O 3.24Å; F117-G167 WeakPolarHBondContact CD2-O 3.4Å; F117-F170 HydrophobicContact CD2-CB 4.31Å; F117-F170 HydrophobicContact CE2-CB 4.13Å; F117-L174 HydrophobicContact CD2-CD1 4.25Å; F117-L174 HydrophobicContact CE2-CD1 3.54Å; F117-L174 HydrophobicContact CZ-CD1 4.15Å
118V98.5Very high97.1Very high27 Ų2742 Ų4216%0.16420%0.198CC..Hα-helixtrans-57.3-44.9175.9173.80000111.2F14 A18 D114 V115 V121 R122 L150F14-V118 HydrophobicContact CE1-CG1 3.86Å; F14-V118 HydrophobicContact CZ-CG1 4.31Å; A18-V118 HydrophobicContact CB-CG1 3.76Å; A18-V118 HydrophobicContact CB-CG2 4.34Å; D114-V118 WeakPolarHBondContact O-CG2 3.48Å; D114-V118 PolarHBondContact O-N 3.28Å; V115-V118 PolarHBondContact O-N 2.89Å; V118-V121 PolarHBondContact O-N 3.29Å; V118-R122 PolarHBondContact O-N 3.18Å; V118-R122 VanDerWaalsContact O-N 3.08Å; V118-L150 HydrophobicContact CB-CD2 4.35Å; V118-L150 HydrophobicContact CG2-CD2 3.92Å
119Y98.3Very high96.2Very high98 Ų9842.7 Ų42.738%0.38421%0.206SC..Hα-helixtrans-62.4-45175.7176-108.7000112.2V115 L116 F117 V121 R122 E123 L175 R179V115-Y119 PolarHBondContact O-N 3.31Å; L116-Y119 PolarHBondContact O-N 2.91Å; F117-Y119 VanDerWaalsContact C-N 3.31Å; F117-Y119 PolarHBondContact O-N 3.39Å; Y119-V121 PolarHBondContact O-N 2.95Å; Y119-R122 WeakPolarHBondContact O-CB 3.45Å; Y119-R122 PolarHBondContact O-N 2.91Å; Y119-E123 HydrophobicContact CD1-CG 4.49Å; Y119-E123 HydrophobicContact CE1-CG 3.98Å; Y119-E123 HydrophobicContact CE2-CG 4Å; Y119-E123 PolarHBondContact O-N 3.42Å; Y119-L175 HydrophobicContact CD1-CD1 4.02Å; Y119-L175 HydrophobicContact CD1-CD2 4.16Å; Y119-L175 HydrophobicContact CE1-CD1 3.61Å; Y119-L175 HydrophobicContact CE1-CD2 3.99Å; Y119-L175 HydrophobicContact CE1-CG 4.47Å; Y119-R179 PolarHBondContact OH-NH2 3.23Å
120A98.7Very high94.7Very high0 Ų045.2 Ų45.20%023%0.233CC..Hα-helixtrans-59.9-43.6177.400000112.2L116 F117 R122 E123 C124 G171 L174 L175L116-A120 WeakPolarHBondContact O-CB 3.5Å; L116-A120 PolarHBondContact O-N 2.99Å; F117-A120 WeakPolarHBondContact O-CB 3.47Å; F117-A120 PolarHBondContact O-N 3.3Å; F117-A120 VanDerWaalsContact O-N 3.15Å; A120-R122 VanDerWaalsContact C-N 3.33Å; A120-R122 PolarHBondContact O-N 2.71Å; A120-E123 PolarHBondContact O-N 3.06Å; A120-C124 PolarHBondContact O-N 3.01Å; A120-C124 PolarHBondContact O-SG 3.19Å; A120-C124 VanDerWaalsContact O-SG 3.42Å; A120-G171 WeakPolarHBondContact CB-O 3.2Å; A120-L174 HydrophobicContact CB-CB 3.98Å; A120-L175 HydrophobicContact CB-CB 3.88Å
121V98.4Very high92.9Very high0 Ų054.1 Ų54.10%027%0.272CS..Hα-helixtrans-60.4-43.4175.1176.40000111F14 F117 V118 Y119 E123 C124 C125 L149 L150 L174F14-V121 HydrophobicContact CE2-CG1 4.03Å; F14-V121 HydrophobicContact CZ-CB 4.38Å; F14-V121 HydrophobicContact CZ-CG1 4.23Å; F117-V121 HydrophobicContact CD1-CG2 4.19Å; F117-V121 HydrophobicContact CE1-CG2 3.87Å; F117-V121 HydrophobicContact CE2-CG2 4.46Å; F117-V121 HydrophobicContact CZ-CG2 4.01Å; F117-V121 WeakPolarHBondContact O-CG2 3.35Å; F117-V121 PolarHBondContact O-N 3Å; V118-V121 PolarHBondContact O-N 3.29Å; Y119-V121 PolarHBondContact O-N 2.95Å; V121-E123 VanDerWaalsContact C-N 3.31Å; V121-E123 PolarHBondContact O-N 2.98Å; V121-C124 WeakPolarHBondContact O-CB 3.37Å; V121-C124 PolarHBondContact O-N 3.12Å; V121-C125 PolarHBondContact O-N 3.11Å; V121-C125 PolarHBondContact O-SG 3.2Å; V121-L149 HydrophobicContact CG1-CB 4.07Å; V121-L149 HydrophobicContact CG1-CD1 4.05Å; V121-L149 HydrophobicContact CG2-CB 3.71Å; V121-L149 HydrophobicContact CG2-CD1 4Å; V121-L149 HydrophobicContact CG2-CG 4.46Å; V121-L150 HydrophobicContact CB-CD2 4.05Å; V121-L150 HydrophobicContact CB-CG 4.46Å; V121-L150 HydrophobicContact CG1-CD2 4.24Å; V121-L150 HydrophobicContact CG1-CG 4.1Å; V121-L150 HydrophobicContact CG2-CD2 3.91Å; V121-L150 HydrophobicContact CG2-CG 4.46Å; V121-L174 HydrophobicContact CG2-CD1 4.38Å
122R97.1Very high91.2Very high132 Ų13256.8 Ų56.850%0.49828%0.283SS..Hα-helixtrans-58.8-43175.8-171.1177.6179.6-178.4-0.6111.8F14 V118 Y119 A120 C125 K126F14-R122 HydrophobicContact CE1-CB 3.79Å; F14-R122 HydrophobicContact CE1-CG 4.2Å; F14-R122 HydrophobicContact CE2-CB 4.31Å; F14-R122 HydrophobicContact CZ-CB 3.64Å; F14-R122 HydrophobicContact CZ-CG 4.35Å; V118-R122 PolarHBondContact O-N 3.18Å; V118-R122 VanDerWaalsContact O-N 3.08Å; Y119-R122 WeakPolarHBondContact O-CB 3.45Å; Y119-R122 PolarHBondContact O-N 2.91Å; A120-R122 VanDerWaalsContact C-N 3.33Å; A120-R122 PolarHBondContact O-N 2.71Å; R122-C125 PolarHBondContact O-N 2.93Å; R122-K126 PolarHBondContact O-N 3.19Å
123E97.7Very high89.3Confident5 Ų556.3 Ų56.32%0.02329%0.291CS..Hα-helixtrans-67-39.1177.1-69.9-60.1123.800112.5Y119 A120 V121 K126 C127 L175 A178 R179 Q182Y119-E123 HydrophobicContact CD1-CG 4.49Å; Y119-E123 HydrophobicContact CE1-CG 3.98Å; Y119-E123 HydrophobicContact CE2-CG 4Å; Y119-E123 PolarHBondContact O-N 3.42Å; A120-E123 PolarHBondContact O-N 3.06Å; V121-E123 VanDerWaalsContact C-N 3.31Å; V121-E123 PolarHBondContact O-N 2.98Å; E123-K126 WeakPolarHBondContact O-CB 3.21Å; E123-K126 PolarHBondContact O-N 3.44Å; E123-K126 WeakPolarHBondContact OE1-CE 3.33Å; E123-K126 IonicContact OE1-NZ 3.77Å; E123-K126 PolarHBondContact OE1-NZ 3.42Å; E123-K126 IonicContact OE2-NZ 2.63Å; E123-C127 PolarHBondContact O-SG 3.26Å; E123-L175 HydrophobicContact CB-CD1 4.02Å; E123-L175 HydrophobicContact CG-CD1 3.84Å; E123-A178 HydrophobicContact CB-CB 3.88Å; E123-R179 IonicContact OE2-CZ 3.91Å; E123-R179 IonicContact OE2-NH1 2.92Å; E123-R179 PolarHBondContact OE2-NH1 3.37Å; E123-Q182 PolarHBondContact OE2-NE2 3.3Å
124C97.7Very high87.6Confident4 Ų455.6 Ų55.63%0.02729%0.291CS..Hα-helixtrans-60.2-43.5171.2-76.30000112.1A120 V121 K126 C127 L145 L174 L394A120-C124 PolarHBondContact O-N 3.01Å; A120-C124 PolarHBondContact O-SG 3.19Å; A120-C124 VanDerWaalsContact O-SG 3.42Å; V121-C124 WeakPolarHBondContact O-CB 3.37Å; V121-C124 PolarHBondContact O-N 3.12Å; C124-K126 PolarHBondContact O-N 3.43Å; C124-C127 WeakPolarHBondContact O-CA 3.37Å; C124-C127 VanDerWaalsContact O-CB 3.27Å; C124-C127 WeakPolarHBondContact O-CB 3.33Å; C124-C127 PolarHBondContact O-N 2.92Å; C124-L145 HydrophobicContact CB-CD2 4.36Å; C124-L174 PolarHBondContact SG-O 3.37Å; C124-L394 HydrophobicContact CB-CD2 3.54Å
125C95.2Very high86.5Confident9 Ų964.6 Ų64.66%0.06133%0.33CS..Hα-helixtrans-63-27.1177.5-690000113.3V121 R122 C127 I128 K142 S146V121-C125 PolarHBondContact O-N 3.11Å; V121-C125 PolarHBondContact O-SG 3.2Å; R122-C125 PolarHBondContact O-N 2.93Å; C125-C127 PolarHBondContact O-N 3.37Å; C125-I128 PolarHBondContact O-N 2.79Å; C125-K142 WeakPolarHBondContact O-CD 3.26Å; C125-K142 WeakPolarHBondContact O-CE 3.38Å; C125-S146 PolarHBondContact SG-OG 2.99Å
126K93.7Very high85.9Confident117 Ų11766.1 Ų66.151%0.50933%0.331SS..Hα-helixtrans-67.5-24.2172-67175.4-179.2175.30112.4R122 E123 C124 I128R122-K126 PolarHBondContact O-N 3.19Å; E123-K126 WeakPolarHBondContact O-CB 3.21Å; E123-K126 PolarHBondContact O-N 3.44Å; E123-K126 WeakPolarHBondContact OE1-CE 3.33Å; E123-K126 IonicContact OE1-NZ 3.77Å; E123-K126 PolarHBondContact OE1-NZ 3.42Å; E123-K126 IonicContact OE2-NZ 2.63Å; C124-K126 PolarHBondContact O-N 3.43Å; K126-I128 VanDerWaalsContact C-N 3.34Å
127C93Very high85.3Confident35 Ų3567 Ų6724%0.23634%0.336CS..THydrogen-bonded Turntrans-83.9-6.2-179.7-54.30000113.5E123 C124 C125 F181E123-C127 PolarHBondContact O-SG 3.26Å; C124-C127 WeakPolarHBondContact O-CA 3.37Å; C124-C127 VanDerWaalsContact O-CB 3.27Å; C124-C127 WeakPolarHBondContact O-CB 3.33Å; C124-C127 PolarHBondContact O-N 2.92Å; C125-C127 PolarHBondContact O-N 3.37Å; C127-F181 HydrophobicContact CB-CB 3.9Å; C127-F181 HydrophobicContact CB-CD1 4.05Å; C127-F181 HydrophobicContact CB-CG 4.25Å
128I89.9Confident84.8Confident25 Ų2570.1 Ų70.113%0.12836%0.356CS..SBendtrans-92.1131.3177.1-62.4166.1000111C125 K126 G130 P141 K142 L145 V397C125-I128 PolarHBondContact O-N 2.79Å; K126-I128 VanDerWaalsContact C-N 3.34Å; I128-G130 PolarHBondContact O-N 2.91Å; I128-P141 HydrophobicContact CG2-CB 3.81Å; I128-K142 HydrophobicContact CB-CG 4.28Å; I128-K142 HydrophobicContact CG2-CG 4.48Å; I128-K142 WeakPolarHBondContact O-CE 3.26Å; I128-L145 HydrophobicContact CD1-CB 3.8Å; I128-L145 HydrophobicContact CD1-CD2 3.24Å; I128-L145 HydrophobicContact CD1-CG 4.03Å; I128-L145 HydrophobicContact CG1-CD2 4.33Å; I128-V397 HydrophobicContact CD1-CG2 3.66Å; I128-V397 HydrophobicContact CG1-CG2 4.26Å
129D78.1Confident84.3Confident99 Ų9970.2 Ų70.253%0.52935%0.354SS..  trans-61.8121.5171.9-61-50.4000111.3K131 R360D129-K131 PolarHBondContact O-N 3.06Å; D129-R360 IonicContact OD2-NH2 2.92Å; D129-R360 PolarHBondContact OD2-NH2 3.31Å
130G67.6Low84Confident60 Ų6070.1 Ų70.162%0.61936%0.356SS*.THydrogen-bonded Turntrans-76.86.2177.100000115I128 K132I128-G130 PolarHBondContact O-N 2.91Å; G130-K132 VanDerWaalsContact C-N 3.32Å; G130-K132 PolarHBondContact O-N 2.95Å
131K60.2Low83.8Confident188 Ų18870.4 Ų70.482%0.81736%0.357SS*.THydrogen-bonded Turntrans-73.6-13.2-169.3-67.9-172.8178.5-177.30114.9D129 V133D129-K131 PolarHBondContact O-N 3.06Å; K131-V133 PolarHBondContact O-N 2.67Å
132K63Low83.5Confident73 Ų7373.9 Ų73.932%0.31737%0.373SS..SBendtrans-76.4110.6175-71.5-175.5-178173.20109.3G130 G134 P141 V397 G398 L448G130-K132 VanDerWaalsContact C-N 3.32Å; G130-K132 PolarHBondContact O-N 2.95Å; K132-G134 VanDerWaalsContact C-N 3.33Å; K132-G134 PolarHBondContact O-N 2.93Å; K132-P141 HydrophobicContact CB-CG 3.92Å; K132-P141 HydrophobicContact CD-CG 4.21Å; K132-V397 PolarHBondContact NZ-O 2.97Å; K132-G398 PolarHBondContact NZ-O 3.07Å; K132-L448 HydrophobicContact CB-CD1 4.5Å; K132-L448 HydrophobicContact CD-CD1 3.94Å
133V59.2Low83.4Confident130 Ų13068.8 Ų68.879%0.78835%0.354SS*.  trans-76.178.5-176.1-1720000110.2K131K131-V133 PolarHBondContact O-N 2.67Å
134G61.9Low83.4Confident16 Ų1668.6 Ų68.617%0.16535%0.353CS..  trans-75.3133.2153.900000108.5K132 E139K132-G134 VanDerWaalsContact C-N 3.33Å; K132-G134 PolarHBondContact O-N 2.93Å; G134-E139 WeakPolarHBondContact CA-OE2 3.44Å
135K74Confident83.3Confident196 Ų19668.4 Ų68.485%0.85235%0.352SS*.SBendtrans-71.5-40177.5-74.4-174.2178.5-177.80109.9E139K135-E139 PolarHBondContact N-OE2 2.96Å; K135-E139 VanDerWaalsContact N-OE2 3.1Å
136E85.6Confident83.5Confident123 Ų12368 Ų6858%0.57535%0.349SS*.SBendtrans-91.9154.5-179.4-61.7-180-178.900111.8T138 E139E136-T138 VanDerWaalsContact C-N 3.29Å; E136-T138 PolarHBondContact O-N 3.33Å; E136-T138 PolarHBondContact OE2-OG1 3.02Å; E136-E139 HydrophobicContact CB-CG 4.24Å; E136-E139 PolarHBondContact O-N 3.1Å
137L85.7Confident83.7Confident66 Ų6663.1 Ų63.135%0.34633%0.329SS..G310 helixtrans-60.4-40.2177.1175.362.1000112W13 E139 K140 F143W13-L137 HydrophobicContact CB-CD2 3.66Å; W13-L137 HydrophobicContact CD2-CD1 4.21Å; W13-L137 HydrophobicContact CD2-CD2 4.43Å; W13-L137 HydrophobicContact CG-CD1 4.19Å; W13-L137 HydrophobicContact CG-CD2 3.76Å; L137-E139 PolarHBondContact O-N 3.2Å; L137-K140 HydrophobicContact CD1-CD 4.24Å; L137-K140 WeakPolarHBondContact O-CB 3.37Å; L137-K140 PolarHBondContact O-N 3.19Å; L137-K140 VanDerWaalsContact O-N 3.08Å; L137-F143 HydrophobicContact CD1-CB 4.47Å; L137-F143 HydrophobicContact CD1-CD2 4.15Å; L137-F143 HydrophobicContact CD2-CD2 4.14Å; L137-F143 HydrophobicContact CD2-CE2 4.25Å; L137-F143 HydrophobicContact CG-CD2 3.75Å; L137-F143 HydrophobicContact CG-CE2 4.24Å; L137-F143 HydrophobicContact CG-CG 4.35Å; L137-F143 WeakPolarHBondContact O-CB 3.33Å
138T87.4Confident83.9Confident70 Ų7061.5 Ų61.543%0.42932%0.318SS..G310 helixtrans-63.3-25.6-179.547.60000113.1E136 F143 I144E136-T138 VanDerWaalsContact C-N 3.29Å; E136-T138 PolarHBondContact O-N 3.33Å; E136-T138 PolarHBondContact OE2-OG1 3.02Å; T138-F143 HydrophobicContact CG2-CE1 4.08Å; T138-F143 HydrophobicContact CG2-CZ 4.3Å; T138-I144 WeakPolarHBondContact O-CG1 3.4Å
139E88.5Confident84.3Confident28 Ų2860.3 Ų60.313%0.13131%0.312CS..G310 helixtrans-84.6-9.8176.4-63.5-172.5143.700113.1G134 K135 E136 L137 T447 R450G134-E139 WeakPolarHBondContact CA-OE2 3.44Å; K135-E139 PolarHBondContact N-OE2 2.96Å; K135-E139 VanDerWaalsContact N-OE2 3.1Å; E136-E139 HydrophobicContact CB-CG 4.24Å; E136-E139 PolarHBondContact O-N 3.1Å; L137-E139 PolarHBondContact O-N 3.2Å; E139-T447 HydrophobicContact CG-CG2 3.81Å; E139-T447 WeakPolarHBondContact OE1-CG2 3.46Å; E139-R450 IonicContact OE1-CZ 2.68Å; E139-R450 IonicContact OE1-NH1 2.72Å; E139-R450 PolarHBondContact OE1-NH1 2.97Å; E139-R450 IonicContact OE1-NH2 3.99Å; E139-R450 IonicContact OE2-NH2 2.72Å
140K91.6Very high85.3Confident97 Ų9755.9 Ų55.942%0.42229%0.288SS..SBendtrans-75.5135.6-174.9-67.6-177.7-177.6174.60111.2L137 K142 F143 I144L137-K140 HydrophobicContact CD1-CD 4.24Å; L137-K140 WeakPolarHBondContact O-CB 3.37Å; L137-K140 PolarHBondContact O-N 3.19Å; L137-K140 VanDerWaalsContact O-N 3.08Å; K140-K142 PolarHBondContact O-N 3.29Å; K140-F143 HydrophobicContact CB-CB 4.47Å; K140-F143 WeakPolarHBondContact O-CB 3.44Å; K140-F143 PolarHBondContact O-N 2.83Å; K140-I144 WeakPolarHBondContact O-CG1 3.14Å; K140-I144 PolarHBondContact O-N 3.37Å
141P93.6Very high86.8Confident5 Ų556.9 Ų56.93%0.03227%0.273CS..Hα-helixtrans-50.6-38178.5-28.431.8000114.8I128 K132 L145 V397 L448I128-P141 HydrophobicContact CG2-CB 3.81Å; K132-P141 HydrophobicContact CB-CG 3.92Å; K132-P141 HydrophobicContact CD-CG 4.21Å; P141-L145 WeakPolarHBondContact O-CB 3.4Å; P141-L145 PolarHBondContact O-N 2.79Å; P141-V397 HydrophobicContact CB-CB 4.24Å; P141-L448 HydrophobicContact CG-CD1 3.89Å
142K94.1Very high88.6Confident74 Ų7448 Ų4832%0.32224%0.235SC..Hα-helixtrans-68.6-39.4-179.8-65-174.7-179.5-172.40112.4W13 C125 I128 K140 S146W13-K142 HydrophobicContact CH2-CB 4.43Å; C125-K142 WeakPolarHBondContact O-CD 3.26Å; C125-K142 WeakPolarHBondContact O-CE 3.38Å; I128-K142 HydrophobicContact CB-CG 4.28Å; I128-K142 HydrophobicContact CG2-CG 4.48Å; I128-K142 WeakPolarHBondContact O-CE 3.26Å; K140-K142 PolarHBondContact O-N 3.29Å; K142-S146 WeakPolarHBondContact O-CB 3.47Å; K142-S146 PolarHBondContact O-N 3.32Å; K142-S146 PolarHBondContact O-OG 3.03Å
143F94.8Very high90.3Very high25 Ų2544.5 Ų44.511%0.1122%0.22CC..Hα-helixtrans-66.9-50.1176.5-175.9-85.6000109.7W13 L17 L137 T138 K140 L145 S146 V147 Y440W13-F143 HydrophobicContact CD2-CD2 4.15Å; W13-F143 AromaticContact CE3-CD2 3.49Å; W13-F143 HydrophobicContact CE3-CD2 3.49Å; W13-F143 VanDerWaalsContact CE3-CD2 3.49Å; W13-F143 HydrophobicContact CE3-CE2 4.06Å; W13-F143 HydrophobicContact CE3-CG 4.47Å; W13-F143 HydrophobicContact CZ3-CB 4.33Å; W13-F143 AromaticContact CZ3-CD2 3.91Å; W13-F143 HydrophobicContact CZ3-CD2 3.91Å; W13-F143 HydrophobicContact CZ3-CG 4.49Å; L17-F143 HydrophobicContact CD1-CD2 4.1Å; L17-F143 HydrophobicContact CD1-CE2 3.8Å; L17-F143 HydrophobicContact CD1-CZ 4.15Å; L17-F143 HydrophobicContact CD2-CE2 4.39Å; L17-F143 HydrophobicContact CD2-CZ 4.17Å; L17-F143 HydrophobicContact CG-CE2 4.27Å; L137-F143 HydrophobicContact CD1-CB 4.47Å; L137-F143 HydrophobicContact CD1-CD2 4.15Å; L137-F143 HydrophobicContact CD2-CD2 4.14Å; L137-F143 HydrophobicContact CD2-CE2 4.25Å; L137-F143 HydrophobicContact CG-CD2 3.75Å; L137-F143 HydrophobicContact CG-CE2 4.24Å; L137-F143 HydrophobicContact CG-CG 4.35Å; L137-F143 WeakPolarHBondContact O-CB 3.33Å; T138-F143 HydrophobicContact CG2-CE1 4.08Å; T138-F143 HydrophobicContact CG2-CZ 4.3Å; K140-F143 HydrophobicContact CB-CB 4.47Å; K140-F143 WeakPolarHBondContact O-CB 3.44Å; K140-F143 PolarHBondContact O-N 2.83Å; F143-L145 PolarHBondContact O-N 3.46Å; F143-S146 WeakPolarHBondContact O-CB 3.49Å; F143-S146 PolarHBondContact O-N 3.04Å; F143-S146 VanDerWaalsContact O-N 3.07Å; F143-V147 HydrophobicContact CD1-CG2 4.18Å; F143-V147 HydrophobicContact CE1-CG2 3.8Å; F143-V147 HydrophobicContact CZ-CG2 4.24Å; F143-V147 PolarHBondContact O-N 3.23Å; F143-Y440 WeakPolarHBondContact CD1-OH 3Å; F143-Y440 WeakPolarHBondContact CE1-OH 3.3Å
144I96.1Very high92.1Very high1 Ų138.3 Ų38.31%0.00518%0.182CC..Hα-helixtrans-54.6-52.2177.6-62172.6000110.4T138 K140 S146 V147 L148 V397 L445 L448T138-I144 WeakPolarHBondContact O-CG1 3.4Å; K140-I144 WeakPolarHBondContact O-CG1 3.14Å; K140-I144 PolarHBondContact O-N 3.37Å; I144-S146 VanDerWaalsContact C-N 3.3Å; I144-S146 PolarHBondContact O-N 3.33Å; I144-V147 PolarHBondContact O-N 3.11Å; I144-L148 HydrophobicContact CG2-CD1 3.93Å; I144-L148 HydrophobicContact CG2-CG 4.2Å; I144-L148 VanDerWaalsContact O-CG 3.3Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 3.44Å; I144-V397 HydrophobicContact CB-CG1 4.38Å; I144-V397 HydrophobicContact CG2-CG1 4.04Å; I144-L445 HydrophobicContact CG2-CD2 4.15Å; I144-L448 HydrophobicContact CD1-CB 3.94Å; I144-L448 HydrophobicContact CD1-CD1 4.42Å; I144-L448 HydrophobicContact CD1-CD2 4.1Å; I144-L448 HydrophobicContact CD1-CG 4.37Å
145L97.2Very high93.8Very high0 Ų038.1 Ų38.10%018%0.177CC..Hα-helixtrans-58-43.7178-179.571000111.9C124 I128 P141 F143 V147 L148 L149 S393 L394 V397C124-L145 HydrophobicContact CB-CD2 4.36Å; I128-L145 HydrophobicContact CD1-CB 3.8Å; I128-L145 HydrophobicContact CD1-CD2 3.24Å; I128-L145 HydrophobicContact CD1-CG 4.03Å; I128-L145 HydrophobicContact CG1-CD2 4.33Å; P141-L145 WeakPolarHBondContact O-CB 3.4Å; P141-L145 PolarHBondContact O-N 2.79Å; F143-L145 PolarHBondContact O-N 3.46Å; L145-V147 VanDerWaalsContact C-N 3.27Å; L145-V147 PolarHBondContact O-N 2.82Å; L145-L148 PolarHBondContact O-N 3.46Å; L145-L149 HydrophobicContact CD1-CD1 3.73Å; L145-L149 HydrophobicContact CD1-CG 4.02Å; L145-L149 HydrophobicContact CD2-CD1 4.03Å; L145-L149 HydrophobicContact CG-CD1 3.77Å; L145-L149 HydrophobicContact CG-CG 4.34Å; L145-L149 PolarHBondContact O-N 3.2Å; L145-S393 WeakPolarHBondContact CD1-O 3.46Å; L145-L394 HydrophobicContact CD1-CD2 4.09Å; L145-L394 HydrophobicContact CD2-CD2 3.57Å; L145-L394 HydrophobicContact CG-CD2 4.43Å; L145-V397 HydrophobicContact CB-CG1 4.18Å; L145-V397 HydrophobicContact CB-CG2 4.49Å
146S97.6Very high95Very high0 Ų029.1 Ų29.10%014%0.138CC..Hα-helixtrans-58.2-42.9-179-58.70000110.8C125 K142 F143 I144 L150C125-S146 PolarHBondContact SG-OG 2.99Å; K142-S146 WeakPolarHBondContact O-CB 3.47Å; K142-S146 PolarHBondContact O-N 3.32Å; K142-S146 PolarHBondContact O-OG 3.03Å; F143-S146 WeakPolarHBondContact O-CB 3.49Å; F143-S146 PolarHBondContact O-N 3.04Å; F143-S146 VanDerWaalsContact O-N 3.07Å; I144-S146 VanDerWaalsContact C-N 3.3Å; I144-S146 PolarHBondContact O-N 3.33Å; S146-L150 WeakPolarHBondContact O-CB 3.4Å; S146-L150 VanDerWaalsContact O-CG 3.24Å; S146-L150 WeakPolarHBondContact O-CG 3.49Å; S146-L150 PolarHBondContact O-N 3.15Å
147V98.1Very high95.5Very high15 Ų1523.3 Ų23.39%0.09111%0.111CC..Hα-helixtrans-68.1-46.7175.9-179.30000111.1L17 F143 I144 L145 L149 W151 Y440L17-V147 HydrophobicContact CD1-CG2 3.75Å; L17-V147 HydrophobicContact CD2-CG2 3.92Å; F143-V147 HydrophobicContact CD1-CG2 4.18Å; F143-V147 HydrophobicContact CE1-CG2 3.8Å; F143-V147 HydrophobicContact CZ-CG2 4.24Å; F143-V147 PolarHBondContact O-N 3.23Å; I144-V147 PolarHBondContact O-N 3.11Å; L145-V147 VanDerWaalsContact C-N 3.27Å; L145-V147 PolarHBondContact O-N 2.82Å; V147-L149 PolarHBondContact O-N 3.45Å; V147-L149 VanDerWaalsContact O-N 3.13Å; V147-W151 HydrophobicContact CG1-CB 4.22Å; V147-W151 HydrophobicContact CG1-CG 4.42Å; V147-W151 WeakPolarHBondContact O-CA 3.45Å; V147-W151 WeakPolarHBondContact O-CB 3.4Å; V147-W151 PolarHBondContact O-N 3.11Å; V147-Y440 HydrophobicContact CB-CD1 4.27Å; V147-Y440 HydrophobicContact CB-CE1 3.48Å; V147-Y440 VanDerWaalsContact CB-CE1 3.48Å; V147-Y440 HydrophobicContact CG1-CD1 3.57Å; V147-Y440 HydrophobicContact CG1-CE1 3.27Å; V147-Y440 HydrophobicContact CG1-CE2 4.36Å; V147-Y440 HydrophobicContact CG1-CG 4.25Å; V147-Y440 HydrophobicContact CG2-CE1 4.18Å
148L98.5Very high96.1Very high0 Ų020.1 Ų20.10%010%0.095CC..Hα-helixtrans-58.4-28.7-179.8-67.9-178.6000113.9I144 L145 N152 F406 F437 Y440 S441 L445I144-L148 HydrophobicContact CG2-CD1 3.93Å; I144-L148 HydrophobicContact CG2-CG 4.2Å; I144-L148 VanDerWaalsContact O-CG 3.3Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 3.44Å; L145-L148 PolarHBondContact O-N 3.46Å; L148-N152 PolarHBondContact O-ND2 2.88Å; L148-F406 HydrophobicContact CD1-CE1 3.85Å; L148-F406 HydrophobicContact CD1-CZ 4.15Å; L148-F406 HydrophobicContact CD2-CE1 4.04Å; L148-F406 HydrophobicContact CD2-CZ 4.19Å; L148-F437 HydrophobicContact CD2-CE2 4.31Å; L148-F437 HydrophobicContact CD2-CZ 4.2Å; L148-Y440 HydrophobicContact CD2-CD1 4.48Å; L148-S441 WeakPolarHBondContact CD2-OG 3.37Å; L148-L445 HydrophobicContact CD1-CD1 4.44Å
149L98.6Very high96.6Very high0 Ų016.9 Ų16.90%08%0.075CC..Hα-helixtrans-94.1-54.3177.8-70.4174.7000112.6F117 V121 L145 V147 W151 N152 L174 L390 L394F117-L149 WeakPolarHBondContact CE1-O 3.49Å; F117-L149 HydrophobicContact CZ-CB 4.38Å; V121-L149 HydrophobicContact CG1-CB 4.07Å; V121-L149 HydrophobicContact CG1-CD1 4.05Å; V121-L149 HydrophobicContact CG2-CB 3.71Å; V121-L149 HydrophobicContact CG2-CD1 4Å; V121-L149 HydrophobicContact CG2-CG 4.46Å; L145-L149 HydrophobicContact CD1-CD1 3.73Å; L145-L149 HydrophobicContact CD1-CG 4.02Å; L145-L149 HydrophobicContact CD2-CD1 4.03Å; L145-L149 HydrophobicContact CG-CD1 3.77Å; L145-L149 HydrophobicContact CG-CG 4.34Å; L145-L149 PolarHBondContact O-N 3.2Å; V147-L149 PolarHBondContact O-N 3.45Å; V147-L149 VanDerWaalsContact O-N 3.13Å; L149-W151 PolarHBondContact O-N 3.45Å; L149-N152 VanDerWaalsContact O-CB 3.31Å; L149-N152 WeakPolarHBondContact O-CB 3.25Å; L149-N152 PolarHBondContact O-N 3.05Å; L149-L174 HydrophobicContact CD1-CD1 4.31Å; L149-L174 HydrophobicContact CD2-CD1 4.19Å; L149-L390 HydrophobicContact CD2-CB 4.39Å; L149-L390 HydrophobicContact CD2-CD2 4Å; L149-L394 HydrophobicContact CD1-CD2 4.09Å
150L98.3Very high97.1Very high6 Ų615.7 Ų15.73%0.0317%0.069CC..Hα-helixtrans-66.8-38.3-175.1-65.7177.2000112.4F14 L17 A18 V21 F117 V118 V121 S146F14-L150 HydrophobicContact CE2-CD1 4.05Å; F14-L150 HydrophobicContact CZ-CD1 4.05Å; L17-L150 HydrophobicContact CB-CD1 4.3Å; A18-L150 HydrophobicContact CB-CD1 4.28Å; V21-L150 HydrophobicContact CG1-CB 4.35Å; V21-L150 WeakPolarHBondContact CG2-O 3.33Å; F117-L150 HydrophobicContact CD1-CD2 4.32Å; F117-L150 HydrophobicContact CE1-CD2 4.35Å; V118-L150 HydrophobicContact CB-CD2 4.35Å; V118-L150 HydrophobicContact CG2-CD2 3.92Å; V121-L150 HydrophobicContact CB-CD2 4.05Å; V121-L150 HydrophobicContact CB-CG 4.46Å; V121-L150 HydrophobicContact CG1-CD2 4.24Å; V121-L150 HydrophobicContact CG1-CG 4.1Å; V121-L150 HydrophobicContact CG2-CD2 3.91Å; V121-L150 HydrophobicContact CG2-CG 4.46Å; S146-L150 WeakPolarHBondContact O-CB 3.4Å; S146-L150 VanDerWaalsContact O-CG 3.24Å; S146-L150 WeakPolarHBondContact O-CG 3.49Å; S146-L150 PolarHBondContact O-N 3.15Å
151W98.1Very high97.4Very high81 Ų8111 Ų1131%0.3075%0.049SC..THydrogen-bonded Turntrans-100.423.9179.8-66.571.4000111.6L17 G20 V21 L24 V147 L149 F153 F437L17-W151 PolarHBondContact O-NE1 2.94Å; L17-W151 VanDerWaalsContact O-NE1 3.12Å; G20-W151 VanDerWaalsContact C-CZ2 3.49Å; V21-W151 HydrophobicContact CB-CD2 3.94Å; V21-W151 HydrophobicContact CB-CG 4.26Å; V21-W151 HydrophobicContact CB-CH2 4.5Å; V21-W151 HydrophobicContact CB-CZ2 3.92Å; V21-W151 HydrophobicContact CG2-CD2 4.01Å; V21-W151 HydrophobicContact CG2-CE3 4.31Å; V21-W151 HydrophobicContact CG2-CG 4.24Å; V21-W151 VanDerWaalsContact N-CZ2 3.28Å; L24-W151 HydrophobicContact CD2-CE3 4.15Å; L24-W151 HydrophobicContact CD2-CZ3 3.73Å; V147-W151 HydrophobicContact CG1-CB 4.22Å; V147-W151 HydrophobicContact CG1-CG 4.42Å; V147-W151 WeakPolarHBondContact O-CA 3.45Å; V147-W151 WeakPolarHBondContact O-CB 3.4Å; V147-W151 PolarHBondContact O-N 3.11Å; L149-W151 PolarHBondContact O-N 3.45Å; W151-F153 PolarHBondContact O-N 3.47Å; W151-F153 VanDerWaalsContact O-N 3.1Å; W151-F437 WeakPolarHBondContact O-CD2 3.36Å
152N98.5Very high97.5Very high1 Ų111.6 Ų11.61%0.0055%0.051CC..  trans-59.5116.7-179.7-170-90.4000110.7L148 L149 G154 L155 L156 L390 H414 F437L148-N152 PolarHBondContact O-ND2 2.88Å; L149-N152 VanDerWaalsContact O-CB 3.31Å; L149-N152 WeakPolarHBondContact O-CB 3.25Å; L149-N152 PolarHBondContact O-N 3.05Å; N152-G154 VanDerWaalsContact C-N 3.33Å; N152-G154 PolarHBondContact O-N 3.11Å; N152-G154 PolarHBondContact OD1-N 3.12Å; N152-L155 HydrophobicContact CB-CB 4.25Å; N152-L155 HydrophobicContact CB-CD1 4.21Å; N152-L155 HydrophobicContact CB-CG 4.34Å; N152-L155 PolarHBondContact O-N 3.3Å; N152-L155 PolarHBondContact OD1-N 3.05Å; N152-L156 PolarHBondContact O-N 3.33Å; N152-L390 HydrophobicContact CB-CD2 4.23Å; N152-H414 PolarHBondContact OD1-NE2 3.13Å; N152-F437 HydrophobicContact CB-CE2 4.47Å
153F98.5Very high97.6Very high1 Ų18 Ų80%0.0044%0.036CC..Hα-helixtrans-51.5-52-178.3165.4-96.6000112.1W151 L155 L156 I157 H414 F418 K430 L433 M434 F437W151-F153 PolarHBondContact O-N 3.47Å; W151-F153 VanDerWaalsContact O-N 3.1Å; F153-L155 VanDerWaalsContact C-N 3.35Å; F153-L155 PolarHBondContact O-N 3.26Å; F153-L156 WeakPolarHBondContact O-CB 3.47Å; F153-L156 PolarHBondContact O-N 2.8Å; F153-L156 VanDerWaalsContact O-N 3.1Å; F153-I157 HydrophobicContact CD1-CD1 4.28Å; F153-I157 HydrophobicContact CD1-CG1 4.48Å; F153-I157 HydrophobicContact CD2-CG2 4.01Å; F153-I157 HydrophobicContact CE1-CD1 3.49Å; F153-I157 VanDerWaalsContact CE1-CD1 3.49Å; F153-I157 HydrophobicContact CE1-CG1 4.1Å; F153-I157 HydrophobicContact CE1-CG2 4.45Å; F153-I157 HydrophobicContact CE2-CD1 4.41Å; F153-I157 HydrophobicContact CE2-CG2 3.49Å; F153-I157 VanDerWaalsContact CE2-CG2 3.49Å; F153-I157 HydrophobicContact CZ-CD1 3.58Å; F153-I157 HydrophobicContact CZ-CG1 4.17Å; F153-I157 HydrophobicContact CZ-CG2 3.77Å; F153-I157 WeakPolarHBondContact O-CG1 3.42Å; F153-I157 PolarHBondContact O-N 3.45Å; F153-H414 HydrophobicContact CD1-CB 3.53Å; F153-H414 AromaticContact CD1-CD2 3.98Å; F153-H414 AromaticContact CD1-CG 3.63Å; F153-H414 HydrophobicContact CE1-CB 3.94Å; F153-F418 HydrophobicContact CE1-CD2 4.28Å; F153-F418 AromaticContact CE1-CE2 3.88Å; F153-F418 HydrophobicContact CE1-CE2 3.88Å; F153-F418 HydrophobicContact CZ-CD2 4.07Å; F153-F418 AromaticContact CZ-CE2 3.55Å; F153-F418 HydrophobicContact CZ-CE2 3.55Å; F153-F418 HydrophobicContact CZ-CZ 4.41Å; F153-K430 HydrophobicContact CE2-CB 4.49Å; F153-K430 VanDerWaalsContact CE2-O 3.23Å; F153-K430 WeakPolarHBondContact CE2-O 3.49Å; F153-L433 HydrophobicContact CD2-CB 3.66Å; F153-L433 HydrophobicContact CE2-CB 3.95Å; F153-M434 HydrophobicContact CD1-SD 3.78Å; F153-M434 HydrophobicContact CD2-CB 3.94Å; F153-M434 VanDerWaalsContact CD2-N 3.33Å; F153-M434 HydrophobicContact CE1-CB 4.36Å; F153-M434 HydrophobicContact CE1-SD 3.96Å; F153-M434 HydrophobicContact CE2-CB 3.71Å; F153-M434 HydrophobicContact CG-CB 4.36Å; F153-M434 HydrophobicContact CG-SD 4.07Å; F153-M434 HydrophobicContact CZ-CB 3.91Å; F153-M434 HydrophobicContact CZ-SD 4.46Å; F153-F437 HydrophobicContact CB-CB 3.88Å; F153-F437 HydrophobicContact CB-CD1 4.16Å; F153-F437 HydrophobicContact CB-CD2 4.5Å; F153-F437 HydrophobicContact CB-CG 3.91Å
154G98.1Very high97.7Very high0 Ų07 Ų70%03%0.031CC..Hα-helixtrans-59.7-41.3-176.800000113.5N152 I157 V158 H414N152-G154 VanDerWaalsContact C-N 3.33Å; N152-G154 PolarHBondContact O-N 3.11Å; N152-G154 PolarHBondContact OD1-N 3.12Å; G154-I157 WeakPolarHBondContact O-CG1 3.39Å; G154-V158 VanDerWaalsContact O-CB 3.31Å; G154-V158 WeakPolarHBondContact O-CB 3.21Å; G154-V158 WeakPolarHBondContact O-CG2 3.38Å; G154-V158 PolarHBondContact O-N 2.76Å; G154-H414 PolarHBondContact N-CD2 2.81Å; G154-H414 PolarHBondContact N-NE2 3.16Å; G154-H414 VanDerWaalsContact N-NE2 3.17Å
155L97.7Very high97.8Very high12 Ų127.2 Ų7.26%0.0633%0.032CC..Hα-helixtrans-65.8-41.8173.9-74.7177.6000112.5F117 N152 F153 I157 V158 D159 N166 F170 L386 L390F117-L155 HydrophobicContact CE1-CD1 4Å; F117-L155 HydrophobicContact CE2-CD1 3.82Å; F117-L155 HydrophobicContact CZ-CD1 3.41Å; F117-L155 VanDerWaalsContact CZ-CD1 3.41Å; N152-L155 HydrophobicContact CB-CB 4.25Å; N152-L155 HydrophobicContact CB-CD1 4.21Å; N152-L155 HydrophobicContact CB-CG 4.34Å; N152-L155 PolarHBondContact O-N 3.3Å; N152-L155 PolarHBondContact OD1-N 3.05Å; F153-L155 VanDerWaalsContact C-N 3.35Å; F153-L155 PolarHBondContact O-N 3.26Å; L155-I157 PolarHBondContact O-N 3.11Å; L155-V158 PolarHBondContact O-N 3.42Å; L155-D159 WeakPolarHBondContact O-CB 3.24Å; L155-D159 PolarHBondContact O-N 3.41Å; L155-N166 HydrophobicContact CD2-CB 4.3Å; L155-F170 HydrophobicContact CD2-CD2 3.53Å; L155-F170 HydrophobicContact CD2-CE2 3.84Å; L155-L386 HydrophobicContact CD2-CD1 4.06Å; L155-L390 HydrophobicContact CD1-CD1 3.76Å; L155-L390 HydrophobicContact CD1-CD2 3.65Å; L155-L390 HydrophobicContact CD1-CG 4.35Å; L155-L390 HydrophobicContact CD2-CD1 4.03Å; L155-L390 HydrophobicContact CG-CD1 4.07Å; L155-L390 HydrophobicContact CG-CD2 4.16Å
156L98Very high97.8Very high6 Ų67.8 Ų7.83%0.0314%0.035CC..Hα-helixtrans-59.5-48.7178.6-74.3169.8000111.4V21 L24 K25 N152 F153 H160V21-L156 HydrophobicContact CG2-CD1 4.36Å; V21-L156 HydrophobicContact CG2-CD2 3.81Å; L24-L156 HydrophobicContact CD2-CD1 4.3Å; K25-L156 HydrophobicContact CG-CD2 3.94Å; N152-L156 PolarHBondContact O-N 3.33Å; F153-L156 WeakPolarHBondContact O-CB 3.47Å; F153-L156 PolarHBondContact O-N 2.8Å; F153-L156 VanDerWaalsContact O-N 3.1Å; L156-H160 WeakPolarHBondContact O-CA 3.32Å; L156-H160 VanDerWaalsContact O-CB 3.29Å; L156-H160 WeakPolarHBondContact O-CB 3.36Å; L156-H160 PolarHBondContact O-N 3.45Å
157I97.6Very high97.8Very high1 Ų17.8 Ų7.81%0.0054%0.035CC..Hα-helixtrans-72-36.4-177.961.9158.8000112.8F153 G154 L155 I161 H162 L417 L421F153-I157 HydrophobicContact CD1-CD1 4.28Å; F153-I157 HydrophobicContact CD1-CG1 4.48Å; F153-I157 HydrophobicContact CD2-CG2 4.01Å; F153-I157 HydrophobicContact CE1-CD1 3.49Å; F153-I157 VanDerWaalsContact CE1-CD1 3.49Å; F153-I157 HydrophobicContact CE1-CG1 4.1Å; F153-I157 HydrophobicContact CE1-CG2 4.45Å; F153-I157 HydrophobicContact CE2-CD1 4.41Å; F153-I157 HydrophobicContact CE2-CG2 3.49Å; F153-I157 VanDerWaalsContact CE2-CG2 3.49Å; F153-I157 HydrophobicContact CZ-CD1 3.58Å; F153-I157 HydrophobicContact CZ-CG1 4.17Å; F153-I157 HydrophobicContact CZ-CG2 3.77Å; F153-I157 WeakPolarHBondContact O-CG1 3.42Å; F153-I157 PolarHBondContact O-N 3.45Å; G154-I157 WeakPolarHBondContact O-CG1 3.39Å; L155-I157 PolarHBondContact O-N 3.11Å; I157-I161 HydrophobicContact CG2-CD1 4.21Å; I157-I161 WeakPolarHBondContact O-CB 3.44Å; I157-I161 PolarHBondContact O-N 2.92Å; I157-H162 WeakPolarHBondContact O-CB 3.36Å; I157-H162 PolarHBondContact O-N 3.07Å; I157-L417 HydrophobicContact CD1-CB 3.53Å; I157-L417 HydrophobicContact CD1-CD1 4.24Å; I157-L421 HydrophobicContact CB-CD1 3.89Å; I157-L421 HydrophobicContact CG2-CD1 3.98Å
158V97.8Very high97.8Very high0 Ų07.9 Ų7.90%03%0.034CC..Iπ-helixtrans-73.2-42.3-177.3173.70000111G154 L155 H162 F163 Q164 N166 K383 L386 L417 L420G154-V158 VanDerWaalsContact O-CB 3.31Å; G154-V158 WeakPolarHBondContact O-CB 3.21Å; G154-V158 WeakPolarHBondContact O-CG2 3.38Å; G154-V158 PolarHBondContact O-N 2.76Å; L155-V158 PolarHBondContact O-N 3.42Å; V158-H162 WeakPolarHBondContact O-CB 3.31Å; V158-F163 CarbonylContact O-C 3.56Å; V158-F163 PolarHBondContact O-N 3.41Å; V158-Q164 HydrophobicContact CG1-CB 4.35Å; V158-Q164 HydrophobicContact CG1-CG 4.4Å; V158-Q164 PolarHBondContact O-N 2.97Å; V158-N166 WeakPolarHBondContact CG1-ND2 3.39Å; V158-K383 HydrophobicContact CG2-CB 4.46Å; V158-L386 HydrophobicContact CB-CD1 4.49Å; V158-L386 HydrophobicContact CG2-CD1 4.15Å; V158-L417 HydrophobicContact CG2-CD1 4.17Å; V158-L420 HydrophobicContact CG2-CD1 4.35Å
159D98.2Very high97.9Very high1 Ų18 Ų81%0.0054%0.035CC..Iπ-helixtrans-90.8-38.6-174.8-66.7-16.6000112.8V110 L155 F163 Q164 N166 G167V110-D159 HydrophobicContact CG1-CB 4Å; L155-D159 WeakPolarHBondContact O-CB 3.24Å; L155-D159 PolarHBondContact O-N 3.41Å; D159-F163 WeakPolarHBondContact O-CA 3.31Å; D159-Q164 WeakPolarHBondContact CA-O 3.27Å; D159-Q164 VanDerWaalsContact CB-O 3.27Å; D159-Q164 WeakPolarHBondContact CB-O 3.39Å; D159-Q164 VanDerWaalsContact CG-O 3.29Å; D159-Q164 PolarHBondContact O-N 3.47Å; D159-N166 VanDerWaalsContact OD1-CB 3.23Å; D159-N166 WeakPolarHBondContact OD1-CB 3.45Å; D159-N166 PolarHBondContact OD1-N 2.88Å; D159-N166 PolarHBondContact OD1-ND2 2.9Å; D159-N166 PolarHBondContact OD2-N 3.34Å; D159-G167 WeakPolarHBondContact OD2-CA 3.33Å; D159-G167 PolarHBondContact OD2-N 3.37Å
160H97.7Very high97.9Very high3 Ų38.3 Ų8.31%0.0144%0.036CC..Iπ-helixtrans-104.1-6.7-169.3-60.3-82.4000114.6K25 L28 R107 D114 L156K25-H160 VanDerWaalsContact CD-CE1 3.49Å; K25-H160 WeakPolarHBondContact CD-CE1 3.5Å; K25-H160 WeakPolarHBondContact CE-NE2 3.49Å; L28-H160 HydrophobicContact CB-CB 4.48Å; L28-H160 HydrophobicContact CD1-CB 4.1Å; R107-H160 VanDerWaalsContact NH1-C 3.27Å; R107-H160 PolarHBondContact NH1-O 3.35Å; R107-H160 VanDerWaalsContact NH1-O 3.12Å; D114-H160 IonicContact OD2-CE1 3.84Å; D114-H160 PolarHBondContact OD2-CE1 2.97Å; D114-H160 VanDerWaalsContact OD2-CE1 3.24Å; D114-H160 IonicContact OD2-NE2 3.31Å; D114-H160 PolarHBondContact OD2-NE2 3.2Å; L156-H160 WeakPolarHBondContact O-CA 3.32Å; L156-H160 VanDerWaalsContact O-CB 3.29Å; L156-H160 WeakPolarHBondContact O-CB 3.36Å; L156-H160 PolarHBondContact O-N 3.45Å
161I97.4Very high97.9Very high0 Ų08 Ų80%04%0.035CC..Iπ-helixtrans-117.7-73.8168.8-50.7-178.6000108L28 Y32 H33 R107 I157 F163 L421 E426 I429L28-I161 HydrophobicContact CD1-CG1 4.27Å; L28-I161 HydrophobicContact CD2-CD1 4.18Å; L28-I161 HydrophobicContact CD2-CG1 4.35Å; Y32-I161 HydrophobicContact CD1-CG2 4.3Å; Y32-I161 CarbonylContact O-C 3.58Å; Y32-I161 VanDerWaalsContact O-C 3.26Å; Y32-I161 WeakPolarHBondContact O-CG2 2.78Å; H33-I161 WeakPolarHBondContact CA-O 3.47Å; R107-I161 PolarHBondContact NH1-O 3.06Å; R107-I161 PolarHBondContact NH2-O 3.05Å; I157-I161 HydrophobicContact CG2-CD1 4.21Å; I157-I161 WeakPolarHBondContact O-CB 3.44Å; I157-I161 PolarHBondContact O-N 2.92Å; I161-F163 PolarHBondContact O-N 3.14Å; I161-L421 HydrophobicContact CB-CD1 4.14Å; I161-L421 HydrophobicContact CB-CD2 4Å; I161-L421 HydrophobicContact CD1-CD1 3.88Å; I161-L421 HydrophobicContact CG2-CD1 3.91Å; I161-L421 HydrophobicContact CG2-CD2 3.44Å; I161-L421 VanDerWaalsContact CG2-CD2 3.44Å; I161-L421 HydrophobicContact CG2-CG 4.32Å; I161-E426 HydrophobicContact CG2-CG 4Å; I161-I429 HydrophobicContact CD1-CG2 4.26Å
162H96.3Very high97.9Very high16 Ų164.9 Ų4.97%0.0742%0.024CC..Iπ-helixtrans-52-31.2179.6-177.96.6000113.8S34 D36 I157 V158 L421S34-H162 WeakPolarHBondContact CB-CE1 3.41Å; S34-H162 WeakPolarHBondContact CB-ND1 3.31Å; S34-H162 VanDerWaalsContact CB-O 3.3Å; S34-H162 WeakPolarHBondContact CB-O 3.35Å; S34-H162 PolarHBondContact N-O 2.98Å; S34-H162 PolarHBondContact OG-CE1 2.94Å; S34-H162 PolarHBondContact OG-ND1 3.08Å; S34-H162 PolarHBondContact OG-O 3.18Å; D36-H162 IonicContact OD2-CE1 3.77Å; D36-H162 IonicContact OD2-NE2 2.82Å; I157-H162 WeakPolarHBondContact O-CB 3.36Å; I157-H162 PolarHBondContact O-N 3.07Å; V158-H162 WeakPolarHBondContact O-CB 3.31Å; H162-L421 HydrophobicContact CB-CD2 4.28Å
163F97.4Very high97.9Very high0 Ų04.8 Ų4.80%02%0.023CC..Iπ-helixtrans83.1102.5175.5-172.6-89.2000115H33 D36 F37 H40 Q106 V110 V158 D159 I161 Y165H33-F163 HydrophobicContact CB-CB 4.14Å; D36-F163 VanDerWaalsContact CB-O 3.29Å; D36-F163 WeakPolarHBondContact CB-O 3.1Å; F37-F163 VanDerWaalsContact CA-CD1 3.41Å; F37-F163 HydrophobicContact CB-CB 4.3Å; F37-F163 HydrophobicContact CB-CD1 3.94Å; F37-F163 HydrophobicContact CB-CG 4.13Å; F37-F163 HydrophobicContact CD2-CB 4.4Å; F37-F163 AromaticContact CD2-CD1 4Å; F37-F163 HydrophobicContact CD2-CD1 4Å; F37-F163 AromaticContact CD2-CD2 3.77Å; F37-F163 HydrophobicContact CD2-CD2 3.77Å; F37-F163 HydrophobicContact CD2-CE1 4.26Å; F37-F163 HydrophobicContact CD2-CE2 4.05Å; F37-F163 AromaticContact CD2-CG 3.75Å; F37-F163 HydrophobicContact CD2-CG 3.75Å; F37-F163 HydrophobicContact CD2-CZ 4.29Å; F37-F163 HydrophobicContact CE2-CD2 4.39Å; F37-F163 HydrophobicContact CE2-CE2 4.38Å; F37-F163 HydrophobicContact CG-CD1 4.4Å; F37-F163 HydrophobicContact CG-CG 4.43Å; H40-F163 HydrophobicContact CB-CE1 3.74Å; H40-F163 AromaticContact CD2-CE1 3.7Å; H40-F163 AromaticContact CG-CE1 3.92Å; Q106-F163 HydrophobicContact CB-CE2 3.64Å; Q106-F163 HydrophobicContact CB-CZ 3.61Å; Q106-F163 HydrophobicContact CG-CZ 4.17Å; Q106-F163 WeakPolarHBondContact O-CE2 2.97Å; Q106-F163 VanDerWaalsContact OE1-CE1 3.24Å; V110-F163 HydrophobicContact CG2-CD2 4.45Å; V110-F163 HydrophobicContact CG2-CE2 3.72Å; V110-F163 HydrophobicContact CG2-CZ 4Å; V158-F163 CarbonylContact O-C 3.56Å; V158-F163 PolarHBondContact O-N 3.41Å; D159-F163 WeakPolarHBondContact O-CA 3.31Å; I161-F163 PolarHBondContact O-N 3.14Å; F163-Y165 HydrophobicContact CE1-CE2 4.41Å; F163-Y165 HydrophobicContact CZ-CE2 4.19Å
164Q96.2Very high97.9Very high3 Ų34.8 Ų4.81%0.0142%0.023CC..  trans-162171173.6-66.6-157.6-54.700112D36 V110 V158 D159 N166 K383D36-Q164 HydrophobicContact CB-CG 4.22Å; D36-Q164 WeakPolarHBondContact OD2-CG 3.24Å; D36-Q164 PolarHBondContact OD2-NE2 3.5Å; V110-Q164 WeakPolarHBondContact CG1-O 3.21Å; V158-Q164 HydrophobicContact CG1-CB 4.35Å; V158-Q164 HydrophobicContact CG1-CG 4.4Å; V158-Q164 PolarHBondContact O-N 2.97Å; D159-Q164 WeakPolarHBondContact CA-O 3.27Å; D159-Q164 VanDerWaalsContact CB-O 3.27Å; D159-Q164 WeakPolarHBondContact CB-O 3.39Å; D159-Q164 VanDerWaalsContact CG-O 3.29Å; D159-Q164 PolarHBondContact O-N 3.47Å; Q164-N166 WeakPolarHBondContact CB-ND2 3.48Å; Q164-N166 PolarHBondContact OE1-ND2 3.15Å; Q164-K383 VanDerWaalsContact CD-NZ 3.34Å; Q164-K383 VanDerWaalsContact OE1-CD 3.29Å
165Y97.7Very high97.9Very high5 Ų55.2 Ų5.22%0.023%0.026CC..  trans-103.138.9175.5-65.4-92.9000113.5H40 F71 F74 L78 S109 V110 M113 F163 L169H40-Y165 HydrophobicContact CB-CE2 4.44Å; H40-Y165 AromaticContact CE1-CD2 3.64Å; H40-Y165 AromaticContact CG-CE2 3.94Å; H40-Y165 AromaticContact ND1-CD2 3.77Å; H40-Y165 AromaticContact ND1-CE2 3.7Å; H40-Y165 AromaticContact NE2-CD2 3.95Å; F71-Y165 HydrophobicContact CZ-CD2 4.17Å; F71-Y165 HydrophobicContact CZ-CG 4.46Å; F74-Y165 HydrophobicContact CE1-CD1 4.01Å; F74-Y165 HydrophobicContact CE1-CD2 4.44Å; F74-Y165 HydrophobicContact CE1-CE1 4.12Å; F74-Y165 HydrophobicContact CE1-CG 4.16Å; F74-Y165 AromaticContact CZ-CD1 3.78Å; F74-Y165 HydrophobicContact CZ-CD1 3.78Å; F74-Y165 AromaticContact CZ-CE1 3.8Å; F74-Y165 HydrophobicContact CZ-CE1 3.8Å; F74-Y165 HydrophobicContact CZ-CG 4.39Å; L78-Y165 HydrophobicContact CD1-CE1 4.01Å; L78-Y165 WeakPolarHBondContact CD1-OH 3.33Å; S109-Y165 PolarHBondContact OG-OH 3.03Å; V110-Y165 HydrophobicContact CB-CD1 4.41Å; V110-Y165 HydrophobicContact CB-CE1 4.31Å; V110-Y165 HydrophobicContact CG2-CD1 3.79Å; V110-Y165 HydrophobicContact CG2-CD2 4.38Å; V110-Y165 HydrophobicContact CG2-CE1 3.57Å; V110-Y165 HydrophobicContact CG2-CE2 4.21Å; V110-Y165 HydrophobicContact CG2-CG 4.2Å; M113-Y165 HydrophobicContact CG-CD1 4.35Å; M113-Y165 HydrophobicContact CG-CE1 4.46Å; F163-Y165 HydrophobicContact CE1-CE2 4.41Å; F163-Y165 HydrophobicContact CZ-CE2 4.19Å; Y165-L169 WeakPolarHBondContact O-CG 3.4Å
166N97.9Very high98Very high12 Ų124.7 Ų4.76%0.0642%0.023CC..Hα-helixtrans-72-37.5-175.6-60.3-77.1000112.8L155 V158 D159 Q164 F168 L169 F170 K199L155-N166 HydrophobicContact CD2-CB 4.3Å; V158-N166 WeakPolarHBondContact CG1-ND2 3.39Å; D159-N166 VanDerWaalsContact OD1-CB 3.23Å; D159-N166 WeakPolarHBondContact OD1-CB 3.45Å; D159-N166 PolarHBondContact OD1-N 2.88Å; D159-N166 PolarHBondContact OD1-ND2 2.9Å; D159-N166 PolarHBondContact OD2-N 3.34Å; Q164-N166 WeakPolarHBondContact CB-ND2 3.48Å; Q164-N166 PolarHBondContact OE1-ND2 3.15Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3.44Å; N166-L169 PolarHBondContact O-N 2.96Å; N166-L169 VanDerWaalsContact O-N 3.08Å; N166-F170 HydrophobicContact CB-CD2 3.84Å; N166-F170 HydrophobicContact CB-CE2 3.76Å; N166-F170 WeakPolarHBondContact O-CB 3.46Å; N166-F170 WeakPolarHBondContact O-CD2 3.44Å; N166-F170 WeakPolarHBondContact O-CG 3.35Å; N166-F170 PolarHBondContact O-N 2.87Å; N166-K199 PolarHBondContact OD1-NZ 3.45Å
167G98Very high98Very high1 Ų14.4 Ų4.41%0.012%0.022CC..Hα-helixtrans-56.1-44.417900000111.8F117 D159 L169 F170 G171F117-G167 WeakPolarHBondContact CB-O 3.34Å; F117-G167 VanDerWaalsContact CD2-O 3.24Å; F117-G167 WeakPolarHBondContact CD2-O 3.4Å; D159-G167 WeakPolarHBondContact OD2-CA 3.33Å; D159-G167 PolarHBondContact OD2-N 3.37Å; G167-L169 PolarHBondContact O-N 3.08Å; G167-F170 PolarHBondContact O-N 3.38Å; G167-G171 PolarHBondContact O-N 3.28Å
168F98.2Very high98.1Very high17 Ų174.4 Ų4.48%0.0752%0.022CC..Hα-helixtrans-52.7-54.1170.6170.6-124.6000112.8F74 M113 L116 N166 G171 L172 F198F74-F168 HydrophobicContact CD2-CE1 4.43Å; F74-F168 HydrophobicContact CE2-CE1 4.42Å; F74-F168 HydrophobicContact CZ-CD1 4.5Å; M113-F168 HydrophobicContact CB-CB 3.9Å; M113-F168 HydrophobicContact CB-CD2 4.18Å; M113-F168 HydrophobicContact CB-CG 4.13Å; M113-F168 HydrophobicContact SD-CD2 4.26Å; M113-F168 HydrophobicContact SD-CE2 4.36Å; L116-F168 HydrophobicContact CB-CD2 4.43Å; L116-F168 HydrophobicContact CD2-CD2 3.62Å; L116-F168 HydrophobicContact CD2-CE2 3.51Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3.44Å; F168-G171 WeakPolarHBondContact O-CA 3.11Å; F168-G171 PolarHBondContact O-N 2.68Å; F168-G171 VanDerWaalsContact O-N 3.07Å; F168-L172 HydrophobicContact CE2-CD1 4.38Å; F168-L172 HydrophobicContact CZ-CD1 4.1Å; F168-L172 PolarHBondContact O-N 3.31Å; F168-L172 VanDerWaalsContact O-N 3.11Å; F168-F198 AromaticContact CE1-CD1 3.77Å; F168-F198 HydrophobicContact CE1-CD1 3.77Å; F168-F198 AromaticContact CE1-CE1 3.53Å; F168-F198 HydrophobicContact CE1-CE1 3.53Å; F168-F198 HydrophobicContact CE1-CZ 4.16Å; F168-F198 HydrophobicContact CZ-CD1 4.3Å; F168-F198 AromaticContact CZ-CE1 3.73Å; F168-F198 HydrophobicContact CZ-CE1 3.73Å; F168-F198 AromaticContact CZ-CZ 3.88Å; F168-F198 HydrophobicContact CZ-CZ 3.88Å
169L98.5Very high98.1Very high1 Ų15.1 Ų5.11%0.0052%0.024CC..Hα-helixtrans-68.1-39.8-177.2-60.5178.4000112.2F71 Y165 N166 G167 G171 L172 M173 L195 F198 K199 Y202F71-L169 HydrophobicContact CD2-CD2 4.45Å; F71-L169 HydrophobicContact CE2-CD1 4.31Å; F71-L169 HydrophobicContact CE2-CD2 4.42Å; Y165-L169 WeakPolarHBondContact O-CG 3.4Å; N166-L169 PolarHBondContact O-N 2.96Å; N166-L169 VanDerWaalsContact O-N 3.08Å; G167-L169 PolarHBondContact O-N 3.08Å; L169-G171 PolarHBondContact O-N 3.24Å; L169-L172 WeakPolarHBondContact O-CB 3.48Å; L169-L172 PolarHBondContact O-N 3.29Å; L169-M173 PolarHBondContact O-N 3.41Å; L169-L195 HydrophobicContact CB-CD1 4.06Å; L169-L195 HydrophobicContact CD2-CD1 4.24Å; L169-L195 WeakPolarHBondContact O-CD1 3.12Å; L169-F198 HydrophobicContact CD2-CB 3.57Å; L169-F198 HydrophobicContact CD2-CD1 4.06Å; L169-F198 HydrophobicContact CD2-CG 4.02Å; L169-K199 HydrophobicContact CD1-CB 3.91Å; L169-K199 HydrophobicContact CD1-CD 3.47Å; L169-K199 VanDerWaalsContact CD1-CD 3.47Å; L169-K199 HydrophobicContact CD1-CG 4.32Å; L169-Y202 HydrophobicContact CB-CE2 3.95Å; L169-Y202 WeakPolarHBondContact CB-OH 3.46Å; L169-Y202 HydrophobicContact CD1-CE2 4.41Å
170F98.6Very high98.1Very high8 Ų85 Ų54%0.0352%0.024CC..Hα-helixtrans-66.6-27.9171.2-71.7-54000112.1F117 L155 N166 G167 M173 L174 Y202 L386 L387 L390F117-F170 HydrophobicContact CD2-CB 4.31Å; F117-F170 HydrophobicContact CE2-CB 4.13Å; L155-F170 HydrophobicContact CD2-CD2 3.53Å; L155-F170 HydrophobicContact CD2-CE2 3.84Å; N166-F170 HydrophobicContact CB-CD2 3.84Å; N166-F170 HydrophobicContact CB-CE2 3.76Å; N166-F170 WeakPolarHBondContact O-CB 3.46Å; N166-F170 WeakPolarHBondContact O-CD2 3.44Å; N166-F170 WeakPolarHBondContact O-CG 3.35Å; N166-F170 PolarHBondContact O-N 2.87Å; G167-F170 PolarHBondContact O-N 3.38Å; F170-M173 HydrophobicContact CD1-CE 3.68Å; F170-M173 HydrophobicContact CD1-SD 4.39Å; F170-M173 HydrophobicContact CE1-CE 4.19Å; F170-M173 PolarHBondContact O-N 3.43Å; F170-L174 WeakPolarHBondContact O-CB 3.45Å; F170-L174 VanDerWaalsContact O-CG 3.26Å; F170-L174 WeakPolarHBondContact O-CG 3.44Å; F170-L174 PolarHBondContact O-N 3.24Å; F170-Y202 HydrophobicContact CD1-CE1 4.15Å; F170-Y202 WeakPolarHBondContact CD1-OH 3.33Å; F170-Y202 HydrophobicContact CE1-CE1 4.1Å; F170-Y202 PolarHBondContact N-OH 2.97Å; F170-L386 HydrophobicContact CE2-CB 3.78Å; F170-L386 HydrophobicContact CE2-CD1 4.41Å; F170-L386 HydrophobicContact CZ-CB 3.68Å; F170-L387 HydrophobicContact CE1-CB 4.31Å; F170-L387 HydrophobicContact CE1-CD1 3.94Å; F170-L390 HydrophobicContact CB-CD1 3.77Å; F170-L390 HydrophobicContact CD1-CD1 3.7Å; F170-L390 HydrophobicContact CD2-CD1 3.39Å; F170-L390 HydrophobicContact CE1-CD1 4.06Å; F170-L390 HydrophobicContact CE2-CD1 3.74Å; F170-L390 HydrophobicContact CG-CD1 3.34Å; F170-L390 HydrophobicContact CZ-CD1 4.07Å
171G98.6Very high98Very high0 Ų07.3 Ų7.30%03%0.034CC..Hα-helixtrans-61.1-48.117100000111.2A120 G167 F168 L169 M173 L174 L175A120-G171 WeakPolarHBondContact CB-O 3.2Å; G167-G171 PolarHBondContact O-N 3.28Å; F168-G171 WeakPolarHBondContact O-CA 3.11Å; F168-G171 PolarHBondContact O-N 2.68Å; F168-G171 VanDerWaalsContact O-N 3.07Å; L169-G171 PolarHBondContact O-N 3.24Å; G171-M173 VanDerWaalsContact C-N 3.34Å; G171-M173 PolarHBondContact O-N 3.3Å; G171-L174 PolarHBondContact O-N 3.42Å; G171-L175 WeakPolarHBondContact O-CB 3.2Å; G171-L175 PolarHBondContact O-N 3.4Å
172L98.7Very high97.9Very high14 Ų149.9 Ų9.97%0.0735%0.046CC..Hα-helixtrans-58.3-44.7172.6-71.3172000111.9L116 F168 L169 S176 L191 L195 F198L116-L172 HydrophobicContact CD2-CD2 3.69Å; L116-L172 HydrophobicContact CD2-CG 3.72Å; F168-L172 HydrophobicContact CE2-CD1 4.38Å; F168-L172 HydrophobicContact CZ-CD1 4.1Å; F168-L172 PolarHBondContact O-N 3.31Å; F168-L172 VanDerWaalsContact O-N 3.11Å; L169-L172 WeakPolarHBondContact O-CB 3.48Å; L169-L172 PolarHBondContact O-N 3.29Å; L172-S176 WeakPolarHBondContact O-CB 3.19Å; L172-S176 PolarHBondContact O-N 3.39Å; L172-L191 HydrophobicContact CD2-CD2 4.27Å; L172-L195 HydrophobicContact CB-CB 4.35Å; L172-L195 HydrophobicContact CB-CD1 3.98Å; L172-L195 HydrophobicContact CD1-CD1 4.16Å; L172-F198 HydrophobicContact CD1-CD2 3.92Å; L172-F198 HydrophobicContact CD1-CE2 4.18Å; L172-F198 HydrophobicContact CD1-CG 4.4Å
173M98.7Very high97.9Very high0 Ų017.1 Ų17.10%08%0.077CC..Hα-helixtrans-62.8-51.5178.7-169.1-176.767.900112.1L169 F170 G171 L175 S176 I177 L195 Y202 L387 P391L169-M173 PolarHBondContact O-N 3.41Å; F170-M173 HydrophobicContact CD1-CE 3.68Å; F170-M173 HydrophobicContact CD1-SD 4.39Å; F170-M173 HydrophobicContact CE1-CE 4.19Å; F170-M173 PolarHBondContact O-N 3.43Å; G171-M173 VanDerWaalsContact C-N 3.34Å; G171-M173 PolarHBondContact O-N 3.3Å; M173-L175 VanDerWaalsContact C-N 3.31Å; M173-L175 PolarHBondContact O-N 3.09Å; M173-S176 WeakPolarHBondContact O-CB 3.26Å; M173-S176 PolarHBondContact O-N 2.96Å; M173-I177 HydrophobicContact CG-CD1 4.13Å; M173-I177 WeakPolarHBondContact O-CG1 3.49Å; M173-I177 PolarHBondContact O-N 3.04Å; M173-L195 HydrophobicContact CB-CD2 3.56Å; M173-L195 HydrophobicContact CG-CD2 4.05Å; M173-Y202 HydrophobicContact CB-CE1 4.22Å; M173-Y202 HydrophobicContact CG-CE1 4.34Å; M173-Y202 HydrophobicContact SD-CD1 3.97Å; M173-Y202 HydrophobicContact SD-CE1 3.69Å; M173-L387 HydrophobicContact CE-CD1 4.4Å; M173-L387 HydrophobicContact SD-CD1 3.64Å; M173-P391 HydrophobicContact CE-CG 3.55Å; M173-P391 HydrophobicContact SD-CG 4.5Å
174L98.7Very high97.9Very high0 Ų021.4 Ų21.40%09%0.093CC..Hα-helixtrans-63.9-38.4-179.5-71-176.9000111.2F117 A120 V121 C124 L149 F170 G171 I177 A178 L394F117-L174 HydrophobicContact CD2-CD1 4.25Å; F117-L174 HydrophobicContact CE2-CD1 3.54Å; F117-L174 HydrophobicContact CZ-CD1 4.15Å; A120-L174 HydrophobicContact CB-CB 3.98Å; V121-L174 HydrophobicContact CG2-CD1 4.38Å; C124-L174 PolarHBondContact SG-O 3.37Å; L149-L174 HydrophobicContact CD1-CD1 4.31Å; L149-L174 HydrophobicContact CD2-CD1 4.19Å; F170-L174 WeakPolarHBondContact O-CB 3.45Å; F170-L174 VanDerWaalsContact O-CG 3.26Å; F170-L174 WeakPolarHBondContact O-CG 3.44Å; F170-L174 PolarHBondContact O-N 3.24Å; G171-L174 PolarHBondContact O-N 3.42Å; L174-I177 HydrophobicContact CD2-CD1 4.4Å; L174-I177 PolarHBondContact O-N 3.11Å; L174-A178 WeakPolarHBondContact O-CB 3.38Å; L174-A178 PolarHBondContact O-N 3.45Å; L174-L394 HydrophobicContact CD2-CD1 3.83Å; L174-L394 HydrophobicContact CD2-CG 4.44Å
175L98.7Very high97.9Very high10 Ų1022.5 Ų22.55%0.05210%0.098CC..Hα-helixtrans-64.6-44175.5-173.961.1000110.8L116 Y119 A120 E123 G171 M173 I177 A178 R179 L191L116-L175 HydrophobicContact CD1-CD2 4.27Å; Y119-L175 HydrophobicContact CD1-CD1 4.02Å; Y119-L175 HydrophobicContact CD1-CD2 4.16Å; Y119-L175 HydrophobicContact CE1-CD1 3.61Å; Y119-L175 HydrophobicContact CE1-CD2 3.99Å; Y119-L175 HydrophobicContact CE1-CG 4.47Å; A120-L175 HydrophobicContact CB-CB 3.88Å; E123-L175 HydrophobicContact CB-CD1 4.02Å; E123-L175 HydrophobicContact CG-CD1 3.84Å; G171-L175 WeakPolarHBondContact O-CB 3.2Å; G171-L175 PolarHBondContact O-N 3.4Å; M173-L175 VanDerWaalsContact C-N 3.31Å; M173-L175 PolarHBondContact O-N 3.09Å; L175-I177 PolarHBondContact O-N 3.38Å; L175-A178 PolarHBondContact O-N 2.92Å; L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 3.46Å; L175-L191 HydrophobicContact CB-CD1 4.27Å; L175-L191 HydrophobicContact CD2-CD1 3.93Å; L175-L191 HydrophobicContact CD2-CD2 4.22Å; L175-L191 HydrophobicContact CG-CD1 3.7Å
176S98.7Very high97.9Very high0 Ų024.9 Ų24.90%011%0.11CC..Hα-helixtrans-56.3-48.6173.2172.10000111.5L172 M173 A178 R179 L180 G188 Y209L172-S176 WeakPolarHBondContact O-CB 3.19Å; L172-S176 PolarHBondContact O-N 3.39Å; M173-S176 WeakPolarHBondContact O-CB 3.26Å; M173-S176 PolarHBondContact O-N 2.96Å; S176-A178 PolarHBondContact O-N 3.49Å; S176-R179 PolarHBondContact O-N 2.95Å; S176-L180 WeakPolarHBondContact O-CG 3.36Å; S176-L180 PolarHBondContact O-N 3.46Å; S176-L180 VanDerWaalsContact O-N 3.08Å; S176-G188 PolarHBondContact OG-O 2.87Å; S176-Y209 WeakPolarHBondContact OG-CE1 3.43Å; S176-Y209 PolarHBondContact OG-OH 3.1Å
177I98.6Very high97.9Very high1 Ų128 Ų281%0.00512%0.124CC..Hα-helixtrans-57.7-48.1175-67.2166.2000110.5M173 L174 L175 R179 L180 F181 F362 L363 L366 L394M173-I177 HydrophobicContact CG-CD1 4.13Å; M173-I177 WeakPolarHBondContact O-CG1 3.49Å; M173-I177 PolarHBondContact O-N 3.04Å; L174-I177 HydrophobicContact CD2-CD1 4.4Å; L174-I177 PolarHBondContact O-N 3.11Å; L175-I177 PolarHBondContact O-N 3.38Å; I177-R179 VanDerWaalsContact C-N 3.31Å; I177-R179 PolarHBondContact O-N 3.35Å; I177-L180 WeakPolarHBondContact O-CB 3.28Å; I177-L180 PolarHBondContact O-N 2.94Å; I177-L180 VanDerWaalsContact O-N 3.09Å; I177-F181 HydrophobicContact CG2-CD2 3.84Å; I177-F181 HydrophobicContact CG2-CE2 3.72Å; I177-F181 VanDerWaalsContact O-CD2 3.3Å; I177-F181 WeakPolarHBondContact O-CD2 3.03Å; I177-F181 PolarHBondContact O-N 3.44Å; I177-F362 HydrophobicContact CG1-CE1 4.13Å; I177-F362 HydrophobicContact CG1-CZ 4.49Å; I177-F362 HydrophobicContact CG2-CE1 4.45Å; I177-L363 HydrophobicContact CD1-CD1 4.09Å; I177-L363 HydrophobicContact CG2-CD1 4.05Å; I177-L366 HydrophobicContact CD1-CD1 3.98Å; I177-L366 HydrophobicContact CD1-CD2 4.36Å; I177-L366 HydrophobicContact CG1-CD1 4.13Å; I177-L394 HydrophobicContact CG2-CD1 3.97Å
178A98.5Very high97.9Very high1 Ų128 Ų281%0.00812%0.124CC..Hα-helixtrans-58.5-42.1179.100000112E123 L174 L175 S176 L180 F181 Q182E123-A178 HydrophobicContact CB-CB 3.88Å; L174-A178 WeakPolarHBondContact O-CB 3.38Å; L174-A178 PolarHBondContact O-N 3.45Å; L175-A178 PolarHBondContact O-N 2.92Å; S176-A178 PolarHBondContact O-N 3.49Å; A178-L180 VanDerWaalsContact C-N 3.33Å; A178-L180 PolarHBondContact O-N 3.26Å; A178-F181 PolarHBondContact O-N 3.28Å; A178-Q182 WeakPolarHBondContact O-CB 3.47Å; A178-Q182 WeakPolarHBondContact O-CG 3.33Å; A178-Q182 PolarHBondContact O-N 2.94Å
179R98.3Very high97.9Very high14 Ų1427.4 Ų27.45%0.05312%0.123CC..Hα-helixtrans-61.5-40.1175-65.7-56.5-179.9-112.7-0.7112.3Y119 E123 L175 S176 I177 Q182 K183 R184 E187 L191Y119-R179 PolarHBondContact OH-NH2 3.23Å; E123-R179 IonicContact OE2-CZ 3.91Å; E123-R179 IonicContact OE2-NH1 2.92Å; E123-R179 PolarHBondContact OE2-NH1 3.37Å; L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 3.46Å; S176-R179 PolarHBondContact O-N 2.95Å; I177-R179 VanDerWaalsContact C-N 3.31Å; I177-R179 PolarHBondContact O-N 3.35Å; R179-Q182 CarbonylContact O-C 3.42Å; R179-Q182 PolarHBondContact O-N 2.92Å; R179-K183 PolarHBondContact O-N 3.36Å; R179-R184 HydrophobicContact CB-CB 4.24Å; R179-R184 VanDerWaalsContact NE-CZ 3.34Å; R179-R184 WeakPolarHBondContact O-CA 3.26Å; R179-R184 PolarHBondContact O-N 2.97Å; R179-E187 HydrophobicContact CB-CB 4.23Å; R179-E187 WeakPolarHBondContact CD-OE2 3.37Å; R179-E187 HydrophobicContact CG-CB 4.02Å; R179-E187 IonicContact CZ-OE2 2.88Å; R179-E187 IonicContact NE-OE2 3.9Å; R179-E187 PolarHBondContact NE-OE2 2.77Å; R179-L191 HydrophobicContact CG-CD1 3.93Å
180L97.7Very high97.9Very high0 Ų032.2 Ų32.20%014%0.144CC..Hα-helixtrans-65.1-37.9174.7-65.7-177.7000112.9S176 I177 A178 Q182 K183 Y209 Y212 L213 F362S176-L180 WeakPolarHBondContact O-CG 3.36Å; S176-L180 PolarHBondContact O-N 3.46Å; S176-L180 VanDerWaalsContact O-N 3.08Å; I177-L180 WeakPolarHBondContact O-CB 3.28Å; I177-L180 PolarHBondContact O-N 2.94Å; I177-L180 VanDerWaalsContact O-N 3.09Å; A178-L180 VanDerWaalsContact C-N 3.33Å; A178-L180 PolarHBondContact O-N 3.26Å; L180-Q182 VanDerWaalsContact C-N 3.3Å; L180-K183 PolarHBondContact O-N 3.03Å; L180-Y209 HydrophobicContact CD1-CD1 3.85Å; L180-Y209 HydrophobicContact CD1-CE1 3.53Å; L180-Y212 HydrophobicContact CB-CE1 4.06Å; L180-Y212 HydrophobicContact CD1-CD1 4.09Å; L180-Y212 HydrophobicContact CD1-CE1 4.19Å; L180-Y212 HydrophobicContact CD2-CE1 4.25Å; L180-Y212 HydrophobicContact CG-CE1 4.4Å; L180-L213 HydrophobicContact CD2-CD2 3.76Å; L180-F362 HydrophobicContact CB-CE1 4.46Å; L180-F362 HydrophobicContact CD1-CD1 4.21Å; L180-F362 HydrophobicContact CD1-CE1 3.5Å; L180-F362 HydrophobicContact CD1-CE2 4.13Å; L180-F362 HydrophobicContact CD1-CZ 3.45Å; L180-F362 VanDerWaalsContact CD1-CZ 3.45Å
181F96.4Very high97.9Very high50 Ų5033 Ų3322%0.21915%0.148CC..Hα-helixtrans-65.4-35.4173-87.9-112.4000112.1C127 I177 A178 K183 P359 R360 L363C127-F181 HydrophobicContact CB-CB 3.9Å; C127-F181 HydrophobicContact CB-CD1 4.05Å; C127-F181 HydrophobicContact CB-CG 4.25Å; I177-F181 HydrophobicContact CG2-CD2 3.84Å; I177-F181 HydrophobicContact CG2-CE2 3.72Å; I177-F181 VanDerWaalsContact O-CD2 3.3Å; I177-F181 WeakPolarHBondContact O-CD2 3.03Å; I177-F181 PolarHBondContact O-N 3.44Å; A178-F181 PolarHBondContact O-N 3.28Å; F181-K183 PolarHBondContact O-N 2.97Å; F181-P359 HydrophobicContact CB-CB 4.29Å; F181-P359 HydrophobicContact CD1-CB 3.68Å; F181-P359 HydrophobicContact CD2-CB 3.52Å; F181-P359 HydrophobicContact CE1-CB 3.78Å; F181-P359 HydrophobicContact CE2-CB 3.62Å; F181-P359 WeakPolarHBondContact CE2-O 3.37Å; F181-P359 HydrophobicContact CG-CB 3.55Å; F181-P359 HydrophobicContact CG-CG 4.4Å; F181-P359 HydrophobicContact CZ-CB 3.75Å; F181-P359 WeakPolarHBondContact CZ-O 3.37Å; F181-R360 HydrophobicContact CE1-CG 4.15Å; F181-R360 HydrophobicContact CZ-CG 4.4Å; F181-L363 HydrophobicContact CE2-CB 4.06Å; F181-L363 HydrophobicContact CE2-CD2 4.14Å; F181-L363 HydrophobicContact CZ-CB 3.98Å; F181-L363 HydrophobicContact CZ-CD2 3.73Å; F181-L363 HydrophobicContact CZ-CG 4.49Å
182Q96.2Very high97.9Very high54 Ų5433.7 Ų33.725%0.25215%0.151SC..THydrogen-bonded Turntrans-79.98.9176-64.5166.1-4.900113.2E123 A178 R179 L180 R184E123-Q182 PolarHBondContact OE2-NE2 3.3Å; A178-Q182 WeakPolarHBondContact O-CB 3.47Å; A178-Q182 WeakPolarHBondContact O-CG 3.33Å; A178-Q182 PolarHBondContact O-N 2.94Å; R179-Q182 CarbonylContact O-C 3.42Å; R179-Q182 PolarHBondContact O-N 2.92Å; L180-Q182 VanDerWaalsContact C-N 3.3Å; Q182-R184 HydrophobicContact CB-CG 4.4Å; Q182-R184 PolarHBondContact O-N 2.93Å
183K95.3Very high97.9Very high169 Ų16933.2 Ų33.274%0.73515%0.15SC*.THydrogen-bonded Turntrans61.116.4-176.9-54.5178.4178.3177.60114.7R179 L180 F181 H185R179-K183 PolarHBondContact O-N 3.36Å; L180-K183 PolarHBondContact O-N 3.03Å; F181-K183 PolarHBondContact O-N 2.97Å; K183-H185 VanDerWaalsContact C-N 3.3Å; K183-H185 PolarHBondContact O-CD2 2.97Å; K183-H185 VanDerWaalsContact O-CD2 3.24Å; K183-H185 PolarHBondContact O-N 3.12Å; K183-H185 VanDerWaalsContact O-N 3.14Å
184R96.9Very high97.9Very high90 Ų9034.2 Ų34.234%0.3416%0.155SC..  trans-8969175-62.7-165.7-76.1169.2-23.5109.8R179 Q182 M186 E187 G188R179-R184 HydrophobicContact CB-CB 4.24Å; R179-R184 VanDerWaalsContact NE-CZ 3.34Å; R179-R184 WeakPolarHBondContact O-CA 3.26Å; R179-R184 PolarHBondContact O-N 2.97Å; Q182-R184 HydrophobicContact CB-CG 4.4Å; Q182-R184 PolarHBondContact O-N 2.93Å; R184-M186 PolarHBondContact O-N 3.32Å; R184-E187 HydrophobicContact CB-CB 4.35Å; R184-E187 WeakPolarHBondContact CD-OE1 3.25Å; R184-E187 IonicContact CZ-OE1 2.93Å; R184-E187 IonicContact CZ-OE2 3.78Å; R184-E187 IonicContact NE-OE1 3.91Å; R184-E187 IonicContact NE-OE2 2.97Å; R184-E187 IonicContact NH1-OE1 3.54Å; R184-E187 PolarHBondContact NH1-OE1 2.99Å; R184-E187 IonicContact NH1-OE2 3.83Å; R184-E187 PolarHBondContact NH1-OE2 3.42Å; R184-E187 PolarHBondContact O-N 3.29Å; R184-G188 PolarHBondContact O-N 2.81Å
185H96.6Very high97.9Very high26 Ų2634.2 Ų34.212%0.1216%0.155CC..Hα-helixtrans-62.2-40.1-170.3-62.7-69.2000113.9K183 G188 A189 L213 Y217K183-H185 VanDerWaalsContact C-N 3.3Å; K183-H185 PolarHBondContact O-CD2 2.97Å; K183-H185 VanDerWaalsContact O-CD2 3.24Å; K183-H185 PolarHBondContact O-N 3.12Å; K183-H185 VanDerWaalsContact O-N 3.14Å; H185-G188 PolarHBondContact O-N 3.47Å; H185-A189 WeakPolarHBondContact O-CB 3.37Å; H185-A189 PolarHBondContact O-N 3.39Å; H185-L213 HydrophobicContact CB-CD2 4Å; H185-Y217 HydrophobicContact CB-CD2 3.59Å; H185-Y217 HydrophobicContact CB-CE2 4.21Å; H185-Y217 HydrophobicContact CB-CG 3.92Å; H185-Y217 AromaticContact CD2-CD2 3.67Å; H185-Y217 AromaticContact CG-CD2 3.81Å
186M97.2Very high97.8Very high54 Ų5436 Ų3627%0.26617%0.165SC..Hα-helixtrans-64.7-46.8178.7-63.6-59.690.500112.1R184 G188 A189 F190 Y217 L241R184-M186 PolarHBondContact O-N 3.32Å; M186-G188 VanDerWaalsContact C-N 3.35Å; M186-G188 PolarHBondContact O-N 3.43Å; M186-A189 PolarHBondContact O-N 3Å; M186-F190 WeakPolarHBondContact O-CB 3.4Å; M186-F190 PolarHBondContact O-N 3.43Å; M186-Y217 HydrophobicContact CE-CD1 3.57Å; M186-Y217 HydrophobicContact CE-CD2 4.21Å; M186-Y217 HydrophobicContact CE-CE1 3.06Å; M186-Y217 HydrophobicContact CE-CE2 3.79Å; M186-Y217 HydrophobicContact CE-CG 4.1Å; M186-Y217 HydrophobicContact SD-CE1 4.12Å; M186-L241 HydrophobicContact CE-CD2 3.24Å; M186-L241 HydrophobicContact CE-CG 3.72Å; M186-L241 HydrophobicContact SD-CD2 4.28Å
187E98.1Very high97.8Very high78 Ų7837 Ų3736%0.36417%0.169SC..Hα-helixtrans-61.5-44175.9-67.6-177.3-139.900111.3R179 R184 A189 F190 L191R179-E187 HydrophobicContact CB-CB 4.23Å; R179-E187 WeakPolarHBondContact CD-OE2 3.37Å; R179-E187 HydrophobicContact CG-CB 4.02Å; R179-E187 IonicContact CZ-OE2 2.88Å; R179-E187 IonicContact NE-OE2 3.9Å; R179-E187 PolarHBondContact NE-OE2 2.77Å; R184-E187 HydrophobicContact CB-CB 4.35Å; R184-E187 WeakPolarHBondContact CD-OE1 3.25Å; R184-E187 IonicContact CZ-OE1 2.93Å; R184-E187 IonicContact CZ-OE2 3.78Å; R184-E187 IonicContact NE-OE1 3.91Å; R184-E187 IonicContact NE-OE2 2.97Å; R184-E187 IonicContact NH1-OE1 3.54Å; R184-E187 PolarHBondContact NH1-OE1 2.99Å; R184-E187 IonicContact NH1-OE2 3.83Å; R184-E187 PolarHBondContact NH1-OE2 3.42Å; R184-E187 PolarHBondContact O-N 3.29Å; E187-A189 VanDerWaalsContact C-N 3.35Å; E187-A189 PolarHBondContact O-N 3.49Å; E187-F190 PolarHBondContact O-N 3.32Å; E187-L191 WeakPolarHBondContact O-CB 3.39Å; E187-L191 VanDerWaalsContact O-CG 3.29Å; E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.93Å
188G98.3Very high97.8Very high0 Ų038.1 Ų38.10%017%0.174CC..Hα-helixtrans-60.2-43.617700000112.6S176 R184 H185 M186 F192S176-G188 PolarHBondContact OG-O 2.87Å; R184-G188 PolarHBondContact O-N 2.81Å; H185-G188 PolarHBondContact O-N 3.47Å; M186-G188 VanDerWaalsContact C-N 3.35Å; M186-G188 PolarHBondContact O-N 3.43Å; G188-F192 WeakPolarHBondContact O-CB 3.21Å; G188-F192 PolarHBondContact O-N 3.29Å; G188-F192 VanDerWaalsContact O-N 3.09Å
189A98.3Very high97.8Very high6 Ų639 Ų395%0.0518%0.178CC..Hα-helixtrans-65.9-44.3176.700000112.2H185 M186 E187 F192 A193 L213 L241H185-A189 WeakPolarHBondContact O-CB 3.37Å; H185-A189 PolarHBondContact O-N 3.39Å; M186-A189 PolarHBondContact O-N 3Å; E187-A189 VanDerWaalsContact C-N 3.35Å; E187-A189 PolarHBondContact O-N 3.49Å; A189-F192 PolarHBondContact O-N 3.17Å; A189-A193 WeakPolarHBondContact O-CB 3.43Å; A189-A193 PolarHBondContact O-N 3.18Å; A189-L213 HydrophobicContact CB-CD1 3.72Å; A189-L241 HydrophobicContact CB-CD2 3.63Å
190F98.7Very high97.6Very high102 Ų10241.2 Ų41.245%0.44719%0.189SC..Hα-helixtrans-58.7-51.1176.2171.1-100.3000111.6M186 E187 F192 A193 V194 V244 V248M186-F190 WeakPolarHBondContact O-CB 3.4Å; M186-F190 PolarHBondContact O-N 3.43Å; E187-F190 PolarHBondContact O-N 3.32Å; F190-F192 VanDerWaalsContact C-N 3.29Å; F190-F192 PolarHBondContact O-N 2.98Å; F190-A193 PolarHBondContact O-N 3.19Å; F190-V194 HydrophobicContact CD2-CG2 4.42Å; F190-V194 HydrophobicContact CE1-CG2 4.13Å; F190-V194 HydrophobicContact CE2-CG2 4.02Å; F190-V194 HydrophobicContact CZ-CG2 3.86Å; F190-V194 WeakPolarHBondContact O-CG2 3.27Å; F190-V194 PolarHBondContact O-N 3.39Å; F190-V244 HydrophobicContact CB-CG1 3.75Å; F190-V244 HydrophobicContact CD2-CG1 4.21Å; F190-V248 HydrophobicContact CD2-CG2 3.67Å; F190-V248 HydrophobicContact CE2-CG2 3.73Å
191L98.7Very high97.5Very high25 Ų2543.2 Ų43.213%0.13120%0.199CC..Hα-helixtrans-60.5-38.8178.9-71.8168.1000112.3L172 L175 R179 E187 L195L172-L191 HydrophobicContact CD2-CD2 4.27Å; L175-L191 HydrophobicContact CB-CD1 4.27Å; L175-L191 HydrophobicContact CD2-CD1 3.93Å; L175-L191 HydrophobicContact CD2-CD2 4.22Å; L175-L191 HydrophobicContact CG-CD1 3.7Å; R179-L191 HydrophobicContact CG-CD1 3.93Å; E187-L191 WeakPolarHBondContact O-CB 3.39Å; E187-L191 VanDerWaalsContact O-CG 3.29Å; E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.93Å; L191-L195 WeakPolarHBondContact O-CB 3.31Å; L191-L195 PolarHBondContact O-N 3.34Å
192F98.7Very high97.6Very high13 Ų1340.9 Ų40.96%0.05719%0.189CC..Hα-helixtrans-70.8-39.7177.2-175.9-110.7000112.5G188 A189 F190 V194 L195 L196 V205 A206 Y209G188-F192 WeakPolarHBondContact O-CB 3.21Å; G188-F192 PolarHBondContact O-N 3.29Å; G188-F192 VanDerWaalsContact O-N 3.09Å; A189-F192 PolarHBondContact O-N 3.17Å; F190-F192 VanDerWaalsContact C-N 3.29Å; F190-F192 PolarHBondContact O-N 2.98Å; F192-V194 VanDerWaalsContact C-N 3.32Å; F192-V194 PolarHBondContact O-N 3.36Å; F192-L195 HydrophobicContact CD2-CD2 4.24Å; F192-L195 WeakPolarHBondContact O-CB 3.4Å; F192-L195 PolarHBondContact O-N 2.94Å; F192-L196 HydrophobicContact CD1-CD1 4.12Å; F192-L196 HydrophobicContact CD1-CG 4.46Å; F192-L196 HydrophobicContact CE1-CD1 3.66Å; F192-L196 HydrophobicContact CE1-CD2 4.32Å; F192-L196 HydrophobicContact CE1-CG 3.99Å; F192-L196 HydrophobicContact CE2-CG 4.5Å; F192-L196 HydrophobicContact CZ-CD1 4.14Å; F192-L196 HydrophobicContact CZ-CD2 3.96Å; F192-L196 HydrophobicContact CZ-CG 4Å; F192-L196 PolarHBondContact O-N 3.49Å; F192-V205 HydrophobicContact CE2-CG2 3.73Å; F192-V205 HydrophobicContact CZ-CG2 4.03Å; F192-A206 HydrophobicContact CE1-CB 3.89Å; F192-A206 HydrophobicContact CZ-CB 3.88Å; F192-Y209 HydrophobicContact CB-CD1 3.92Å; F192-Y209 HydrophobicContact CB-CE1 3.67Å; F192-Y209 HydrophobicContact CB-CG 4.49Å; F192-Y209 AromaticContact CD1-CD1 3.84Å; F192-Y209 HydrophobicContact CD1-CD1 3.84Å; F192-Y209 AromaticContact CD1-CD2 3.91Å; F192-Y209 HydrophobicContact CD1-CD2 3.91Å; F192-Y209 HydrophobicContact CD1-CE1 4.3Å; F192-Y209 HydrophobicContact CD1-CE2 4.36Å; F192-Y209 AromaticContact CD1-CG 3.61Å; F192-Y209 HydrophobicContact CD1-CG 3.61Å; F192-Y209 HydrophobicContact CD2-CD1 4.21Å; F192-Y209 AromaticContact CD2-CD2 3.68Å; F192-Y209 HydrophobicContact CD2-CD2 3.68Å; F192-Y209 AromaticContact CD2-CE1 3.91Å; F192-Y209 HydrophobicContact CD2-CE1 3.91Å; F192-Y209 AromaticContact CD2-CE2 3.32Å; F192-Y209 HydrophobicContact CD2-CE2 3.32Å; F192-Y209 HydrophobicContact CD2-CG 4.09Å; F192-Y209 AromaticContact CD2-CZ 3.44Å; F192-Y209 VanDerWaalsContact CD2-CZ 3.44Å; F192-Y209 HydrophobicContact CE1-CD1 4.45Å; F192-Y209 AromaticContact CE1-CD2 3.76Å; F192-Y209 HydrophobicContact CE1-CD2 3.76Å; F192-Y209 HydrophobicContact CE1-CE2 4.41Å; F192-Y209 AromaticContact CE1-CG 3.76Å; F192-Y209 HydrophobicContact CE1-CG 3.76Å; F192-Y209 AromaticContact CE2-CD2 3.54Å; F192-Y209 HydrophobicContact CE2-CD2 3.54Å; F192-Y209 AromaticContact CE2-CE2 3.41Å; F192-Y209 HydrophobicContact CE2-CE2 3.41Å; F192-Y209 VanDerWaalsContact CE2-CE2 3.41Å; F192-Y209 HydrophobicContact CE2-CG 4.25Å; F192-Y209 AromaticContact CG-CD1 3.7Å; F192-Y209 HydrophobicContact CG-CD1 3.7Å; F192-Y209 AromaticContact CG-CD2 3.87Å; F192-Y209 HydrophobicContact CG-CD2 3.87Å; F192-Y209 AromaticContact CG-CE1 3.68Å; F192-Y209 HydrophobicContact CG-CE1 3.68Å; F192-Y209 AromaticContact CG-CE2 3.84Å; F192-Y209 HydrophobicContact CG-CE2 3.84Å; F192-Y209 AromaticContact CG-CG 3.78Å; F192-Y209 HydrophobicContact CG-CG 3.78Å; F192-Y209 AromaticContact CG-CZ 3.73Å; F192-Y209 AromaticContact CZ-CD2 3.58Å; F192-Y209 HydrophobicContact CZ-CD2 3.58Å; F192-Y209 AromaticContact CZ-CE2 3.98Å; F192-Y209 HydrophobicContact CZ-CE2 3.98Å; F192-Y209 HydrophobicContact CZ-CG 4.1Å
193A98.5Very high97.6Very high5 Ų543 Ų434%0.04120%0.201CC..Hα-helixtrans-61.3-43174.200000111A189 F190 L196 H197 V248A189-A193 WeakPolarHBondContact O-CB 3.43Å; A189-A193 PolarHBondContact O-N 3.18Å; F190-A193 PolarHBondContact O-N 3.19Å; A193-L196 PolarHBondContact O-N 2.93Å; A193-H197 PolarHBondContact O-CD2 3.1Å; A193-H197 VanDerWaalsContact O-CD2 3.31Å; A193-H197 PolarHBondContact O-N 3.49Å; A193-V248 HydrophobicContact CB-CB 4.1Å; A193-V248 HydrophobicContact CB-CG1 3.98Å; A193-V248 HydrophobicContact CB-CG2 4.23Å
194V98.7Very high97.7Very high20 Ų2037.9 Ų37.912%0.12118%0.178CC..Hα-helixtrans-59.5-48.2174169.20000110.2F70 F190 F192 L196 H197 F198 V248F70-V194 HydrophobicContact CD2-CG1 4.17Å; F70-V194 HydrophobicContact CE2-CB 4.46Å; F70-V194 HydrophobicContact CE2-CG1 4.35Å; F70-V194 HydrophobicContact CE2-CG2 4.26Å; F190-V194 HydrophobicContact CD2-CG2 4.42Å; F190-V194 HydrophobicContact CE1-CG2 4.13Å; F190-V194 HydrophobicContact CE2-CG2 4.02Å; F190-V194 HydrophobicContact CZ-CG2 3.86Å; F190-V194 WeakPolarHBondContact O-CG2 3.27Å; F190-V194 PolarHBondContact O-N 3.39Å; F192-V194 VanDerWaalsContact C-N 3.32Å; F192-V194 PolarHBondContact O-N 3.36Å; V194-L196 VanDerWaalsContact C-N 3.33Å; V194-L196 PolarHBondContact O-N 3.49Å; V194-H197 CarbonylContact O-C 3.55Å; V194-H197 PolarHBondContact O-N 3.14Å; V194-F198 HydrophobicContact CG1-CD2 3.66Å; V194-F198 HydrophobicContact CG1-CE2 3.48Å; V194-F198 VanDerWaalsContact CG1-CE2 3.48Å; V194-F198 WeakPolarHBondContact O-CD2 3.27Å; V194-F198 PolarHBondContact O-N 3.12Å; V194-F198 VanDerWaalsContact O-N 3.12Å; V194-V248 HydrophobicContact CG2-CG1 3.91Å; V194-V248 HydrophobicContact CG2-CG2 4.23Å
195L98.7Very high97.8Very high0 Ų033.6 Ų33.60%016%0.162CC..Hα-helixtrans-57.1-40.7178.8179.460.8000113.7L169 L172 M173 L191 F192 H197 F198 K199 Y202L169-L195 HydrophobicContact CB-CD1 4.06Å; L169-L195 HydrophobicContact CD2-CD1 4.24Å; L169-L195 WeakPolarHBondContact O-CD1 3.12Å; L172-L195 HydrophobicContact CB-CB 4.35Å; L172-L195 HydrophobicContact CB-CD1 3.98Å; L172-L195 HydrophobicContact CD1-CD1 4.16Å; M173-L195 HydrophobicContact CB-CD2 3.56Å; M173-L195 HydrophobicContact CG-CD2 4.05Å; L191-L195 WeakPolarHBondContact O-CB 3.31Å; L191-L195 PolarHBondContact O-N 3.34Å; F192-L195 HydrophobicContact CD2-CD2 4.24Å; F192-L195 WeakPolarHBondContact O-CB 3.4Å; F192-L195 PolarHBondContact O-N 2.94Å; L195-H197 PolarHBondContact O-N 2.96Å; L195-F198 WeakPolarHBondContact O-CB 3.44Å; L195-F198 PolarHBondContact O-N 3.44Å; L195-K199 PolarHBondContact O-N 3.02Å; L195-Y202 HydrophobicContact CD1-CD2 3.51Å; L195-Y202 HydrophobicContact CD1-CE1 4.35Å; L195-Y202 HydrophobicContact CD1-CE2 3.3Å; L195-Y202 HydrophobicContact CD1-CG 4.15Å; L195-Y202 HydrophobicContact CD2-CD1 3.6Å; L195-Y202 HydrophobicContact CD2-CD2 3.94Å; L195-Y202 HydrophobicContact CD2-CE1 3.82Å; L195-Y202 HydrophobicContact CD2-CE2 4.17Å; L195-Y202 HydrophobicContact CD2-CG 3.67Å; L195-Y202 HydrophobicContact CG-CD1 4.08Å; L195-Y202 HydrophobicContact CG-CD2 3.46Å; L195-Y202 VanDerWaalsContact CG-CD2 3.46Å; L195-Y202 HydrophobicContact CG-CE1 4.34Å; L195-Y202 HydrophobicContact CG-CE2 3.78Å; L195-Y202 HydrophobicContact CG-CG 3.64Å
196L98Very high97.9Very high47 Ų4733.4 Ų33.425%0.24616%0.164CC..Hα-helixtrans-59.5-35.5176.3-75.4172.2000112.4F192 A193 V194 F198 K199 Y202 L203F192-L196 HydrophobicContact CD1-CD1 4.12Å; F192-L196 HydrophobicContact CD1-CG 4.46Å; F192-L196 HydrophobicContact CE1-CD1 3.66Å; F192-L196 HydrophobicContact CE1-CD2 4.32Å; F192-L196 HydrophobicContact CE1-CG 3.99Å; F192-L196 HydrophobicContact CE2-CG 4.5Å; F192-L196 HydrophobicContact CZ-CD1 4.14Å; F192-L196 HydrophobicContact CZ-CD2 3.96Å; F192-L196 HydrophobicContact CZ-CG 4Å; F192-L196 PolarHBondContact O-N 3.49Å; A193-L196 PolarHBondContact O-N 2.93Å; V194-L196 VanDerWaalsContact C-N 3.33Å; V194-L196 PolarHBondContact O-N 3.49Å; L196-F198 VanDerWaalsContact C-N 3.34Å; L196-K199 CarbonylContact O-C 3.58Å; L196-Y202 VanDerWaalsContact CD2-C 3.49Å; L196-L203 HydrophobicContact CD2-CB 4.45Å
197H98.3Very high97.9Very high21 Ų2133 Ų3310%0.09717%0.166CC..Hα-helixtrans-84-6.6176.8-75.3-72.5000113.8P68 F70 A193 V194 L195 S249 S252P68-H197 CarbonylContact C-O 3.58Å; P68-H197 VanDerWaalsContact CB-O 3.27Å; P68-H197 WeakPolarHBondContact CB-O 3.3Å; F70-H197 HydrophobicContact CB-CB 4.29Å; F70-H197 WeakPolarHBondContact CB-O 3.33Å; F70-H197 HydrophobicContact CD2-CB 3.32Å; F70-H197 HydrophobicContact CE2-CB 3.74Å; F70-H197 HydrophobicContact CG-CB 3.83Å; F70-H197 PolarHBondContact N-O 3.14Å; F70-H197 VanDerWaalsContact N-O 3.15Å; A193-H197 PolarHBondContact O-CD2 3.1Å; A193-H197 VanDerWaalsContact O-CD2 3.31Å; A193-H197 PolarHBondContact O-N 3.49Å; V194-H197 CarbonylContact O-C 3.55Å; V194-H197 PolarHBondContact O-N 3.14Å; L195-H197 PolarHBondContact O-N 2.96Å; H197-S249 WeakPolarHBondContact NE2-CA 3.22Å; H197-S249 PolarHBondContact NE2-OG 3.28Å; H197-S252 WeakPolarHBondContact CB-OG 3.49Å; H197-S252 VanDerWaalsContact CG-CB 3.47Å; H197-S252 VanDerWaalsContact CG-OG 3.29Å; H197-S252 WeakPolarHBondContact ND1-CB 3.41Å; H197-S252 PolarHBondContact ND1-OG 3.12Å
198F98.5Very high97.9Very high26 Ų2629.3 Ų29.311%0.11415%0.149CC..Hα-helixtrans-90.5-35.4166.3-89.4-83.8000112.5P68 F70 F71 F74 F168 L169 L172 V194 L195 L196P68-F198 WeakPolarHBondContact CD-O 3.36Å; F70-F198 HydrophobicContact CB-CD1 4.35Å; F70-F198 HydrophobicContact CB-CD2 3.88Å; F70-F198 HydrophobicContact CB-CE1 4.37Å; F70-F198 HydrophobicContact CB-CE2 3.88Å; F70-F198 HydrophobicContact CB-CG 4.11Å; F70-F198 HydrophobicContact CB-CZ 4.13Å; F70-F198 HydrophobicContact CD2-CD2 4.27Å; F70-F198 HydrophobicContact CD2-CE2 4.29Å; F70-F198 WeakPolarHBondContact O-CE1 3.42Å; F71-F198 HydrophobicContact CB-CD1 4.28Å; F71-F198 WeakPolarHBondContact CB-O 3.34Å; F71-F198 AromaticContact CD2-CD1 3.86Å; F71-F198 HydrophobicContact CD2-CD1 3.86Å; F71-F198 WeakPolarHBondContact CD2-O 3.12Å; F71-F198 HydrophobicContact CG-CD1 4.47Å; F74-F198 HydrophobicContact CB-CE1 3.67Å; F74-F198 HydrophobicContact CB-CZ 4.46Å; F74-F198 HydrophobicContact CG-CE1 4.12Å; F168-F198 AromaticContact CE1-CD1 3.77Å; F168-F198 HydrophobicContact CE1-CD1 3.77Å; F168-F198 AromaticContact CE1-CE1 3.53Å; F168-F198 HydrophobicContact CE1-CE1 3.53Å; F168-F198 HydrophobicContact CE1-CZ 4.16Å; F168-F198 HydrophobicContact CZ-CD1 4.3Å; F168-F198 AromaticContact CZ-CE1 3.73Å; F168-F198 HydrophobicContact CZ-CE1 3.73Å; F168-F198 AromaticContact CZ-CZ 3.88Å; F168-F198 HydrophobicContact CZ-CZ 3.88Å; L169-F198 HydrophobicContact CD2-CB 3.57Å; L169-F198 HydrophobicContact CD2-CD1 4.06Å; L169-F198 HydrophobicContact CD2-CG 4.02Å; L172-F198 HydrophobicContact CD1-CD2 3.92Å; L172-F198 HydrophobicContact CD1-CE2 4.18Å; L172-F198 HydrophobicContact CD1-CG 4.4Å; V194-F198 HydrophobicContact CG1-CD2 3.66Å; V194-F198 HydrophobicContact CG1-CE2 3.48Å; V194-F198 VanDerWaalsContact CG1-CE2 3.48Å; V194-F198 WeakPolarHBondContact O-CD2 3.27Å; V194-F198 PolarHBondContact O-N 3.12Å; V194-F198 VanDerWaalsContact O-N 3.12Å; L195-F198 WeakPolarHBondContact O-CB 3.44Å; L195-F198 PolarHBondContact O-N 3.44Å; L196-F198 VanDerWaalsContact C-N 3.34Å
199K97.4Very high97.9Very high20 Ų2029.5 Ų29.59%0.08715%0.149CC..  trans-156.2121.5176.4-159.5168.4177.6163.40111.1Y67 N166 L169 L195 L196 I201 Y202Y67-K199 HydrophobicContact CD2-CG 4.31Å; Y67-K199 HydrophobicContact CE2-CD 3.72Å; Y67-K199 HydrophobicContact CE2-CG 3.96Å; Y67-K199 WeakPolarHBondContact OH-CE 3.35Å; Y67-K199 PolarHBondContact OH-NZ 3.33Å; N166-K199 PolarHBondContact OD1-NZ 3.45Å; L169-K199 HydrophobicContact CD1-CB 3.91Å; L169-K199 HydrophobicContact CD1-CD 3.47Å; L169-K199 VanDerWaalsContact CD1-CD 3.47Å; L169-K199 HydrophobicContact CD1-CG 4.32Å; L195-K199 PolarHBondContact O-N 3.02Å; L196-K199 CarbonylContact O-C 3.58Å; K199-I201 HydrophobicContact CB-CG2 4.35Å; K199-I201 HydrophobicContact CD-CG2 3.92Å; K199-I201 HydrophobicContact CG-CB 4.46Å; K199-I201 HydrophobicContact CG-CG2 3.76Å; K199-I201 PolarHBondContact O-N 3.24Å; K199-I201 VanDerWaalsContact O-N 3.14Å; K199-Y202 HydrophobicContact CB-CD2 3.99Å; K199-Y202 HydrophobicContact CB-CE2 3.96Å; K199-Y202 VanDerWaalsContact O-CD2 3.31Å; K199-Y202 WeakPolarHBondContact O-CD2 3.33Å; K199-Y202 PolarHBondContact O-N 3.05Å
200H94.5Very high97.8Very high60 Ų6031.3 Ų31.328%0.27817%0.168SC..G310 helixtrans-67.8-15.9-174.659.9-97.3000113.8P68 Y202 L203 L269 F270P68-H200 HydrophobicContact CG-CB 4.39Å; H200-Y202 PolarHBondContact O-N 3.05Å; H200-Y202 VanDerWaalsContact O-N 3.14Å; H200-L203 WeakPolarHBondContact O-CB 3.46Å; H200-L203 PolarHBondContact O-N 3.02Å; H200-L269 PolarHBondContact CE1-O 2.99Å; H200-F270 HydrophobicContact CB-CZ 4.33Å
201I95.9Very high97.7Very high41 Ų4127.7 Ų27.721%0.2116%0.155CC..G310 helixtrans-58.1-26.9175.9-161171.9000113.1K199 L203 Y204 A384K199-I201 HydrophobicContact CB-CG2 4.35Å; K199-I201 HydrophobicContact CD-CG2 3.92Å; K199-I201 HydrophobicContact CG-CB 4.46Å; K199-I201 HydrophobicContact CG-CG2 3.76Å; K199-I201 PolarHBondContact O-N 3.24Å; K199-I201 VanDerWaalsContact O-N 3.14Å; I201-L203 PolarHBondContact O-N 3.4Å; I201-L203 VanDerWaalsContact O-N 3.12Å; I201-Y204 HydrophobicContact CD1-CE2 4.37Å; I201-Y204 HydrophobicContact CG1-CD2 4Å; I201-Y204 HydrophobicContact CG1-CE2 3.82Å; I201-Y204 WeakPolarHBondContact O-CB 3.37Å; I201-Y204 VanDerWaalsContact O-CG 3.24Å; I201-Y204 PolarHBondContact O-N 2.94Å; I201-Y204 VanDerWaalsContact O-N 3.1Å; I201-A384 HydrophobicContact CD1-CB 3.88Å
202Y98.1Very high97.6Very high2 Ų226.9 Ų26.91%0.00815%0.15CC..G310 helixtrans-68.8-7.3176.5-66.7-75.9000113.1L169 F170 M173 L195 L196 K199 H200 Y204 V205 A206 L387L169-Y202 HydrophobicContact CB-CE2 3.95Å; L169-Y202 WeakPolarHBondContact CB-OH 3.46Å; L169-Y202 HydrophobicContact CD1-CE2 4.41Å; F170-Y202 HydrophobicContact CD1-CE1 4.15Å; F170-Y202 WeakPolarHBondContact CD1-OH 3.33Å; F170-Y202 HydrophobicContact CE1-CE1 4.1Å; F170-Y202 PolarHBondContact N-OH 2.97Å; M173-Y202 HydrophobicContact CB-CE1 4.22Å; M173-Y202 HydrophobicContact CG-CE1 4.34Å; M173-Y202 HydrophobicContact SD-CD1 3.97Å; M173-Y202 HydrophobicContact SD-CE1 3.69Å; L195-Y202 HydrophobicContact CD1-CD2 3.51Å; L195-Y202 HydrophobicContact CD1-CE1 4.35Å; L195-Y202 HydrophobicContact CD1-CE2 3.3Å; L195-Y202 HydrophobicContact CD1-CG 4.15Å; L195-Y202 HydrophobicContact CD2-CD1 3.6Å; L195-Y202 HydrophobicContact CD2-CD2 3.94Å; L195-Y202 HydrophobicContact CD2-CE1 3.82Å; L195-Y202 HydrophobicContact CD2-CE2 4.17Å; L195-Y202 HydrophobicContact CD2-CG 3.67Å; L195-Y202 HydrophobicContact CG-CD1 4.08Å; L195-Y202 HydrophobicContact CG-CD2 3.46Å; L195-Y202 VanDerWaalsContact CG-CD2 3.46Å; L195-Y202 HydrophobicContact CG-CE1 4.34Å; L195-Y202 HydrophobicContact CG-CE2 3.78Å; L195-Y202 HydrophobicContact CG-CG 3.64Å; L196-Y202 VanDerWaalsContact CD2-C 3.49Å; K199-Y202 HydrophobicContact CB-CD2 3.99Å; K199-Y202 HydrophobicContact CB-CE2 3.96Å; K199-Y202 VanDerWaalsContact O-CD2 3.31Å; K199-Y202 WeakPolarHBondContact O-CD2 3.33Å; K199-Y202 PolarHBondContact O-N 3.05Å; H200-Y202 PolarHBondContact O-N 3.05Å; H200-Y202 VanDerWaalsContact O-N 3.14Å; Y202-Y204 PolarHBondContact O-N 3.3Å; Y202-V205 HydrophobicContact CD1-CG2 4.45Å; Y202-V205 WeakPolarHBondContact O-CG2 3.36Å; Y202-V205 PolarHBondContact O-N 2.89Å; Y202-V205 VanDerWaalsContact O-N 3.1Å; Y202-A206 PolarHBondContact O-N 3.39Å; Y202-L387 HydrophobicContact CD1-CD1 3.56Å; Y202-L387 HydrophobicContact CE1-CD1 3.46Å; Y202-L387 VanDerWaalsContact CE1-CD1 3.46Å
203L96.8Very high97.5Very high98 Ų9827 Ų2751%0.51315%0.151SC..G310 helixtrans-56.1-29.2166.9-172.263.8000111.6L196 H200 I201 V205 A206 P207L196-L203 HydrophobicContact CD2-CB 4.45Å; H200-L203 WeakPolarHBondContact O-CB 3.46Å; H200-L203 PolarHBondContact O-N 3.02Å; I201-L203 PolarHBondContact O-N 3.4Å; I201-L203 VanDerWaalsContact O-N 3.12Å; L203-V205 PolarHBondContact O-N 3.12Å; L203-A206 HydrophobicContact CD1-CB 4.09Å; L203-A206 WeakPolarHBondContact O-CB 3.39Å; L203-A206 PolarHBondContact O-N 3.24Å; L203-A206 VanDerWaalsContact O-N 3.12Å; L203-P207 WeakPolarHBondContact O-CD 3.43Å
204Y97.4Very high97.4Very high62 Ų6229.7 Ų29.724%0.24317%0.165CC..G310 helixtrans-55.6-34.2176.1-69.61.1000112.9I201 Y202 C369 S373 L387I201-Y204 HydrophobicContact CD1-CE2 4.37Å; I201-Y204 HydrophobicContact CG1-CD2 4Å; I201-Y204 HydrophobicContact CG1-CE2 3.82Å; I201-Y204 WeakPolarHBondContact O-CB 3.37Å; I201-Y204 VanDerWaalsContact O-CG 3.24Å; I201-Y204 PolarHBondContact O-N 2.94Å; I201-Y204 VanDerWaalsContact O-N 3.1Å; Y202-Y204 PolarHBondContact O-N 3.3Å; Y204-C369 WeakPolarHBondContact O-CB 3.43Å; Y204-S373 WeakPolarHBondContact CB-OG 3.2Å; Y204-L387 HydrophobicContact CD2-CD2 4Å; Y204-L387 HydrophobicContact CG-CD2 4.42Å
205V98.2Very high97.2Very high0 Ų029 Ų290%016%0.16CC..G310 helixtrans-101.4-5.6-179-650000113.4F192 Y202 L203 P207 A208 Y209 L366 A370 L387F192-V205 HydrophobicContact CE2-CG2 3.73Å; F192-V205 HydrophobicContact CZ-CG2 4.03Å; Y202-V205 HydrophobicContact CD1-CG2 4.45Å; Y202-V205 WeakPolarHBondContact O-CG2 3.36Å; Y202-V205 PolarHBondContact O-N 2.89Å; Y202-V205 VanDerWaalsContact O-N 3.1Å; L203-V205 PolarHBondContact O-N 3.12Å; V205-P207 VanDerWaalsContact C-CD 3.43Å; V205-A208 WeakPolarHBondContact O-CB 3.46Å; V205-A208 PolarHBondContact O-N 3Å; V205-A208 VanDerWaalsContact O-N 3.15Å; V205-Y209 HydrophobicContact CG2-CE2 4.31Å; V205-Y209 PolarHBondContact O-N 2.99Å; V205-L366 HydrophobicContact CB-CD1 4.44Å; V205-L366 HydrophobicContact CB-CG 3.98Å; V205-L366 HydrophobicContact CG1-CD2 4.12Å; V205-L366 HydrophobicContact CG1-CG 3.95Å; V205-A370 HydrophobicContact CG1-CB 3.82Å; V205-L387 HydrophobicContact CG1-CD1 4.4Å; V205-L387 HydrophobicContact CG1-CD2 4.2Å; V205-L387 HydrophobicContact CG1-CG 4.23Å
206A98.1Very high96.8Very high21 Ų2130.7 Ų30.717%0.17417%0.172CC..Hα-helixtrans-57-37.3-179.100000114.4F192 Y202 L203 A208 Y209 G210F192-A206 HydrophobicContact CE1-CB 3.89Å; F192-A206 HydrophobicContact CZ-CB 3.88Å; Y202-A206 PolarHBondContact O-N 3.39Å; L203-A206 HydrophobicContact CD1-CB 4.09Å; L203-A206 WeakPolarHBondContact O-CB 3.39Å; L203-A206 PolarHBondContact O-N 3.24Å; L203-A206 VanDerWaalsContact O-N 3.12Å; A206-A208 VanDerWaalsContact C-N 3.29Å; A206-A208 PolarHBondContact O-N 2.91Å; A206-Y209 WeakPolarHBondContact O-CB 3.39Å; A206-Y209 PolarHBondContact O-N 2.89Å; A206-Y209 VanDerWaalsContact O-N 3.16Å; A206-G210 PolarHBondContact O-N 3.18Å
207P97.9Very high96.6Very high47 Ų4730.2 Ų30.231%0.30517%0.167SC..Hα-helixtrans-56.5-41.1175.6-27.936.6000113.3L203 V205 Y209 G210 V211 I345 I349L203-P207 WeakPolarHBondContact O-CD 3.43Å; V205-P207 VanDerWaalsContact C-CD 3.43Å; P207-Y209 PolarHBondContact O-N 3.45Å; P207-G210 PolarHBondContact O-N 3.23Å; P207-V211 WeakPolarHBondContact O-CB 3.24Å; P207-V211 WeakPolarHBondContact O-CG2 3.31Å; P207-V211 PolarHBondContact O-N 2.87Å; P207-I345 HydrophobicContact CB-CG2 4.41Å; P207-I349 VanDerWaalsContact C-CD1 3.49Å; P207-I349 HydrophobicContact CB-CD1 3.71Å; P207-I349 HydrophobicContact CB-CG1 4.31Å
208A97.9Very high96.5Very high0 Ų029.3 Ų29.30%016%0.163CC..Hα-helixtrans-64.1-41.5178.500000111.7V205 A206 Y212 F362 C365 L366V205-A208 WeakPolarHBondContact O-CB 3.46Å; V205-A208 PolarHBondContact O-N 3Å; V205-A208 VanDerWaalsContact O-N 3.15Å; A206-A208 VanDerWaalsContact C-N 3.29Å; A206-A208 PolarHBondContact O-N 2.91Å; A208-Y212 WeakPolarHBondContact O-CB 3.4Å; A208-Y212 PolarHBondContact O-N 2.94Å; A208-F362 HydrophobicContact CB-CD2 4.42Å; A208-F362 HydrophobicContact CB-CE2 4.26Å; A208-C365 HydrophobicContact CB-CB 4.44Å; A208-L366 HydrophobicContact CB-CB 3.99Å
209Y98.2Very high96.2Very high3 Ų328.5 Ų28.51%0.01216%0.159CC..Hα-helixtrans-63.4-51.2175.2-86-89.6000112.1S176 L180 F192 V205 A206 P207 V211 Y212 L213 F362 L366S176-Y209 WeakPolarHBondContact OG-CE1 3.43Å; S176-Y209 PolarHBondContact OG-OH 3.1Å; L180-Y209 HydrophobicContact CD1-CD1 3.85Å; L180-Y209 HydrophobicContact CD1-CE1 3.53Å; F192-Y209 HydrophobicContact CB-CD1 3.92Å; F192-Y209 HydrophobicContact CB-CE1 3.67Å; F192-Y209 HydrophobicContact CB-CG 4.49Å; F192-Y209 AromaticContact CD1-CD1 3.84Å; F192-Y209 HydrophobicContact CD1-CD1 3.84Å; F192-Y209 AromaticContact CD1-CD2 3.91Å; F192-Y209 HydrophobicContact CD1-CD2 3.91Å; F192-Y209 HydrophobicContact CD1-CE1 4.3Å; F192-Y209 HydrophobicContact CD1-CE2 4.36Å; F192-Y209 AromaticContact CD1-CG 3.61Å; F192-Y209 HydrophobicContact CD1-CG 3.61Å; F192-Y209 HydrophobicContact CD2-CD1 4.21Å; F192-Y209 AromaticContact CD2-CD2 3.68Å; F192-Y209 HydrophobicContact CD2-CD2 3.68Å; F192-Y209 AromaticContact CD2-CE1 3.91Å; F192-Y209 HydrophobicContact CD2-CE1 3.91Å; F192-Y209 AromaticContact CD2-CE2 3.32Å; F192-Y209 HydrophobicContact CD2-CE2 3.32Å; F192-Y209 HydrophobicContact CD2-CG 4.09Å; F192-Y209 AromaticContact CD2-CZ 3.44Å; F192-Y209 VanDerWaalsContact CD2-CZ 3.44Å; F192-Y209 HydrophobicContact CE1-CD1 4.45Å; F192-Y209 AromaticContact CE1-CD2 3.76Å; F192-Y209 HydrophobicContact CE1-CD2 3.76Å; F192-Y209 HydrophobicContact CE1-CE2 4.41Å; F192-Y209 AromaticContact CE1-CG 3.76Å; F192-Y209 HydrophobicContact CE1-CG 3.76Å; F192-Y209 AromaticContact CE2-CD2 3.54Å; F192-Y209 HydrophobicContact CE2-CD2 3.54Å; F192-Y209 AromaticContact CE2-CE2 3.41Å; F192-Y209 HydrophobicContact CE2-CE2 3.41Å; F192-Y209 VanDerWaalsContact CE2-CE2 3.41Å; F192-Y209 HydrophobicContact CE2-CG 4.25Å; F192-Y209 AromaticContact CG-CD1 3.7Å; F192-Y209 HydrophobicContact CG-CD1 3.7Å; F192-Y209 AromaticContact CG-CD2 3.87Å; F192-Y209 HydrophobicContact CG-CD2 3.87Å; F192-Y209 AromaticContact CG-CE1 3.68Å; F192-Y209 HydrophobicContact CG-CE1 3.68Å; F192-Y209 AromaticContact CG-CE2 3.84Å; F192-Y209 HydrophobicContact CG-CE2 3.84Å; F192-Y209 AromaticContact CG-CG 3.78Å; F192-Y209 HydrophobicContact CG-CG 3.78Å; F192-Y209 AromaticContact CG-CZ 3.73Å; F192-Y209 AromaticContact CZ-CD2 3.58Å; F192-Y209 HydrophobicContact CZ-CD2 3.58Å; F192-Y209 AromaticContact CZ-CE2 3.98Å; F192-Y209 HydrophobicContact CZ-CE2 3.98Å; F192-Y209 HydrophobicContact CZ-CG 4.1Å; V205-Y209 HydrophobicContact CG2-CE2 4.31Å; V205-Y209 PolarHBondContact O-N 2.99Å; A206-Y209 WeakPolarHBondContact O-CB 3.39Å; A206-Y209 PolarHBondContact O-N 2.89Å; A206-Y209 VanDerWaalsContact O-N 3.16Å; P207-Y209 PolarHBondContact O-N 3.45Å; Y209-V211 PolarHBondContact O-N 3.34Å; Y209-Y212 PolarHBondContact O-N 3.33Å; Y209-L213 VanDerWaalsContact O-CB 3.31Å; Y209-L213 WeakPolarHBondContact O-CB 3.12Å; Y209-L213 WeakPolarHBondContact O-CG 3.49Å; Y209-L213 PolarHBondContact O-N 2.98Å; Y209-F362 HydrophobicContact CD1-CE2 4.23Å; Y209-F362 HydrophobicContact CD1-CZ 4.07Å; Y209-F362 HydrophobicContact CD2-CE2 4.11Å; Y209-F362 HydrophobicContact CD2-CZ 4.14Å; Y209-F362 HydrophobicContact CE1-CE2 4.43Å; Y209-F362 AromaticContact CE1-CZ 3.82Å; Y209-F362 HydrophobicContact CE1-CZ 3.82Å; Y209-F362 HydrophobicContact CE2-CE2 4.34Å; Y209-F362 AromaticContact CE2-CZ 3.92Å; Y209-F362 HydrophobicContact CE2-CZ 3.92Å; Y209-F362 HydrophobicContact CG-CE2 4.07Å; Y209-F362 HydrophobicContact CG-CZ 4.23Å; Y209-F362 AromaticContact CZ-CZ 3.77Å; Y209-L366 HydrophobicContact CD2-CD1 4.1Å; Y209-L366 HydrophobicContact CE2-CD1 3.4Å; Y209-L366 VanDerWaalsContact CE2-CD1 3.4Å
210G96.9Very high95.8Very high44 Ų4431.4 Ų31.445%0.45418%0.179SC..Hα-helixtrans-58.4-49.9-178.300000111.9A206 P207 L214A206-G210 PolarHBondContact O-N 3.18Å; P207-G210 PolarHBondContact O-N 3.23Å; G210-L214 WeakPolarHBondContact O-CB 3.46Å; G210-L214 PolarHBondContact O-N 2.9Å
211V96.7Very high95.5Very high27 Ų2730 Ų3016%0.16418%0.178CC..Hα-helixtrans-67.8-41.8-179.5172.10000111.4P207 Y209 R215 I349 L352 W353P207-V211 WeakPolarHBondContact O-CB 3.24Å; P207-V211 WeakPolarHBondContact O-CG2 3.31Å; P207-V211 PolarHBondContact O-N 2.87Å; Y209-V211 PolarHBondContact O-N 3.34Å; V211-R215 WeakPolarHBondContact O-CB 3.3Å; V211-R215 PolarHBondContact O-N 2.89Å; V211-I349 HydrophobicContact CB-CD1 4.4Å; V211-I349 HydrophobicContact CB-CG2 4.23Å; V211-I349 HydrophobicContact CG1-CG2 4.12Å; V211-I349 HydrophobicContact CG2-CD1 4.17Å; V211-I349 HydrophobicContact CG2-CG2 3.48Å; V211-I349 VanDerWaalsContact CG2-CG2 3.48Å; V211-L352 HydrophobicContact CB-CD2 4.16Å; V211-L352 HydrophobicContact CG1-CB 4.34Å; V211-L352 HydrophobicContact CG1-CD2 3.91Å; V211-L352 HydrophobicContact CG1-CG 4.07Å; V211-W353 HydrophobicContact CG1-CB 4.15Å; V211-W353 HydrophobicContact CG1-CE3 4.09Å
212Y96.8Very high95Very high8 Ų831.6 Ų31.63%0.03119%0.187CC..Hα-helixtrans-64.9-45.8178.7177.8-112.8000112.6L180 A208 Y209 R215 S216 L352 P359 F362L180-Y212 HydrophobicContact CB-CE1 4.06Å; L180-Y212 HydrophobicContact CD1-CD1 4.09Å; L180-Y212 HydrophobicContact CD1-CE1 4.19Å; L180-Y212 HydrophobicContact CD2-CE1 4.25Å; L180-Y212 HydrophobicContact CG-CE1 4.4Å; A208-Y212 WeakPolarHBondContact O-CB 3.4Å; A208-Y212 PolarHBondContact O-N 2.94Å; Y209-Y212 PolarHBondContact O-N 3.33Å; Y212-R215 PolarHBondContact O-N 3.48Å; Y212-S216 WeakPolarHBondContact CD2-OG 3.48Å; Y212-S216 WeakPolarHBondContact CE2-OG 3.36Å; Y212-S216 WeakPolarHBondContact O-CA 3.39Å; Y212-S216 WeakPolarHBondContact O-CB 3.44Å; Y212-S216 PolarHBondContact O-N 3.15Å; Y212-S216 PolarHBondContact O-OG 3.4Å; Y212-L352 HydrophobicContact CD2-CD1 4.25Å; Y212-P359 WeakPolarHBondContact OH-CG 3.3Å; Y212-F362 HydrophobicContact CD1-CB 4.1Å; Y212-F362 HydrophobicContact CD1-CD1 4.4Å; Y212-F362 AromaticContact CD1-CD2 3.89Å; Y212-F362 HydrophobicContact CD1-CD2 3.89Å; Y212-F362 HydrophobicContact CD1-CE2 4.44Å; Y212-F362 AromaticContact CD1-CG 3.85Å; Y212-F362 HydrophobicContact CD1-CG 3.85Å; Y212-F362 HydrophobicContact CD2-CB 3.47Å; Y212-F362 VanDerWaalsContact CD2-CB 3.47Å; Y212-F362 HydrophobicContact CD2-CD2 4.4Å; Y212-F362 HydrophobicContact CD2-CG 4.13Å; Y212-F362 HydrophobicContact CE1-CB 4.35Å; Y212-F362 HydrophobicContact CE1-CG 4.27Å; Y212-F362 HydrophobicContact CE2-CB 3.74Å; Y212-F362 HydrophobicContact CE2-CG 4.49Å; Y212-F362 HydrophobicContact CG-CB 3.64Å; Y212-F362 AromaticContact CG-CD2 3.68Å; Y212-F362 HydrophobicContact CG-CD2 3.68Å; Y212-F362 AromaticContact CG-CG 3.75Å; Y212-F362 HydrophobicContact CG-CG 3.75Å
213L97Very high94.4Very high14 Ų1436.2 Ų36.27%0.07321%0.207CC..Hα-helixtrans-66.2-44.6179.1-73.6169.6000110.7L180 H185 A189 Y209 R215 Y217 C218 L241L180-L213 HydrophobicContact CD2-CD2 3.76Å; H185-L213 HydrophobicContact CB-CD2 4Å; A189-L213 HydrophobicContact CB-CD1 3.72Å; Y209-L213 VanDerWaalsContact O-CB 3.31Å; Y209-L213 WeakPolarHBondContact O-CB 3.12Å; Y209-L213 WeakPolarHBondContact O-CG 3.49Å; Y209-L213 PolarHBondContact O-N 2.98Å; L213-R215 PolarHBondContact O-N 3.31Å; L213-Y217 WeakPolarHBondContact O-CA 3.44Å; L213-Y217 WeakPolarHBondContact O-CB 3.39Å; L213-Y217 PolarHBondContact O-N 3.43Å; L213-C218 PolarHBondContact O-N 3.25Å; L213-L241 HydrophobicContact CB-CD1 3.97Å; L213-L241 HydrophobicContact CD1-CD2 4.27Å; L213-L241 HydrophobicContact CD2-CD2 4.44Å
214L95.6Very high93.6Very high62 Ų6237.1 Ų37.133%0.32522%0.219SC..Iπ-helixtrans-58-49.6174.2-173.861.8000110.8G210 C218 F219 F233 V238 W353G210-L214 WeakPolarHBondContact O-CB 3.46Å; G210-L214 PolarHBondContact O-N 2.9Å; L214-C218 HydrophobicContact CD1-CB 4.05Å; L214-C218 VanDerWaalsContact O-CB 3.28Å; L214-C218 WeakPolarHBondContact O-CB 3.45Å; L214-C218 PolarHBondContact O-N 2.66Å; L214-F219 HydrophobicContact CG-CE2 4.44Å; L214-F219 VanDerWaalsContact O-CD2 3.31Å; L214-F219 WeakPolarHBondContact O-CD2 3.33Å; L214-F219 PolarHBondContact O-N 3.41Å; L214-F233 HydrophobicContact CD1-CE2 3.93Å; L214-V238 HydrophobicContact CD1-CG2 4.37Å; L214-W353 HydrophobicContact CB-CZ3 4.25Å; L214-W353 HydrophobicContact CD2-CH2 3.86Å; L214-W353 HydrophobicContact CD2-CZ3 3.61Å; L214-W353 HydrophobicContact CG-CH2 4.11Å; L214-W353 HydrophobicContact CG-CZ3 3.77Å
215R93.4Very high92.9Very high5 Ų539.4 Ų39.42%0.01924%0.235CC..Iπ-helixtrans-70-38.8-176.1179.959.5-17493.4-9.9114.4V211 Y212 L213 N222 G226 W353 P356V211-R215 WeakPolarHBondContact O-CB 3.3Å; V211-R215 PolarHBondContact O-N 2.89Å; Y212-R215 PolarHBondContact O-N 3.48Å; L213-R215 PolarHBondContact O-N 3.31Å; R215-N222 VanDerWaalsContact CZ-OD1 3.25Å; R215-N222 PolarHBondContact NH1-OD1 2.92Å; R215-N222 PolarHBondContact NH2-OD1 3.49Å; R215-G226 PolarHBondContact NH2-O 2.84Å; R215-W353 HydrophobicContact CB-CE3 3.99Å; R215-W353 HydrophobicContact CB-CZ3 4.25Å; R215-W353 WeakPolarHBondContact CD-O 3.43Å; R215-W353 PolarHBondContact NE-O 2.82Å; R215-W353 VanDerWaalsContact NE-O 3.09Å; R215-P356 HydrophobicContact CG-CB 4.4Å
216S92.1Very high92Very high37 Ų3740.7 Ų40.726%0.25925%0.248SC..Iπ-helixtrans-104.1-25.4-168-49.40000113.5Y212Y212-S216 WeakPolarHBondContact CD2-OG 3.48Å; Y212-S216 WeakPolarHBondContact CE2-OG 3.36Å; Y212-S216 WeakPolarHBondContact O-CA 3.39Å; Y212-S216 WeakPolarHBondContact O-CB 3.44Å; Y212-S216 PolarHBondContact O-N 3.15Å; Y212-S216 PolarHBondContact O-OG 3.4Å
217Y93.5Very high91.4Very high37 Ų3741.5 Ų41.515%0.14525%0.252CS..Iπ-helixtrans-102.5-47.4177.9-179.9-104.5000112H185 M186 L213 R237 L241H185-Y217 HydrophobicContact CB-CD2 3.59Å; H185-Y217 HydrophobicContact CB-CE2 4.21Å; H185-Y217 HydrophobicContact CB-CG 3.92Å; H185-Y217 AromaticContact CD2-CD2 3.67Å; H185-Y217 AromaticContact CG-CD2 3.81Å; M186-Y217 HydrophobicContact CE-CD1 3.57Å; M186-Y217 HydrophobicContact CE-CD2 4.21Å; M186-Y217 HydrophobicContact CE-CE1 3.06Å; M186-Y217 HydrophobicContact CE-CE2 3.79Å; M186-Y217 HydrophobicContact CE-CG 4.1Å; M186-Y217 HydrophobicContact SD-CE1 4.12Å; L213-Y217 WeakPolarHBondContact O-CA 3.44Å; L213-Y217 WeakPolarHBondContact O-CB 3.39Å; L213-Y217 PolarHBondContact O-N 3.43Å; Y217-R237 HydrophobicContact CD1-CB 3.91Å; Y217-R237 HydrophobicContact CD1-CG 4.35Å; Y217-R237 HydrophobicContact CE1-CB 3.41Å; Y217-R237 VanDerWaalsContact CE1-CB 3.41Å; Y217-R237 HydrophobicContact CE1-CG 3.65Å; Y217-R237 HydrophobicContact CE2-CG 4.5Å; Y217-R237 WeakPolarHBondContact O-CD 3.42Å; Y217-R237 PolarHBondContact O-NH1 3.14Å; Y217-L241 HydrophobicContact CD1-CD1 3.81Å; Y217-L241 HydrophobicContact CD1-CD2 4.48Å; Y217-L241 HydrophobicContact CD1-CG 3.98Å; Y217-L241 HydrophobicContact CE1-CD1 4.45Å; Y217-L241 HydrophobicContact CE1-CG 4.16Å
218C94.9Very high90.9Very high1 Ų139.8 Ų39.81%0.00724%0.241CC..Iπ-helixtrans-77.3-33.3-174.1-54.30000113.7L213 L214 F233 S234 V238 L241L213-C218 PolarHBondContact O-N 3.25Å; L214-C218 HydrophobicContact CD1-CB 4.05Å; L214-C218 VanDerWaalsContact O-CB 3.28Å; L214-C218 WeakPolarHBondContact O-CB 3.45Å; L214-C218 PolarHBondContact O-N 2.66Å; C218-F233 HydrophobicContact CB-CD2 4.41Å; C218-F233 HydrophobicContact CB-CE2 4.21Å; C218-S234 PolarHBondContact O-N 3.33Å; C218-V238 HydrophobicContact CB-CG2 3.61Å; C218-V238 WeakPolarHBondContact SG-CG2 3.39Å; C218-L241 VanDerWaalsContact SG-CD1 3.55Å
219F93.3Very high90.4Very high10 Ų1045.7 Ų45.74%0.04426%0.263CS..BIsolated β-bridgetrans-87.6115.6168.7-69.9-82.2000110.3L214 I228 W230 F233 W353L214-F219 HydrophobicContact CG-CE2 4.44Å; L214-F219 VanDerWaalsContact O-CD2 3.31Å; L214-F219 WeakPolarHBondContact O-CD2 3.33Å; L214-F219 PolarHBondContact O-N 3.41Å; F219-I228 HydrophobicContact CD1-CG2 3.37Å; F219-I228 HydrophobicContact CD2-CG2 4.39Å; F219-I228 HydrophobicContact CE1-CG2 3.45Å; F219-I228 VanDerWaalsContact CE1-CG2 3.45Å; F219-I228 HydrophobicContact CE2-CG2 4.48Å; F219-I228 HydrophobicContact CG-CG2 3.87Å; F219-I228 HydrophobicContact CZ-CG2 4.04Å; F219-W230 AromaticContact CE1-CE3 3.93Å; F219-W230 HydrophobicContact CE1-CE3 3.93Å; F219-W230 HydrophobicContact CE1-CZ3 4.42Å; F219-W230 AromaticContact CZ-CE3 3.9Å; F219-W230 HydrophobicContact CZ-CE3 3.9Å; F219-W230 AromaticContact CZ-CZ3 3.92Å; F219-W230 HydrophobicContact CZ-CZ3 3.92Å; F219-F233 HydrophobicContact CD1-CB 4Å; F219-F233 HydrophobicContact CD1-CD2 4.17Å; F219-F233 HydrophobicContact CD2-CD2 4.29Å; F219-F233 HydrophobicContact CE1-CB 3.68Å; F219-F233 AromaticContact CE1-CD2 3.71Å; F219-F233 HydrophobicContact CE1-CD2 3.71Å; F219-F233 HydrophobicContact CE1-CG 4.13Å; F219-F233 AromaticContact CE2-CD2 3.82Å; F219-F233 HydrophobicContact CE2-CD2 3.82Å; F219-F233 HydrophobicContact CE2-CE2 4.25Å; F219-F233 HydrophobicContact CG-CD2 4.46Å; F219-F233 HydrophobicContact CZ-CB 4.33Å; F219-F233 AromaticContact CZ-CD2 3.51Å; F219-F233 HydrophobicContact CZ-CD2 3.51Å; F219-F233 HydrophobicContact CZ-CE2 4.18Å; F219-F233 HydrophobicContact CZ-CG 4.3Å; F219-W353 HydrophobicContact CD2-CH2 4.46Å; F219-W353 AromaticContact CE2-CH2 3.61Å; F219-W353 HydrophobicContact CE2-CH2 3.61Å; F219-W353 HydrophobicContact CE2-CZ2 4.26Å; F219-W353 HydrophobicContact CE2-CZ3 4.3Å; F219-W353 HydrophobicContact CZ-CH2 4.26Å
220T88.8Confident90.1Very high80 Ų8053.4 Ų53.449%0.49129%0.292SS..  trans-85.6-21-171.456.70000114S232T220-S232 PolarHBondContact N-O 3.36Å; T220-S232 PolarHBondContact N-OG 2.88Å; T220-S232 WeakPolarHBondContact OG1-CB 3.46Å; T220-S232 PolarHBondContact OG1-O 3.39Å
221A87.3Confident89.9Confident31 Ų3161.1 Ų61.126%0.25631%0.313SS..  trans-140.8146.1-177.400000112.2R229 S232A221-R229 WeakPolarHBondContact O-CB 3.4Å; A221-S232 PolarHBondContact N-OG 3.1Å; A221-S232 VanDerWaalsContact N-OG 3.13Å; A221-S232 PolarHBondContact O-OG 3.01Å
222N85Confident89.7Confident75 Ų7560.4 Ų60.440%0.40131%0.309SS..BIsolated β-bridgetrans-106155172.7-64.5-33.2000110.3R215R215-N222 VanDerWaalsContact CZ-OD1 3.25Å; R215-N222 PolarHBondContact NH1-OD1 2.92Å; R215-N222 PolarHBondContact NH2-OD1 3.49Å
223K85.5Confident89.6Confident99 Ų9963 Ų6343%0.4332%0.321SS..  trans-72.3161.1164.3-69.3-167.8-158.7168.80109.9D225 G226 S227 R229K223-D225 WeakPolarHBondContact CB-OD1 3.47Å; K223-D225 PolarHBondContact O-N 3.45Å; K223-G226 WeakPolarHBondContact O-CA 3.24Å; K223-G226 PolarHBondContact O-N 3.47Å; K223-S227 WeakPolarHBondContact CD-OG 3.18Å; K223-S227 PolarHBondContact N-O 3.13Å; K223-R229 HydrophobicContact CG-CB 4.25Å
224P81.7Confident89.6Confident117 Ų11763.8 Ų63.876%0.7633%0.327SS*.THydrogen-bonded Turntrans-58.2-31.5-178.6-25.234.7000114.5G226 K525P224-G226 PolarHBondContact O-N 3.08Å; P224-K525 PolarHBondContact O-NZ 2.78Å; P224-K525 VanDerWaalsContact O-NZ 3.16Å
225D82.7Confident89.6Confident110 Ų11068.1 Ų68.159%0.58834%0.344SS*.THydrogen-bonded Turntrans-70.5-9173.767.2-13.5000113.5K223 S227K223-D225 WeakPolarHBondContact CB-OD1 3.47Å; K223-D225 PolarHBondContact O-N 3.45Å; D225-S227 WeakPolarHBondContact OD1-CB 3.48Å; D225-S227 PolarHBondContact OD1-N 3.36Å; D225-S227 PolarHBondContact OD1-OG 3.31Å; D225-S227 WeakPolarHBondContact OD2-CB 3.48Å; D225-S227 PolarHBondContact OD2-OG 3.01Å
226G79.5Confident89.7Confident27 Ų2772.7 Ų72.728%0.27837%0.372SS..SBendtrans89.9-5.3-175.900000114.6R215 K223 P224R215-G226 PolarHBondContact NH2-O 2.84Å; K223-G226 WeakPolarHBondContact O-CA 3.24Å; K223-G226 PolarHBondContact O-N 3.47Å; P224-G226 PolarHBondContact O-N 3.08Å
227S85.2Confident89.9Confident37 Ų3775.2 Ų75.226%0.25938%0.376SS..  trans-72.4163177.472.50000111.8K223 D225 R229K223-S227 WeakPolarHBondContact CD-OG 3.18Å; K223-S227 PolarHBondContact N-O 3.13Å; D225-S227 WeakPolarHBondContact OD1-CB 3.48Å; D225-S227 PolarHBondContact OD1-N 3.36Å; D225-S227 PolarHBondContact OD1-OG 3.31Å; D225-S227 WeakPolarHBondContact OD2-CB 3.48Å; D225-S227 PolarHBondContact OD2-OG 3.01Å; S227-R229 PolarHBondContact O-N 3.22Å
228I86.3Confident90.1Very high12 Ų1275.9 Ų75.96%0.06238%0.384CS..BIsolated β-bridgetrans-71.9128.5-175.9-61.4171.2000109.5F219 W230 W353F219-I228 HydrophobicContact CD1-CG2 3.37Å; F219-I228 HydrophobicContact CD2-CG2 4.39Å; F219-I228 HydrophobicContact CE1-CG2 3.45Å; F219-I228 VanDerWaalsContact CE1-CG2 3.45Å; F219-I228 HydrophobicContact CE2-CG2 4.48Å; F219-I228 HydrophobicContact CG-CG2 3.87Å; F219-I228 HydrophobicContact CZ-CG2 4.04Å; I228-W230 HydrophobicContact CG2-CD2 4.21Å; I228-W230 HydrophobicContact CG2-CE3 4.49Å; I228-W230 HydrophobicContact CG2-CG 4.42Å; I228-W230 PolarHBondContact O-N 2.94Å; I228-W353 HydrophobicContact CD1-CD2 4.03Å; I228-W353 HydrophobicContact CD1-CH2 4.26Å; I228-W353 HydrophobicContact CD1-CZ2 3.49Å; I228-W353 VanDerWaalsContact CD1-CZ2 3.49Å
229R88.8Confident90.2Very high123 Ų12380.8 Ų80.846%0.46441%0.409SS..  trans-84.194.4163.3-175.1-176.1-63.7-169.7-0.4107.6A221 K223 S227 K231 S232A221-R229 WeakPolarHBondContact O-CB 3.4Å; K223-R229 HydrophobicContact CG-CB 4.25Å; S227-R229 PolarHBondContact O-N 3.22Å; R229-K231 PolarHBondContact O-N 3.33Å; R229-K231 VanDerWaalsContact O-N 3.08Å; R229-S232 WeakPolarHBondContact O-CA 3.27Å; R229-S232 WeakPolarHBondContact O-CB 3.44Å; R229-S232 PolarHBondContact O-N 3.07Å; R229-S232 PolarHBondContact O-OG 3.47Å
230W91Very high90.4Very high165 Ų16582.2 Ų82.263%0.62542%0.42SS*.G310 helixtrans-53.1-34.3-174.9-68.3100.5000114.5F219 I228 S232 F233 W353F219-W230 AromaticContact CE1-CE3 3.93Å; F219-W230 HydrophobicContact CE1-CE3 3.93Å; F219-W230 HydrophobicContact CE1-CZ3 4.42Å; F219-W230 AromaticContact CZ-CE3 3.9Å; F219-W230 HydrophobicContact CZ-CE3 3.9Å; F219-W230 AromaticContact CZ-CZ3 3.92Å; F219-W230 HydrophobicContact CZ-CZ3 3.92Å; I228-W230 HydrophobicContact CG2-CD2 4.21Å; I228-W230 HydrophobicContact CG2-CE3 4.49Å; I228-W230 HydrophobicContact CG2-CG 4.42Å; I228-W230 PolarHBondContact O-N 2.94Å; W230-S232 PolarHBondContact O-N 3.05Å; W230-S232 VanDerWaalsContact O-N 3.15Å; W230-F233 WeakPolarHBondContact O-CB 3.38Å; W230-F233 PolarHBondContact O-N 3.02Å; W230-W353 AromaticContact CH2-CZ2 3.95Å; W230-W353 HydrophobicContact CH2-CZ2 3.95Å; W230-W353 HydrophobicContact CZ3-CZ2 4.32Å
231K92.1Very high90.8Very high207 Ų20779.4 Ų79.490%0.940%0.402SS*.G310 helixtrans-64.5-13.3174.4-61.3-173.4178.7-174.80114.5R229 F233R229-K231 PolarHBondContact O-N 3.33Å; R229-K231 VanDerWaalsContact O-N 3.08Å; K231-F233 VanDerWaalsContact C-N 3.28Å
232S92.6Very high91.3Very high11 Ų1179.9 Ų79.98%0.07741%0.41CS..G310 helixtrans-85.70.5179.785.10000113.5T220 A221 R229 W230 S234T220-S232 PolarHBondContact N-O 3.36Å; T220-S232 PolarHBondContact N-OG 2.88Å; T220-S232 WeakPolarHBondContact OG1-CB 3.46Å; T220-S232 PolarHBondContact OG1-O 3.39Å; A221-S232 PolarHBondContact N-OG 3.1Å; A221-S232 VanDerWaalsContact N-OG 3.13Å; A221-S232 PolarHBondContact O-OG 3.01Å; R229-S232 WeakPolarHBondContact O-CA 3.27Å; R229-S232 WeakPolarHBondContact O-CB 3.44Å; R229-S232 PolarHBondContact O-N 3.07Å; R229-S232 PolarHBondContact O-OG 3.47Å; W230-S232 PolarHBondContact O-N 3.05Å; W230-S232 VanDerWaalsContact O-N 3.15Å; S232-S234 PolarHBondContact O-N 3.2Å
233F95.7Very high91.9Very high63 Ų6380.7 Ų80.728%0.27641%0.414SS..BIsolated β-bridgetrans-64.8123.6177.2-174.1-107.4000111.2L214 C218 F219 W230 K231 F235 V238L214-F233 HydrophobicContact CD1-CE2 3.93Å; C218-F233 HydrophobicContact CB-CD2 4.41Å; C218-F233 HydrophobicContact CB-CE2 4.21Å; F219-F233 HydrophobicContact CD1-CB 4Å; F219-F233 HydrophobicContact CD1-CD2 4.17Å; F219-F233 HydrophobicContact CD2-CD2 4.29Å; F219-F233 HydrophobicContact CE1-CB 3.68Å; F219-F233 AromaticContact CE1-CD2 3.71Å; F219-F233 HydrophobicContact CE1-CD2 3.71Å; F219-F233 HydrophobicContact CE1-CG 4.13Å; F219-F233 AromaticContact CE2-CD2 3.82Å; F219-F233 HydrophobicContact CE2-CD2 3.82Å; F219-F233 HydrophobicContact CE2-CE2 4.25Å; F219-F233 HydrophobicContact CG-CD2 4.46Å; F219-F233 HydrophobicContact CZ-CB 4.33Å; F219-F233 AromaticContact CZ-CD2 3.51Å; F219-F233 HydrophobicContact CZ-CD2 3.51Å; F219-F233 HydrophobicContact CZ-CE2 4.18Å; F219-F233 HydrophobicContact CZ-CG 4.3Å; W230-F233 WeakPolarHBondContact O-CB 3.38Å; W230-F233 PolarHBondContact O-N 3.02Å; K231-F233 VanDerWaalsContact C-N 3.28Å; F233-F235 HydrophobicContact CD1-CD1 4.36Å; F233-F235 HydrophobicContact CD1-CD2 4.15Å; F233-F235 HydrophobicContact CD1-CE1 4.21Å; F233-F235 AromaticContact CD1-CE2 3.98Å; F233-F235 HydrophobicContact CD1-CE2 3.98Å; F233-F235 HydrophobicContact CD1-CG 4.33Å; F233-F235 HydrophobicContact CD1-CZ 4.01Å; F233-F235 AromaticContact CE1-CD1 3.76Å; F233-F235 HydrophobicContact CE1-CD1 3.76Å; F233-F235 HydrophobicContact CE1-CD2 4.37Å; F233-F235 AromaticContact CE1-CE1 3.66Å; F233-F235 HydrophobicContact CE1-CE1 3.66Å; F233-F235 HydrophobicContact CE1-CE2 4.27Å; F233-F235 HydrophobicContact CE1-CG 4.13Å; F233-F235 AromaticContact CE1-CZ 3.92Å; F233-F235 HydrophobicContact CE1-CZ 3.92Å; F233-V238 HydrophobicContact CE1-CG2 4.24Å; F233-V238 HydrophobicContact CE2-CG2 3.66Å; F233-V238 HydrophobicContact CZ-CB 4.47Å; F233-V238 HydrophobicContact CZ-CG2 3.46Å; F233-V238 VanDerWaalsContact CZ-CG2 3.46Å
234S95.9Very high92.5Very high30 Ų3077.3 Ų77.321%0.2140%0.401CS..  trans-103.5108.8178.1178.60000110.7C218 S232 V236 R237 V238C218-S234 PolarHBondContact O-N 3.33Å; S232-S234 PolarHBondContact O-N 3.2Å; S234-V236 VanDerWaalsContact C-N 3.28Å; S234-V236 PolarHBondContact O-N 2.98Å; S234-R237 PolarHBondContact O-N 2.89Å; S234-R237 PolarHBondContact OG-N 2.86Å; S234-V238 PolarHBondContact O-N 2.65Å
235F95.8Very high93.3Very high153 Ų15375.2 Ų75.267%0.67139%0.386SS*.Hα-helixtrans-59.6-38.8173.2-73.2-82.4000112.2F233 R237 V238 I239F233-F235 HydrophobicContact CD1-CD1 4.36Å; F233-F235 HydrophobicContact CD1-CD2 4.15Å; F233-F235 HydrophobicContact CD1-CE1 4.21Å; F233-F235 AromaticContact CD1-CE2 3.98Å; F233-F235 HydrophobicContact CD1-CE2 3.98Å; F233-F235 HydrophobicContact CD1-CG 4.33Å; F233-F235 HydrophobicContact CD1-CZ 4.01Å; F233-F235 AromaticContact CE1-CD1 3.76Å; F233-F235 HydrophobicContact CE1-CD1 3.76Å; F233-F235 HydrophobicContact CE1-CD2 4.37Å; F233-F235 AromaticContact CE1-CE1 3.66Å; F233-F235 HydrophobicContact CE1-CE1 3.66Å; F233-F235 HydrophobicContact CE1-CE2 4.27Å; F233-F235 HydrophobicContact CE1-CG 4.13Å; F233-F235 AromaticContact CE1-CZ 3.92Å; F233-F235 HydrophobicContact CE1-CZ 3.92Å; F235-R237 VanDerWaalsContact C-N 3.3Å; F235-R237 PolarHBondContact O-N 2.86Å; F235-V238 PolarHBondContact O-N 3.04Å; F235-I239 WeakPolarHBondContact O-CB 3.49Å; F235-I239 VanDerWaalsContact O-CG1 3.3Å; F235-I239 WeakPolarHBondContact O-CG1 3.48Å; F235-I239 PolarHBondContact O-N 3.44Å
236V96.7Very high94Very high102 Ų10276.5 Ų76.562%0.61839%0.387SS*.Hα-helixtrans-55.8-46.5176.4179.60000110.7S234 V238 I239 S240S234-V236 VanDerWaalsContact C-N 3.28Å; S234-V236 PolarHBondContact O-N 2.98Å; V236-V238 PolarHBondContact O-N 3.45Å; V236-I239 PolarHBondContact O-N 3Å; V236-S240 PolarHBondContact O-N 3.27Å; V236-S240 PolarHBondContact O-OG 3.4Å
237R96.6Very high94.9Very high90 Ų9080 Ų8034%0.3440%0.399SS..Hα-helixtrans-65.2-38.2179.3-73.9-170-177.9-167.2-0.7113.3Y217 S234 F235 S240 L241Y217-R237 HydrophobicContact CD1-CB 3.91Å; Y217-R237 HydrophobicContact CD1-CG 4.35Å; Y217-R237 HydrophobicContact CE1-CB 3.41Å; Y217-R237 VanDerWaalsContact CE1-CB 3.41Å; Y217-R237 HydrophobicContact CE1-CG 3.65Å; Y217-R237 HydrophobicContact CE2-CG 4.5Å; Y217-R237 WeakPolarHBondContact O-CD 3.42Å; Y217-R237 PolarHBondContact O-NH1 3.14Å; S234-R237 PolarHBondContact O-N 2.89Å; S234-R237 PolarHBondContact OG-N 2.86Å; F235-R237 VanDerWaalsContact C-N 3.3Å; F235-R237 PolarHBondContact O-N 2.86Å; R237-S240 PolarHBondContact O-N 3.24Å; R237-L241 PolarHBondContact O-N 3.25Å
238V97Very high95.6Very high50 Ų5078.5 Ų78.530%0.30339%0.388SS..Hα-helixtrans-67-44.2175.3175.70000110.8L214 C218 F233 S234 F235 V236 S240 L241 G242L214-V238 HydrophobicContact CD1-CG2 4.37Å; C218-V238 HydrophobicContact CB-CG2 3.61Å; C218-V238 WeakPolarHBondContact SG-CG2 3.39Å; F233-V238 HydrophobicContact CE1-CG2 4.24Å; F233-V238 HydrophobicContact CE2-CG2 3.66Å; F233-V238 HydrophobicContact CZ-CB 4.47Å; F233-V238 HydrophobicContact CZ-CG2 3.46Å; F233-V238 VanDerWaalsContact CZ-CG2 3.46Å; S234-V238 PolarHBondContact O-N 2.65Å; F235-V238 PolarHBondContact O-N 3.04Å; V236-V238 PolarHBondContact O-N 3.45Å; V238-S240 VanDerWaalsContact C-N 3.33Å; V238-S240 PolarHBondContact O-N 3.3Å; V238-L241 PolarHBondContact O-N 2.93Å; V238-G242 PolarHBondContact O-N 3.45Å
239I97.5Very high96.1Very high104 Ų10479.4 Ų79.453%0.53340%0.395SS..Hα-helixtrans-61.3-44175.7-68.6166.9000109.8F235 V236 L241 G242 L243F235-I239 WeakPolarHBondContact O-CB 3.49Å; F235-I239 VanDerWaalsContact O-CG1 3.3Å; F235-I239 WeakPolarHBondContact O-CG1 3.48Å; F235-I239 PolarHBondContact O-N 3.44Å; V236-I239 PolarHBondContact O-N 3Å; I239-L241 PolarHBondContact O-N 3.4Å; I239-G242 CarbonylContact O-C 3.5Å; I239-G242 PolarHBondContact O-N 2.95Å; I239-G242 VanDerWaalsContact O-N 3.17Å; I239-L243 HydrophobicContact CG2-CD1 3.94Å; I239-L243 HydrophobicContact CG2-CG 4.16Å; I239-L243 WeakPolarHBondContact O-CB 3.3Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.3Å; I239-L243 PolarHBondContact O-N 3.41Å
240S97.6Very high96.6Very high41 Ų4175.7 Ų75.729%0.28739%0.391SS..Hα-helixtrans-59.1-44176-57.50000112.6V236 R237 V238 L243 V244V236-S240 PolarHBondContact O-N 3.27Å; V236-S240 PolarHBondContact O-OG 3.4Å; R237-S240 PolarHBondContact O-N 3.24Å; V238-S240 VanDerWaalsContact C-N 3.33Å; V238-S240 PolarHBondContact O-N 3.3Å; S240-L243 PolarHBondContact O-N 3.11Å; S240-V244 WeakPolarHBondContact O-CG2 3.39Å; S240-V244 PolarHBondContact O-N 2.83Å; S240-V244 VanDerWaalsContact O-N 3.1Å
241L97.4Very high96.9Very high21 Ų2173.6 Ų73.611%0.1139%0.391CS..Hα-helixtrans-62.5-45.7173.3-78.2176.8000111.9M186 A189 L213 Y217 C218 R237 V238 I239 L243 V244 V245M186-L241 HydrophobicContact CE-CD2 3.24Å; M186-L241 HydrophobicContact CE-CG 3.72Å; M186-L241 HydrophobicContact SD-CD2 4.28Å; A189-L241 HydrophobicContact CB-CD2 3.63Å; L213-L241 HydrophobicContact CB-CD1 3.97Å; L213-L241 HydrophobicContact CD1-CD2 4.27Å; L213-L241 HydrophobicContact CD2-CD2 4.44Å; Y217-L241 HydrophobicContact CD1-CD1 3.81Å; Y217-L241 HydrophobicContact CD1-CD2 4.48Å; Y217-L241 HydrophobicContact CD1-CG 3.98Å; Y217-L241 HydrophobicContact CE1-CD1 4.45Å; Y217-L241 HydrophobicContact CE1-CG 4.16Å; C218-L241 VanDerWaalsContact SG-CD1 3.55Å; R237-L241 PolarHBondContact O-N 3.25Å; V238-L241 PolarHBondContact O-N 2.93Å; I239-L241 PolarHBondContact O-N 3.4Å; L241-L243 VanDerWaalsContact C-N 3.31Å; L241-L243 PolarHBondContact O-N 3.16Å; L241-V244 PolarHBondContact O-N 3.19Å; L241-V245 WeakPolarHBondContact O-CG2 3.23Å; L241-V245 PolarHBondContact O-N 2.81Å; L241-V245 VanDerWaalsContact O-N 3.09Å
242G97.3Very high97.2Very high40 Ų4063.8 Ų63.841%0.41235%0.348SS..Hα-helixtrans-59.3-42177.900000111.9V238 I239 V245 F246V238-G242 PolarHBondContact O-N 3.45Å; I239-G242 CarbonylContact O-C 3.5Å; I239-G242 PolarHBondContact O-N 2.95Å; I239-G242 VanDerWaalsContact O-N 3.17Å; G242-V245 PolarHBondContact O-N 3.25Å; G242-F246 WeakPolarHBondContact O-CB 3.44Å; G242-F246 PolarHBondContact O-N 2.81Å
243L98.1Very high97.4Very high92 Ų9265 Ų6548%0.48235%0.354SS..Hα-helixtrans-63.4-42.9176.4-74.5173.6000111.8I239 S240 L241 V245 F246 L247I239-L243 HydrophobicContact CG2-CD1 3.94Å; I239-L243 HydrophobicContact CG2-CG 4.16Å; I239-L243 WeakPolarHBondContact O-CB 3.3Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.3Å; I239-L243 PolarHBondContact O-N 3.41Å; S240-L243 PolarHBondContact O-N 3.11Å; L241-L243 VanDerWaalsContact C-N 3.31Å; L241-L243 PolarHBondContact O-N 3.16Å; L243-V245 PolarHBondContact O-N 3.35Å; L243-F246 PolarHBondContact O-N 3.07Å; L243-L247 VanDerWaalsContact O-CB 3.3Å; L243-L247 WeakPolarHBondContact O-CB 3.47Å; L243-L247 WeakPolarHBondContact O-CG 3.4Å; L243-L247 PolarHBondContact O-N 3.39Å
244V98.1Very high97.5Very high29 Ų2963.1 Ų63.118%0.17635%0.352CS..Hα-helixtrans-58.5-50.3175168.80000110.7F190 S240 L241 F246 V248F190-V244 HydrophobicContact CB-CG1 3.75Å; F190-V244 HydrophobicContact CD2-CG1 4.21Å; S240-V244 WeakPolarHBondContact O-CG2 3.39Å; S240-V244 PolarHBondContact O-N 2.83Å; S240-V244 VanDerWaalsContact O-N 3.1Å; L241-V244 PolarHBondContact O-N 3.19Å; V244-F246 VanDerWaalsContact C-N 3.35Å; V244-F246 PolarHBondContact O-N 3.46Å; V244-V248 WeakPolarHBondContact O-CB 3.48Å; V244-V248 VanDerWaalsContact O-CG2 3.23Å; V244-V248 WeakPolarHBondContact O-CG2 3.36Å; V244-V248 PolarHBondContact O-N 2.97Å; V244-V248 VanDerWaalsContact O-N 3.08Å
245V97.6Very high97.6Very high73 Ų7363.8 Ų63.844%0.44236%0.356SS..Hα-helixtrans-63.9-42.2-179.7175.70000111.2L241 G242 L243 S249L241-V245 WeakPolarHBondContact O-CG2 3.23Å; L241-V245 PolarHBondContact O-N 2.81Å; L241-V245 VanDerWaalsContact O-N 3.09Å; G242-V245 PolarHBondContact O-N 3.25Å; L243-V245 PolarHBondContact O-N 3.35Å; V245-S249 VanDerWaalsContact O-CB 3.3Å; V245-S249 WeakPolarHBondContact O-CB 3.44Å; V245-S249 PolarHBondContact O-N 3.06Å; V245-S249 PolarHBondContact O-OG 3.39Å
246F98.1Very high97.7Very high137 Ų13756.5 Ų56.560%0.60132%0.324SS*.Hα-helixtrans-63.6-50.1178.8175.8-98.3000111.4G242 L243 V244 V248 S249 A250G242-F246 WeakPolarHBondContact O-CB 3.44Å; G242-F246 PolarHBondContact O-N 2.81Å; L243-F246 PolarHBondContact O-N 3.07Å; V244-F246 VanDerWaalsContact C-N 3.35Å; V244-F246 PolarHBondContact O-N 3.46Å; F246-V248 PolarHBondContact O-N 3.36Å; F246-S249 CarbonylContact O-C 3.58Å; F246-S249 PolarHBondContact O-N 3.5Å; F246-A250 VanDerWaalsContact O-CB 3.3Å; F246-A250 WeakPolarHBondContact O-CB 3.23Å; F246-A250 PolarHBondContact O-N 3.01Å
247L98.3Very high97.7Very high101 Ų10156.7 Ų56.753%0.52932%0.321SS..Hα-helixtrans-61.1-45.6-179.8-72.6170.9000111.6L243 S249 A250 L251L243-L247 VanDerWaalsContact O-CB 3.3Å; L243-L247 WeakPolarHBondContact O-CB 3.47Å; L243-L247 WeakPolarHBondContact O-CG 3.4Å; L243-L247 PolarHBondContact O-N 3.39Å; L247-S249 VanDerWaalsContact C-N 3.32Å; L247-S249 PolarHBondContact O-N 3.42Å; L247-A250 PolarHBondContact O-N 3.12Å; L247-L251 WeakPolarHBondContact O-CG 3.26Å; L247-L251 PolarHBondContact O-N 3.13Å
248V98.5Very high97.7Very high4 Ų456.3 Ų56.32%0.02434%0.337CS..Hα-helixtrans-61.9-42.6176.6176.10000111F70 F190 A193 V194 V244 F246 L251 S252F70-V248 HydrophobicContact CE2-CG1 3.58Å; F70-V248 HydrophobicContact CZ-CG1 3.98Å; F70-V248 WeakPolarHBondContact CZ-O 3.4Å; F190-V248 HydrophobicContact CD2-CG2 3.67Å; F190-V248 HydrophobicContact CE2-CG2 3.73Å; A193-V248 HydrophobicContact CB-CB 4.1Å; A193-V248 HydrophobicContact CB-CG1 3.98Å; A193-V248 HydrophobicContact CB-CG2 4.23Å; V194-V248 HydrophobicContact CG2-CG1 3.91Å; V194-V248 HydrophobicContact CG2-CG2 4.23Å; V244-V248 WeakPolarHBondContact O-CB 3.48Å; V244-V248 VanDerWaalsContact O-CG2 3.23Å; V244-V248 WeakPolarHBondContact O-CG2 3.36Å; V244-V248 PolarHBondContact O-N 2.97Å; V244-V248 VanDerWaalsContact O-N 3.08Å; F246-V248 PolarHBondContact O-N 3.36Å; V248-L251 PolarHBondContact O-N 3.37Å; V248-S252 PolarHBondContact O-N 2.95Å
249S98Very high97.7Very high32 Ų3257.6 Ų57.622%0.22434%0.342CS..Hα-helixtrans-69.5-35.7178.1-54.90000112.8H197 V245 F246 L247 S252 L253H197-S249 WeakPolarHBondContact NE2-CA 3.22Å; H197-S249 PolarHBondContact NE2-OG 3.28Å; V245-S249 VanDerWaalsContact O-CB 3.3Å; V245-S249 WeakPolarHBondContact O-CB 3.44Å; V245-S249 PolarHBondContact O-N 3.06Å; V245-S249 PolarHBondContact O-OG 3.39Å; F246-S249 CarbonylContact O-C 3.58Å; F246-S249 PolarHBondContact O-N 3.5Å; L247-S249 VanDerWaalsContact C-N 3.32Å; L247-S249 PolarHBondContact O-N 3.42Å; S249-S252 PolarHBondContact O-N 3.15Å; S249-L253 WeakPolarHBondContact O-CB 3.3Å; S249-L253 PolarHBondContact O-N 3.26Å
250A98.1Very high97.7Very high44 Ų4459.3 Ų59.336%0.36435%0.352SS..Hα-helixtrans-65.9-38.7174.100000111.2F246 L247 G254F246-A250 VanDerWaalsContact O-CB 3.3Å; F246-A250 WeakPolarHBondContact O-CB 3.23Å; F246-A250 PolarHBondContact O-N 3.01Å; L247-A250 PolarHBondContact O-N 3.12Å; A250-G254 WeakPolarHBondContact O-CA 3.46Å; A250-G254 PolarHBondContact O-N 2.86Å
251L98.1Very high97.7Very high122 Ų12258.3 Ų58.364%0.63934%0.343SS*.Hα-helixtrans-66.7-39.1174.7-72.3171.2000112.4F70 L247 V248F70-L251 HydrophobicContact CE1-CB 4.12Å; F70-L251 HydrophobicContact CZ-CB 4.06Å; L247-L251 WeakPolarHBondContact O-CG 3.26Å; L247-L251 PolarHBondContact O-N 3.13Å; V248-L251 PolarHBondContact O-N 3.37Å
252S97.9Very high97.6Very high0 Ų059 Ų590%035%0.346CS..Hα-helixtrans-75.3-56.7-179.8179.10000112.4P69 F70 H197 V248 S249P69-S252 WeakPolarHBondContact CB-O 3.36Å; F70-S252 VanDerWaalsContact CE1-CB 3.45Å; H197-S252 WeakPolarHBondContact CB-OG 3.49Å; H197-S252 VanDerWaalsContact CG-CB 3.47Å; H197-S252 VanDerWaalsContact CG-OG 3.29Å; H197-S252 WeakPolarHBondContact ND1-CB 3.41Å; H197-S252 PolarHBondContact ND1-OG 3.12Å; V248-S252 PolarHBondContact O-N 2.95Å; S249-S252 PolarHBondContact O-N 3.15Å
253L97.7Very high97.5Very high38 Ų3861.8 Ų61.820%0.19936%0.357CS..Hα-helixtrans-93.1-19-171.1-60.8175.9000113.2P69 S249 F256 L257 L262P69-L253 HydrophobicContact CG-CD2 4.06Å; S249-L253 WeakPolarHBondContact O-CB 3.3Å; S249-L253 PolarHBondContact O-N 3.26Å; L253-F256 PolarHBondContact O-N 2.9Å; L253-F256 VanDerWaalsContact O-N 3.14Å; L253-L257 PolarHBondContact O-N 2.84Å; L253-L262 HydrophobicContact CB-CD2 4Å; L253-L262 HydrophobicContact CD2-CD2 4.25Å
254G97.5Very high97.5Very high23 Ų2359.5 Ų59.524%0.23734%0.344CS..Hα-helixtrans-56.8-45-176.200000114.6A250 F256 L257 A258A250-G254 WeakPolarHBondContact O-CA 3.46Å; A250-G254 PolarHBondContact O-N 2.86Å; G254-F256 VanDerWaalsContact C-N 3.29Å; G254-F256 PolarHBondContact O-N 3.2Å; G254-L257 WeakPolarHBondContact O-CB 3.48Å; G254-L257 PolarHBondContact O-N 3.39Å; G254-A258 PolarHBondContact O-N 2.95Å
255P97.4Very high97.4Very high44 Ų4458.1 Ų58.129%0.28634%0.336SS..Hα-helixtrans-56.9-42174.8-26.835.7000112.7A258 L259P255-A258 PolarHBondContact O-N 3.17Å; P255-L259 VanDerWaalsContact O-CG 3.26Å; P255-L259 WeakPolarHBondContact O-CG 3.46Å; P255-L259 PolarHBondContact O-N 3.23Å; P255-L259 VanDerWaalsContact O-N 3.11Å
256F97.6Very high97.2Very high0 Ų059.2 Ų59.20%034%0.335CS..Hα-helixtrans-77.1-26.9179.9-60.2-81.1000112.7I52 W55 Y56 P69 L253 G254 N260 Q261 L262 V265I52-F256 HydrophobicContact CG2-CE1 3.91Å; I52-F256 HydrophobicContact CG2-CE2 4.49Å; I52-F256 HydrophobicContact CG2-CZ 3.72Å; W55-F256 HydrophobicContact CE3-CZ 4.18Å; Y56-F256 HydrophobicContact CD2-CD1 4.01Å; Y56-F256 AromaticContact CD2-CE1 3.46Å; Y56-F256 HydrophobicContact CD2-CE1 3.46Å; Y56-F256 VanDerWaalsContact CD2-CE1 3.46Å; Y56-F256 AromaticContact CD2-CZ 3.96Å; Y56-F256 HydrophobicContact CD2-CZ 3.96Å; Y56-F256 HydrophobicContact CE2-CD1 4.24Å; Y56-F256 AromaticContact CE2-CE1 3.58Å; Y56-F256 HydrophobicContact CE2-CE1 3.58Å; Y56-F256 HydrophobicContact CE2-CE2 4.23Å; Y56-F256 AromaticContact CE2-CZ 3.57Å; Y56-F256 HydrophobicContact CE2-CZ 3.57Å; P69-F256 HydrophobicContact CB-CD2 4.13Å; P69-F256 HydrophobicContact CB-CE2 3.66Å; P69-F256 HydrophobicContact CG-CD2 3.78Å; P69-F256 HydrophobicContact CG-CE2 3.73Å; L253-F256 PolarHBondContact O-N 2.9Å; L253-F256 VanDerWaalsContact O-N 3.14Å; G254-F256 VanDerWaalsContact C-N 3.29Å; G254-F256 PolarHBondContact O-N 3.2Å; F256-N260 PolarHBondContact O-N 2.95Å; F256-Q261 HydrophobicContact CD1-CB 4.48Å; F256-Q261 PolarHBondContact O-N 3.32Å; F256-L262 HydrophobicContact CB-CD2 4.01Å; F256-L262 PolarHBondContact O-N 3.19Å; F256-V265 HydrophobicContact CB-CG2 3.97Å; F256-V265 HydrophobicContact CD1-CG2 3.77Å; F256-V265 HydrophobicContact CG-CG2 3.84Å
257L97.1Very high97Very high105 Ų10555.6 Ų55.655%0.5533%0.327SS..Hα-helixtrans-66.3-46.6168.8179.163.5000110.9L253 G254 L259 N260 L262L253-L257 PolarHBondContact O-N 2.84Å; G254-L257 WeakPolarHBondContact O-CB 3.48Å; G254-L257 PolarHBondContact O-N 3.39Å; L257-L259 PolarHBondContact O-N 3.4Å; L257-N260 PolarHBondContact O-N 3.26Å; L257-L262 HydrophobicContact CB-CD1 3.92Å; L257-L262 HydrophobicContact CB-CD2 4.43Å; L257-L262 HydrophobicContact CB-CG 4.08Å; L257-L262 HydrophobicContact CD1-CD1 3.51Å; L257-L262 HydrophobicContact CD1-CG 4.25Å; L257-L262 HydrophobicContact CG-CD1 4.22Å
258A97.4Very high96.8Very high82 Ų8253.2 Ų53.268%0.67831%0.311SS*.Hα-helixtrans-62.6-31.4177.700000112.6G254 P255 N260G254-A258 PolarHBondContact O-N 2.95Å; P255-A258 PolarHBondContact O-N 3.17Å; A258-N260 VanDerWaalsContact C-N 3.32Å
259L96.8Very high96.5Very high78 Ų7853.5 Ų53.541%0.40831%0.312SS..THydrogen-bonded Turntrans-83.3-1.2175.1-65.2170.5000113.8I52 P255 L257 Q261I52-L259 HydrophobicContact CG2-CD1 4.43Å; P255-L259 VanDerWaalsContact O-CG 3.26Å; P255-L259 WeakPolarHBondContact O-CG 3.46Å; P255-L259 PolarHBondContact O-N 3.23Å; P255-L259 VanDerWaalsContact O-N 3.11Å; L257-L259 PolarHBondContact O-N 3.4Å; L259-Q261 VanDerWaalsContact C-N 3.25Å; L259-Q261 HydrophobicContact CB-CB 4.41Å; L259-Q261 HydrophobicContact CB-CG 3.79Å; L259-Q261 WeakPolarHBondContact O-CG 3.25Å; L259-Q261 PolarHBondContact O-N 3.07Å
260N97.1Very high96.1Very high139 Ų13955.9 Ų55.974%0.74332%0.318SS*.THydrogen-bonded Turntrans57.632-172-63.3-57.2000114.3F256 L257 A258F256-N260 PolarHBondContact O-N 2.95Å; L257-N260 PolarHBondContact O-N 3.26Å; A258-N260 VanDerWaalsContact C-N 3.32Å
261Q96.7Very high95.1Very high21 Ų2156.2 Ų56.210%0.09832%0.317CS..  trans-1073.2-174.7-62.1-175.6-19.300114S53 Y57 F256 L259 P263 Q264 V265S53-Q261 PolarHBondContact O-NE2 3.07Å; S53-Q261 PolarHBondContact O-OE1 2.96Å; Y57-Q261 HydrophobicContact CE2-CB 4.35Å; Y57-Q261 HydrophobicContact CE2-CG 3.81Å; Y57-Q261 VanDerWaalsContact CE2-NE2 3.33Å; F256-Q261 HydrophobicContact CD1-CB 4.48Å; F256-Q261 PolarHBondContact O-N 3.32Å; L259-Q261 VanDerWaalsContact C-N 3.25Å; L259-Q261 HydrophobicContact CB-CB 4.41Å; L259-Q261 HydrophobicContact CB-CG 3.79Å; L259-Q261 WeakPolarHBondContact O-CG 3.25Å; L259-Q261 PolarHBondContact O-N 3.07Å; Q261-P263 VanDerWaalsContact C-CD 3.48Å; Q261-Q264 WeakPolarHBondContact O-CA 3.34Å; Q261-Q264 WeakPolarHBondContact O-CB 3.47Å; Q261-Q264 PolarHBondContact O-N 3.48Å; Q261-V265 PolarHBondContact O-N 3.48Å
262L96.1Very high93.8Very high34 Ų3458.1 Ų58.118%0.17832%0.32CS..Hα-helixtrans-53-43.3178.1-70.9-174.4000114.2L253 F256 L257 Q264 V265 F266L253-L262 HydrophobicContact CB-CD2 4Å; L253-L262 HydrophobicContact CD2-CD2 4.25Å; F256-L262 HydrophobicContact CB-CD2 4.01Å; F256-L262 PolarHBondContact O-N 3.19Å; L257-L262 HydrophobicContact CB-CD1 3.92Å; L257-L262 HydrophobicContact CB-CD2 4.43Å; L257-L262 HydrophobicContact CB-CG 4.08Å; L257-L262 HydrophobicContact CD1-CD1 3.51Å; L257-L262 HydrophobicContact CD1-CG 4.25Å; L257-L262 HydrophobicContact CG-CD1 4.22Å; L262-Q264 PolarHBondContact O-N 3.12Å; L262-V265 PolarHBondContact O-N 3.31Å; L262-F266 HydrophobicContact CB-CD2 4.35Å; L262-F266 HydrophobicContact CB-CE2 4.17Å; L262-F266 WeakPolarHBondContact O-CD2 3.18Å; L262-F266 PolarHBondContact O-N 3.3Å
263P96.3Very high92.6Very high99 Ų9967.2 Ų67.264%0.64336%0.36SS*.Hα-helixtrans-58.8-36.4176.4-2536000112.6Q261 F266 S267Q261-P263 VanDerWaalsContact C-CD 3.48Å; P263-F266 PolarHBondContact O-N 2.92Å; P263-S267 WeakPolarHBondContact O-CB 3.44Å; P263-S267 PolarHBondContact O-N 3.44Å
264Q96.1Very high91.7Very high45 Ų4569.1 Ų69.121%0.2136%0.364CS..Hα-helixtrans-70.8-40.2177.2180628.800112Y56 Y57 Q261 L262 F266 S267 R268Y56-Q264 PolarHBondContact O-NE2 2.82Å; Y57-Q264 HydrophobicContact CD1-CG 4.37Å; Y57-Q264 HydrophobicContact CD2-CG 4.17Å; Y57-Q264 HydrophobicContact CE1-CG 4.01Å; Y57-Q264 HydrophobicContact CE2-CB 4.14Å; Y57-Q264 HydrophobicContact CE2-CG 3.76Å; Y57-Q264 HydrophobicContact CG-CG 4.45Å; Q261-Q264 WeakPolarHBondContact O-CA 3.34Å; Q261-Q264 WeakPolarHBondContact O-CB 3.47Å; Q261-Q264 PolarHBondContact O-N 3.48Å; L262-Q264 PolarHBondContact O-N 3.12Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.85Å; Q264-S267 PolarHBondContact O-N 2.9Å; Q264-S267 PolarHBondContact O-OG 3.39Å; Q264-S267 PolarHBondContact OE1-OG 3.45Å; Q264-R268 WeakPolarHBondContact O-CG 3.32Å; Q264-R268 PolarHBondContact O-N 2.9Å
265V96.6Very high91.1Very high0 Ų068.1 Ų68.10%035%0.354CS..Hα-helixtrans-61.8-45.1174.2177.90000110.2Y56 P69 F256 Q261 L262 S267 R268 L269Y56-V265 HydrophobicContact CD2-CG2 3.76Å; Y56-V265 HydrophobicContact CE1-CG1 4.34Å; Y56-V265 HydrophobicContact CE2-CG2 4.04Å; Y56-V265 HydrophobicContact CG-CG2 4Å; P69-V265 HydrophobicContact CG-CG1 4.45Å; F256-V265 HydrophobicContact CB-CG2 3.97Å; F256-V265 HydrophobicContact CD1-CG2 3.77Å; F256-V265 HydrophobicContact CG-CG2 3.84Å; Q261-V265 PolarHBondContact O-N 3.48Å; L262-V265 PolarHBondContact O-N 3.31Å; V265-S267 PolarHBondContact O-N 3.03Å; V265-R268 PolarHBondContact O-N 3.43Å; V265-L269 HydrophobicContact CG1-CD1 3.75Å; V265-L269 HydrophobicContact CG1-CG 4.36Å; V265-L269 VanDerWaalsContact O-CG 3.25Å; V265-L269 WeakPolarHBondContact O-CG 3.39Å; V265-L269 PolarHBondContact O-N 3.37Å
266F94.5Very high90.6Very high95 Ų9566.8 Ų66.842%0.41735%0.345SS..Hα-helixtrans-66.6-35.7178.3-72.1-55.6000113.4L262 P263 Q264 R268 L269 F270L262-F266 HydrophobicContact CB-CD2 4.35Å; L262-F266 HydrophobicContact CB-CE2 4.17Å; L262-F266 WeakPolarHBondContact O-CD2 3.18Å; L262-F266 PolarHBondContact O-N 3.3Å; P263-F266 PolarHBondContact O-N 2.92Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.85Å; F266-R268 VanDerWaalsContact C-N 3.29Å; F266-R268 PolarHBondContact O-N 3.24Å; F266-L269 HydrophobicContact CD1-CD1 4.25Å; F266-L269 PolarHBondContact O-N 3.03Å; F266-F270 HydrophobicContact CD1-CD2 4.4Å; F266-F270 HydrophobicContact CD1-CE2 4.18Å; F266-F270 PolarHBondContact O-N 2.79Å
267S93.9Very high90.1Very high62 Ų6267.5 Ų67.543%0.43435%0.349SS..Hα-helixtrans-64.8-34.2176.776.80000112.1P263 Q264 V265P263-S267 WeakPolarHBondContact O-CB 3.44Å; P263-S267 PolarHBondContact O-N 3.44Å; Q264-S267 PolarHBondContact O-N 2.9Å; Q264-S267 PolarHBondContact O-OG 3.39Å; Q264-S267 PolarHBondContact OE1-OG 3.45Å; V265-S267 PolarHBondContact O-N 3.03Å
268R93.6Very high89.4Confident51 Ų5165.2 Ų65.219%0.19234%0.335CS..Hα-helixtrans-71.2-44.8173.2-68.6-72.3-169.9-166.30.8112.3Y56 E58 T64 Q264 V265 F266 F270Y56-R268 HydrophobicContact CD1-CB 4.12Å; Y56-R268 HydrophobicContact CD1-CG 4.1Å; Y56-R268 PolarHBondContact O-NE 3.35Å; Y56-R268 PolarHBondContact O-NH2 2.93Å; E58-R268 PolarHBondContact O-NH2 3.47Å; T64-R268 PolarHBondContact OG1-NH1 2.94Å; Q264-R268 WeakPolarHBondContact O-CG 3.32Å; Q264-R268 PolarHBondContact O-N 2.9Å; V265-R268 PolarHBondContact O-N 3.43Å; F266-R268 VanDerWaalsContact C-N 3.29Å; F266-R268 PolarHBondContact O-N 3.24Å; R268-F270 PolarHBondContact O-N 2.77Å
269L92.1Very high88.6Confident10 Ų1062.9 Ų62.95%0.05232%0.316CS..Hα-helixtrans-66.9-36.1-178-70.1167.3000113.4D66 P68 H200 V265 F266 P271D66-L269 WeakPolarHBondContact O-CD2 3.32Å; P68-L269 HydrophobicContact CB-CD1 4.48Å; P68-L269 HydrophobicContact CB-CD2 3.93Å; P68-L269 HydrophobicContact CG-CD2 3.82Å; H200-L269 PolarHBondContact CE1-O 2.99Å; V265-L269 HydrophobicContact CG1-CD1 3.75Å; V265-L269 HydrophobicContact CG1-CG 4.36Å; V265-L269 VanDerWaalsContact O-CG 3.25Å; V265-L269 WeakPolarHBondContact O-CG 3.39Å; V265-L269 PolarHBondContact O-N 3.37Å; F266-L269 HydrophobicContact CD1-CD1 4.25Å; F266-L269 PolarHBondContact O-N 3.03Å; L269-P271 VanDerWaalsContact C-CD 3.47Å; L269-P271 WeakPolarHBondContact O-CD 3.36Å
270F89.4Confident88.3Confident81 Ų8160.2 Ų60.236%0.35530%0.301SS..  trans-123.374.9-174.8-59-74.5000111.3H200 F266 R268 F272H200-F270 HydrophobicContact CB-CZ 4.33Å; F266-F270 HydrophobicContact CD1-CD2 4.4Å; F266-F270 HydrophobicContact CD1-CE2 4.18Å; F266-F270 PolarHBondContact O-N 2.79Å; R268-F270 PolarHBondContact O-N 2.77Å; F270-F272 HydrophobicContact CB-CE2 3.99Å; F270-F272 HydrophobicContact CB-CZ 4.01Å; F270-F272 WeakPolarHBondContact O-CD2 3.11Å; F270-F272 WeakPolarHBondContact O-CE2 3.17Å; F270-F272 PolarHBondContact O-N 3.14Å
271P77.6Confident88.2Confident52 Ų5254.3 Ų54.334%0.33827%0.268SS..  trans-74.493.7179.729.9-34.7000111.1L269 K273 R274L269-P271 VanDerWaalsContact C-CD 3.47Å; L269-P271 WeakPolarHBondContact O-CD 3.36Å; P271-K273 PolarHBondContact O-N 2.87Å; P271-R274 HydrophobicContact CG-CG 4.47Å
272F71.2Confident88.2Confident162 Ų16253.4 Ų53.471%0.71126%0.264SS*.THydrogen-bonded Turntrans-65.8-7.1-175.8-66.4-77.1000115.8F270 R274 Q323F270-F272 HydrophobicContact CB-CE2 3.99Å; F270-F272 HydrophobicContact CB-CZ 4.01Å; F270-F272 WeakPolarHBondContact O-CD2 3.11Å; F270-F272 WeakPolarHBondContact O-CE2 3.17Å; F270-F272 PolarHBondContact O-N 3.14Å; F272-R274 VanDerWaalsContact C-N 3.27Å; F272-R274 PolarHBondContact O-N 3.37Å; F272-Q323 PolarHBondContact O-NE2 3.05Å
273K72.5Confident88.2Confident190 Ų19051.8 Ų51.883%0.82626%0.256SS*.THydrogen-bonded Turntrans-81.22.9-178.5-65.1-173.6179.6-1790114.7P271P271-K273 PolarHBondContact O-N 2.87Å
274R77.4Confident88.3Confident79 Ų7947.2 Ų47.230%0.29823%0.226SC..  trans-84.5148.7-179.1-57.2-167.6-174.3176.72.3111.9D66 P271 F272 W378 H379D66-R274 IonicContact OD2-NH2 3.06Å; P271-R274 HydrophobicContact CG-CG 4.47Å; F272-R274 VanDerWaalsContact C-N 3.27Å; F272-R274 PolarHBondContact O-N 3.37Å; R274-W378 WeakPolarHBondContact O-CZ2 3.33Å; R274-W378 PolarHBondContact O-NE1 3.1Å; R274-W378 VanDerWaalsContact O-NE1 3.15Å; R274-H379 HydrophobicContact CB-CB 4.46Å; R274-H379 WeakPolarHBondContact CD-CD2 3.47Å; R274-H379 WeakPolarHBondContact CD-NE2 3.33Å
275G85.1Confident88.4Confident2 Ų248.6 Ų48.62%0.02123%0.231CC..  trans-77.1170.7176.400000114C277 H379G275-C277 PolarHBondContact O-N 3.46Å; G275-H379 PolarHBondContact O-ND1 3.34Å
276L88Confident88.3Confident16 Ų1649.1 Ų49.18%0.08423%0.233CC..SBendtrans-53.4-47.8-177173.965.2000113.2W286 V332 T337 W378 H379L276-W286 HydrophobicContact CD1-CD2 4.02Å; L276-W286 HydrophobicContact CD1-CG 3.95Å; L276-W286 HydrophobicContact CD2-CB 4.2Å; L276-W286 HydrophobicContact CD2-CD2 4.26Å; L276-W286 HydrophobicContact CD2-CE3 4.27Å; L276-W286 HydrophobicContact CD2-CG 4.24Å; L276-W286 HydrophobicContact CG-CB 4.31Å; L276-W286 HydrophobicContact CG-CG 4.21Å; L276-V332 HydrophobicContact CD1-CG1 4.33Å; L276-V332 HydrophobicContact CD2-CB 4.11Å; L276-V332 HydrophobicContact CD2-CG2 4.36Å; L276-T337 HydrophobicContact CD1-CG2 3.61Å; L276-W378 HydrophobicContact CB-CE3 4.26Å; L276-W378 HydrophobicContact CB-CH2 4.06Å; L276-W378 HydrophobicContact CB-CZ3 3.81Å; L276-W378 HydrophobicContact CD1-CE3 3.61Å; L276-W378 HydrophobicContact CD1-CZ3 3.74Å; L276-W378 HydrophobicContact CG-CZ3 4.38Å; L276-H379 VanDerWaalsContact O-CA 3.31Å; L276-H379 WeakPolarHBondContact O-CA 3.46Å; L276-H379 PolarHBondContact O-N 3.1Å
277C87.4Confident88.4Confident14 Ų1444.6 Ų44.610%0.09521%0.213CC..SBendtrans-115.5152.2176.5-67.80000110.2G275 W281 N290 M316G275-C277 PolarHBondContact O-N 3.46Å; C277-W281 HydrophobicContact CB-CG 4.29Å; C277-N290 PolarHBondContact SG-ND2 3.01Å; C277-M316 HydrophobicContact CB-CE 4.44Å
278H81.8Confident88.6Confident57 Ų5743.8 Ų43.826%0.26420%0.204SC..  trans-70.9171.5168.1-166-99.8000110.8Y280 H379 H381H278-Y280 VanDerWaalsContact C-N 3.31Å; H278-Y280 CarbonylContact C-O 3.6Å; H278-Y280 CarbonylContact O-C 3.26Å; H278-Y280 PolarHBondContact O-N 2.86Å; H278-H379 AromaticContact CD2-CE1 3.72Å; H278-H379 AromaticContact CD2-NE2 3.68Å; H278-H381 AromaticContact CD2-CE1 3.61Å; H278-H381 AromaticContact NE2-CE1 3.96Å
279A81.5Confident88.7Confident33 Ų3343.4 Ų43.427%0.27320%0.203SC..SBendtrans-57.2-43.9179.700000112.4G319 V321A279-G319 WeakPolarHBondContact CB-O 3.5Å; A279-V321 HydrophobicContact CB-CG2 4.23Å
280Y90.5Very high88.7Confident22 Ų2243.1 Ų43.19%0.08620%0.201CC..SBendtrans-88.8120.1161.5178.9-135.7000108.7H278 A282 E382 S416 P419 L492 S496H278-Y280 VanDerWaalsContact C-N 3.31Å; H278-Y280 CarbonylContact C-O 3.6Å; H278-Y280 CarbonylContact O-C 3.26Å; H278-Y280 PolarHBondContact O-N 2.86Å; Y280-A282 PolarHBondContact O-N 3.28Å; Y280-E382 HydrophobicContact CD1-CB 4.18Å; Y280-E382 HydrophobicContact CD1-CG 3.75Å; Y280-E382 HydrophobicContact CE1-CB 3.88Å; Y280-E382 HydrophobicContact CE1-CG 3.69Å; Y280-S416 WeakPolarHBondContact CE1-O 3.44Å; Y280-S416 PolarHBondContact OH-O 2.9Å; Y280-P419 HydrophobicContact CE1-CB 4.09Å; Y280-P419 HydrophobicContact CE1-CG 4.17Å; Y280-P419 HydrophobicContact CE2-CB 4.24Å; Y280-P419 HydrophobicContact CE2-CG 4.03Å; Y280-L492 HydrophobicContact CD2-CB 4.05Å; Y280-L492 HydrophobicContact CD2-CD2 4.09Å; Y280-L492 HydrophobicContact CD2-CG 4.46Å; Y280-L492 HydrophobicContact CE2-CB 4.27Å; Y280-L492 HydrophobicContact CE2-CD2 4.2Å; Y280-S496 WeakPolarHBondContact CE2-OG 2.69Å
281W93.4Very high89Confident16 Ų1639.9 Ų39.96%0.06119%0.189CC..PPolyproline II helixtrans-73.1124.2-177.7-57.5-9.9000109.7C277 A287 N290 A291 M316 L493 S496C277-W281 HydrophobicContact CB-CG 4.29Å; W281-A287 HydrophobicContact CB-CB 4.1Å; W281-A287 HydrophobicContact CE3-CB 4.09Å; W281-N290 HydrophobicContact CD2-CB 4.42Å; W281-N290 HydrophobicContact CE3-CB 4.16Å; W281-N290 HydrophobicContact CH2-CB 3.55Å; W281-N290 HydrophobicContact CZ2-CB 3.86Å; W281-N290 HydrophobicContact CZ3-CB 3.72Å; W281-A291 HydrophobicContact CZ3-CB 4.25Å; W281-M316 HydrophobicContact CZ2-CB 3.74Å; W281-M316 HydrophobicContact CZ2-CE 3.94Å; W281-M316 HydrophobicContact CZ2-CG 4.5Å; W281-L493 HydrophobicContact CH2-CD1 4.09Å; W281-L493 HydrophobicContact CH2-CG 4.49Å; W281-L493 HydrophobicContact CZ3-CD1 4.22Å; W281-L493 HydrophobicContact CZ3-CG 4.14Å; W281-S496 WeakPolarHBondContact O-CB 3.33Å; W281-S496 PolarHBondContact O-OG 3.42Å
282A96.6Very high89.8Confident1 Ų141.7 Ų41.71%0.00820%0.196CC..PPolyproline II helixtrans-55.2138.1164.500000109.5Y280 N284 A287 F374 V380 E382Y280-A282 PolarHBondContact O-N 3.28Å; A282-N284 PolarHBondContact O-N 2.63Å; A282-N284 PolarHBondContact O-OD1 2.76Å; A282-A287 WeakPolarHBondContact O-CB 3.01Å; A282-F374 HydrophobicContact CB-CE2 4.22Å; A282-F374 HydrophobicContact CB-CZ 4.16Å; A282-V380 VanDerWaalsContact CB-O 3.23Å; A282-V380 WeakPolarHBondContact CB-O 3.04Å; A282-E382 HydrophobicContact CB-CB 4.45Å
283P97.6Very high90.8Very high0 Ų034.5 Ų34.50%017%0.165CC..SBendtrans-73.969.7-177.635.4-44.8000111.8F374 S416 S496 C499 A500 I503P283-F374 HydrophobicContact CG-CE1 4.3Å; P283-F374 HydrophobicContact CG-CZ 3.89Å; P283-F374 WeakPolarHBondContact O-CE1 3.48Å; P283-S416 VanDerWaalsContact CG-CB 3.5Å; P283-S416 WeakPolarHBondContact CG-OG 3.43Å; P283-S496 WeakPolarHBondContact CA-O 3.1Å; P283-S496 WeakPolarHBondContact CB-O 2.82Å; P283-C499 HydrophobicContact CB-CB 3.46Å; P283-C499 VanDerWaalsContact CB-CB 3.46Å; P283-C499 HydrophobicContact CG-CB 4.19Å; P283-A500 VanDerWaalsContact C-CB 3.47Å; P283-A500 HydrophobicContact CB-CB 4.29Å; P283-A500 WeakPolarHBondContact O-CA 3.35Å; P283-I503 HydrophobicContact CB-CD1 3.88Å; P283-I503 HydrophobicContact CG-CD1 3.45Å; P283-I503 VanDerWaalsContact CG-CD1 3.45Å; P283-I503 WeakPolarHBondContact O-CD1 3.19Å
284N97.7Very high91.6Very high3 Ų329 Ų292%0.01614%0.141CC..SBendtrans-126.1-170.1-175.366.315.5000111.5A282 W286 A287 F374 M375 A500A282-N284 PolarHBondContact O-N 2.63Å; A282-N284 PolarHBondContact O-OD1 2.76Å; N284-W286 PolarHBondContact O-N 2.62Å; N284-W286 WeakPolarHBondContact OD1-CB 3.3Å; N284-W286 PolarHBondContact OD1-N 3.29Å; N284-A287 PolarHBondContact O-N 3.02Å; N284-A287 PolarHBondContact OD1-N 3.32Å; N284-F374 HydrophobicContact CB-CD1 4.08Å; N284-F374 HydrophobicContact CB-CE1 3.87Å; N284-F374 HydrophobicContact CB-CZ 4.49Å; N284-F374 WeakPolarHBondContact CB-O 3.21Å; N284-F374 PolarHBondContact ND2-O 3.49Å; N284-M375 HydrophobicContact CB-SD 4.31Å; N284-A500 WeakPolarHBondContact O-CB 3.29Å
285F97.7Very high92.3Very high75 Ų7529.1 Ų29.133%0.32915%0.15SC..Hα-helixtrans-59.6-37.9-179.5-177-101.4000112A287 L288 Y289 M375 F376F285-A287 VanDerWaalsContact C-N 3.33Å; F285-A287 PolarHBondContact O-N 3.19Å; F285-L288 WeakPolarHBondContact O-CB 3.29Å; F285-L288 PolarHBondContact O-N 3.5Å; F285-L288 VanDerWaalsContact O-N 3.14Å; F285-Y289 HydrophobicContact CE1-CD2 4.24Å; F285-Y289 PolarHBondContact O-N 3.17Å; F285-M375 HydrophobicContact CB-CE 3.89Å; F285-M375 VanDerWaalsContact CB-O 3.26Å; F285-M375 WeakPolarHBondContact CB-O 3.43Å; F285-M375 PolarHBondContact N-O 2.78Å; F285-F376 HydrophobicContact CB-CD1 3.99Å; F285-F376 HydrophobicContact CB-CE1 3.75Å; F285-F376 AromaticContact CD1-CD1 3.98Å; F285-F376 HydrophobicContact CD1-CD1 3.98Å; F285-F376 AromaticContact CD1-CE1 3.77Å; F285-F376 HydrophobicContact CD1-CE1 3.77Å; F285-F376 AromaticContact CD2-CE1 3.97Å; F285-F376 HydrophobicContact CD2-CE1 3.97Å; F285-F376 HydrophobicContact CE1-CE1 4.36Å; F285-F376 HydrophobicContact CG-CD1 4.04Å; F285-F376 AromaticContact CG-CE1 3.55Å; F285-F376 HydrophobicContact CG-CE1 3.55Å; F285-F376 HydrophobicContact CG-CZ 4.48Å
286W96Very high92.6Very high10 Ų1031.9 Ų31.94%0.03816%0.164CC..Hα-helixtrans-68.8-30-178.7-53.5127.4000112.8L276 N284 L288 Y289 N290 V332 T337 F376 G377L276-W286 HydrophobicContact CD1-CD2 4.02Å; L276-W286 HydrophobicContact CD1-CG 3.95Å; L276-W286 HydrophobicContact CD2-CB 4.2Å; L276-W286 HydrophobicContact CD2-CD2 4.26Å; L276-W286 HydrophobicContact CD2-CE3 4.27Å; L276-W286 HydrophobicContact CD2-CG 4.24Å; L276-W286 HydrophobicContact CG-CB 4.31Å; L276-W286 HydrophobicContact CG-CG 4.21Å; N284-W286 PolarHBondContact O-N 2.62Å; N284-W286 WeakPolarHBondContact OD1-CB 3.3Å; N284-W286 PolarHBondContact OD1-N 3.29Å; W286-L288 VanDerWaalsContact C-N 3.32Å; W286-L288 PolarHBondContact O-N 3.4Å; W286-Y289 HydrophobicContact CE3-CG 4.34Å; W286-Y289 PolarHBondContact O-N 3.12Å; W286-N290 WeakPolarHBondContact O-CB 3.31Å; W286-N290 PolarHBondContact O-N 3.3Å; W286-N290 PolarHBondContact O-ND2 3.14Å; W286-N290 VanDerWaalsContact O-ND2 3.16Å; W286-V332 HydrophobicContact CE3-CG2 4.4Å; W286-V332 HydrophobicContact CH2-CG1 3.86Å; W286-V332 HydrophobicContact CZ2-CG1 4.35Å; W286-V332 HydrophobicContact CZ3-CG1 4Å; W286-V332 HydrophobicContact CZ3-CG2 3.93Å; W286-T337 HydrophobicContact CH2-CG2 4.31Å; W286-T337 HydrophobicContact CZ2-CG2 3.6Å; W286-F376 HydrophobicContact CZ2-CB 4.28Å; W286-F376 HydrophobicContact CZ2-CD1 4.24Å; W286-F376 WeakPolarHBondContact CZ2-O 3.42Å; W286-F376 PolarHBondContact NE1-O 2.78Å; W286-G377 PolarHBondContact NE1-O 2.88Å; W286-G377 VanDerWaalsContact NE1-O 3.11Å
287A96.1Very high92.6Very high0 Ų031.5 Ų31.50%016%0.163CC..Hα-helixtrans-61.1-41.6170.200000111.9W281 A282 N284 F285 A291 A500W281-A287 HydrophobicContact CB-CB 4.1Å; W281-A287 HydrophobicContact CE3-CB 4.09Å; A282-A287 WeakPolarHBondContact O-CB 3.01Å; N284-A287 PolarHBondContact O-N 3.02Å; N284-A287 PolarHBondContact OD1-N 3.32Å; F285-A287 VanDerWaalsContact C-N 3.33Å; F285-A287 PolarHBondContact O-N 3.19Å; A287-A291 VanDerWaalsContact O-CB 3.29Å; A287-A291 WeakPolarHBondContact O-CB 3.26Å; A287-A291 PolarHBondContact O-N 3.04Å; A287-A500 HydrophobicContact CB-CB 4.32Å
288L96.9Very high92.6Very high45 Ų4534.8 Ų34.824%0.23618%0.182CC..Hα-helixtrans-66.3-43.2175.2-57.7177.3000111.3F285 W286 A291 L292 V497 A500 V501F285-L288 WeakPolarHBondContact O-CB 3.29Å; F285-L288 PolarHBondContact O-N 3.5Å; F285-L288 VanDerWaalsContact O-N 3.14Å; W286-L288 VanDerWaalsContact C-N 3.32Å; W286-L288 PolarHBondContact O-N 3.4Å; L288-A291 PolarHBondContact O-N 3.35Å; L288-L292 WeakPolarHBondContact O-CB 3.33Å; L288-L292 PolarHBondContact O-N 3.25Å; L288-V497 HydrophobicContact CD2-CG1 4Å; L288-A500 HydrophobicContact CD1-CB 4.3Å; L288-A500 HydrophobicContact CD2-CB 3.74Å; L288-A500 HydrophobicContact CG-CB 3.77Å; L288-V501 HydrophobicContact CD2-CG2 4.01Å
289Y95.9Very high93Very high43 Ų4336 Ų3617%0.16919%0.19CC..Hα-helixtrans-60.8-47.3178-167.5-91.9000112.1F285 W286 L292 D293 H326 L329 P330 V332F285-Y289 HydrophobicContact CE1-CD2 4.24Å; F285-Y289 PolarHBondContact O-N 3.17Å; W286-Y289 HydrophobicContact CE3-CG 4.34Å; W286-Y289 PolarHBondContact O-N 3.12Å; Y289-L292 PolarHBondContact O-N 2.76Å; Y289-D293 PolarHBondContact O-N 3.38Å; Y289-H326 AromaticContact CD1-CD2 3.98Å; Y289-H326 AromaticContact CD1-NE2 3.67Å; Y289-H326 AromaticContact CE1-CD2 3.81Å; Y289-H326 AromaticContact CE1-NE2 3.76Å; Y289-L329 HydrophobicContact CD1-CD1 4Å; Y289-L329 HydrophobicContact CD2-CD1 4.03Å; Y289-L329 HydrophobicContact CE1-CB 3.77Å; Y289-L329 HydrophobicContact CE1-CD1 3.77Å; Y289-L329 HydrophobicContact CE1-CG 4.44Å; Y289-L329 HydrophobicContact CE2-CB 4.5Å; Y289-L329 HydrophobicContact CE2-CD1 3.8Å; Y289-L329 HydrophobicContact CG-CD1 4.14Å; Y289-L329 WeakPolarHBondContact OH-CB 3.27Å; Y289-P330 WeakPolarHBondContact OH-CD 3.41Å; Y289-P330 PolarHBondContact OH-O 2.85Å; Y289-V332 HydrophobicContact CD1-CG2 4.41Å; Y289-V332 HydrophobicContact CE1-CG2 3.84Å
290N93.5Very high93.3Very high4 Ų434.9 Ų34.92%0.02118%0.182CC..Hα-helixtrans-66.8-38.6178.4-65.9-22.1000112C277 W281 W286 L292 D293 K294 M316 H326C277-N290 PolarHBondContact SG-ND2 3.01Å; W281-N290 HydrophobicContact CD2-CB 4.42Å; W281-N290 HydrophobicContact CE3-CB 4.16Å; W281-N290 HydrophobicContact CH2-CB 3.55Å; W281-N290 HydrophobicContact CZ2-CB 3.86Å; W281-N290 HydrophobicContact CZ3-CB 3.72Å; W286-N290 WeakPolarHBondContact O-CB 3.31Å; W286-N290 PolarHBondContact O-N 3.3Å; W286-N290 PolarHBondContact O-ND2 3.14Å; W286-N290 VanDerWaalsContact O-ND2 3.16Å; N290-L292 VanDerWaalsContact C-N 3.34Å; N290-D293 PolarHBondContact O-N 3.15Å; N290-K294 WeakPolarHBondContact O-CB 3.28Å; N290-K294 PolarHBondContact O-N 3.29Å; N290-M316 HydrophobicContact CB-CE 4.18Å; N290-M316 WeakPolarHBondContact ND2-CE 3.19Å; N290-H326 PolarHBondContact OD1-NE2 2.7Å
291A94Very high93.1Very high13 Ų1337.1 Ų37.111%0.10720%0.195CC..Hα-helixtrans-63.2-42.6174.400000111.3W281 A287 L288 K294 V295 V497W281-A291 HydrophobicContact CZ3-CB 4.25Å; A287-A291 VanDerWaalsContact O-CB 3.29Å; A287-A291 WeakPolarHBondContact O-CB 3.26Å; A287-A291 PolarHBondContact O-N 3.04Å; L288-A291 PolarHBondContact O-N 3.35Å; A291-K294 PolarHBondContact O-N 2.94Å; A291-V295 WeakPolarHBondContact O-CG2 3.25Å; A291-V295 PolarHBondContact O-N 3.37Å; A291-V497 HydrophobicContact CB-CG2 3.48Å; A291-V497 VanDerWaalsContact CB-CG2 3.48Å
292L95.2Very high92.9Very high91 Ų9145 Ų4548%0.47623%0.23SC..Hα-helixtrans-62.2-48.6175.9-179.361.4000111.5L288 Y289 N290 K294 V295 L296 L329L288-L292 WeakPolarHBondContact O-CB 3.33Å; L288-L292 PolarHBondContact O-N 3.25Å; Y289-L292 PolarHBondContact O-N 2.76Å; N290-L292 VanDerWaalsContact C-N 3.34Å; L292-K294 PolarHBondContact O-N 3.3Å; L292-V295 PolarHBondContact O-N 2.94Å; L292-L296 HydrophobicContact CD1-CD1 4.15Å; L292-L296 HydrophobicContact CD1-CG 4.11Å; L292-L296 HydrophobicContact CG-CD1 3.98Å; L292-L296 HydrophobicContact CG-CG 4.36Å; L292-L296 WeakPolarHBondContact O-CB 3.15Å; L292-L296 VanDerWaalsContact O-CG 3.28Å; L292-L296 WeakPolarHBondContact O-CG 3.16Å; L292-L296 PolarHBondContact O-N 3.45Å; L292-L329 HydrophobicContact CB-CD1 4.35Å; L292-L329 HydrophobicContact CD2-CD1 4.22Å; L292-L329 HydrophobicContact CG-CD1 4.23Å
293D92.6Very high92.5Very high10 Ų1049.9 Ų49.95%0.05326%0.255CS..Hα-helixtrans-55.2-42.7175.5-172.761.3000111.4Y289 N290 L296 S297 H326 T327 V328 L329Y289-D293 PolarHBondContact O-N 3.38Å; N290-D293 PolarHBondContact O-N 3.15Å; D293-L296 PolarHBondContact O-N 3.44Å; D293-S297 WeakPolarHBondContact O-CB 3.23Å; D293-S297 PolarHBondContact O-N 3.23Å; D293-S297 PolarHBondContact O-OG 3.17Å; D293-H326 IonicContact OD2-CD2 3.62Å; D293-T327 PolarHBondContact OD1-N 2.67Å; D293-T327 PolarHBondContact OD2-N 2.88Å; D293-V328 WeakPolarHBondContact OD1-CA 3.43Å; D293-V328 PolarHBondContact OD1-N 3.06Å; D293-L329 HydrophobicContact CB-CB 4.31Å; D293-L329 HydrophobicContact CB-CD1 3.89Å; D293-L329 HydrophobicContact CB-CG 4.01Å; D293-L329 PolarHBondContact OD1-N 2.69Å
294K89.2Confident91.7Very high75 Ų7558.8 Ų58.833%0.32629%0.294SS..Hα-helixtrans-65.5-45178.4-172.165.7-180-1740112.4N290 A291 L292 S297 V298 S315N290-K294 WeakPolarHBondContact O-CB 3.28Å; N290-K294 PolarHBondContact O-N 3.29Å; A291-K294 PolarHBondContact O-N 2.94Å; L292-K294 PolarHBondContact O-N 3.3Å; K294-S297 PolarHBondContact O-N 3.07Å; K294-V298 WeakPolarHBondContact O-CG2 3.24Å; K294-V298 PolarHBondContact O-N 3.46Å; K294-S315 PolarHBondContact NZ-OG 3.37Å
295V91.1Very high91.1Very high81 Ų8166.7 Ų66.749%0.49133%0.328SS..Hα-helixtrans-62.3-45.9177.5169.40000110.4A291 L292 S297 V298 I299A291-V295 WeakPolarHBondContact O-CG2 3.25Å; A291-V295 PolarHBondContact O-N 3.37Å; L292-V295 PolarHBondContact O-N 2.94Å; V295-S297 VanDerWaalsContact C-N 3.33Å; V295-S297 PolarHBondContact O-N 3.17Å; V295-V298 PolarHBondContact O-N 3.03Å; V295-I299 HydrophobicContact CG1-CD1 3.72Å; V295-I299 HydrophobicContact CG1-CG1 4.46Å; V295-I299 WeakPolarHBondContact O-CG1 3.44Å; V295-I299 PolarHBondContact O-N 2.84Å
296L91.8Very high90.2Very high60 Ų6065.3 Ų65.331%0.31432%0.324SS..Hα-helixtrans-61.9-40.2176.7-68.6175.1000112L292 D293 V298 I299 G300 V328 L329L292-L296 HydrophobicContact CD1-CD1 4.15Å; L292-L296 HydrophobicContact CD1-CG 4.11Å; L292-L296 HydrophobicContact CG-CD1 3.98Å; L292-L296 HydrophobicContact CG-CG 4.36Å; L292-L296 WeakPolarHBondContact O-CB 3.15Å; L292-L296 VanDerWaalsContact O-CG 3.28Å; L292-L296 WeakPolarHBondContact O-CG 3.16Å; L292-L296 PolarHBondContact O-N 3.45Å; D293-L296 PolarHBondContact O-N 3.44Å; L296-V298 PolarHBondContact O-N 3.49Å; L296-I299 PolarHBondContact O-N 3.27Å; L296-G300 PolarHBondContact O-N 2.91Å; L296-V328 HydrophobicContact CB-CB 4.21Å; L296-V328 HydrophobicContact CB-CG1 4.1Å; L296-V328 HydrophobicContact CB-CG2 4.21Å; L296-V328 HydrophobicContact CD1-CG1 4.19Å; L296-L329 HydrophobicContact CD1-CD2 3.87Å; L296-L329 HydrophobicContact CD1-CG 4.29Å
297S87.9Confident89.3Confident9 Ų968.5 Ų68.56%0.06334%0.341CS..Hα-helixtrans-61.9-43.8176-59.70000112D293 K294 V295 G300 L301 T327D293-S297 WeakPolarHBondContact O-CB 3.23Å; D293-S297 PolarHBondContact O-N 3.23Å; D293-S297 PolarHBondContact O-OG 3.17Å; K294-S297 PolarHBondContact O-N 3.07Å; V295-S297 VanDerWaalsContact C-N 3.33Å; V295-S297 PolarHBondContact O-N 3.17Å; S297-G300 PolarHBondContact O-N 3.44Å; S297-L301 WeakPolarHBondContact O-CB 3.18Å; S297-L301 WeakPolarHBondContact O-CG 3.07Å; S297-L301 PolarHBondContact O-N 2.91Å; S297-T327 WeakPolarHBondContact OG-CB 3.37Å
298V87.7Confident88.1Confident82 Ų8272.5 Ų72.550%0.49737%0.368SS..Hα-helixtrans-66.4-42.8178.2171.70000111.2K294 V295 L296 K302K294-V298 WeakPolarHBondContact O-CG2 3.24Å; K294-V298 PolarHBondContact O-N 3.46Å; V295-V298 PolarHBondContact O-N 3.03Å; L296-V298 PolarHBondContact O-N 3.49Å; V298-K302 WeakPolarHBondContact O-CB 3.2Å; V298-K302 PolarHBondContact O-N 3.44Å
299I89.4Confident86.9Confident84 Ų8477 Ų7743%0.43139%0.392SS..Hα-helixtrans-64.7-46.4176.4-67.8169.7000110.3V295 L296 L301 K302 L303V295-I299 HydrophobicContact CG1-CD1 3.72Å; V295-I299 HydrophobicContact CG1-CG1 4.46Å; V295-I299 WeakPolarHBondContact O-CG1 3.44Å; V295-I299 PolarHBondContact O-N 2.84Å; L296-I299 PolarHBondContact O-N 3.27Å; I299-L301 VanDerWaalsContact C-N 3.35Å; I299-L301 PolarHBondContact O-N 2.93Å; I299-K302 PolarHBondContact O-N 3.48Å; I299-L303 HydrophobicContact CG2-CD1 3.69Å; I299-L303 HydrophobicContact CG2-CG 4.27Å; I299-L303 WeakPolarHBondContact O-CB 3.44Å; I299-L303 WeakPolarHBondContact O-CG 3.2Å; I299-L303 PolarHBondContact O-N 2.93Å
300G88Confident85.6Confident9 Ų981.3 Ų81.39%0.09342%0.418CS..Hα-helixtrans-61.1-40.5179.500000112.9L296 S297 K304 F305 L306L296-G300 PolarHBondContact O-N 2.91Å; S297-G300 PolarHBondContact O-N 3.44Å; G300-K304 PolarHBondContact O-N 3.27Å; G300-K304 VanDerWaalsContact O-N 3.11Å; G300-F305 PolarHBondContact O-N 3.42Å; G300-L306 PolarHBondContact O-N 2.91Å
301L87Confident84.3Confident68 Ų6882.9 Ų82.936%0.35643%0.426SS..Hα-helixtrans-63.9-46.3171.7-83175000112.4S297 I299 L303 K304 L306 P308 I311S297-L301 WeakPolarHBondContact O-CB 3.18Å; S297-L301 WeakPolarHBondContact O-CG 3.07Å; S297-L301 PolarHBondContact O-N 2.91Å; I299-L301 VanDerWaalsContact C-N 3.35Å; I299-L301 PolarHBondContact O-N 2.93Å; L301-L303 VanDerWaalsContact C-N 3.28Å; L301-L303 PolarHBondContact O-N 3.49Å; L301-K304 PolarHBondContact O-N 2.91Å; L301-K304 VanDerWaalsContact O-N 3.13Å; L301-L306 HydrophobicContact CD2-CB 4.33Å; L301-P308 HydrophobicContact CD2-CB 3.98Å; L301-I311 HydrophobicContact CD1-CD1 3.57Å; L301-I311 HydrophobicContact CD2-CD1 3.39Å; L301-I311 HydrophobicContact CG-CD1 3.49Å; L301-I311 VanDerWaalsContact CG-CD1 3.49Å
302K88.1Confident82.7Confident183 Ų18385.5 Ų85.580%0.79644%0.442SS*.Hα-helixtrans-64.5-35.3-179-172175.6179.9-178.20112V298 I299 K304V298-K302 WeakPolarHBondContact O-CB 3.2Å; V298-K302 PolarHBondContact O-N 3.44Å; I299-K302 PolarHBondContact O-N 3.48Å; K302-K304 VanDerWaalsContact C-N 3.33Å
303L89.3Confident80.6Confident103 Ų10391.4 Ų91.454%0.53946%0.464SS..THydrogen-bonded Turntrans-87.73.9177-62.8179.5000113.5I299 L301 F305I299-L303 HydrophobicContact CG2-CD1 3.69Å; I299-L303 HydrophobicContact CG2-CG 4.27Å; I299-L303 WeakPolarHBondContact O-CB 3.44Å; I299-L303 WeakPolarHBondContact O-CG 3.2Å; I299-L303 PolarHBondContact O-N 2.93Å; L301-L303 VanDerWaalsContact C-N 3.28Å; L301-L303 PolarHBondContact O-N 3.49Å; L303-F305 HydrophobicContact CB-CD2 3.54Å; L303-F305 HydrophobicContact CB-CE2 3.74Å; L303-F305 HydrophobicContact CB-CG 4.45Å; L303-F305 HydrophobicContact CD1-CD2 4.1Å; L303-F305 HydrophobicContact CD1-CE2 3.81Å; L303-F305 HydrophobicContact CG-CD2 4.48Å; L303-F305 HydrophobicContact CG-CE2 4.42Å; L303-F305 PolarHBondContact O-N 3.37Å
304K81.7Confident78.5Confident187 Ų18792.8 Ų92.881%0.81348%0.476SS*.THydrogen-bonded Turntrans57.822.1-177.5-54.3-178.3178.3-178.70114.9G300 L301 K302 L306G300-K304 PolarHBondContact O-N 3.27Å; G300-K304 VanDerWaalsContact O-N 3.11Å; L301-K304 PolarHBondContact O-N 2.91Å; L301-K304 VanDerWaalsContact O-N 3.13Å; K302-K304 VanDerWaalsContact C-N 3.33Å; K304-L306 VanDerWaalsContact C-N 3.29Å
305F83.6Confident76.5Confident168 Ų16891.1 Ų91.174%0.73748%0.475SS*.SBendtrans-76.4-20.8170.8-70.8-55.1000112.6G300 L303G300-F305 PolarHBondContact O-N 3.42Å; L303-F305 HydrophobicContact CB-CD2 3.54Å; L303-F305 HydrophobicContact CB-CE2 3.74Å; L303-F305 HydrophobicContact CB-CG 4.45Å; L303-F305 HydrophobicContact CD1-CD2 4.1Å; L303-F305 HydrophobicContact CD1-CE2 3.81Å; L303-F305 HydrophobicContact CG-CD2 4.48Å; L303-F305 HydrophobicContact CG-CE2 4.42Å; L303-F305 PolarHBondContact O-N 3.37Å
306L79.6Confident74.2Confident46 Ų4689.6 Ų89.624%0.24146%0.462CS..SBendtrans-115132.1176.8-62.8172.7000109.3G300 L301 K304 P308 I311 V328G300-L306 PolarHBondContact O-N 2.91Å; L301-L306 HydrophobicContact CD2-CB 4.33Å; K304-L306 VanDerWaalsContact C-N 3.29Å; L306-P308 WeakPolarHBondContact O-CD 3.28Å; L306-I311 HydrophobicContact CB-CD1 4.41Å; L306-V328 HydrophobicContact CD1-CG2 3.82Å
307D76.7Confident71.9Confident77 Ų7788.9 Ų88.941%0.41246%0.461SS..  trans-76.6121.2170.6-170.8-20.4000109N309 N310D307-N309 PolarHBondContact O-N 3.35Å; D307-N309 WeakPolarHBondContact OD1-CB 3.34Å; D307-N309 PolarHBondContact OD1-N 3Å; D307-N309 PolarHBondContact OD1-ND2 3.14Å; D307-N310 HydrophobicContact CB-CB 4.46Å; D307-N310 PolarHBondContact O-N 3.14Å
308P72Confident70.1Confident85 Ų8591 Ų9155%0.55248%0.476SS*.THydrogen-bonded Turntrans-56.4-21.7176.421.8-32.9000113.9L301 L306L301-P308 HydrophobicContact CD2-CB 3.98Å; L306-P308 WeakPolarHBondContact O-CD 3.28Å
309N71.7Confident68.1Low139 Ų13988.5 Ų88.574%0.74347%0.466SS*.THydrogen-bonded Turntrans-75.1-24.5177.2-64-39.1000113.5D307D307-N309 PolarHBondContact O-N 3.35Å; D307-N309 WeakPolarHBondContact OD1-CB 3.34Å; D307-N309 PolarHBondContact OD1-N 3Å; D307-N309 PolarHBondContact OD1-ND2 3.14Å
310N68.4Low66Low134 Ų13489.5 Ų89.572%0.71747%0.472SS*.SBendtrans-91.8-4.3-178.5-71-22.9000113.3D307 P312D307-N310 HydrophobicContact CB-CB 4.46Å; D307-N310 PolarHBondContact O-N 3.14Å; N310-P312 WeakPolarHBondContact O-CD 3.37Å
311I64.9Low64.1Low37 Ų3792.2 Ų92.219%0.1949%0.487CS..SBendtrans-83123.5179.4-59.9178.7000108.4L301 L306 K313 T327L301-I311 HydrophobicContact CD1-CD1 3.57Å; L301-I311 HydrophobicContact CD2-CD1 3.39Å; L301-I311 HydrophobicContact CG-CD1 3.49Å; L301-I311 VanDerWaalsContact CG-CD1 3.49Å; L306-I311 HydrophobicContact CB-CD1 4.41Å; I311-K313 PolarHBondContact O-N 3.39Å; I311-T327 HydrophobicContact CD1-CG2 4.42Å; I311-T327 HydrophobicContact CG1-CG2 4.04Å; I311-T327 HydrophobicContact CG2-CG2 3.99Å
312P60.9Low62.6Low68 Ų6894 Ų9444%0.44249%0.493SS..  trans-53.5119172.6-11.317.5000109N310 A314N310-P312 WeakPolarHBondContact O-CD 3.37Å; P312-A314 PolarHBondContact O-N 2.84Å
313K51Low61.2Low214 Ų21491.6 Ų91.693%0.9349%0.485SS*.SBendtrans-70.867.8174-78.5-177.2179.3173.40110.1I311I311-K313 PolarHBondContact O-N 3.39Å
314A49.7Very low60.1Low39 Ų3989.4 Ų89.432%0.32247%0.471SS..  trans-154.490.1163.700000108P312 M316 F324P312-A314 PolarHBondContact O-N 2.84Å; A314-M316 PolarHBondContact O-N 2.67Å; A314-F324 HydrophobicContact CB-CD1 4.08Å; A314-F324 HydrophobicContact CB-CE1 3.65Å
315S45.4Very low59.6Low41 Ų4187.6 Ų87.629%0.28747%0.466SS..  trans-59127.6172.2-168.90000108.1K294 T317 S318K294-S315 PolarHBondContact NZ-OG 3.37Å; S315-T317 VanDerWaalsContact CB-OG1 3.3Å; S315-T317 WeakPolarHBondContact CB-OG1 3.26Å; S315-T317 CarbonylContact O-C 3.57Å; S315-T317 PolarHBondContact O-N 2.83Å; S315-T317 PolarHBondContact OG-OG1 2.94Å; S315-S318 PolarHBondContact O-N 3.25Å; S315-S318 PolarHBondContact O-OG 3.25Å
316M42.8Very low59.5Low48 Ų4880.8 Ų80.824%0.23644%0.436CS..THydrogen-bonded Turntrans-48.1-14.8169-72.2-81.1-69.600113.7C277 W281 N290 A314 F324C277-M316 HydrophobicContact CB-CE 4.44Å; W281-M316 HydrophobicContact CZ2-CB 3.74Å; W281-M316 HydrophobicContact CZ2-CE 3.94Å; W281-M316 HydrophobicContact CZ2-CG 4.5Å; N290-M316 HydrophobicContact CB-CE 4.18Å; N290-M316 WeakPolarHBondContact ND2-CE 3.19Å; A314-M316 PolarHBondContact O-N 2.67Å; M316-F324 HydrophobicContact SD-CB 4.06Å; M316-F324 HydrophobicContact SD-CD2 3.62Å; M316-F324 HydrophobicContact SD-CE2 4.35Å; M316-F324 HydrophobicContact SD-CG 4.02Å
317T45.3Very low59.4Low45 Ų4580.9 Ų80.928%0.27644%0.439SS..THydrogen-bonded Turntrans-82.2-5.1173.566.60000114.4S315 G319 F489S315-T317 VanDerWaalsContact CB-OG1 3.3Å; S315-T317 WeakPolarHBondContact CB-OG1 3.26Å; S315-T317 CarbonylContact O-C 3.57Å; S315-T317 PolarHBondContact O-N 2.83Å; S315-T317 PolarHBondContact OG-OG1 2.94Å; T317-G319 PolarHBondContact O-N 3.36Å; T317-F489 HydrophobicContact CG2-CB 4.48Å; T317-F489 WeakPolarHBondContact O-CD1 3.45Å; T317-F489 WeakPolarHBondContact O-CD2 3.36Å; T317-F489 WeakPolarHBondContact O-CE2 3.34Å; T317-F489 WeakPolarHBondContact O-CG 3.28Å; T317-F489 VanDerWaalsContact O-CZ 3.29Å; T317-F489 WeakPolarHBondContact O-CZ 3.35Å
318S48.1Very low59.7Low55 Ų5580.4 Ų80.439%0.38544%0.438SS..SBendtrans-77.3-2.2-175.269.10000114.2S315 L320S315-S318 PolarHBondContact O-N 3.25Å; S315-S318 PolarHBondContact O-OG 3.25Å; S318-L320 PolarHBondContact O-N 3.28Å
319G45.7Very low60.5Low29 Ų2978 Ų7830%0.29942%0.42SS..  trans76.71.6-179.500000114.9A279 T317A279-G319 WeakPolarHBondContact CB-O 3.5Å; T317-G319 PolarHBondContact O-N 3.36Å
320L46.2Very low61.4Low104 Ų10475.9 Ų75.955%0.54541%0.414SS..  trans-84.4129179.3-68.4171000111.1S318 Q322 F324S318-L320 PolarHBondContact O-N 3.28Å; L320-Q322 PolarHBondContact O-N 3.32Å; L320-Q322 VanDerWaalsContact O-N 3.16Å; L320-F324 WeakPolarHBondContact O-CE2 3.39Å; L320-F324 VanDerWaalsContact O-CZ 3.23Å; L320-F324 WeakPolarHBondContact O-CZ 3.26Å
321V48.7Very low62.4Low67 Ų6772.2 Ų72.241%0.40640%0.399SS..  trans-84.183.5176.5-173.50000109.1A279A279-V321 HydrophobicContact CB-CG2 4.23Å
322Q55.5Low63.6Low106 Ų10671.6 Ų71.650%0.49540%0.397SS..  trans-124.1164.2175.7-65.6-177.1-12.900111.5L320 F324L320-Q322 PolarHBondContact O-N 3.32Å; L320-Q322 VanDerWaalsContact O-N 3.16Å; Q322-F324 HydrophobicContact CB-CE1 3.97Å; Q322-F324 HydrophobicContact CB-CE2 4.11Å; Q322-F324 HydrophobicContact CB-CZ 3.7Å; Q322-F324 WeakPolarHBondContact O-CD2 3.09Å; Q322-F324 VanDerWaalsContact O-CE2 3.22Å; Q322-F324 WeakPolarHBondContact O-CE2 3.31Å; Q322-F324 PolarHBondContact O-N 3.25Å
323Q58.3Low65.1Low132 Ų13272 Ų7262%0.61740%0.398SS*.  trans-73.7111169.4-71.3-179.3-800108F272F272-Q323 PolarHBondContact O-NE2 3.05Å
324F65.8Low67Low56 Ų5664.5 Ų64.525%0.24637%0.372CS..  trans-104.3148-179.4-61.1-71000111.2A314 M316 L320 Q322A314-F324 HydrophobicContact CB-CD1 4.08Å; A314-F324 HydrophobicContact CB-CE1 3.65Å; M316-F324 HydrophobicContact SD-CB 4.06Å; M316-F324 HydrophobicContact SD-CD2 3.62Å; M316-F324 HydrophobicContact SD-CE2 4.35Å; M316-F324 HydrophobicContact SD-CG 4.02Å; L320-F324 WeakPolarHBondContact O-CE2 3.39Å; L320-F324 VanDerWaalsContact O-CZ 3.23Å; L320-F324 WeakPolarHBondContact O-CZ 3.26Å; Q322-F324 HydrophobicContact CB-CE1 3.97Å; Q322-F324 HydrophobicContact CB-CE2 4.11Å; Q322-F324 HydrophobicContact CB-CZ 3.7Å; Q322-F324 WeakPolarHBondContact O-CD2 3.09Å; Q322-F324 VanDerWaalsContact O-CE2 3.22Å; Q322-F324 WeakPolarHBondContact O-CE2 3.31Å; Q322-F324 PolarHBondContact O-N 3.25Å
325Q71.1Confident69Low150 Ų15068 Ų6870%0.70138%0.384SS*.  trans-96.1129.9166.3-67.4-177-11.400108.8S331Q325-S331 VanDerWaalsContact CA-OG 3.29Å; Q325-S331 WeakPolarHBondContact CA-OG 3.42Å
326H80.8Confident71.4Confident25 Ų2567.6 Ų67.612%0.11638%0.384CS..  trans-61.3142.9171.2-6987.7000110Y289 N290 D293 L329 S331Y289-H326 AromaticContact CD1-CD2 3.98Å; Y289-H326 AromaticContact CD1-NE2 3.67Å; Y289-H326 AromaticContact CE1-CD2 3.81Å; Y289-H326 AromaticContact CE1-NE2 3.76Å; N290-H326 PolarHBondContact OD1-NE2 2.7Å; D293-H326 IonicContact OD2-CD2 3.62Å; H326-L329 HydrophobicContact CB-CB 4.42Å; H326-L329 WeakPolarHBondContact CB-O 3.45Å; H326-S331 PolarHBondContact N-OG 3.19Å; H326-S331 VanDerWaalsContact N-OG 3.14Å
327T77.8Confident73.9Confident48 Ų4865.5 Ų65.529%0.29437%0.373SS..SBendtrans-84.2-37.7-170.4-58.20000112.1D293 S297 I311D293-T327 PolarHBondContact OD1-N 2.67Å; D293-T327 PolarHBondContact OD2-N 2.88Å; S297-T327 WeakPolarHBondContact OG-CB 3.37Å; I311-T327 HydrophobicContact CD1-CG2 4.42Å; I311-T327 HydrophobicContact CG1-CG2 4.04Å; I311-T327 HydrophobicContact CG2-CG2 3.99Å
328V83.6Confident76.3Confident67 Ų6767.8 Ų67.841%0.40638%0.384SS..SBendtrans-117.6-45.6-178-179.80000110.6D293 L296 L306D293-V328 WeakPolarHBondContact OD1-CA 3.43Å; D293-V328 PolarHBondContact OD1-N 3.06Å; L296-V328 HydrophobicContact CB-CB 4.21Å; L296-V328 HydrophobicContact CB-CG1 4.1Å; L296-V328 HydrophobicContact CB-CG2 4.21Å; L296-V328 HydrophobicContact CD1-CG1 4.19Å; L306-V328 HydrophobicContact CD1-CG2 3.82Å
329L89.4Confident78.6Confident33 Ų3369.1 Ų69.117%0.17339%0.386CS..SBendtrans-78.1156.1178.3-62.3-174.9000111.2Y289 L292 D293 L296 H326 S331Y289-L329 HydrophobicContact CD1-CD1 4Å; Y289-L329 HydrophobicContact CD2-CD1 4.03Å; Y289-L329 HydrophobicContact CE1-CB 3.77Å; Y289-L329 HydrophobicContact CE1-CD1 3.77Å; Y289-L329 HydrophobicContact CE1-CG 4.44Å; Y289-L329 HydrophobicContact CE2-CB 4.5Å; Y289-L329 HydrophobicContact CE2-CD1 3.8Å; Y289-L329 HydrophobicContact CG-CD1 4.14Å; Y289-L329 WeakPolarHBondContact OH-CB 3.27Å; L292-L329 HydrophobicContact CB-CD1 4.35Å; L292-L329 HydrophobicContact CD2-CD1 4.22Å; L292-L329 HydrophobicContact CG-CD1 4.23Å; D293-L329 HydrophobicContact CB-CB 4.31Å; D293-L329 HydrophobicContact CB-CD1 3.89Å; D293-L329 HydrophobicContact CB-CG 4.01Å; D293-L329 PolarHBondContact OD1-N 2.69Å; L296-L329 HydrophobicContact CD1-CD2 3.87Å; L296-L329 HydrophobicContact CD1-CG 4.29Å; H326-L329 HydrophobicContact CB-CB 4.42Å; H326-L329 WeakPolarHBondContact CB-O 3.45Å; L329-S331 PolarHBondContact O-N 3.03Å
330P89.3Confident81.1Confident95 Ų9570.1 Ų70.162%0.61739%0.387SS*.PPolyproline II helixtrans-59136.4174.5-25.533.7000112.9Y289 V332Y289-P330 WeakPolarHBondContact OH-CD 3.41Å; Y289-P330 PolarHBondContact OH-O 2.85Å; P330-V332 PolarHBondContact O-N 3.46Å
331S89.8Confident83.6Confident58 Ų5865.8 Ų65.841%0.40637%0.365SS..PPolyproline II helixtrans-65.5125.9174.1-670000111.1Q325 H326 L329Q325-S331 VanDerWaalsContact CA-OG 3.29Å; Q325-S331 WeakPolarHBondContact CA-OG 3.42Å; H326-S331 PolarHBondContact N-OG 3.19Å; H326-S331 VanDerWaalsContact N-OG 3.14Å; L329-S331 PolarHBondContact O-N 3.03Å
332V91.4Very high85.9Confident24 Ų2467.2 Ų67.215%0.14537%0.37CS..PPolyproline II helixtrans-86.5126.5-177.3-174.20000109.9L276 W286 Y289 P330 A336 T337 W378L276-V332 HydrophobicContact CD1-CG1 4.33Å; L276-V332 HydrophobicContact CD2-CB 4.11Å; L276-V332 HydrophobicContact CD2-CG2 4.36Å; W286-V332 HydrophobicContact CE3-CG2 4.4Å; W286-V332 HydrophobicContact CH2-CG1 3.86Å; W286-V332 HydrophobicContact CZ2-CG1 4.35Å; W286-V332 HydrophobicContact CZ3-CG1 4Å; W286-V332 HydrophobicContact CZ3-CG2 3.93Å; Y289-V332 HydrophobicContact CD1-CG2 4.41Å; Y289-V332 HydrophobicContact CE1-CG2 3.84Å; P330-V332 PolarHBondContact O-N 3.46Å; V332-A336 HydrophobicContact CG1-CB 4.19Å; V332-T337 HydrophobicContact CG1-CG2 3.54Å; V332-W378 WeakPolarHBondContact O-CZ3 3.36Å
333T91.1Very high88Confident75 Ų7567.5 Ų67.546%0.4637%0.374SS..PPolyproline II helixtrans-92.115917866.40000111.9L335 A336 T337T333-L335 PolarHBondContact O-N 2.98Å; T333-A336 WeakPolarHBondContact O-CB 3.46Å; T333-A336 PolarHBondContact O-N 2.85Å; T333-A336 WeakPolarHBondContact OG1-CB 3.48Å; T333-A336 PolarHBondContact OG1-N 2.74Å; T333-T337 PolarHBondContact O-N 3.33Å; T333-T337 VanDerWaalsContact O-N 3.07Å
334P91Very high89.8Confident58 Ų5861.7 Ų61.738%0.37735%0.349SS..Hα-helixtrans-57.5-31.6173.1-24.132.2000113.8T337 L338 W378P334-T337 WeakPolarHBondContact CA-OG1 3.19Å; P334-T337 PolarHBondContact O-OG1 3.18Å; P334-L338 WeakPolarHBondContact O-CB 3.41Å; P334-L338 PolarHBondContact O-N 3Å; P334-L338 VanDerWaalsContact O-N 3.12Å; P334-W378 HydrophobicContact CB-CD2 4.08Å; P334-W378 HydrophobicContact CB-CE3 4.18Å; P334-W378 HydrophobicContact CB-CG 4.42Å; P334-W378 HydrophobicContact CG-CD2 3.94Å; P334-W378 HydrophobicContact CG-CE3 4.01Å; P334-W378 HydrophobicContact CG-CH2 3.85Å; P334-W378 HydrophobicContact CG-CZ2 3.76Å; P334-W378 HydrophobicContact CG-CZ3 3.98Å
335L92.4Very high91.4Very high111 Ų11159.5 Ų59.558%0.58134%0.339SS*.Hα-helixtrans-70.4-40.7175.9-178.860.5000111.2T333 L338 I339T333-L335 PolarHBondContact O-N 2.98Å; L335-L338 HydrophobicContact CD1-CD2 4.48Å; L335-L338 PolarHBondContact O-N 3.48Å; L335-I339 HydrophobicContact CD1-CD1 4.3Å; L335-I339 HydrophobicContact CD1-CG1 4.45Å; L335-I339 HydrophobicContact CG-CD1 4.02Å; L335-I339 VanDerWaalsContact O-CG1 3.31Å; L335-I339 WeakPolarHBondContact O-CG1 3.44Å; L335-I339 PolarHBondContact O-N 3.36Å
336A94.9Very high92.6Very high34 Ų3457.6 Ų57.628%0.28133%0.334SS..Hα-helixtrans-62.4-43.1176.500000111.5V332 T333 L338 I339 C340V332-A336 HydrophobicContact CG1-CB 4.19Å; T333-A336 WeakPolarHBondContact O-CB 3.46Å; T333-A336 PolarHBondContact O-N 2.85Å; T333-A336 WeakPolarHBondContact OG1-CB 3.48Å; T333-A336 PolarHBondContact OG1-N 2.74Å; A336-L338 VanDerWaalsContact C-N 3.35Å; A336-L338 PolarHBondContact O-N 2.95Å; A336-I339 PolarHBondContact O-N 2.75Å; A336-C340 WeakPolarHBondContact O-CB 3.44Å; A336-C340 PolarHBondContact O-N 3.49Å; A336-C340 PolarHBondContact O-SG 2.65Å
337T95.4Very high93.2Very high3 Ų358.8 Ų58.82%0.01834%0.343CS..Hα-helixtrans-63.5-39.9176590000112.3L276 W286 V332 T333 P334 C340 T341 F376 W378L276-T337 HydrophobicContact CD1-CG2 3.61Å; W286-T337 HydrophobicContact CH2-CG2 4.31Å; W286-T337 HydrophobicContact CZ2-CG2 3.6Å; V332-T337 HydrophobicContact CG1-CG2 3.54Å; T333-T337 PolarHBondContact O-N 3.33Å; T333-T337 VanDerWaalsContact O-N 3.07Å; P334-T337 WeakPolarHBondContact CA-OG1 3.19Å; P334-T337 PolarHBondContact O-OG1 3.18Å; T337-C340 PolarHBondContact O-N 3.24Å; T337-T341 WeakPolarHBondContact O-CB 3.35Å; T337-T341 PolarHBondContact O-N 2.97Å; T337-T341 PolarHBondContact O-OG1 2.74Å; T337-F376 VanDerWaalsContact CB-O 3.25Å; T337-F376 WeakPolarHBondContact CB-O 3.25Å; T337-W378 HydrophobicContact CG2-CE3 3.75Å; T337-W378 HydrophobicContact CG2-CZ3 4.41Å
338L95.3Very high94Very high93 Ų9356.6 Ų56.649%0.48733%0.33SS..Hα-helixtrans-60.6-47.9174.317963.3000111.4P334 L335 A336 T341 L342P334-L338 WeakPolarHBondContact O-CB 3.41Å; P334-L338 PolarHBondContact O-N 3Å; P334-L338 VanDerWaalsContact O-N 3.12Å; L335-L338 HydrophobicContact CD1-CD2 4.48Å; L335-L338 PolarHBondContact O-N 3.48Å; A336-L338 VanDerWaalsContact C-N 3.35Å; A336-L338 PolarHBondContact O-N 2.95Å; L338-T341 PolarHBondContact O-N 3.45Å; L338-L342 HydrophobicContact CD1-CD1 4.25Å; L338-L342 HydrophobicContact CD1-CG 4.27Å; L338-L342 HydrophobicContact CG-CD1 4.17Å; L338-L342 VanDerWaalsContact O-CG 3.31Å; L338-L342 WeakPolarHBondContact O-CG 3.49Å; L338-L342 PolarHBondContact O-N 3.34Å
339I98Very high94.6Very high84 Ų8454.6 Ų54.643%0.43132%0.317SS..Hα-helixtrans-60.5-49177.7-68.2166.4000110.6L335 A336 T341 L342 I343L335-I339 HydrophobicContact CD1-CD1 4.3Å; L335-I339 HydrophobicContact CD1-CG1 4.45Å; L335-I339 HydrophobicContact CG-CD1 4.02Å; L335-I339 VanDerWaalsContact O-CG1 3.31Å; L335-I339 WeakPolarHBondContact O-CG1 3.44Å; L335-I339 PolarHBondContact O-N 3.36Å; A336-I339 PolarHBondContact O-N 2.75Å; I339-T341 VanDerWaalsContact C-N 3.3Å; I339-T341 PolarHBondContact O-N 2.8Å; I339-L342 PolarHBondContact O-N 2.99Å; I339-I343 HydrophobicContact CG2-CD1 3.66Å; I339-I343 HydrophobicContact CG2-CG1 4.35Å; I339-I343 VanDerWaalsContact O-CG1 3.31Å; I339-I343 WeakPolarHBondContact O-CG1 3.29Å; I339-I343 PolarHBondContact O-N 3.03Å
340C97.9Very high94.8Very high49 Ų4958.6 Ų58.633%0.33133%0.333SS..Hα-helixtrans-57.5-43.9177.2-71.40000112A336 T337 I343 A344 F376A336-C340 WeakPolarHBondContact O-CB 3.44Å; A336-C340 PolarHBondContact O-N 3.49Å; A336-C340 PolarHBondContact O-SG 2.65Å; T337-C340 PolarHBondContact O-N 3.24Å; C340-I343 PolarHBondContact O-N 2.68Å; C340-A344 VanDerWaalsContact O-CB 3.3Å; C340-A344 WeakPolarHBondContact O-CB 3.38Å; C340-A344 PolarHBondContact O-N 2.77Å; C340-F376 HydrophobicContact CB-CB 4.05Å; C340-F376 HydrophobicContact CB-CD1 4.3Å; C340-F376 HydrophobicContact CB-CG 4.26Å
341T98Very high94.9Very high14 Ų1454.7 Ų54.79%0.08631%0.308CS..Hα-helixtrans-61.9-47.3177.5-59.70000111.3T337 L338 I339 A344 I345 F376 G377T337-T341 WeakPolarHBondContact O-CB 3.35Å; T337-T341 PolarHBondContact O-N 2.97Å; T337-T341 PolarHBondContact O-OG1 2.74Å; L338-T341 PolarHBondContact O-N 3.45Å; I339-T341 VanDerWaalsContact C-N 3.3Å; I339-T341 PolarHBondContact O-N 2.8Å; T341-A344 PolarHBondContact O-N 3.41Å; T341-I345 HydrophobicContact CG2-CD1 3.82Å; T341-I345 HydrophobicContact CG2-CG1 4.47Å; T341-I345 VanDerWaalsContact O-CG1 3.27Å; T341-I345 WeakPolarHBondContact O-CG1 3.49Å; T341-I345 PolarHBondContact O-N 3.09Å; T341-F376 VanDerWaalsContact OG1-C 3.23Å; T341-F376 WeakPolarHBondContact OG1-CB 3.38Å; T341-F376 PolarHBondContact OG1-O 2.69Å; T341-G377 PolarHBondContact OG1-N 3.48Å
342L97.8Very high95.1Very high97 Ų9752.3 Ų52.351%0.50829%0.29SS..Hα-helixtrans-63.5-43.5179.3-70.3176.1000112L338 I339 A344 I345 L346L338-L342 HydrophobicContact CD1-CD1 4.25Å; L338-L342 HydrophobicContact CD1-CG 4.27Å; L338-L342 HydrophobicContact CG-CD1 4.17Å; L338-L342 VanDerWaalsContact O-CG 3.31Å; L338-L342 WeakPolarHBondContact O-CG 3.49Å; L338-L342 PolarHBondContact O-N 3.34Å; I339-L342 PolarHBondContact O-N 2.99Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.33Å; L342-I345 PolarHBondContact O-N 2.97Å; L342-L346 VanDerWaalsContact O-CB 3.31Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 PolarHBondContact O-N 3.25Å
343I98.1Very high95.2Very high111 Ų11153.2 Ų53.257%0.56929%0.291SS*.Hα-helixtrans-59.7-44.5174.9-69.2170.5000110.5I339 C340 I345 L346 P347I339-I343 HydrophobicContact CG2-CD1 3.66Å; I339-I343 HydrophobicContact CG2-CG1 4.35Å; I339-I343 VanDerWaalsContact O-CG1 3.31Å; I339-I343 WeakPolarHBondContact O-CG1 3.29Å; I339-I343 PolarHBondContact O-N 3.03Å; C340-I343 PolarHBondContact O-N 2.68Å; I343-I345 VanDerWaalsContact C-N 3.33Å; I343-I345 PolarHBondContact O-N 3.34Å; I343-L346 PolarHBondContact O-N 3.45Å; I343-P347 WeakPolarHBondContact O-CD 3.37Å
344A97.7Very high95.1Very high11 Ų1154.9 Ų54.99%0.09129%0.292CS..Hα-helixtrans-66.3-33179.700000113C340 T341 L342 S372 F376 W507 Y511C340-A344 VanDerWaalsContact O-CB 3.3Å; C340-A344 WeakPolarHBondContact O-CB 3.38Å; C340-A344 PolarHBondContact O-N 2.77Å; T341-A344 PolarHBondContact O-N 3.41Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.33Å; A344-S372 PolarHBondContact O-OG 2.82Å; A344-F376 HydrophobicContact CB-CD2 3.63Å; A344-F376 HydrophobicContact CB-CE2 3.69Å; A344-W507 HydrophobicContact CB-CZ2 4.14Å; A344-Y511 WeakPolarHBondContact O-CE2 3.44Å; A344-Y511 PolarHBondContact O-OH 3.43Å
345I97.7Very high94.7Very high9 Ų955.4 Ų55.45%0.04629%0.289CS..Hα-helixtrans-74.9-38.8176.9-71175.1000111.7P207 T341 L342 I343 S348 I349P207-I345 HydrophobicContact CB-CG2 4.41Å; T341-I345 HydrophobicContact CG2-CD1 3.82Å; T341-I345 HydrophobicContact CG2-CG1 4.47Å; T341-I345 VanDerWaalsContact O-CG1 3.27Å; T341-I345 WeakPolarHBondContact O-CG1 3.49Å; T341-I345 PolarHBondContact O-N 3.09Å; L342-I345 PolarHBondContact O-N 2.97Å; I343-I345 VanDerWaalsContact C-N 3.33Å; I343-I345 PolarHBondContact O-N 3.34Å; I345-S348 WeakPolarHBondContact O-CB 3.42Å; I345-S348 PolarHBondContact O-N 3.38Å; I345-S348 PolarHBondContact O-OG 3.2Å; I345-I349 HydrophobicContact CG2-CD1 4.32Å; I345-I349 HydrophobicContact CG2-CG1 3.54Å; I345-I349 PolarHBondContact O-N 2.91Å
346L96.5Very high94.2Very high111 Ų11152.2 Ų52.258%0.58128%0.275SS*.Hα-helixtrans-53.2-48.3-164.8178.169.9000114.7L342 I343 S348 I349 F350L342-L346 VanDerWaalsContact O-CB 3.31Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 PolarHBondContact O-N 3.25Å; I343-L346 PolarHBondContact O-N 3.45Å; L346-S348 VanDerWaalsContact C-N 3.3Å; L346-S348 PolarHBondContact O-N 3.2Å; L346-I349 WeakPolarHBondContact O-CB 3.46Å; L346-I349 PolarHBondContact O-N 3Å; L346-F350 WeakPolarHBondContact O-CB 3.48Å; L346-F350 PolarHBondContact O-N 3.04Å
347P94.7Very high93.7Very high50 Ų5053.8 Ų53.833%0.32528%0.276SS..Hα-helixtrans-65.2-29.5-179.7-17.724.6000114.3I343 F350 C351 Y511I343-P347 WeakPolarHBondContact O-CD 3.37Å; P347-F350 PolarHBondContact O-N 2.83Å; P347-C351 WeakPolarHBondContact O-CB 3.21Å; P347-C351 PolarHBondContact O-N 3.37Å; P347-C351 PolarHBondContact O-SG 3.01Å; P347-Y511 HydrophobicContact CB-CE1 3.86Å; P347-Y511 WeakPolarHBondContact CB-OH 3.45Å; P347-Y511 WeakPolarHBondContact CD-OH 3.35Å; P347-Y511 HydrophobicContact CG-CE1 4.24Å; P347-Y511 WeakPolarHBondContact CG-OH 3.43Å
348S94.3Very high93.4Very high2 Ų255 Ų551%0.01429%0.29CS..Hα-helixtrans-67.8-40.2174.578.10000111.7I345 L346 C351 L352I345-S348 WeakPolarHBondContact O-CB 3.42Å; I345-S348 PolarHBondContact O-N 3.38Å; I345-S348 PolarHBondContact O-OG 3.2Å; L346-S348 VanDerWaalsContact C-N 3.3Å; L346-S348 PolarHBondContact O-N 3.2Å; S348-C351 PolarHBondContact O-N 3.4Å; S348-L352 WeakPolarHBondContact O-CB 3.45Å; S348-L352 PolarHBondContact O-N 3.49Å
349I95.6Very high93.3Very high24 Ų2452.2 Ų52.212%0.12328%0.277CS..Hα-helixtrans-67-42.5175.2-66.5-68.8000110.8P207 V211 I345 L346 C351 L352 W353 C365P207-I349 VanDerWaalsContact C-CD1 3.49Å; P207-I349 HydrophobicContact CB-CD1 3.71Å; P207-I349 HydrophobicContact CB-CG1 4.31Å; V211-I349 HydrophobicContact CB-CD1 4.4Å; V211-I349 HydrophobicContact CB-CG2 4.23Å; V211-I349 HydrophobicContact CG1-CG2 4.12Å; V211-I349 HydrophobicContact CG2-CD1 4.17Å; V211-I349 HydrophobicContact CG2-CG2 3.48Å; V211-I349 VanDerWaalsContact CG2-CG2 3.48Å; I345-I349 HydrophobicContact CG2-CD1 4.32Å; I345-I349 HydrophobicContact CG2-CG1 3.54Å; I345-I349 PolarHBondContact O-N 2.91Å; L346-I349 WeakPolarHBondContact O-CB 3.46Å; L346-I349 PolarHBondContact O-N 3Å; I349-C351 VanDerWaalsContact C-N 3.34Å; I349-C351 PolarHBondContact O-N 2.89Å; I349-L352 WeakPolarHBondContact O-CB 3.36Å; I349-L352 PolarHBondContact O-N 2.86Å; I349-W353 PolarHBondContact O-N 3.09Å; I349-C365 VanDerWaalsContact CD1-SG 3.57Å
350F94.1Very high93.1Very high117 Ų11753.4 Ų53.451%0.51328%0.276SS..Hα-helixtrans-58.8-47174.5-173.4-87.2000110.9L346 P347 L352 W353 F354L346-F350 WeakPolarHBondContact O-CB 3.48Å; L346-F350 PolarHBondContact O-N 3.04Å; P347-F350 PolarHBondContact O-N 2.83Å; F350-L352 VanDerWaalsContact C-N 3.34Å; F350-L352 PolarHBondContact O-N 3.18Å; F350-W353 PolarHBondContact O-N 2.96Å; F350-F354 AromaticContact CD1-CD2 3.73Å; F350-F354 HydrophobicContact CD1-CD2 3.73Å; F350-F354 HydrophobicContact CD1-CE2 4.39Å; F350-F354 AromaticContact CD2-CD2 3.52Å; F350-F354 HydrophobicContact CD2-CD2 3.52Å; F350-F354 AromaticContact CD2-CE2 3.34Å; F350-F354 HydrophobicContact CD2-CE2 3.34Å; F350-F354 HydrophobicContact CE1-CB 4.42Å; F350-F354 AromaticContact CE1-CD2 3.57Å; F350-F354 HydrophobicContact CE1-CD2 3.57Å; F350-F354 HydrophobicContact CE1-CE2 4.15Å; F350-F354 HydrophobicContact CE1-CG 4.16Å; F350-F354 AromaticContact CE2-CD2 3.36Å; F350-F354 HydrophobicContact CE2-CD2 3.36Å; F350-F354 AromaticContact CE2-CE2 3.04Å; F350-F354 HydrophobicContact CE2-CE2 3.04Å; F350-F354 HydrophobicContact CE2-CG 4.44Å; F350-F354 AromaticContact CE2-CZ 3.91Å; F350-F354 HydrophobicContact CE2-CZ 3.91Å; F350-F354 AromaticContact CG-CD2 3.7Å; F350-F354 HydrophobicContact CG-CD2 3.7Å; F350-F354 HydrophobicContact CG-CE2 4.02Å; F350-F354 AromaticContact CZ-CD2 3.37Å; F350-F354 HydrophobicContact CZ-CD2 3.37Å; F350-F354 AromaticContact CZ-CE2 3.49Å; F350-F354 HydrophobicContact CZ-CE2 3.49Å; F350-F354 VanDerWaalsContact CZ-CE2 3.49Å; F350-F354 HydrophobicContact CZ-CG 4.09Å; F350-F354 HydrophobicContact CZ-CZ 4.24Å; F350-F354 VanDerWaalsContact O-CD2 3.32Å; F350-F354 WeakPolarHBondContact O-CD2 3.35Å; F350-F354 PolarHBondContact O-N 3.11Å
351C92.1Very high92.9Very high13 Ų1351.5 Ų51.59%0.08827%0.265CS..Hα-helixtrans-61.4-42.3176.4-73.70000111.9P347 S348 I349 W353 K355 V514P347-C351 WeakPolarHBondContact O-CB 3.21Å; P347-C351 PolarHBondContact O-N 3.37Å; P347-C351 PolarHBondContact O-SG 3.01Å; S348-C351 PolarHBondContact O-N 3.4Å; I349-C351 VanDerWaalsContact C-N 3.34Å; I349-C351 PolarHBondContact O-N 2.89Å; C351-W353 VanDerWaalsContact C-N 3.34Å; C351-W353 PolarHBondContact O-N 3.06Å; C351-K355 CarbonylContact O-C 3.42Å; C351-K355 WeakPolarHBondContact O-CA 3.14Å; C351-K355 WeakPolarHBondContact O-CB 3.26Å; C351-K355 PolarHBondContact O-N 3.24Å; C351-V514 HydrophobicContact CB-CG1 4.3Å
352L92.9Very high92.8Very high8 Ų850.9 Ų50.94%0.04226%0.261CS..Hα-helixtrans-61.3-39.7176.6-17862.4000112.6V211 Y212 S348 I349 F350 F362 C365V211-L352 HydrophobicContact CB-CD2 4.16Å; V211-L352 HydrophobicContact CG1-CB 4.34Å; V211-L352 HydrophobicContact CG1-CD2 3.91Å; V211-L352 HydrophobicContact CG1-CG 4.07Å; Y212-L352 HydrophobicContact CD2-CD1 4.25Å; S348-L352 WeakPolarHBondContact O-CB 3.45Å; S348-L352 PolarHBondContact O-N 3.49Å; I349-L352 WeakPolarHBondContact O-CB 3.36Å; I349-L352 PolarHBondContact O-N 2.86Å; F350-L352 VanDerWaalsContact C-N 3.34Å; F350-L352 PolarHBondContact O-N 3.18Å; L352-F362 HydrophobicContact CD1-CB 4.34Å; L352-C365 HydrophobicContact CB-CB 4.25Å; L352-C365 HydrophobicContact CD2-CB 3.9Å; L352-C365 HydrophobicContact CG-CB 4.47Å
353W92.9Very high92.8Very high43 Ų4346.3 Ų46.316%0.16324%0.237CC..Hα-helixtrans-72.5-54.4179.4-178.6-97.1000112.9V211 L214 R215 F219 I228 W230 I349 F350 C351V211-W353 HydrophobicContact CG1-CB 4.15Å; V211-W353 HydrophobicContact CG1-CE3 4.09Å; L214-W353 HydrophobicContact CB-CZ3 4.25Å; L214-W353 HydrophobicContact CD2-CH2 3.86Å; L214-W353 HydrophobicContact CD2-CZ3 3.61Å; L214-W353 HydrophobicContact CG-CH2 4.11Å; L214-W353 HydrophobicContact CG-CZ3 3.77Å; R215-W353 HydrophobicContact CB-CE3 3.99Å; R215-W353 HydrophobicContact CB-CZ3 4.25Å; R215-W353 WeakPolarHBondContact CD-O 3.43Å; R215-W353 PolarHBondContact NE-O 2.82Å; R215-W353 VanDerWaalsContact NE-O 3.09Å; F219-W353 HydrophobicContact CD2-CH2 4.46Å; F219-W353 AromaticContact CE2-CH2 3.61Å; F219-W353 HydrophobicContact CE2-CH2 3.61Å; F219-W353 HydrophobicContact CE2-CZ2 4.26Å; F219-W353 HydrophobicContact CE2-CZ3 4.3Å; F219-W353 HydrophobicContact CZ-CH2 4.26Å; I228-W353 HydrophobicContact CD1-CD2 4.03Å; I228-W353 HydrophobicContact CD1-CH2 4.26Å; I228-W353 HydrophobicContact CD1-CZ2 3.49Å; I228-W353 VanDerWaalsContact CD1-CZ2 3.49Å; W230-W353 AromaticContact CH2-CZ2 3.95Å; W230-W353 HydrophobicContact CH2-CZ2 3.95Å; W230-W353 HydrophobicContact CZ3-CZ2 4.32Å; I349-W353 PolarHBondContact O-N 3.09Å; F350-W353 PolarHBondContact O-N 2.96Å; C351-W353 VanDerWaalsContact C-N 3.34Å; C351-W353 PolarHBondContact O-N 3.06Å
354F89.7Confident92.7Very high111 Ų11141.4 Ų41.449%0.48721%0.211SC..Hα-helixtrans-82-22.6-171.6-72.2-75.6000113.3F350F350-F354 AromaticContact CD1-CD2 3.73Å; F350-F354 HydrophobicContact CD1-CD2 3.73Å; F350-F354 HydrophobicContact CD1-CE2 4.39Å; F350-F354 AromaticContact CD2-CD2 3.52Å; F350-F354 HydrophobicContact CD2-CD2 3.52Å; F350-F354 AromaticContact CD2-CE2 3.34Å; F350-F354 HydrophobicContact CD2-CE2 3.34Å; F350-F354 HydrophobicContact CE1-CB 4.42Å; F350-F354 AromaticContact CE1-CD2 3.57Å; F350-F354 HydrophobicContact CE1-CD2 3.57Å; F350-F354 HydrophobicContact CE1-CE2 4.15Å; F350-F354 HydrophobicContact CE1-CG 4.16Å; F350-F354 AromaticContact CE2-CD2 3.36Å; F350-F354 HydrophobicContact CE2-CD2 3.36Å; F350-F354 AromaticContact CE2-CE2 3.04Å; F350-F354 HydrophobicContact CE2-CE2 3.04Å; F350-F354 HydrophobicContact CE2-CG 4.44Å; F350-F354 AromaticContact CE2-CZ 3.91Å; F350-F354 HydrophobicContact CE2-CZ 3.91Å; F350-F354 AromaticContact CG-CD2 3.7Å; F350-F354 HydrophobicContact CG-CD2 3.7Å; F350-F354 HydrophobicContact CG-CE2 4.02Å; F350-F354 AromaticContact CZ-CD2 3.37Å; F350-F354 HydrophobicContact CZ-CD2 3.37Å; F350-F354 AromaticContact CZ-CE2 3.49Å; F350-F354 HydrophobicContact CZ-CE2 3.49Å; F350-F354 VanDerWaalsContact CZ-CE2 3.49Å; F350-F354 HydrophobicContact CZ-CG 4.09Å; F350-F354 HydrophobicContact CZ-CZ 4.24Å; F350-F354 VanDerWaalsContact O-CD2 3.32Å; F350-F354 WeakPolarHBondContact O-CD2 3.35Å; F350-F354 PolarHBondContact O-N 3.11Å
355K83.5Confident92.7Very high68 Ų6841 Ų4130%0.29621%0.208SC..SBendtrans-136.768.5-176.9-63.6177.8176.3-177.10110.4C351 Q357 S518C351-K355 CarbonylContact O-C 3.42Å; C351-K355 WeakPolarHBondContact O-CA 3.14Å; C351-K355 WeakPolarHBondContact O-CB 3.26Å; C351-K355 PolarHBondContact O-N 3.24Å; K355-Q357 PolarHBondContact O-N 2.64Å; K355-Q357 VanDerWaalsContact O-N 3.1Å; K355-S518 VanDerWaalsContact CD-O 3.3Å; K355-S518 WeakPolarHBondContact CD-O 3.03Å; K355-S518 WeakPolarHBondContact CE-O 3.22Å; K355-S518 PolarHBondContact NZ-O 2.9Å
356P80.6Confident92.7Very high45 Ų4540.6 Ų40.629%0.29221%0.206SC..  trans-63.7116.3-176.228.1-36.6000111R215 G358R215-P356 HydrophobicContact CG-CB 4.4Å; P356-G358 VanDerWaalsContact C-N 3.3Å
357Q84.7Confident92.8Very high66 Ų6635.3 Ų35.331%0.30818%0.178SC..  trans-96.926.7175.7-56177.6-0.500112K355 G361 S518K355-Q357 PolarHBondContact O-N 2.64Å; K355-Q357 VanDerWaalsContact O-N 3.1Å; Q357-G361 PolarHBondContact O-N 3.43Å; Q357-S518 PolarHBondContact NE2-OG 3.19Å; Q357-S518 VanDerWaalsContact NE2-OG 3.09Å
358G88.8Confident93Very high29 Ų2932.9 Ų32.930%0.29916%0.163SC..Hα-helixtrans63.4-157.3-174.800000113.6P356 R360 G361 F362P356-G358 VanDerWaalsContact C-N 3.3Å; G358-R360 PolarHBondContact O-N 3.39Å; G358-G361 PolarHBondContact O-N 3.42Å; G358-F362 PolarHBondContact O-N 2.97Å; G358-F362 VanDerWaalsContact O-N 3.15Å
359P93.2Very high93.2Very high35 Ų3532.8 Ų32.823%0.22716%0.162CC..Hα-helixtrans-59.1-29.8-176.4-23.631000114.6F181 Y212 F362 L363F181-P359 HydrophobicContact CB-CB 4.29Å; F181-P359 HydrophobicContact CD1-CB 3.68Å; F181-P359 HydrophobicContact CD2-CB 3.52Å; F181-P359 HydrophobicContact CE1-CB 3.78Å; F181-P359 HydrophobicContact CE2-CB 3.62Å; F181-P359 WeakPolarHBondContact CE2-O 3.37Å; F181-P359 HydrophobicContact CG-CB 3.55Å; F181-P359 HydrophobicContact CG-CG 4.4Å; F181-P359 HydrophobicContact CZ-CB 3.75Å; F181-P359 WeakPolarHBondContact CZ-O 3.37Å; Y212-P359 WeakPolarHBondContact OH-CG 3.3Å; P359-F362 WeakPolarHBondContact O-CB 3.46Å; P359-F362 PolarHBondContact O-N 3.15Å; P359-L363 WeakPolarHBondContact O-CB 3.41Å; P359-L363 PolarHBondContact O-N 3.05Å
360R93.4Very high93.3Very high109 Ų10931.8 Ų31.841%0.41116%0.157SC..Hα-helixtrans-68.3-38.6174.6-73.1-171.4-177.9164.67.8112.3D129 F181 G358 F362 L363 R364D129-R360 IonicContact OD2-NH2 2.92Å; D129-R360 PolarHBondContact OD2-NH2 3.31Å; F181-R360 HydrophobicContact CE1-CG 4.15Å; F181-R360 HydrophobicContact CZ-CG 4.4Å; G358-R360 PolarHBondContact O-N 3.39Å; R360-F362 VanDerWaalsContact C-N 3.34Å; R360-L363 PolarHBondContact O-N 2.99Å; R360-R364 WeakPolarHBondContact O-CG 3.48Å; R360-R364 PolarHBondContact O-N 2.84Å
361G94.1Very high93.5Very high9 Ų926.2 Ų26.29%0.09313%0.132CC..Hα-helixtrans-62.4-42.7172.900000112Q357 G358 R364 C365Q357-G361 PolarHBondContact O-N 3.43Å; G358-G361 PolarHBondContact O-N 3.42Å; G361-R364 PolarHBondContact O-N 3.35Å; G361-C365 WeakPolarHBondContact O-CB 3.41Å; G361-C365 PolarHBondContact O-N 3.04Å
362F96.4Very high93.8Very high0 Ų025.6 Ų25.60%013%0.128CC..Hα-helixtrans-57.6-50.9171.4159.2-107.3000111.9I177 L180 A208 Y209 Y212 L352 G358 P359 R360 R364 C365 L366I177-F362 HydrophobicContact CG1-CE1 4.13Å; I177-F362 HydrophobicContact CG1-CZ 4.49Å; I177-F362 HydrophobicContact CG2-CE1 4.45Å; L180-F362 HydrophobicContact CB-CE1 4.46Å; L180-F362 HydrophobicContact CD1-CD1 4.21Å; L180-F362 HydrophobicContact CD1-CE1 3.5Å; L180-F362 HydrophobicContact CD1-CE2 4.13Å; L180-F362 HydrophobicContact CD1-CZ 3.45Å; L180-F362 VanDerWaalsContact CD1-CZ 3.45Å; A208-F362 HydrophobicContact CB-CD2 4.42Å; A208-F362 HydrophobicContact CB-CE2 4.26Å; Y209-F362 HydrophobicContact CD1-CE2 4.23Å; Y209-F362 HydrophobicContact CD1-CZ 4.07Å; Y209-F362 HydrophobicContact CD2-CE2 4.11Å; Y209-F362 HydrophobicContact CD2-CZ 4.14Å; Y209-F362 HydrophobicContact CE1-CE2 4.43Å; Y209-F362 AromaticContact CE1-CZ 3.82Å; Y209-F362 HydrophobicContact CE1-CZ 3.82Å; Y209-F362 HydrophobicContact CE2-CE2 4.34Å; Y209-F362 AromaticContact CE2-CZ 3.92Å; Y209-F362 HydrophobicContact CE2-CZ 3.92Å; Y209-F362 HydrophobicContact CG-CE2 4.07Å; Y209-F362 HydrophobicContact CG-CZ 4.23Å; Y209-F362 AromaticContact CZ-CZ 3.77Å; Y212-F362 HydrophobicContact CD1-CB 4.1Å; Y212-F362 HydrophobicContact CD1-CD1 4.4Å; Y212-F362 AromaticContact CD1-CD2 3.89Å; Y212-F362 HydrophobicContact CD1-CD2 3.89Å; Y212-F362 HydrophobicContact CD1-CE2 4.44Å; Y212-F362 AromaticContact CD1-CG 3.85Å; Y212-F362 HydrophobicContact CD1-CG 3.85Å; Y212-F362 HydrophobicContact CD2-CB 3.47Å; Y212-F362 VanDerWaalsContact CD2-CB 3.47Å; Y212-F362 HydrophobicContact CD2-CD2 4.4Å; Y212-F362 HydrophobicContact CD2-CG 4.13Å; Y212-F362 HydrophobicContact CE1-CB 4.35Å; Y212-F362 HydrophobicContact CE1-CG 4.27Å; Y212-F362 HydrophobicContact CE2-CB 3.74Å; Y212-F362 HydrophobicContact CE2-CG 4.49Å; Y212-F362 HydrophobicContact CG-CB 3.64Å; Y212-F362 AromaticContact CG-CD2 3.68Å; Y212-F362 HydrophobicContact CG-CD2 3.68Å; Y212-F362 AromaticContact CG-CG 3.75Å; Y212-F362 HydrophobicContact CG-CG 3.75Å; L352-F362 HydrophobicContact CD1-CB 4.34Å; G358-F362 PolarHBondContact O-N 2.97Å; G358-F362 VanDerWaalsContact O-N 3.15Å; P359-F362 WeakPolarHBondContact O-CB 3.46Å; P359-F362 PolarHBondContact O-N 3.15Å; R360-F362 VanDerWaalsContact C-N 3.34Å; F362-R364 VanDerWaalsContact C-N 3.33Å; F362-R364 PolarHBondContact O-N 3.35Å; F362-C365 CarbonylContact O-C 3.45Å; F362-C365 WeakPolarHBondContact O-CB 3.31Å; F362-C365 PolarHBondContact O-N 2.88Å; F362-C365 VanDerWaalsContact O-N 3.14Å; F362-L366 HydrophobicContact CE1-CD1 4.15Å; F362-L366 HydrophobicContact CE2-CB 4.41Å; F362-L366 HydrophobicContact CE2-CD1 4.01Å; F362-L366 HydrophobicContact CZ-CD1 3.51Å; F362-L366 WeakPolarHBondContact O-CB 3.42Å; F362-L366 PolarHBondContact O-N 3.2Å
363L97.4Very high94.1Very high2 Ų225.3 Ų25.31%0.0113%0.127CC..Hα-helixtrans-61.4-40.4-178.1-176.359.6000112.2I177 F181 P359 R360 L366 T367 P391 L394 L395I177-L363 HydrophobicContact CD1-CD1 4.09Å; I177-L363 HydrophobicContact CG2-CD1 4.05Å; F181-L363 HydrophobicContact CE2-CB 4.06Å; F181-L363 HydrophobicContact CE2-CD2 4.14Å; F181-L363 HydrophobicContact CZ-CB 3.98Å; F181-L363 HydrophobicContact CZ-CD2 3.73Å; F181-L363 HydrophobicContact CZ-CG 4.49Å; P359-L363 WeakPolarHBondContact O-CB 3.41Å; P359-L363 PolarHBondContact O-N 3.05Å; R360-L363 PolarHBondContact O-N 2.99Å; L363-L366 WeakPolarHBondContact O-CB 3.34Å; L363-L366 PolarHBondContact O-N 3.44Å; L363-T367 PolarHBondContact O-N 3.21Å; L363-T367 PolarHBondContact O-OG1 3.25Å; L363-P391 HydrophobicContact CD1-CB 3.78Å; L363-L394 HydrophobicContact CD1-CD1 4.14Å; L363-L394 HydrophobicContact CD2-CB 3.63Å; L363-L394 HydrophobicContact CD2-CD1 4.11Å; L363-L395 HydrophobicContact CB-CD2 4.23Å; L363-L395 HydrophobicContact CD2-CD2 3.61Å; L363-L395 HydrophobicContact CD2-CG 3.68Å; L363-L395 HydrophobicContact CG-CD1 4.17Å; L363-L395 HydrophobicContact CG-CD2 3.93Å; L363-L395 HydrophobicContact CG-CG 3.86Å
364R96.8Very high94.3Very high7 Ų723.4 Ų23.43%0.02612%0.12CC..Hα-helixtrans-64.3-42.4173.6-75.3174.5168-170.1-13.8112.6R360 G361 F362 T367 L368 L395 D402 V514 D517R360-R364 WeakPolarHBondContact O-CG 3.48Å; R360-R364 PolarHBondContact O-N 2.84Å; G361-R364 PolarHBondContact O-N 3.35Å; F362-R364 VanDerWaalsContact C-N 3.33Å; F362-R364 PolarHBondContact O-N 3.35Å; R364-T367 PolarHBondContact O-N 3.12Å; R364-L368 WeakPolarHBondContact O-CB 3.21Å; R364-L368 WeakPolarHBondContact O-CG 3.42Å; R364-L368 PolarHBondContact O-N 2.76Å; R364-L395 HydrophobicContact CB-CD1 4.45Å; R364-L395 HydrophobicContact CG-CD1 3.61Å; R364-L395 HydrophobicContact CG-CD2 3.92Å; R364-L395 HydrophobicContact CG-CG 4.44Å; R364-D402 IonicContact CZ-OD1 3.24Å; R364-D402 IonicContact CZ-OD2 3.58Å; R364-D402 IonicContact NE-OD1 3.95Å; R364-D402 IonicContact NE-OD2 3.79Å; R364-D402 IonicContact NH2-OD1 2.65Å; R364-D402 PolarHBondContact NH2-OD1 3.27Å; R364-D402 IonicContact NH2-OD2 4Å; R364-D402 PolarHBondContact NH2-OD2 2.88Å; R364-V514 HydrophobicContact CB-CG2 3.89Å; R364-V514 HydrophobicContact CG-CG2 4.39Å; R364-D517 IonicContact CZ-OD2 2.75Å; R364-D517 VanDerWaalsContact CZ-OD2 3.31Å; R364-D517 IonicContact NH1-OD2 2.8Å; R364-D517 PolarHBondContact NH1-OD2 2.96Å; R364-D517 IonicContact NH2-OD2 3.76Å; R364-D517 PolarHBondContact NH2-OD2 3.4Å
365C97.5Very high94.7Very high3 Ų318.1 Ų18.12%0.0210%0.097CC..Hα-helixtrans-64.1-41.5175.2-179.60000111.3A208 I349 L352 G361 F362 L368 C369A208-C365 HydrophobicContact CB-CB 4.44Å; I349-C365 VanDerWaalsContact CD1-SG 3.57Å; L352-C365 HydrophobicContact CB-CB 4.25Å; L352-C365 HydrophobicContact CD2-CB 3.9Å; L352-C365 HydrophobicContact CG-CB 4.47Å; G361-C365 WeakPolarHBondContact O-CB 3.41Å; G361-C365 PolarHBondContact O-N 3.04Å; F362-C365 CarbonylContact O-C 3.45Å; F362-C365 WeakPolarHBondContact O-CB 3.31Å; F362-C365 PolarHBondContact O-N 2.88Å; F362-C365 VanDerWaalsContact O-N 3.14Å; C365-L368 CarbonylContact O-C 3.32Å; C365-L368 PolarHBondContact O-N 2.92Å; C365-C369 WeakPolarHBondContact O-CB 3.25Å; C365-C369 PolarHBondContact O-N 2.87Å; C365-C369 PolarHBondContact O-SG 3.24Å
366L98.4Very high95.4Very high0 Ų016.2 Ų16.20%09%0.088CC..Hα-helixtrans-58.8-49.2174.1-179152.2000111.3I177 V205 A208 Y209 F362 L363 L368 C369 A370 P391I177-L366 HydrophobicContact CD1-CD1 3.98Å; I177-L366 HydrophobicContact CD1-CD2 4.36Å; I177-L366 HydrophobicContact CG1-CD1 4.13Å; V205-L366 HydrophobicContact CB-CD1 4.44Å; V205-L366 HydrophobicContact CB-CG 3.98Å; V205-L366 HydrophobicContact CG1-CD2 4.12Å; V205-L366 HydrophobicContact CG1-CG 3.95Å; A208-L366 HydrophobicContact CB-CB 3.99Å; Y209-L366 HydrophobicContact CD2-CD1 4.1Å; Y209-L366 HydrophobicContact CE2-CD1 3.4Å; Y209-L366 VanDerWaalsContact CE2-CD1 3.4Å; F362-L366 HydrophobicContact CE1-CD1 4.15Å; F362-L366 HydrophobicContact CE2-CB 4.41Å; F362-L366 HydrophobicContact CE2-CD1 4.01Å; F362-L366 HydrophobicContact CZ-CD1 3.51Å; F362-L366 WeakPolarHBondContact O-CB 3.42Å; F362-L366 PolarHBondContact O-N 3.2Å; L363-L366 WeakPolarHBondContact O-CB 3.34Å; L363-L366 PolarHBondContact O-N 3.44Å; L366-L368 VanDerWaalsContact C-N 3.33Å; L366-L368 PolarHBondContact O-N 2.81Å; L366-C369 PolarHBondContact O-N 2.99Å; L366-A370 PolarHBondContact O-N 2.99Å; L366-P391 HydrophobicContact CD2-CB 3.69Å; L366-P391 HydrophobicContact CD2-CG 3.52Å
367T98.2Very high96.1Very high0 Ų014.3 Ų14.30%08%0.077CC..Hα-helixtrans-61.7-40.4176.2-54.80000111.7L363 R364 A370 L371 A388 P391 M392 L510L363-T367 PolarHBondContact O-N 3.21Å; L363-T367 PolarHBondContact O-OG1 3.25Å; R364-T367 PolarHBondContact O-N 3.12Å; T367-A370 PolarHBondContact O-N 2.69Å; T367-L371 HydrophobicContact CG2-CD1 4.17Å; T367-L371 HydrophobicContact CG2-CG 4.48Å; T367-L371 WeakPolarHBondContact O-CB 3.41Å; T367-L371 WeakPolarHBondContact O-CG 3.16Å; T367-L371 PolarHBondContact O-N 3.1Å; T367-A388 HydrophobicContact CG2-CB 4.4Å; T367-P391 WeakPolarHBondContact OG1-CB 3.45Å; T367-M392 HydrophobicContact CG2-CB 4.13Å; T367-M392 HydrophobicContact CG2-SD 4.01Å; T367-L510 HydrophobicContact CG2-CD2 3.7Å
368L98.2Very high96.5Very high0 Ų014 Ų140%07%0.073CC..Hα-helixtrans-66.6-36.6174.7-80.6175000112.5R364 C365 L366 L371 S372 L510 Y511 V514R364-L368 WeakPolarHBondContact O-CB 3.21Å; R364-L368 WeakPolarHBondContact O-CG 3.42Å; R364-L368 PolarHBondContact O-N 2.76Å; C365-L368 CarbonylContact O-C 3.32Å; C365-L368 PolarHBondContact O-N 2.92Å; L366-L368 VanDerWaalsContact C-N 3.33Å; L366-L368 PolarHBondContact O-N 2.81Å; L368-L371 PolarHBondContact O-N 2.65Å; L368-S372 WeakPolarHBondContact O-CB 3.44Å; L368-S372 PolarHBondContact O-N 3.11Å; L368-S372 PolarHBondContact O-OG 3.1Å; L368-L510 HydrophobicContact CD1-CG 4.49Å; L368-L510 HydrophobicContact CD2-CB 4.08Å; L368-L510 HydrophobicContact CD2-CD2 3.76Å; L368-L510 HydrophobicContact CD2-CG 3.77Å; L368-L510 HydrophobicContact CG-CD2 3.79Å; L368-L510 HydrophobicContact CG-CG 3.91Å; L368-Y511 HydrophobicContact CD1-CD2 4.38Å; L368-Y511 HydrophobicContact CD2-CD2 3.73Å; L368-Y511 HydrophobicContact CD2-CE2 4.32Å; L368-Y511 HydrophobicContact CD2-CG 4.44Å; L368-V514 HydrophobicContact CD1-CB 4.13Å; L368-V514 HydrophobicContact CD1-CG1 4.34Å; L368-V514 HydrophobicContact CD1-CG2 3.77Å
369C98.5Very high96.6Very high0 Ų013.4 Ų13.40%06%0.063CC..Hα-helixtrans-64-44.4174.2-67.20000111.2Y204 C365 L366 S373Y204-C369 WeakPolarHBondContact O-CB 3.43Å; C365-C369 WeakPolarHBondContact O-CB 3.25Å; C365-C369 PolarHBondContact O-N 2.87Å; C365-C369 PolarHBondContact O-SG 3.24Å; L366-C369 PolarHBondContact O-N 2.99Å; C369-S373 WeakPolarHBondContact O-CB 3.48Å; C369-S373 PolarHBondContact O-N 2.86Å; C369-S373 PolarHBondContact O-OG 3.04Å
370A98.5Very high96.7Very high2 Ų212 Ų122%0.0175%0.054CC..Hα-helixtrans-60.7-49.3174.800000111.8V205 L366 T367 S373 F374 L387 A388V205-A370 HydrophobicContact CG1-CB 3.82Å; L366-A370 PolarHBondContact O-N 2.99Å; T367-A370 PolarHBondContact O-N 2.69Å; A370-S373 PolarHBondContact O-N 2.85Å; A370-F374 WeakPolarHBondContact O-CB 3.36Å; A370-F374 PolarHBondContact O-N 3.31Å; A370-L387 HydrophobicContact CB-CB 4.33Å; A370-L387 HydrophobicContact CB-CD2 4.11Å; A370-L387 HydrophobicContact CB-CG 3.82Å; A370-A388 HydrophobicContact CB-CB 4.08Å
371L98.5Very high96.7Very high0 Ų09.2 Ų9.20%05%0.045CC..Hα-helixtrans-65.7-46179-73.5172.8000112.2T367 L368 S373 F374 M375 I385 A388 L409 I503 W507 L510T367-L371 HydrophobicContact CG2-CD1 4.17Å; T367-L371 HydrophobicContact CG2-CG 4.48Å; T367-L371 WeakPolarHBondContact O-CB 3.41Å; T367-L371 WeakPolarHBondContact O-CG 3.16Å; T367-L371 PolarHBondContact O-N 3.1Å; L368-L371 PolarHBondContact O-N 2.65Å; L371-S373 VanDerWaalsContact C-N 3.29Å; L371-S373 PolarHBondContact O-N 3.17Å; L371-F374 CarbonylContact O-C 3.56Å; L371-F374 WeakPolarHBondContact O-CB 3.23Å; L371-F374 PolarHBondContact O-N 2.79Å; L371-F374 VanDerWaalsContact O-N 3.14Å; L371-M375 VanDerWaalsContact O-CB 3.32Å; L371-M375 WeakPolarHBondContact O-CB 3.4Å; L371-M375 WeakPolarHBondContact O-CG 3.3Å; L371-M375 PolarHBondContact O-N 3.29Å; L371-I385 HydrophobicContact CD2-CD1 4.15Å; L371-A388 HydrophobicContact CD2-CB 3.38Å; L371-A388 HydrophobicContact CG-CB 3.54Å; L371-L409 HydrophobicContact CD1-CD2 4.34Å; L371-L409 HydrophobicContact CD2-CD1 3.77Å; L371-L409 HydrophobicContact CD2-CD2 4.11Å; L371-I503 HydrophobicContact CD2-CG2 4.45Å; L371-W507 HydrophobicContact CB-CG 4.36Å; L371-W507 HydrophobicContact CD1-CB 4.33Å; L371-L510 HydrophobicContact CD1-CD2 3.9Å
372S98.5Very high96.7Very high0 Ų09.1 Ų9.10%04%0.042CC..Hα-helixtrans-61.1-39.8178.4-66.50000111.7A344 L368 M375 F376 W507A344-S372 PolarHBondContact O-OG 2.82Å; L368-S372 WeakPolarHBondContact O-CB 3.44Å; L368-S372 PolarHBondContact O-N 3.11Å; L368-S372 PolarHBondContact O-OG 3.1Å; S372-M375 PolarHBondContact O-N 3.44Å; S372-F376 WeakPolarHBondContact O-CD2 3.28Å; S372-F376 PolarHBondContact O-N 2.98Å; S372-W507 PolarHBondContact OG-NE1 3.43Å
373S98.2Very high96.7Very high3 Ų310.7 Ų10.72%0.0215%0.049CC..Hα-helixtrans-68.6-36.8174.4-53.10000112.4Y204 C369 A370 L371 G377Y204-S373 WeakPolarHBondContact CB-OG 3.2Å; C369-S373 WeakPolarHBondContact O-CB 3.48Å; C369-S373 PolarHBondContact O-N 2.86Å; C369-S373 PolarHBondContact O-OG 3.04Å; A370-S373 PolarHBondContact O-N 2.85Å; L371-S373 VanDerWaalsContact C-N 3.29Å; L371-S373 PolarHBondContact O-N 3.17Å; S373-G377 WeakPolarHBondContact O-CA 3.4Å; S373-G377 PolarHBondContact O-N 3.05Å
374F98.2Very high96.7Very high3 Ų311 Ų111%0.0135%0.052CC..Hα-helixtrans-65.7-40.6173.3179.4-94.3000112.1A282 P283 N284 A370 L371 V380 A384 I385 I503A282-F374 HydrophobicContact CB-CE2 4.22Å; A282-F374 HydrophobicContact CB-CZ 4.16Å; P283-F374 HydrophobicContact CG-CE1 4.3Å; P283-F374 HydrophobicContact CG-CZ 3.89Å; P283-F374 WeakPolarHBondContact O-CE1 3.48Å; N284-F374 HydrophobicContact CB-CD1 4.08Å; N284-F374 HydrophobicContact CB-CE1 3.87Å; N284-F374 HydrophobicContact CB-CZ 4.49Å; N284-F374 WeakPolarHBondContact CB-O 3.21Å; N284-F374 PolarHBondContact ND2-O 3.49Å; A370-F374 WeakPolarHBondContact O-CB 3.36Å; A370-F374 PolarHBondContact O-N 3.31Å; L371-F374 CarbonylContact O-C 3.56Å; L371-F374 WeakPolarHBondContact O-CB 3.23Å; L371-F374 PolarHBondContact O-N 2.79Å; L371-F374 VanDerWaalsContact O-N 3.14Å; F374-V380 HydrophobicContact CD2-CG1 3.55Å; F374-V380 HydrophobicContact CE2-CG1 3.96Å; F374-V380 HydrophobicContact CG-CG1 4.34Å; F374-A384 HydrophobicContact CD2-CB 3.94Å; F374-A384 HydrophobicContact CE2-CB 4.32Å; F374-I385 HydrophobicContact CD1-CD1 3.85Å; F374-I385 HydrophobicContact CD2-CB 4.31Å; F374-I385 HydrophobicContact CD2-CD1 4.46Å; F374-I385 HydrophobicContact CE1-CD1 3.75Å; F374-I385 HydrophobicContact CE2-CB 3.8Å; F374-I385 HydrophobicContact CE2-CD1 4.38Å; F374-I385 HydrophobicContact CG-CD1 4.21Å; F374-I385 HydrophobicContact CZ-CB 3.9Å; F374-I385 HydrophobicContact CZ-CD1 4.03Å; F374-I385 HydrophobicContact CZ-CG1 4.33Å; F374-I503 HydrophobicContact CD1-CG2 4.21Å; F374-I503 HydrophobicContact CE1-CD1 4.11Å; F374-I503 HydrophobicContact CE1-CG2 4.08Å
375M98.1Very high96.8Very high0 Ų010.7 Ų10.70%05%0.051CC..Hα-helixtrans-67.7-45.8-177.2-75.1-51.4-66.900112.3N284 F285 L371 S372 I503 T504 W507N284-M375 HydrophobicContact CB-SD 4.31Å; F285-M375 HydrophobicContact CB-CE 3.89Å; F285-M375 VanDerWaalsContact CB-O 3.26Å; F285-M375 WeakPolarHBondContact CB-O 3.43Å; F285-M375 PolarHBondContact N-O 2.78Å; L371-M375 VanDerWaalsContact O-CB 3.32Å; L371-M375 WeakPolarHBondContact O-CB 3.4Å; L371-M375 WeakPolarHBondContact O-CG 3.3Å; L371-M375 PolarHBondContact O-N 3.29Å; S372-M375 PolarHBondContact O-N 3.44Å; M375-I503 HydrophobicContact SD-CG2 3.79Å; M375-T504 HydrophobicContact CE-CG2 4.17Å; M375-T504 WeakPolarHBondContact CE-OG1 3.38Å; M375-W507 HydrophobicContact CG-CD2 4.48Å; M375-W507 HydrophobicContact CG-CG 4.27Å
376F97.9Very high96.8Very high27 Ų2710.6 Ų10.612%0.1185%0.05CC..Hα-helixtrans-118.2-0.6-169.4-58.2-70000114.5F285 W286 T337 C340 T341 A344 S372 W507F285-F376 HydrophobicContact CB-CD1 3.99Å; F285-F376 HydrophobicContact CB-CE1 3.75Å; F285-F376 AromaticContact CD1-CD1 3.98Å; F285-F376 HydrophobicContact CD1-CD1 3.98Å; F285-F376 AromaticContact CD1-CE1 3.77Å; F285-F376 HydrophobicContact CD1-CE1 3.77Å; F285-F376 AromaticContact CD2-CE1 3.97Å; F285-F376 HydrophobicContact CD2-CE1 3.97Å; F285-F376 HydrophobicContact CE1-CE1 4.36Å; F285-F376 HydrophobicContact CG-CD1 4.04Å; F285-F376 AromaticContact CG-CE1 3.55Å; F285-F376 HydrophobicContact CG-CE1 3.55Å; F285-F376 HydrophobicContact CG-CZ 4.48Å; W286-F376 HydrophobicContact CZ2-CB 4.28Å; W286-F376 HydrophobicContact CZ2-CD1 4.24Å; W286-F376 WeakPolarHBondContact CZ2-O 3.42Å; W286-F376 PolarHBondContact NE1-O 2.78Å; T337-F376 VanDerWaalsContact CB-O 3.25Å; T337-F376 WeakPolarHBondContact CB-O 3.25Å; C340-F376 HydrophobicContact CB-CB 4.05Å; C340-F376 HydrophobicContact CB-CD1 4.3Å; C340-F376 HydrophobicContact CB-CG 4.26Å; T341-F376 VanDerWaalsContact OG1-C 3.23Å; T341-F376 WeakPolarHBondContact OG1-CB 3.38Å; T341-F376 PolarHBondContact OG1-O 2.69Å; A344-F376 HydrophobicContact CB-CD2 3.63Å; A344-F376 HydrophobicContact CB-CE2 3.69Å; S372-F376 WeakPolarHBondContact O-CD2 3.28Å; S372-F376 PolarHBondContact O-N 2.98Å; F376-W507 AromaticContact CE2-CH2 3.94Å; F376-W507 HydrophobicContact CE2-CH2 3.94Å; F376-W507 AromaticContact CE2-CZ2 3.93Å; F376-W507 HydrophobicContact CE2-CZ2 3.93Å; F376-W507 HydrophobicContact CZ-CH2 4.2Å
377G95.2Very high96.8Very high6 Ų610.8 Ų10.86%0.0625%0.051CC..  trans-67.2156.3-178.900000113.7W286 T341 S373W286-G377 PolarHBondContact NE1-O 2.88Å; W286-G377 VanDerWaalsContact NE1-O 3.11Å; T341-G377 PolarHBondContact OG1-N 3.48Å; S373-G377 WeakPolarHBondContact O-CA 3.4Å; S373-G377 PolarHBondContact O-N 3.05Å
378W92.7Very high96.9Very high59 Ų5910.9 Ų10.922%0.2235%0.052CC..THydrogen-bonded Turntrans-78.7133.2172.3-174.8-98.5000110.7R274 L276 V332 P334 T337 V380R274-W378 WeakPolarHBondContact O-CZ2 3.33Å; R274-W378 PolarHBondContact O-NE1 3.1Å; R274-W378 VanDerWaalsContact O-NE1 3.15Å; L276-W378 HydrophobicContact CB-CE3 4.26Å; L276-W378 HydrophobicContact CB-CH2 4.06Å; L276-W378 HydrophobicContact CB-CZ3 3.81Å; L276-W378 HydrophobicContact CD1-CE3 3.61Å; L276-W378 HydrophobicContact CD1-CZ3 3.74Å; L276-W378 HydrophobicContact CG-CZ3 4.38Å; V332-W378 WeakPolarHBondContact O-CZ3 3.36Å; P334-W378 HydrophobicContact CB-CD2 4.08Å; P334-W378 HydrophobicContact CB-CE3 4.18Å; P334-W378 HydrophobicContact CB-CG 4.42Å; P334-W378 HydrophobicContact CG-CD2 3.94Å; P334-W378 HydrophobicContact CG-CE3 4.01Å; P334-W378 HydrophobicContact CG-CH2 3.85Å; P334-W378 HydrophobicContact CG-CZ2 3.76Å; P334-W378 HydrophobicContact CG-CZ3 3.98Å; T337-W378 HydrophobicContact CG2-CE3 3.75Å; T337-W378 HydrophobicContact CG2-CZ3 4.41Å; W378-V380 PolarHBondContact O-N 2.98Å
379H91.3Very high96.9Very high17 Ų1710.9 Ų10.98%0.0795%0.052CC..THydrogen-bonded Turntrans53.740.5171.8-159.176.3000113.8R274 G275 L276 H278 H381R274-H379 HydrophobicContact CB-CB 4.46Å; R274-H379 WeakPolarHBondContact CD-CD2 3.47Å; R274-H379 WeakPolarHBondContact CD-NE2 3.33Å; G275-H379 PolarHBondContact O-ND1 3.34Å; L276-H379 VanDerWaalsContact O-CA 3.31Å; L276-H379 WeakPolarHBondContact O-CA 3.46Å; L276-H379 PolarHBondContact O-N 3.1Å; H278-H379 AromaticContact CD2-CE1 3.72Å; H278-H379 AromaticContact CD2-NE2 3.68Å; H379-H381 AromaticContact NE2-NE2 3.97Å
380V93.8Very high96.9Very high5 Ų510.9 Ų10.93%0.035%0.052CC..  trans-75.8131.4178.2-179.80000109.4A282 F374 W378 A384A282-V380 VanDerWaalsContact CB-O 3.23Å; A282-V380 WeakPolarHBondContact CB-O 3.04Å; F374-V380 HydrophobicContact CD2-CG1 3.55Å; F374-V380 HydrophobicContact CE2-CG1 3.96Å; F374-V380 HydrophobicContact CG-CG1 4.34Å; W378-V380 PolarHBondContact O-N 2.98Å; V380-A384 HydrophobicContact CG1-CB 3.76Å
381H93.7Very high96.9Very high51 Ų5110.8 Ų10.824%0.2365%0.051CC..  trans-81.1147.7171.5-65.2-90.6000111.4H278 H379 K383 A384H278-H381 AromaticContact CD2-CE1 3.61Å; H278-H381 AromaticContact NE2-CE1 3.96Å; H379-H381 AromaticContact NE2-NE2 3.97Å; H381-K383 HydrophobicContact CB-CG 3.91Å; H381-K383 PolarHBondContact O-N 2.86Å; H381-A384 WeakPolarHBondContact O-CB 3.35Å; H381-A384 PolarHBondContact O-N 3.43Å
382E95.7Very high96.8Very high6 Ų610.8 Ų10.83%0.0285%0.051CC..G310 helixtrans-49.7-42.5175.561.9-62.6133.700112.8Y280 A282 A384 I385 L417 L420Y280-E382 HydrophobicContact CD1-CB 4.18Å; Y280-E382 HydrophobicContact CD1-CG 3.75Å; Y280-E382 HydrophobicContact CE1-CB 3.88Å; Y280-E382 HydrophobicContact CE1-CG 3.69Å; A282-E382 HydrophobicContact CB-CB 4.45Å; E382-A384 PolarHBondContact O-N 3.44Å; E382-A384 VanDerWaalsContact O-N 3.12Å; E382-I385 WeakPolarHBondContact O-CB 3.43Å; E382-I385 WeakPolarHBondContact O-CG2 3.24Å; E382-I385 PolarHBondContact O-N 2.57Å; E382-L417 HydrophobicContact CB-CD2 4.33Å; E382-L417 HydrophobicContact CG-CD2 4.1Å; E382-L420 HydrophobicContact CG-CD1 4.15Å; E382-L420 HydrophobicContact CG-CD2 3.99Å; E382-L420 HydrophobicContact CG-CG 4.24Å
383K96Very high96.8Very high34 Ų3410.8 Ų10.815%0.1485%0.051CC..G310 helixtrans-61.8-19.717959.8-172.9169.5-167.80114.7D36 V158 Q164 H381 I385 L386 L417D36-K383 IonicContact OD2-NZ 2.67Å; D36-K383 PolarHBondContact OD2-NZ 3.01Å; D36-K383 VanDerWaalsContact OD2-NZ 3.1Å; V158-K383 HydrophobicContact CG2-CB 4.46Å; Q164-K383 VanDerWaalsContact CD-NZ 3.34Å; Q164-K383 VanDerWaalsContact OE1-CD 3.29Å; H381-K383 HydrophobicContact CB-CG 3.91Å; H381-K383 PolarHBondContact O-N 2.86Å; K383-I385 PolarHBondContact O-N 3.24Å; K383-I385 VanDerWaalsContact O-N 3.12Å; K383-L386 PolarHBondContact O-N 3.19Å; K383-L417 HydrophobicContact CB-CD2 4.39Å
384A97.5Very high96.8Very high9 Ų911.8 Ų11.87%0.0746%0.056CC..G310 helixtrans-63.8-16.6176.900000112.9I201 F374 V380 H381 E382 L386 L387I201-A384 HydrophobicContact CD1-CB 3.88Å; F374-A384 HydrophobicContact CD2-CB 3.94Å; F374-A384 HydrophobicContact CE2-CB 4.32Å; V380-A384 HydrophobicContact CG1-CB 3.76Å; H381-A384 WeakPolarHBondContact O-CB 3.35Å; H381-A384 PolarHBondContact O-N 3.43Å; E382-A384 PolarHBondContact O-N 3.44Å; E382-A384 VanDerWaalsContact O-N 3.12Å; A384-L386 PolarHBondContact O-N 3.04Å; A384-L386 VanDerWaalsContact O-N 3.14Å; A384-L387 WeakPolarHBondContact O-CB 3.5Å; A384-L387 PolarHBondContact O-N 2.86Å
385I98.4Very high96.7Very high0 Ų011.9 Ų11.90%06%0.057CC..G310 helixtrans-57.7-26.9175.1-16554.7000112.9L371 F374 E382 K383 L387 A388 I389 L409 L417 I503L371-I385 HydrophobicContact CD2-CD1 4.15Å; F374-I385 HydrophobicContact CD1-CD1 3.85Å; F374-I385 HydrophobicContact CD2-CB 4.31Å; F374-I385 HydrophobicContact CD2-CD1 4.46Å; F374-I385 HydrophobicContact CE1-CD1 3.75Å; F374-I385 HydrophobicContact CE2-CB 3.8Å; F374-I385 HydrophobicContact CE2-CD1 4.38Å; F374-I385 HydrophobicContact CG-CD1 4.21Å; F374-I385 HydrophobicContact CZ-CB 3.9Å; F374-I385 HydrophobicContact CZ-CD1 4.03Å; F374-I385 HydrophobicContact CZ-CG1 4.33Å; E382-I385 WeakPolarHBondContact O-CB 3.43Å; E382-I385 WeakPolarHBondContact O-CG2 3.24Å; E382-I385 PolarHBondContact O-N 2.57Å; K383-I385 PolarHBondContact O-N 3.24Å; K383-I385 VanDerWaalsContact O-N 3.12Å; I385-L387 PolarHBondContact O-N 2.7Å; I385-A388 PolarHBondContact O-N 2.84Å; I385-I389 HydrophobicContact CG1-CD1 3.92Å; I385-I389 HydrophobicContact CG1-CG1 4.29Å; I385-I389 HydrophobicContact CG2-CD1 4.09Å; I385-I389 PolarHBondContact O-N 3.03Å; I385-L409 HydrophobicContact CD1-CD1 3.92Å; I385-L417 HydrophobicContact CG2-CD2 4.36Å; I385-I503 HydrophobicContact CD1-CD1 3.97Å; I385-I503 HydrophobicContact CD1-CG1 4.36Å; I385-I503 HydrophobicContact CD1-CG2 3.99Å; I385-I503 HydrophobicContact CG1-CD1 4.13Å
386L98.4Very high96.7Very high1 Ų111.9 Ų11.91%0.0056%0.057CC..Hα-helixtrans-62.4-27.1176.4-64.1178.3000112.9L155 V158 F170 K383 A384 A388 I389 L390 L417L155-L386 HydrophobicContact CD2-CD1 4.06Å; V158-L386 HydrophobicContact CB-CD1 4.49Å; V158-L386 HydrophobicContact CG2-CD1 4.15Å; F170-L386 HydrophobicContact CE2-CB 3.78Å; F170-L386 HydrophobicContact CE2-CD1 4.41Å; F170-L386 HydrophobicContact CZ-CB 3.68Å; K383-L386 PolarHBondContact O-N 3.19Å; A384-L386 PolarHBondContact O-N 3.04Å; A384-L386 VanDerWaalsContact O-N 3.14Å; L386-A388 PolarHBondContact O-N 3.4Å; L386-I389 HydrophobicContact CD2-CD1 4.28Å; L386-I389 PolarHBondContact O-N 3.38Å; L386-L390 HydrophobicContact CB-CD1 4.49Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 3.19Å; L386-L390 VanDerWaalsContact O-N 3.1Å; L386-L417 HydrophobicContact CD2-CD1 4.35Å
387L98.2Very high96.5Very high4 Ų410.8 Ų10.82%0.0215%0.052CC..Hα-helixtrans-61.1-27.3174.3-17264.4000112.2F170 M173 Y202 Y204 V205 A370 A384 I385 P391F170-L387 HydrophobicContact CE1-CB 4.31Å; F170-L387 HydrophobicContact CE1-CD1 3.94Å; M173-L387 HydrophobicContact CE-CD1 4.4Å; M173-L387 HydrophobicContact SD-CD1 3.64Å; Y202-L387 HydrophobicContact CD1-CD1 3.56Å; Y202-L387 HydrophobicContact CE1-CD1 3.46Å; Y202-L387 VanDerWaalsContact CE1-CD1 3.46Å; Y204-L387 HydrophobicContact CD2-CD2 4Å; Y204-L387 HydrophobicContact CG-CD2 4.42Å; V205-L387 HydrophobicContact CG1-CD1 4.4Å; V205-L387 HydrophobicContact CG1-CD2 4.2Å; V205-L387 HydrophobicContact CG1-CG 4.23Å; A370-L387 HydrophobicContact CB-CB 4.33Å; A370-L387 HydrophobicContact CB-CD2 4.11Å; A370-L387 HydrophobicContact CB-CG 3.82Å; A384-L387 WeakPolarHBondContact O-CB 3.5Å; A384-L387 PolarHBondContact O-N 2.86Å; I385-L387 PolarHBondContact O-N 2.7Å; L387-P391 WeakPolarHBondContact O-CD 3.44Å; L387-P391 VanDerWaalsContact O-CG 3.26Å; L387-P391 WeakPolarHBondContact O-CG 3.39Å
388A98.5Very high96.4Very high1 Ų111.5 Ų11.51%0.0086%0.06CC..Hα-helixtrans-93.9-42.1173.600000112.8T367 A370 L371 I385 L386 L390 P391 M392 L409T367-A388 HydrophobicContact CG2-CB 4.4Å; A370-A388 HydrophobicContact CB-CB 4.08Å; L371-A388 HydrophobicContact CD2-CB 3.38Å; L371-A388 HydrophobicContact CG-CB 3.54Å; I385-A388 PolarHBondContact O-N 2.84Å; L386-A388 PolarHBondContact O-N 3.4Å; A388-L390 PolarHBondContact O-N 3.06Å; A388-P391 WeakPolarHBondContact O-CD 3.5Å; A388-M392 WeakPolarHBondContact O-CB 3.4Å; A388-M392 PolarHBondContact O-N 3.05Å; A388-L409 HydrophobicContact CB-CD2 4.28Å
389I98.7Very high96.3Very high0 Ų012.5 Ų12.50%07%0.066CC..Hα-helixtrans-60.1-47-176-70.9169.5000111.5I385 L386 M392 S393 F406 L409I385-I389 HydrophobicContact CG1-CD1 3.92Å; I385-I389 HydrophobicContact CG1-CG1 4.29Å; I385-I389 HydrophobicContact CG2-CD1 4.09Å; I385-I389 PolarHBondContact O-N 3.03Å; L386-I389 HydrophobicContact CD2-CD1 4.28Å; L386-I389 PolarHBondContact O-N 3.38Å; I389-M392 CarbonylContact O-C 3.57Å; I389-M392 WeakPolarHBondContact O-CA 3.18Å; I389-M392 WeakPolarHBondContact O-CB 3.31Å; I389-M392 PolarHBondContact O-N 3.27Å; I389-M392 VanDerWaalsContact O-N 3.12Å; I389-S393 PolarHBondContact O-N 3.38Å; I389-S393 PolarHBondContact O-OG 2.85Å; I389-F406 HydrophobicContact CG2-CE2 4.28Å; I389-L409 HydrophobicContact CG1-CD2 4.31Å; I389-L409 HydrophobicContact CG1-CG 4Å
390L98.5Very high96.4Very high0 Ų012.2 Ų12.20%07%0.066CC..Hα-helixtrans-68.3-46.1-172.7-60.8168.7000113L149 N152 L155 F170 L386 A388 M392 S393L149-L390 HydrophobicContact CD2-CB 4.39Å; L149-L390 HydrophobicContact CD2-CD2 4Å; N152-L390 HydrophobicContact CB-CD2 4.23Å; L155-L390 HydrophobicContact CD1-CD1 3.76Å; L155-L390 HydrophobicContact CD1-CD2 3.65Å; L155-L390 HydrophobicContact CD1-CG 4.35Å; L155-L390 HydrophobicContact CD2-CD1 4.03Å; L155-L390 HydrophobicContact CG-CD1 4.07Å; L155-L390 HydrophobicContact CG-CD2 4.16Å; F170-L390 HydrophobicContact CB-CD1 3.77Å; F170-L390 HydrophobicContact CD1-CD1 3.7Å; F170-L390 HydrophobicContact CD2-CD1 3.39Å; F170-L390 HydrophobicContact CE1-CD1 4.06Å; F170-L390 HydrophobicContact CE2-CD1 3.74Å; F170-L390 HydrophobicContact CG-CD1 3.34Å; F170-L390 HydrophobicContact CZ-CD1 4.07Å; L386-L390 HydrophobicContact CB-CD1 4.49Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 3.19Å; L386-L390 VanDerWaalsContact O-N 3.1Å; A388-L390 PolarHBondContact O-N 3.06Å; L390-M392 VanDerWaalsContact C-N 3.25Å; L390-M392 PolarHBondContact O-N 3.44Å; L390-S393 WeakPolarHBondContact O-CB 3.45Å; L390-S393 PolarHBondContact O-N 2.97Å
391P98.3Very high96.5Very high0 Ų013.9 Ų13.90%08%0.084CC..Hα-helixtrans-59.8-35.1168-27.437.7000113.3M173 L363 L366 T367 L387 A388 S393 L394M173-P391 HydrophobicContact CE-CG 3.55Å; M173-P391 HydrophobicContact SD-CG 4.5Å; L363-P391 HydrophobicContact CD1-CB 3.78Å; L366-P391 HydrophobicContact CD2-CB 3.69Å; L366-P391 HydrophobicContact CD2-CG 3.52Å; T367-P391 WeakPolarHBondContact OG1-CB 3.45Å; L387-P391 WeakPolarHBondContact O-CD 3.44Å; L387-P391 VanDerWaalsContact O-CG 3.26Å; L387-P391 WeakPolarHBondContact O-CG 3.39Å; A388-P391 WeakPolarHBondContact O-CD 3.5Å; P391-S393 VanDerWaalsContact C-N 3.31Å; P391-S393 PolarHBondContact O-N 3.34Å; P391-L394 WeakPolarHBondContact O-CB 3.24Å; P391-L394 PolarHBondContact O-N 3.02Å
392M98.1Very high96.6Very high0 Ų011.7 Ų11.70%07%0.074CC..Hα-helixtrans-66.3-32177.3-165.166.8-158.700112.2T367 A388 I389 L390 L394 L395 S396 D402 I405 F406 L409 L510T367-M392 HydrophobicContact CG2-CB 4.13Å; T367-M392 HydrophobicContact CG2-SD 4.01Å; A388-M392 WeakPolarHBondContact O-CB 3.4Å; A388-M392 PolarHBondContact O-N 3.05Å; I389-M392 CarbonylContact O-C 3.57Å; I389-M392 WeakPolarHBondContact O-CA 3.18Å; I389-M392 WeakPolarHBondContact O-CB 3.31Å; I389-M392 PolarHBondContact O-N 3.27Å; I389-M392 VanDerWaalsContact O-N 3.12Å; L390-M392 VanDerWaalsContact C-N 3.25Å; L390-M392 PolarHBondContact O-N 3.44Å; M392-L394 PolarHBondContact O-N 3.45Å; M392-L395 HydrophobicContact CE-CB 4.3Å; M392-L395 WeakPolarHBondContact O-CB 3.09Å; M392-L395 PolarHBondContact O-N 2.96Å; M392-L395 HydrophobicContact SD-CB 4.32Å; M392-L395 HydrophobicContact SD-CD1 3.83Å; M392-S396 PolarHBondContact O-N 2.99Å; M392-D402 HydrophobicContact CE-CB 3.94Å; M392-D402 WeakPolarHBondContact CE-O 3.39Å; M392-I405 HydrophobicContact CE-CB 3.71Å; M392-I405 HydrophobicContact CE-CG2 3.63Å; M392-I405 HydrophobicContact SD-CG2 4.33Å; M392-F406 HydrophobicContact CB-CD2 4.15Å; M392-F406 HydrophobicContact CE-CB 4.24Å; M392-F406 HydrophobicContact CG-CB 3.83Å; M392-F406 HydrophobicContact CG-CD2 4.03Å; M392-F406 HydrophobicContact CG-CG 4.44Å; M392-L409 HydrophobicContact CB-CD2 4.24Å; M392-L409 HydrophobicContact CG-CD2 4.23Å; M392-L510 HydrophobicContact CE-CD1 4.45Å; M392-L510 HydrophobicContact SD-CD1 4.41Å; M392-L510 HydrophobicContact SD-CD2 4.36Å
393S98.3Very high96.6Very high0 Ų011.4 Ų11.40%07%0.073CC..Hα-helixtrans-57.1-37172.1-570000112.3L145 I389 L390 P391 L395 S396 F406L145-S393 WeakPolarHBondContact CD1-O 3.46Å; I389-S393 PolarHBondContact O-N 3.38Å; I389-S393 PolarHBondContact O-OG 2.85Å; L390-S393 WeakPolarHBondContact O-CB 3.45Å; L390-S393 PolarHBondContact O-N 2.97Å; P391-S393 VanDerWaalsContact C-N 3.31Å; P391-S393 PolarHBondContact O-N 3.34Å; S393-L395 VanDerWaalsContact C-N 3.31Å; S393-L395 PolarHBondContact O-N 3.27Å; S393-S396 PolarHBondContact O-N 3.39Å; S393-S396 PolarHBondContact O-OG 3.12Å; S393-F406 WeakPolarHBondContact OG-CE2 3.35Å
394L97.5Very high96.7Very high24 Ų2410 Ų1013%0.1267%0.067CC..Hα-helixtrans-66.3-33.2176.5-65.7171000112.3C124 L145 L149 L174 I177 L363 P391 M392C124-L394 HydrophobicContact CB-CD2 3.54Å; L145-L394 HydrophobicContact CD1-CD2 4.09Å; L145-L394 HydrophobicContact CD2-CD2 3.57Å; L145-L394 HydrophobicContact CG-CD2 4.43Å; L149-L394 HydrophobicContact CD1-CD2 4.09Å; L174-L394 HydrophobicContact CD2-CD1 3.83Å; L174-L394 HydrophobicContact CD2-CG 4.44Å; I177-L394 HydrophobicContact CG2-CD1 3.97Å; L363-L394 HydrophobicContact CD1-CD1 4.14Å; L363-L394 HydrophobicContact CD2-CB 3.63Å; L363-L394 HydrophobicContact CD2-CD1 4.11Å; P391-L394 WeakPolarHBondContact O-CB 3.24Å; P391-L394 PolarHBondContact O-N 3.02Å; M392-L394 PolarHBondContact O-N 3.45Å
395L96.6Very high96.8Very high6 Ų69.7 Ų9.73%0.0316%0.064CC..Hα-helixtrans-77.7-32177.4-66.7170.9000112.2L363 R364 M392 S393 V397 G398 D402L363-L395 HydrophobicContact CB-CD2 4.23Å; L363-L395 HydrophobicContact CD2-CD2 3.61Å; L363-L395 HydrophobicContact CD2-CG 3.68Å; L363-L395 HydrophobicContact CG-CD1 4.17Å; L363-L395 HydrophobicContact CG-CD2 3.93Å; L363-L395 HydrophobicContact CG-CG 3.86Å; R364-L395 HydrophobicContact CB-CD1 4.45Å; R364-L395 HydrophobicContact CG-CD1 3.61Å; R364-L395 HydrophobicContact CG-CD2 3.92Å; R364-L395 HydrophobicContact CG-CG 4.44Å; M392-L395 HydrophobicContact CE-CB 4.3Å; M392-L395 WeakPolarHBondContact O-CB 3.09Å; M392-L395 PolarHBondContact O-N 2.96Å; M392-L395 HydrophobicContact SD-CB 4.32Å; M392-L395 HydrophobicContact SD-CD1 3.83Å; S393-L395 VanDerWaalsContact C-N 3.31Å; S393-L395 PolarHBondContact O-N 3.27Å; L395-V397 VanDerWaalsContact C-N 3.27Å; L395-V397 PolarHBondContact O-N 3.5Å; L395-G398 PolarHBondContact O-N 3.18Å; L395-D402 HydrophobicContact CB-CB 4.11Å
396S96.7Very high96.8Very high0 Ų09.7 Ų9.70%06%0.064CC..Hα-helixtrans-59.3-33.6-170.977.60000113.6M392 S393 G398 A403 F406 F449M392-S396 PolarHBondContact O-N 2.99Å; S393-S396 PolarHBondContact O-N 3.39Å; S393-S396 PolarHBondContact O-OG 3.12Å; S396-G398 VanDerWaalsContact C-N 3.3Å; S396-G398 PolarHBondContact O-N 3.4Å; S396-A403 VanDerWaalsContact O-CB 3.26Å; S396-A403 WeakPolarHBondContact O-CB 3.43Å; S396-F406 VanDerWaalsContact CB-CG 3.48Å; S396-F449 VanDerWaalsContact O-CE2 3.27Å; S396-F449 WeakPolarHBondContact O-CE2 3.17Å
397V95.1Very high96.8Very high3 Ų39.6 Ų9.62%0.0186%0.064CC..THydrogen-bonded Turntrans-81.9-8.9179.7-600000113.5I128 K132 P141 I144 L145 L395 L445 L448I128-V397 HydrophobicContact CD1-CG2 3.66Å; I128-V397 HydrophobicContact CG1-CG2 4.26Å; K132-V397 PolarHBondContact NZ-O 2.97Å; P141-V397 HydrophobicContact CB-CB 4.24Å; I144-V397 HydrophobicContact CB-CG1 4.38Å; I144-V397 HydrophobicContact CG2-CG1 4.04Å; L145-V397 HydrophobicContact CB-CG1 4.18Å; L145-V397 HydrophobicContact CB-CG2 4.49Å; L395-V397 VanDerWaalsContact C-N 3.27Å; L395-V397 PolarHBondContact O-N 3.5Å; V397-L445 HydrophobicContact CG1-CD2 4.29Å; V397-L448 HydrophobicContact CB-CD2 4.11Å; V397-L448 HydrophobicContact CG1-CD2 4.38Å
398G91.6Very high96.8Very high22 Ų229.5 Ų9.523%0.2276%0.064CC..THydrogen-bonded Turntrans-80.1-59.1-177.300000113.4K132 L395 S396K132-G398 PolarHBondContact NZ-O 3.07Å; L395-G398 PolarHBondContact O-N 3.18Å; S396-G398 VanDerWaalsContact C-N 3.3Å; S396-G398 PolarHBondContact O-N 3.4Å
399K91.8Very high96.8Very high80 Ų809.5 Ų9.535%0.3486%0.063SC..  trans-131.5146.6-174.7-66.2-176.9177.3-171.30111.1G401 D402 A403 F449 D517K399-G401 VanDerWaalsContact C-N 3.29Å; K399-G401 PolarHBondContact O-N 3.48Å; K399-D402 HydrophobicContact CB-CB 4.41Å; K399-D402 PolarHBondContact O-N 3.04Å; K399-D402 VanDerWaalsContact O-N 3.17Å; K399-A403 PolarHBondContact O-N 3.09Å; K399-F449 VanDerWaalsContact C-CE1 3.43Å; K399-D517 IonicContact NZ-OD1 3.66Å; K399-D517 IonicContact NZ-OD2 3.94Å; K399-D517 PolarHBondContact NZ-OD2 3.41Å
400A93.8Very high96.8Very high10 Ų109.5 Ų9.58%0.0836%0.063CC..Hα-helixtrans-61.1-36.4178.400000113.1D402 A403 S404 F449 E452 L455A400-D402 PolarHBondContact O-N 3.37Å; A400-A403 WeakPolarHBondContact O-CB 3.4Å; A400-A403 PolarHBondContact O-N 3.29Å; A400-S404 PolarHBondContact O-N 3.44Å; A400-F449 HydrophobicContact CB-CB 4.08Å; A400-F449 HydrophobicContact CB-CD1 3.75Å; A400-F449 HydrophobicContact CB-CD2 4.45Å; A400-F449 HydrophobicContact CB-CE1 4.24Å; A400-F449 HydrophobicContact CB-CG 3.85Å; A400-E452 HydrophobicContact CB-CB 4.14Å; A400-E452 WeakPolarHBondContact CB-OE2 3.37Å; A400-L455 HydrophobicContact CB-CD2 3.8Å
401G94.5Very high96.8Very high40 Ų4010 Ų1041%0.4127%0.066SC..Hα-helixtrans-61.2-43.4175.400000112.8K399 S404 I405K399-G401 VanDerWaalsContact C-N 3.29Å; K399-G401 PolarHBondContact O-N 3.48Å; G401-S404 PolarHBondContact O-N 3.21Å; G401-I405 WeakPolarHBondContact O-CD1 3.43Å; G401-I405 WeakPolarHBondContact O-CG1 3.35Å; G401-I405 PolarHBondContact O-N 3.18Å
402D95.8Very high96.8Very high6 Ų610 Ų103%0.0327%0.066CC..Hα-helixtrans-69.3-36.1176-63.3-25.8000110.6R364 M392 L395 K399 A400 I405 F406R364-D402 IonicContact CZ-OD1 3.24Å; R364-D402 IonicContact CZ-OD2 3.58Å; R364-D402 IonicContact NE-OD1 3.95Å; R364-D402 IonicContact NE-OD2 3.79Å; R364-D402 IonicContact NH2-OD1 2.65Å; R364-D402 PolarHBondContact NH2-OD1 3.27Å; R364-D402 IonicContact NH2-OD2 4Å; R364-D402 PolarHBondContact NH2-OD2 2.88Å; M392-D402 HydrophobicContact CE-CB 3.94Å; M392-D402 WeakPolarHBondContact CE-O 3.39Å; L395-D402 HydrophobicContact CB-CB 4.11Å; K399-D402 HydrophobicContact CB-CB 4.41Å; K399-D402 PolarHBondContact O-N 3.04Å; K399-D402 VanDerWaalsContact O-N 3.17Å; A400-D402 PolarHBondContact O-N 3.37Å; D402-I405 PolarHBondContact O-N 2.92Å; D402-F406 WeakPolarHBondContact O-CB 3.34Å; D402-F406 PolarHBondContact O-N 3.33Å
403A97.4Very high96.8Very high0 Ų010 Ų100%07%0.066CC..Hα-helixtrans-60.3-44.8174.100000112.3S396 K399 A400 F406 L407 L445 F449 L455S396-A403 VanDerWaalsContact O-CB 3.26Å; S396-A403 WeakPolarHBondContact O-CB 3.43Å; K399-A403 PolarHBondContact O-N 3.09Å; A400-A403 WeakPolarHBondContact O-CB 3.4Å; A400-A403 PolarHBondContact O-N 3.29Å; A403-F406 WeakPolarHBondContact O-CB 3.44Å; A403-F406 PolarHBondContact O-N 3.09Å; A403-L407 VanDerWaalsContact O-CG 3.29Å; A403-L407 WeakPolarHBondContact O-CG 3.42Å; A403-L407 PolarHBondContact O-N 2.99Å; A403-L445 HydrophobicContact CB-CD1 4.27Å; A403-L445 HydrophobicContact CB-CD2 4.39Å; A403-F449 HydrophobicContact CB-CD2 3.87Å; A403-F449 HydrophobicContact CB-CE2 3.56Å; A403-F449 HydrophobicContact CB-CZ 4.4Å; A403-L455 HydrophobicContact CB-CD2 4.22Å
404S97.7Very high96.8Very high4 Ų410 Ų103%0.0287%0.066CC..Hα-helixtrans-60.9-48.6177178.10000111.8A400 G401 F406 L407 I408 L455 K509A400-S404 PolarHBondContact O-N 3.44Å; G401-S404 PolarHBondContact O-N 3.21Å; S404-F406 VanDerWaalsContact C-N 3.34Å; S404-F406 PolarHBondContact O-N 3.14Å; S404-L407 PolarHBondContact O-N 2.51Å; S404-I408 WeakPolarHBondContact O-CG1 3.33Å; S404-I408 PolarHBondContact O-N 2.94Å; S404-I408 VanDerWaalsContact O-N 3.15Å; S404-L455 WeakPolarHBondContact CB-O 3.49Å; S404-L455 PolarHBondContact OG-O 2.91Å; S404-K509 PolarHBondContact OG-NZ 3.36Å
405I98.1Very high96.9Very high2 Ų29.2 Ų9.21%0.016%0.062CC..Hα-helixtrans-60-46.2176.7-66.1159.9000110.5M392 G401 D402 L407 I408 L409 A506 K509 L510M392-I405 HydrophobicContact CE-CB 3.71Å; M392-I405 HydrophobicContact CE-CG2 3.63Å; M392-I405 HydrophobicContact SD-CG2 4.33Å; G401-I405 WeakPolarHBondContact O-CD1 3.43Å; G401-I405 WeakPolarHBondContact O-CG1 3.35Å; G401-I405 PolarHBondContact O-N 3.18Å; D402-I405 PolarHBondContact O-N 2.92Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.21Å; I405-I408 PolarHBondContact O-N 3.49Å; I405-L409 VanDerWaalsContact O-CB 3.29Å; I405-L409 WeakPolarHBondContact O-CB 3.46Å; I405-L409 PolarHBondContact O-N 3.47Å; I405-A506 HydrophobicContact CG2-CB 4.39Å; I405-K509 HydrophobicContact CD1-CB 4.48Å; I405-K509 HydrophobicContact CD1-CG 4.06Å; I405-K509 HydrophobicContact CG1-CB 4.06Å; I405-K509 HydrophobicContact CG1-CD 3.69Å; I405-K509 HydrophobicContact CG1-CG 3.66Å; I405-L510 HydrophobicContact CD1-CB 4.3Å; I405-L510 HydrophobicContact CD1-CD1 4.25Å; I405-L510 HydrophobicContact CG2-CB 4.15Å
406F98.6Very high96.9Very high0 Ų09 Ų90%06%0.06CC..Hα-helixtrans-56.7-47.7177.4167.6-105.6000111.5L148 I389 M392 S393 S396 D402 A403 S404 I408 L409 T410 F437 L445L148-F406 HydrophobicContact CD1-CE1 3.85Å; L148-F406 HydrophobicContact CD1-CZ 4.15Å; L148-F406 HydrophobicContact CD2-CE1 4.04Å; L148-F406 HydrophobicContact CD2-CZ 4.19Å; I389-F406 HydrophobicContact CG2-CE2 4.28Å; M392-F406 HydrophobicContact CB-CD2 4.15Å; M392-F406 HydrophobicContact CE-CB 4.24Å; M392-F406 HydrophobicContact CG-CB 3.83Å; M392-F406 HydrophobicContact CG-CD2 4.03Å; M392-F406 HydrophobicContact CG-CG 4.44Å; S393-F406 WeakPolarHBondContact OG-CE2 3.35Å; S396-F406 VanDerWaalsContact CB-CG 3.48Å; D402-F406 WeakPolarHBondContact O-CB 3.34Å; D402-F406 PolarHBondContact O-N 3.33Å; A403-F406 WeakPolarHBondContact O-CB 3.44Å; A403-F406 PolarHBondContact O-N 3.09Å; S404-F406 VanDerWaalsContact C-N 3.34Å; S404-F406 PolarHBondContact O-N 3.14Å; F406-I408 PolarHBondContact O-N 2.9Å; F406-L409 PolarHBondContact O-N 3.06Å; F406-T410 HydrophobicContact CD1-CG2 4.42Å; F406-T410 HydrophobicContact CE1-CG2 3.99Å; F406-T410 HydrophobicContact CE2-CG2 4.2Å; F406-T410 HydrophobicContact CZ-CG2 3.87Å; F406-T410 VanDerWaalsContact O-CB 3.31Å; F406-T410 WeakPolarHBondContact O-CB 3.49Å; F406-T410 VanDerWaalsContact O-CG2 3.3Å; F406-T410 WeakPolarHBondContact O-CG2 3.29Å; F406-T410 PolarHBondContact O-N 2.99Å; F406-F437 HydrophobicContact CZ-CZ 4.46Å; F406-L445 HydrophobicContact CD1-CD1 3.65Å; F406-L445 HydrophobicContact CE1-CD1 3.98Å
407L98.6Very high97Very high0 Ų09 Ų90%06%0.06CC..Hα-helixtrans-63.9-40.1-177.2-74170.8000112.3A403 S404 I405 T411 I442 L445 L455 F456A403-L407 VanDerWaalsContact O-CG 3.29Å; A403-L407 WeakPolarHBondContact O-CG 3.42Å; A403-L407 PolarHBondContact O-N 2.99Å; S404-L407 PolarHBondContact O-N 2.51Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.21Å; L407-T411 VanDerWaalsContact O-CB 3.28Å; L407-T411 WeakPolarHBondContact O-CB 3.39Å; L407-T411 PolarHBondContact O-N 3.01Å; L407-T411 VanDerWaalsContact O-N 3.11Å; L407-T411 PolarHBondContact O-OG1 3.43Å; L407-I442 HydrophobicContact CD1-CG1 4.42Å; L407-I442 HydrophobicContact CD2-CG1 3.84Å; L407-L445 HydrophobicContact CD1-CB 4.28Å; L407-L445 HydrophobicContact CD1-CD1 4.08Å; L407-L445 HydrophobicContact CD2-CD1 3.84Å; L407-L445 HydrophobicContact CG-CD1 3.82Å; L407-L455 HydrophobicContact CD1-CD1 3.85Å; L407-F456 HydrophobicContact CB-CE1 3.69Å; L407-F456 HydrophobicContact CB-CZ 3.53Å; L407-F456 HydrophobicContact CD1-CE1 4.1Å; L407-F456 HydrophobicContact CD1-CE2 4.12Å; L407-F456 HydrophobicContact CD1-CZ 3.45Å; L407-F456 VanDerWaalsContact CD1-CZ 3.45Å; L407-F456 HydrophobicContact CG-CZ 4.07Å
408I98.5Very high97Very high2 Ų29.2 Ų9.21%0.016%0.061CC..Hα-helixtrans-65.5-49.9175.2-62.1167.8000109.9S404 I405 F406 T412 F456 E460 L464 Y505 A506S404-I408 WeakPolarHBondContact O-CG1 3.33Å; S404-I408 PolarHBondContact O-N 2.94Å; S404-I408 VanDerWaalsContact O-N 3.15Å; I405-I408 PolarHBondContact O-N 3.49Å; F406-I408 PolarHBondContact O-N 2.9Å; I408-T412 WeakPolarHBondContact O-CB 3.21Å; I408-T412 VanDerWaalsContact O-CG2 3.3Å; I408-T412 WeakPolarHBondContact O-CG2 3.39Å; I408-T412 PolarHBondContact O-N 3.35Å; I408-T412 VanDerWaalsContact O-N 3.1Å; I408-T412 PolarHBondContact O-OG1 3.48Å; I408-F456 HydrophobicContact CG1-CE1 4.2Å; I408-E460 HydrophobicContact CD1-CB 4.38Å; I408-E460 HydrophobicContact CD1-CG 3.85Å; I408-L464 HydrophobicContact CG1-CD1 4.4Å; I408-Y505 HydrophobicContact CD1-CD1 4.03Å; I408-Y505 HydrophobicContact CD1-CE1 3.75Å; I408-Y505 HydrophobicContact CG2-CD1 4.37Å; I408-A506 HydrophobicContact CG2-CB 4.22Å
409L98.7Very high97.2Very high0 Ų09.4 Ų9.40%06%0.058CC..Hα-helixtrans-62.6-45.8-177.7-178.863.3000112.4L371 I385 A388 I389 M392 I405 F406 T412 G413 I503 A506L371-L409 HydrophobicContact CD1-CD2 4.34Å; L371-L409 HydrophobicContact CD2-CD1 3.77Å; L371-L409 HydrophobicContact CD2-CD2 4.11Å; I385-L409 HydrophobicContact CD1-CD1 3.92Å; A388-L409 HydrophobicContact CB-CD2 4.28Å; I389-L409 HydrophobicContact CG1-CD2 4.31Å; I389-L409 HydrophobicContact CG1-CG 4Å; M392-L409 HydrophobicContact CB-CD2 4.24Å; M392-L409 HydrophobicContact CG-CD2 4.23Å; I405-L409 VanDerWaalsContact O-CB 3.29Å; I405-L409 WeakPolarHBondContact O-CB 3.46Å; I405-L409 PolarHBondContact O-N 3.47Å; F406-L409 PolarHBondContact O-N 3.06Å; L409-T412 PolarHBondContact O-OG1 3.32Å; L409-G413 WeakPolarHBondContact O-CA 3.46Å; L409-G413 PolarHBondContact O-N 3.14Å; L409-I503 HydrophobicContact CD1-CG1 4.24Å; L409-I503 HydrophobicContact CD1-CG2 4.16Å; L409-A506 HydrophobicContact CB-CB 3.96Å; L409-A506 HydrophobicContact CD1-CB 4.3Å
410T98.6Very high97.3Very high0 Ų06.7 Ų6.70%05%0.048CC..Hα-helixtrans-69.7-41.9-177.9-159.90000110.8F406 H414 F437F406-T410 HydrophobicContact CD1-CG2 4.42Å; F406-T410 HydrophobicContact CE1-CG2 3.99Å; F406-T410 HydrophobicContact CE2-CG2 4.2Å; F406-T410 HydrophobicContact CZ-CG2 3.87Å; F406-T410 VanDerWaalsContact O-CB 3.31Å; F406-T410 WeakPolarHBondContact O-CB 3.49Å; F406-T410 VanDerWaalsContact O-CG2 3.3Å; F406-T410 WeakPolarHBondContact O-CG2 3.29Å; F406-T410 PolarHBondContact O-N 2.99Å; T410-H414 WeakPolarHBondContact O-CB 3.42Å; T410-H414 PolarHBondContact O-N 2.97Å; T410-H414 PolarHBondContact O-ND1 3.39Å; T410-H414 PolarHBondContact OG1-CE1 3.05Å; T410-H414 PolarHBondContact OG1-ND1 3.39Å; T410-H414 VanDerWaalsContact OG1-ND1 3.17Å; T410-F437 HydrophobicContact CG2-CE1 4.18Å
411T98.4Very high97.3Very high10 Ų106.3 Ų6.36%0.0614%0.044CC..Hα-helixtrans-66.7-45.2-177.9-51.10000110.8L407 Y415 M434 T438 L464 L467L407-T411 VanDerWaalsContact O-CB 3.28Å; L407-T411 WeakPolarHBondContact O-CB 3.39Å; L407-T411 PolarHBondContact O-N 3.01Å; L407-T411 VanDerWaalsContact O-N 3.11Å; L407-T411 PolarHBondContact O-OG1 3.43Å; T411-Y415 WeakPolarHBondContact O-CB 3.46Å; T411-Y415 PolarHBondContact O-N 3.32Å; T411-M434 HydrophobicContact CG2-CE 4.02Å; T411-M434 VanDerWaalsContact O-CE 3.24Å; T411-M434 WeakPolarHBondContact O-CE 3.37Å; T411-T438 HydrophobicContact CG2-CG2 3.92Å; T411-L464 HydrophobicContact CG2-CD2 4.1Å; T411-L467 HydrophobicContact CG2-CD1 3.69Å
412T98.4Very high97.1Very high0 Ų011.1 Ų11.10%05%0.054CC..Hα-helixtrans-71.3-45.6179.653.40000112.4I408 L409 H414 Y415 S416 Y463 L464 C499I408-T412 WeakPolarHBondContact O-CB 3.21Å; I408-T412 VanDerWaalsContact O-CG2 3.3Å; I408-T412 WeakPolarHBondContact O-CG2 3.39Å; I408-T412 PolarHBondContact O-N 3.35Å; I408-T412 VanDerWaalsContact O-N 3.1Å; I408-T412 PolarHBondContact O-OG1 3.48Å; L409-T412 PolarHBondContact O-OG1 3.32Å; T412-H414 VanDerWaalsContact C-N 3.34Å; T412-H414 PolarHBondContact O-N 3.38Å; T412-Y415 PolarHBondContact O-N 3.11Å; T412-S416 PolarHBondContact O-N 3.22Å; T412-S416 PolarHBondContact O-OG 3.14Å; T412-Y463 HydrophobicContact CG2-CE1 3.5Å; T412-Y463 VanDerWaalsContact CG2-CE1 3.5Å; T412-Y463 WeakPolarHBondContact CG2-OH 3.35Å; T412-L464 HydrophobicContact CG2-CD2 4.28Å; T412-C499 PolarHBondContact O-SG 2.76Å
413G98.4Very high96.9Very high0 Ų012.2 Ų12.20%06%0.061CC..Hα-helixtrans-68.9-30.3179.100000113.3L409 S416 L417L409-G413 WeakPolarHBondContact O-CA 3.46Å; L409-G413 PolarHBondContact O-N 3.14Å; G413-S416 VanDerWaalsContact C-OG 3.32Å; G413-S416 WeakPolarHBondContact CA-OG 3.39Å; G413-S416 PolarHBondContact O-OG 3.43Å; G413-L417 WeakPolarHBondContact O-CG 3.14Å
414H98.6Very high96.6Very high0 Ų016 Ų160%09%0.092CC..Hα-helixtrans-74.8-42.3171.3-75.6162.7000112N152 F153 G154 T410 T412 S416 L417 M434 F437N152-H414 PolarHBondContact OD1-NE2 3.13Å; F153-H414 HydrophobicContact CD1-CB 3.53Å; F153-H414 AromaticContact CD1-CD2 3.98Å; F153-H414 AromaticContact CD1-CG 3.63Å; F153-H414 HydrophobicContact CE1-CB 3.94Å; G154-H414 PolarHBondContact N-CD2 2.81Å; G154-H414 PolarHBondContact N-NE2 3.16Å; G154-H414 VanDerWaalsContact N-NE2 3.17Å; T410-H414 WeakPolarHBondContact O-CB 3.42Å; T410-H414 PolarHBondContact O-N 2.97Å; T410-H414 PolarHBondContact O-ND1 3.39Å; T410-H414 PolarHBondContact OG1-CE1 3.05Å; T410-H414 PolarHBondContact OG1-ND1 3.39Å; T410-H414 VanDerWaalsContact OG1-ND1 3.17Å; T412-H414 VanDerWaalsContact C-N 3.34Å; T412-H414 PolarHBondContact O-N 3.38Å; H414-S416 VanDerWaalsContact C-N 3.26Å; H414-S416 PolarHBondContact O-N 3.48Å; H414-L417 WeakPolarHBondContact O-CB 3.49Å; H414-L417 PolarHBondContact O-N 3.23Å; H414-M434 HydrophobicContact CB-CE 3.7Å; H414-M434 HydrophobicContact CB-SD 3.59Å; H414-M434 VanDerWaalsContact CB-SD 3.59Å; H414-F437 AromaticContact CE1-CD1 3.81Å; H414-F437 AromaticContact CE1-CE1 3.33Å; H414-F437 WeakPolarHBondContact CE1-CE1 3.42Å; H414-F437 AromaticContact CE1-CZ 3.8Å; H414-F437 AromaticContact ND1-CD1 3.62Å; H414-F437 AromaticContact ND1-CE1 3.46Å; H414-F437 WeakPolarHBondContact ND1-CE1 3.39Å
415Y98.3Very high96.4Very high9 Ų920.1 Ų20.14%0.03512%0.119CC..Hα-helixtrans-59.7-37.9175.9-177.5-108.3000112.1T411 T412 L417 F418 L467 L470 E471 T495 C499T411-Y415 WeakPolarHBondContact O-CB 3.46Å; T411-Y415 PolarHBondContact O-N 3.32Å; T412-Y415 PolarHBondContact O-N 3.11Å; Y415-L417 PolarHBondContact O-N 3.18Å; Y415-F418 HydrophobicContact CD2-CD1 4.03Å; Y415-F418 HydrophobicContact CD2-CD2 4.08Å; Y415-F418 HydrophobicContact CD2-CE1 4.12Å; Y415-F418 HydrophobicContact CD2-CE2 4.16Å; Y415-F418 HydrophobicContact CD2-CG 4.03Å; Y415-F418 HydrophobicContact CD2-CZ 4.19Å; Y415-F418 AromaticContact CE2-CD1 3.84Å; Y415-F418 HydrophobicContact CE2-CD1 3.84Å; Y415-F418 HydrophobicContact CE2-CE1 4.11Å; Y415-F418 HydrophobicContact CE2-CG 4.14Å; Y415-F418 VanDerWaalsContact O-CB 3.26Å; Y415-F418 WeakPolarHBondContact O-CB 3.43Å; Y415-F418 WeakPolarHBondContact O-CD2 3.44Å; Y415-F418 PolarHBondContact O-N 3.3Å; Y415-L467 HydrophobicContact CD1-CD2 3.52Å; Y415-L467 HydrophobicContact CE1-CD2 4.08Å; Y415-L467 HydrophobicContact CG-CD2 4Å; Y415-L470 HydrophobicContact CE1-CD2 3.7Å; Y415-L470 HydrophobicContact CE1-CG 4.15Å; Y415-E471 HydrophobicContact CE2-CB 3.89Å; Y415-E471 HydrophobicContact CE2-CG 4.29Å; Y415-E471 WeakPolarHBondContact CE2-OE2 3.09Å; Y415-E471 VanDerWaalsContact OH-CA 3.27Å; Y415-E471 WeakPolarHBondContact OH-CA 3.27Å; Y415-E471 PolarHBondContact OH-N 2.95Å; Y415-E471 PolarHBondContact OH-OE2 3.36Å; Y415-T495 HydrophobicContact CD1-CG2 4.17Å; Y415-T495 HydrophobicContact CE1-CG2 3.83Å; Y415-C499 VanDerWaalsContact CD1-SG 3.58Å
416S97.7Very high96.3Very high0 Ų020.8 Ų20.80%012%0.122CC..THydrogen-bonded Turntrans-65.4-7.3175.457.10000115.3Y280 P283 T412 G413 H414Y280-S416 WeakPolarHBondContact CE1-O 3.44Å; Y280-S416 PolarHBondContact OH-O 2.9Å; P283-S416 VanDerWaalsContact CG-CB 3.5Å; P283-S416 WeakPolarHBondContact CG-OG 3.43Å; T412-S416 PolarHBondContact O-N 3.22Å; T412-S416 PolarHBondContact O-OG 3.14Å; G413-S416 VanDerWaalsContact C-OG 3.32Å; G413-S416 WeakPolarHBondContact CA-OG 3.39Å; G413-S416 PolarHBondContact O-OG 3.43Å; H414-S416 VanDerWaalsContact C-N 3.26Å; H414-S416 PolarHBondContact O-N 3.48Å
417L97.6Very high96.1Very high0 Ų022.1 Ų22.10%013%0.129CC..THydrogen-bonded Turntrans-91.4-6.6173.9-57.1176.5000111.9I157 V158 E382 K383 I385 L386 G413 H414 Y415 L420I157-L417 HydrophobicContact CD1-CB 3.53Å; I157-L417 HydrophobicContact CD1-CD1 4.24Å; V158-L417 HydrophobicContact CG2-CD1 4.17Å; E382-L417 HydrophobicContact CB-CD2 4.33Å; E382-L417 HydrophobicContact CG-CD2 4.1Å; K383-L417 HydrophobicContact CB-CD2 4.39Å; I385-L417 HydrophobicContact CG2-CD2 4.36Å; L386-L417 HydrophobicContact CD2-CD1 4.35Å; G413-L417 WeakPolarHBondContact O-CG 3.14Å; H414-L417 WeakPolarHBondContact O-CB 3.49Å; H414-L417 PolarHBondContact O-N 3.23Å; Y415-L417 PolarHBondContact O-N 3.18Å; L417-L420 HydrophobicContact CB-CD1 4.04Å; L417-L420 HydrophobicContact CD2-CD1 3.85Å; L417-L420 HydrophobicContact CG-CD1 4.49Å; L417-L420 WeakPolarHBondContact O-CB 3.42Å; L417-L420 WeakPolarHBondContact O-CG 3.29Å; L417-L420 PolarHBondContact O-N 2.85Å; L417-L420 VanDerWaalsContact O-N 3.1Å
418F96.9Very high96Very high8 Ų826 Ų264%0.03515%0.154CC..G310 helixtrans-57-41.3-178.6-87.2-136.3000113.7F153 Y415 L420 L421 K430 I431 M434 E471F153-F418 HydrophobicContact CE1-CD2 4.28Å; F153-F418 AromaticContact CE1-CE2 3.88Å; F153-F418 HydrophobicContact CE1-CE2 3.88Å; F153-F418 HydrophobicContact CZ-CD2 4.07Å; F153-F418 AromaticContact CZ-CE2 3.55Å; F153-F418 HydrophobicContact CZ-CE2 3.55Å; F153-F418 HydrophobicContact CZ-CZ 4.41Å; Y415-F418 HydrophobicContact CD2-CD1 4.03Å; Y415-F418 HydrophobicContact CD2-CD2 4.08Å; Y415-F418 HydrophobicContact CD2-CE1 4.12Å; Y415-F418 HydrophobicContact CD2-CE2 4.16Å; Y415-F418 HydrophobicContact CD2-CG 4.03Å; Y415-F418 HydrophobicContact CD2-CZ 4.19Å; Y415-F418 AromaticContact CE2-CD1 3.84Å; Y415-F418 HydrophobicContact CE2-CD1 3.84Å; Y415-F418 HydrophobicContact CE2-CE1 4.11Å; Y415-F418 HydrophobicContact CE2-CG 4.14Å; Y415-F418 VanDerWaalsContact O-CB 3.26Å; Y415-F418 WeakPolarHBondContact O-CB 3.43Å; Y415-F418 WeakPolarHBondContact O-CD2 3.44Å; Y415-F418 PolarHBondContact O-N 3.3Å; F418-L420 PolarHBondContact O-N 3.43Å; F418-L420 VanDerWaalsContact O-N 3.16Å; F418-L421 PolarHBondContact O-N 2.92Å; F418-L421 VanDerWaalsContact O-N 3.07Å; F418-K430 HydrophobicContact CD1-CD 4.18Å; F418-K430 HydrophobicContact CD1-CG 4.4Å; F418-K430 HydrophobicContact CE1-CG 4.34Å; F418-K430 HydrophobicContact CG-CD 4.34Å; F418-K430 PolarHBondContact O-NZ 2.81Å; F418-K430 VanDerWaalsContact O-NZ 3.09Å; F418-I431 HydrophobicContact CE1-CG1 4.11Å; F418-M434 HydrophobicContact CE2-CB 3.8Å; F418-M434 HydrophobicContact CE2-CG 3.68Å; F418-M434 HydrophobicContact CE2-SD 4.31Å; F418-M434 HydrophobicContact CZ-CB 3.61Å; F418-M434 HydrophobicContact CZ-CG 3.64Å; F418-E471 VanDerWaalsContact CD1-OE1 3.28Å; F418-E471 WeakPolarHBondContact CD1-OE1 3.31Å; F418-E471 WeakPolarHBondContact CE1-OE1 3.47Å
419P95.1Very high95.8Very high26 Ų2628.5 Ų28.517%0.16917%0.167CC..G310 helixtrans-66.5-13179.1-27.139.7000115Y280 L421 L492 T495Y280-P419 HydrophobicContact CE1-CB 4.09Å; Y280-P419 HydrophobicContact CE1-CG 4.17Å; Y280-P419 HydrophobicContact CE2-CB 4.24Å; Y280-P419 HydrophobicContact CE2-CG 4.03Å; P419-L421 PolarHBondContact O-N 3.03Å; P419-L492 HydrophobicContact CB-CD2 3.48Å; P419-L492 VanDerWaalsContact CB-CD2 3.48Å; P419-L492 HydrophobicContact CG-CD2 3.93Å; P419-T495 HydrophobicContact CG-CG2 4.12Å
420L93.9Very high95.7Very high24 Ų2428.6 Ų28.613%0.12617%0.167CC..G310 helixtrans-65.5-27.6172.1-61.5176.6000111.9V158 E382 L417 F418V158-L420 HydrophobicContact CG2-CD1 4.35Å; E382-L420 HydrophobicContact CG-CD1 4.15Å; E382-L420 HydrophobicContact CG-CD2 3.99Å; E382-L420 HydrophobicContact CG-CG 4.24Å; L417-L420 HydrophobicContact CB-CD1 4.04Å; L417-L420 HydrophobicContact CD2-CD1 3.85Å; L417-L420 HydrophobicContact CG-CD1 4.49Å; L417-L420 WeakPolarHBondContact O-CB 3.42Å; L417-L420 WeakPolarHBondContact O-CG 3.29Å; L417-L420 PolarHBondContact O-N 2.85Å; L417-L420 VanDerWaalsContact O-N 3.1Å; F418-L420 PolarHBondContact O-N 3.43Å; F418-L420 VanDerWaalsContact O-N 3.16Å
421L94Very high95.7Very high1 Ų130.7 Ų30.71%0.00518%0.178CC..  trans-112.279179.3-58.6-173000109.5Y32 I157 I161 H162 F418 P419 T423 K430Y32-L421 HydrophobicContact CD1-CD2 3.89Å; Y32-L421 HydrophobicContact CE1-CD2 4.15Å; I157-L421 HydrophobicContact CB-CD1 3.89Å; I157-L421 HydrophobicContact CG2-CD1 3.98Å; I161-L421 HydrophobicContact CB-CD1 4.14Å; I161-L421 HydrophobicContact CB-CD2 4Å; I161-L421 HydrophobicContact CD1-CD1 3.88Å; I161-L421 HydrophobicContact CG2-CD1 3.91Å; I161-L421 HydrophobicContact CG2-CD2 3.44Å; I161-L421 VanDerWaalsContact CG2-CD2 3.44Å; I161-L421 HydrophobicContact CG2-CG 4.32Å; H162-L421 HydrophobicContact CB-CD2 4.28Å; F418-L421 PolarHBondContact O-N 2.92Å; F418-L421 VanDerWaalsContact O-N 3.07Å; P419-L421 PolarHBondContact O-N 3.03Å; L421-T423 VanDerWaalsContact C-N 3.34Å; L421-K430 HydrophobicContact CB-CD 3.9Å; L421-K430 HydrophobicContact CD1-CB 4.07Å; L421-K430 PolarHBondContact O-NZ 3.35Å
422F89.9Confident95.6Very high141 Ų14135 Ų3562%0.61820%0.2SC*.  trans-86.1-3.9-175.863.1-92.1000113.9Y32Y32-F422 HydrophobicContact CE2-CE1 4.32Å; Y32-F422 HydrophobicContact CE2-CZ 4.18Å; Y32-F422 AromaticContact CZ-CE1 3.86Å; Y32-F422 WeakPolarHBondContact OH-CE1 3.24Å
423T91.7Very high95.6Very high29 Ų2936 Ų3618%0.17821%0.206CC..  trans-80.7138.4-175.947.20000111.7Y32 L421 E426 L427Y32-T423 HydrophobicContact CD2-CG2 3.65Å; Y32-T423 HydrophobicContact CE2-CG2 4.09Å; Y32-T423 HydrophobicContact CG-CG2 4.01Å; L421-T423 VanDerWaalsContact C-N 3.34Å; T423-E426 WeakPolarHBondContact CB-OE2 3.33Å; T423-E426 PolarHBondContact O-N 3.3Å; T423-E426 VanDerWaalsContact OG1-CD 3.29Å; T423-E426 PolarHBondContact OG1-OE2 2.93Å; T423-L427 PolarHBondContact O-N 3.11Å
424A91.4Very high95.6Very high79 Ų7936.7 Ų36.765%0.65321%0.209SC*.THydrogen-bonded Turntrans-61.4-39-176.400000114.6E426 L427 P428A424-E426 VanDerWaalsContact C-N 3.3Å; A424-E426 PolarHBondContact O-N 3.21Å; A424-L427 WeakPolarHBondContact O-CB 3.41Å; A424-L427 PolarHBondContact O-N 3.5Å; A424-P428 WeakPolarHBondContact O-CD 3.44Å
425P93.2Very high95.5Very high91 Ų9141.1 Ų41.159%0.59123%0.232SC*.THydrogen-bonded Turntrans-63.8-32.9177.2-2335.1000113.7P428P425-P428 WeakPolarHBondContact O-CD 3.4Å; P425-P428 WeakPolarHBondContact O-CG 3.33Å
426E95.3Very high95.5Very high16 Ų1645.6 Ų45.68%0.07526%0.256CS..Hα-helixtrans-83.1-15.5-178.9-73.468.8-16000113.2Y32 I161 T423 A424 I429 K430Y32-E426 VanDerWaalsContact CB-CD 3.47Å; Y32-E426 WeakPolarHBondContact CB-OE1 3.19Å; Y32-E426 PolarHBondContact N-OE1 3.25Å; I161-E426 HydrophobicContact CG2-CG 4Å; T423-E426 WeakPolarHBondContact CB-OE2 3.33Å; T423-E426 PolarHBondContact O-N 3.3Å; T423-E426 VanDerWaalsContact OG1-CD 3.29Å; T423-E426 PolarHBondContact OG1-OE2 2.93Å; A424-E426 VanDerWaalsContact C-N 3.3Å; A424-E426 PolarHBondContact O-N 3.21Å; E426-I429 WeakPolarHBondContact O-CB 3.44Å; E426-I429 PolarHBondContact O-N 3.38Å; E426-I429 VanDerWaalsContact O-N 3.13Å; E426-K430 PolarHBondContact O-N 3.03Å
427L94.6Very high95.6Very high29 Ų2946.1 Ų46.115%0.15226%0.258CS..Hα-helixtrans-53.6-54176.9-179.461.7000113.4T423 A424 I429 K430 I431 E475 F476T423-L427 PolarHBondContact O-N 3.11Å; A424-L427 WeakPolarHBondContact O-CB 3.41Å; A424-L427 PolarHBondContact O-N 3.5Å; L427-I429 VanDerWaalsContact C-N 3.25Å; L427-I429 PolarHBondContact O-N 3.01Å; L427-K430 WeakPolarHBondContact O-CG 3.17Å; L427-K430 PolarHBondContact O-N 2.66Å; L427-I431 HydrophobicContact CD1-CD1 3.66Å; L427-I431 HydrophobicContact CD1-CG1 4.23Å; L427-I431 HydrophobicContact CG-CD1 3.97Å; L427-I431 WeakPolarHBondContact O-CB 3.37Å; L427-I431 VanDerWaalsContact O-CG1 3.3Å; L427-I431 WeakPolarHBondContact O-CG1 3.46Å; L427-I431 PolarHBondContact O-N 3.36Å; L427-I431 VanDerWaalsContact O-N 3.11Å; L427-E475 HydrophobicContact CD1-CG 4.34Å; L427-F476 HydrophobicContact CD2-CE1 4.18Å; L427-F476 HydrophobicContact CD2-CZ 3.87Å; L427-F476 HydrophobicContact CG-CZ 4.46Å
428P96.1Very high95.6Very high82 Ų8247 Ų4753%0.53226%0.264SS..Hα-helixtrans-63-33.1176.424.5-34.8000112.5A424 P425 L432A424-P428 WeakPolarHBondContact O-CD 3.44Å; P425-P428 WeakPolarHBondContact O-CD 3.4Å; P425-P428 WeakPolarHBondContact O-CG 3.33Å; P428-L432 VanDerWaalsContact O-CB 3.22Å; P428-L432 WeakPolarHBondContact O-CB 3.36Å; P428-L432 PolarHBondContact O-N 3.45Å
429I96.1Very high95.7Very high53 Ų5351.8 Ų51.827%0.27229%0.289SS..Hα-helixtrans-67.4-51-180-57.3176.7000110.3L28 T31 I161 E426 L427 I431 L432 L433L28-I429 HydrophobicContact CD2-CG2 4.05Å; T31-I429 HydrophobicContact CG2-CD1 4.21Å; I161-I429 HydrophobicContact CD1-CG2 4.26Å; E426-I429 WeakPolarHBondContact O-CB 3.44Å; E426-I429 PolarHBondContact O-N 3.38Å; E426-I429 VanDerWaalsContact O-N 3.13Å; L427-I429 VanDerWaalsContact C-N 3.25Å; L427-I429 PolarHBondContact O-N 3.01Å; I429-I431 PolarHBondContact O-N 2.88Å; I429-L432 PolarHBondContact O-N 3.31Å; I429-L433 HydrophobicContact CG2-CD1 3.86Å; I429-L433 HydrophobicContact CG2-CG 4.34Å; I429-L433 WeakPolarHBondContact O-CB 3.38Å; I429-L433 VanDerWaalsContact O-CG 3.29Å; I429-L433 WeakPolarHBondContact O-CG 3.48Å; I429-L433 PolarHBondContact O-N 2.91Å
430K95.9Very high95.8Very high2 Ų253.3 Ų53.31%0.00929%0.291CS..Hα-helixtrans-63.8-40.9-179.575.5-176.3-176.6-178.90111.4F153 F418 L421 E426 L427 M434 E475F153-K430 HydrophobicContact CE2-CB 4.49Å; F153-K430 VanDerWaalsContact CE2-O 3.23Å; F153-K430 WeakPolarHBondContact CE2-O 3.49Å; F418-K430 HydrophobicContact CD1-CD 4.18Å; F418-K430 HydrophobicContact CD1-CG 4.4Å; F418-K430 HydrophobicContact CE1-CG 4.34Å; F418-K430 HydrophobicContact CG-CD 4.34Å; F418-K430 PolarHBondContact O-NZ 2.81Å; F418-K430 VanDerWaalsContact O-NZ 3.09Å; L421-K430 HydrophobicContact CB-CD 3.9Å; L421-K430 HydrophobicContact CD1-CB 4.07Å; L421-K430 PolarHBondContact O-NZ 3.35Å; E426-K430 PolarHBondContact O-N 3.03Å; L427-K430 WeakPolarHBondContact O-CG 3.17Å; L427-K430 PolarHBondContact O-N 2.66Å; K430-M434 WeakPolarHBondContact O-CB 3.3Å; K430-M434 PolarHBondContact O-N 3.44Å; K430-E475 IonicContact NZ-OE1 3.63Å; K430-E475 PolarHBondContact NZ-OE1 3.08Å
431I97.3Very high96Very high45 Ų4552.2 Ų52.223%0.23129%0.286CS..Hα-helixtrans-62.3-50.2176-69.5170.8000110.4F418 L427 I429 M434 L435 F476F418-I431 HydrophobicContact CE1-CG1 4.11Å; L427-I431 HydrophobicContact CD1-CD1 3.66Å; L427-I431 HydrophobicContact CD1-CG1 4.23Å; L427-I431 HydrophobicContact CG-CD1 3.97Å; L427-I431 WeakPolarHBondContact O-CB 3.37Å; L427-I431 VanDerWaalsContact O-CG1 3.3Å; L427-I431 WeakPolarHBondContact O-CG1 3.46Å; L427-I431 PolarHBondContact O-N 3.36Å; L427-I431 VanDerWaalsContact O-N 3.11Å; I429-I431 PolarHBondContact O-N 2.88Å; I431-M434 PolarHBondContact O-N 3.43Å; I431-L435 HydrophobicContact CG2-CD1 3.81Å; I431-L435 HydrophobicContact CG2-CG 4.32Å; I431-L435 WeakPolarHBondContact O-CB 3.32Å; I431-L435 VanDerWaalsContact O-CG 3.31Å; I431-L435 WeakPolarHBondContact O-CG 3.29Å; I431-L435 PolarHBondContact O-N 3.36Å; I431-F476 HydrophobicContact CD1-CE2 4.32Å; I431-F476 HydrophobicContact CD1-CZ 4.23Å
432L97.5Very high96.2Very high101 Ų10154 Ų5453%0.52930%0.295SS..Hα-helixtrans-61-49.1-178.6178.562.2000111.7P428 I429 M434 L435 L436P428-L432 VanDerWaalsContact O-CB 3.22Å; P428-L432 WeakPolarHBondContact O-CB 3.36Å; P428-L432 PolarHBondContact O-N 3.45Å; I429-L432 PolarHBondContact O-N 3.31Å; L432-M434 VanDerWaalsContact C-N 3.32Å; L432-M434 PolarHBondContact O-N 2.96Å; L432-L435 PolarHBondContact O-N 3.38Å; L432-L436 HydrophobicContact CD1-CD1 4.02Å; L432-L436 HydrophobicContact CD1-CG 4.08Å; L432-L436 HydrophobicContact CG-CD1 3.96Å; L432-L436 HydrophobicContact CG-CG 4.42Å; L432-L436 WeakPolarHBondContact O-CB 3.48Å; L432-L436 VanDerWaalsContact O-CG 3.26Å; L432-L436 WeakPolarHBondContact O-CG 3.4Å; L432-L436 PolarHBondContact O-N 2.66Å
433L97.8Very high96.5Very high21 Ų2149.8 Ų49.811%0.1128%0.283CS..Hα-helixtrans-61.9-40.6179.6-67.6176.1000111.7L24 F153 I429 F437L24-L433 HydrophobicContact CD2-CD2 3.96Å; F153-L433 HydrophobicContact CD2-CB 3.66Å; F153-L433 HydrophobicContact CE2-CB 3.95Å; I429-L433 HydrophobicContact CG2-CD1 3.86Å; I429-L433 HydrophobicContact CG2-CG 4.34Å; I429-L433 WeakPolarHBondContact O-CB 3.38Å; I429-L433 VanDerWaalsContact O-CG 3.29Å; I429-L433 WeakPolarHBondContact O-CG 3.48Å; I429-L433 PolarHBondContact O-N 2.91Å; L433-F437 WeakPolarHBondContact O-CB 3.22Å; L433-F437 PolarHBondContact O-N 3.49Å
434M97.8Very high96.7Very high13 Ų1348.9 Ų48.96%0.06428%0.278CS..Hα-helixtrans-64.5-46.3177.5179.558.9176.700111.8F153 T411 H414 F418 K430 I431 L432 F437 T438F153-M434 HydrophobicContact CD1-SD 3.78Å; F153-M434 HydrophobicContact CD2-CB 3.94Å; F153-M434 VanDerWaalsContact CD2-N 3.33Å; F153-M434 HydrophobicContact CE1-CB 4.36Å; F153-M434 HydrophobicContact CE1-SD 3.96Å; F153-M434 HydrophobicContact CE2-CB 3.71Å; F153-M434 HydrophobicContact CG-CB 4.36Å; F153-M434 HydrophobicContact CG-SD 4.07Å; F153-M434 HydrophobicContact CZ-CB 3.91Å; F153-M434 HydrophobicContact CZ-SD 4.46Å; T411-M434 HydrophobicContact CG2-CE 4.02Å; T411-M434 VanDerWaalsContact O-CE 3.24Å; T411-M434 WeakPolarHBondContact O-CE 3.37Å; H414-M434 HydrophobicContact CB-CE 3.7Å; H414-M434 HydrophobicContact CB-SD 3.59Å; H414-M434 VanDerWaalsContact CB-SD 3.59Å; F418-M434 HydrophobicContact CE2-CB 3.8Å; F418-M434 HydrophobicContact CE2-CG 3.68Å; F418-M434 HydrophobicContact CE2-SD 4.31Å; F418-M434 HydrophobicContact CZ-CB 3.61Å; F418-M434 HydrophobicContact CZ-CG 3.64Å; K430-M434 WeakPolarHBondContact O-CB 3.3Å; K430-M434 PolarHBondContact O-N 3.44Å; I431-M434 PolarHBondContact O-N 3.43Å; L432-M434 VanDerWaalsContact C-N 3.32Å; L432-M434 PolarHBondContact O-N 2.96Å; M434-F437 PolarHBondContact O-N 3.22Å; M434-T438 WeakPolarHBondContact CE-OG1 3.24Å; M434-T438 VanDerWaalsContact O-CB 3.24Å; M434-T438 WeakPolarHBondContact O-CB 3.26Å; M434-T438 PolarHBondContact O-N 3.34Å; M434-T438 PolarHBondContact O-OG1 3.4Å
435L98Very high97Very high93 Ų9345.1 Ų45.149%0.48725%0.247SC..Hα-helixtrans-63.6-46.8178.7-71.6176.4000111.1I431 L432 F437 T438 I439I431-L435 HydrophobicContact CG2-CD1 3.81Å; I431-L435 HydrophobicContact CG2-CG 4.32Å; I431-L435 WeakPolarHBondContact O-CB 3.32Å; I431-L435 VanDerWaalsContact O-CG 3.31Å; I431-L435 WeakPolarHBondContact O-CG 3.29Å; I431-L435 PolarHBondContact O-N 3.36Å; L432-L435 PolarHBondContact O-N 3.38Å; L435-F437 VanDerWaalsContact C-N 3.35Å; L435-F437 PolarHBondContact O-N 2.75Å; L435-T438 PolarHBondContact O-N 3.36Å; L435-I439 HydrophobicContact CB-CD1 4.32Å; L435-I439 VanDerWaalsContact O-CB 3.24Å; L435-I439 WeakPolarHBondContact O-CB 3.33Å; L435-I439 WeakPolarHBondContact O-CD1 3.48Å; L435-I439 WeakPolarHBondContact O-CG1 3.48Å; L435-I439 PolarHBondContact O-N 3.45Å
436L98.2Very high97.1Very high104 Ų10445.8 Ų45.855%0.54524%0.241SC..Hα-helixtrans-57.2-48.6176.9-72.7174000111.3L432 Y440L432-L436 HydrophobicContact CD1-CD1 4.02Å; L432-L436 HydrophobicContact CD1-CG 4.08Å; L432-L436 HydrophobicContact CG-CD1 3.96Å; L432-L436 HydrophobicContact CG-CG 4.42Å; L432-L436 WeakPolarHBondContact O-CB 3.48Å; L432-L436 VanDerWaalsContact O-CG 3.26Å; L432-L436 WeakPolarHBondContact O-CG 3.4Å; L432-L436 PolarHBondContact O-N 2.66Å; L436-Y440 WeakPolarHBondContact O-CB 3.37Å; L436-Y440 PolarHBondContact O-N 2.87Å
437F98.6Very high97Very high10 Ų1047.6 Ų47.64%0.04425%0.253CS..Hα-helixtrans-63.6-46.3178.9-178.8-95000112.3L148 W151 N152 F153 F406 T410 H414 L433 M434 L435 S441L148-F437 HydrophobicContact CD2-CE2 4.31Å; L148-F437 HydrophobicContact CD2-CZ 4.2Å; W151-F437 WeakPolarHBondContact O-CD2 3.36Å; N152-F437 HydrophobicContact CB-CE2 4.47Å; F153-F437 HydrophobicContact CB-CB 3.88Å; F153-F437 HydrophobicContact CB-CD1 4.16Å; F153-F437 HydrophobicContact CB-CD2 4.5Å; F153-F437 HydrophobicContact CB-CG 3.91Å; F406-F437 HydrophobicContact CZ-CZ 4.46Å; T410-F437 HydrophobicContact CG2-CE1 4.18Å; H414-F437 AromaticContact CE1-CD1 3.81Å; H414-F437 AromaticContact CE1-CE1 3.33Å; H414-F437 WeakPolarHBondContact CE1-CE1 3.42Å; H414-F437 AromaticContact CE1-CZ 3.8Å; H414-F437 AromaticContact ND1-CD1 3.62Å; H414-F437 AromaticContact ND1-CE1 3.46Å; H414-F437 WeakPolarHBondContact ND1-CE1 3.39Å; L433-F437 WeakPolarHBondContact O-CB 3.22Å; L433-F437 PolarHBondContact O-N 3.49Å; M434-F437 PolarHBondContact O-N 3.22Å; L435-F437 VanDerWaalsContact C-N 3.35Å; L435-F437 PolarHBondContact O-N 2.75Å; F437-S441 WeakPolarHBondContact CE1-OG 3.4Å; F437-S441 VanDerWaalsContact O-CB 3.26Å; F437-S441 WeakPolarHBondContact O-CB 3.43Å; F437-S441 PolarHBondContact O-N 3.33Å; F437-S441 PolarHBondContact O-OG 3.1Å
438T98.3Very high96.9Very high19 Ų1947.5 Ų47.512%0.11725%0.252CS..Hα-helixtrans-69.2-46.2-175.5-58.30000111.5T411 M434 L435 Y440 S441 I442T411-T438 HydrophobicContact CG2-CG2 3.92Å; M434-T438 WeakPolarHBondContact CE-OG1 3.24Å; M434-T438 VanDerWaalsContact O-CB 3.24Å; M434-T438 WeakPolarHBondContact O-CB 3.26Å; M434-T438 PolarHBondContact O-N 3.34Å; M434-T438 PolarHBondContact O-OG1 3.4Å; L435-T438 PolarHBondContact O-N 3.36Å; T438-Y440 PolarHBondContact O-N 3Å; T438-S441 PolarHBondContact O-N 3.49Å; T438-I442 HydrophobicContact CG2-CD1 3.86Å; T438-I442 HydrophobicContact CG2-CG1 4.5Å; T438-I442 WeakPolarHBondContact O-CB 3.21Å; T438-I442 WeakPolarHBondContact O-CG1 3.46Å; T438-I442 PolarHBondContact O-N 2.99Å
439I98.1Very high96.8Very high109 Ų10943.9 Ų43.956%0.55923%0.228SC*.Hα-helixtrans-61.2-46.6177-67.2167.3000109.7L435 I442 S443L435-I439 HydrophobicContact CB-CD1 4.32Å; L435-I439 VanDerWaalsContact O-CB 3.24Å; L435-I439 WeakPolarHBondContact O-CB 3.33Å; L435-I439 WeakPolarHBondContact O-CD1 3.48Å; L435-I439 WeakPolarHBondContact O-CG1 3.48Å; L435-I439 PolarHBondContact O-N 3.45Å; I439-I442 PolarHBondContact O-N 3.03Å; I439-S443 VanDerWaalsContact O-CB 3.28Å; I439-S443 WeakPolarHBondContact O-CB 3.17Å; I439-S443 PolarHBondContact O-N 3.02Å; I439-S443 PolarHBondContact O-OG 3.28Å
440Y98.3Very high96.6Very high57 Ų5748.4 Ų48.422%0.22424%0.242CC..Hα-helixtrans-60.7-47.1176.2178.6-92.1000111.7F143 V147 L148 L436 T438 I442 S443 S444F143-Y440 WeakPolarHBondContact CD1-OH 3Å; F143-Y440 WeakPolarHBondContact CE1-OH 3.3Å; V147-Y440 HydrophobicContact CB-CD1 4.27Å; V147-Y440 HydrophobicContact CB-CE1 3.48Å; V147-Y440 VanDerWaalsContact CB-CE1 3.48Å; V147-Y440 HydrophobicContact CG1-CD1 3.57Å; V147-Y440 HydrophobicContact CG1-CE1 3.27Å; V147-Y440 HydrophobicContact CG1-CE2 4.36Å; V147-Y440 HydrophobicContact CG1-CG 4.25Å; V147-Y440 HydrophobicContact CG2-CE1 4.18Å; L148-Y440 HydrophobicContact CD2-CD1 4.48Å; L436-Y440 WeakPolarHBondContact O-CB 3.37Å; L436-Y440 PolarHBondContact O-N 2.87Å; T438-Y440 PolarHBondContact O-N 3Å; Y440-I442 PolarHBondContact O-N 3.01Å; Y440-S443 WeakPolarHBondContact CA-OG 3.46Å; Y440-S443 PolarHBondContact O-N 3.38Å; Y440-S443 PolarHBondContact O-OG 3.21Å; Y440-S443 VanDerWaalsContact O-OG 3.06Å; Y440-S444 WeakPolarHBondContact O-CB 3.38Å; Y440-S444 PolarHBondContact O-N 3.24Å; Y440-S444 PolarHBondContact O-OG 3.02Å
441S98.4Very high96.3Very high1 Ų157.7 Ų57.71%0.00728%0.282CS..Hα-helixtrans-59.4-47.4-179.5-61.60000111.8L148 F437 T438 S444 L445L148-S441 WeakPolarHBondContact CD2-OG 3.37Å; F437-S441 WeakPolarHBondContact CE1-OG 3.4Å; F437-S441 VanDerWaalsContact O-CB 3.26Å; F437-S441 WeakPolarHBondContact O-CB 3.43Å; F437-S441 PolarHBondContact O-N 3.33Å; F437-S441 PolarHBondContact O-OG 3.1Å; T438-S441 PolarHBondContact O-N 3.49Å; S441-S444 PolarHBondContact O-OG 2.96Å; S441-L445 WeakPolarHBondContact O-CB 3.44Å; S441-L445 WeakPolarHBondContact O-CG 3.5Å; S441-L445 PolarHBondContact O-N 3.01Å
442I97.9Very high96Very high38 Ų3860.7 Ų60.720%0.19530%0.295CS..Hα-helixtrans-65.9-50179.6-68.6172.3000110.8L407 T438 I439 Y440 K446 F456L407-I442 HydrophobicContact CD1-CG1 4.42Å; L407-I442 HydrophobicContact CD2-CG1 3.84Å; T438-I442 HydrophobicContact CG2-CD1 3.86Å; T438-I442 HydrophobicContact CG2-CG1 4.5Å; T438-I442 WeakPolarHBondContact O-CB 3.21Å; T438-I442 WeakPolarHBondContact O-CG1 3.46Å; T438-I442 PolarHBondContact O-N 2.99Å; I439-I442 PolarHBondContact O-N 3.03Å; Y440-I442 PolarHBondContact O-N 3.01Å; I442-K446 HydrophobicContact CG2-CD 3.84Å; I442-K446 HydrophobicContact CG2-CG 4.33Å; I442-K446 VanDerWaalsContact O-CB 3.25Å; I442-K446 WeakPolarHBondContact O-CB 3.23Å; I442-K446 VanDerWaalsContact O-CG 3.24Å; I442-K446 WeakPolarHBondContact O-CG 3.31Å; I442-K446 PolarHBondContact O-N 3.34Å; I442-F456 HydrophobicContact CD1-CE2 4.46Å; I442-F456 HydrophobicContact CG1-CE2 4.28Å; I442-F456 HydrophobicContact CG1-CZ 4.31Å; I442-F456 HydrophobicContact CG2-CE2 4.16Å
443S96.7Very high95.7Very high53 Ų5364.6 Ų64.637%0.37131%0.308SS..Hα-helixtrans-64.1-48.4-17755.50000112I439 Y440 L445 K446 T447I439-S443 VanDerWaalsContact O-CB 3.28Å; I439-S443 WeakPolarHBondContact O-CB 3.17Å; I439-S443 PolarHBondContact O-N 3.02Å; I439-S443 PolarHBondContact O-OG 3.28Å; Y440-S443 WeakPolarHBondContact CA-OG 3.46Å; Y440-S443 PolarHBondContact O-N 3.38Å; Y440-S443 PolarHBondContact O-OG 3.21Å; Y440-S443 VanDerWaalsContact O-OG 3.06Å; S443-L445 PolarHBondContact O-N 2.74Å; S443-K446 PolarHBondContact O-N 2.99Å; S443-T447 WeakPolarHBondContact O-CB 3.45Å; S443-T447 PolarHBondContact O-N 3.42Å; S443-T447 PolarHBondContact O-OG1 2.93Å
444S95.9Very high95.4Very high10 Ų1069.1 Ų69.17%0.0734%0.338CS..Hα-helixtrans-62.8-43.6-179.761.20000112.6Y440 S441 T447 L448Y440-S444 WeakPolarHBondContact O-CB 3.38Å; Y440-S444 PolarHBondContact O-N 3.24Å; Y440-S444 PolarHBondContact O-OG 3.02Å; S441-S444 PolarHBondContact O-OG 2.96Å; S444-T447 PolarHBondContact O-N 3.34Å; S444-L448 WeakPolarHBondContact O-CB 3.26Å; S444-L448 PolarHBondContact O-N 2.92Å
445L96.3Very high95.3Very high0 Ų069.1 Ų69.10%034%0.339CS..Hα-helixtrans-72.2-36.9177.9-68173.9000112.1I144 L148 V397 A403 F406 L407 S441 S443 T447 L448 F449 L455I144-L445 HydrophobicContact CG2-CD2 4.15Å; L148-L445 HydrophobicContact CD1-CD1 4.44Å; V397-L445 HydrophobicContact CG1-CD2 4.29Å; A403-L445 HydrophobicContact CB-CD1 4.27Å; A403-L445 HydrophobicContact CB-CD2 4.39Å; F406-L445 HydrophobicContact CD1-CD1 3.65Å; F406-L445 HydrophobicContact CE1-CD1 3.98Å; L407-L445 HydrophobicContact CD1-CB 4.28Å; L407-L445 HydrophobicContact CD1-CD1 4.08Å; L407-L445 HydrophobicContact CD2-CD1 3.84Å; L407-L445 HydrophobicContact CG-CD1 3.82Å; S441-L445 WeakPolarHBondContact O-CB 3.44Å; S441-L445 WeakPolarHBondContact O-CG 3.5Å; S441-L445 PolarHBondContact O-N 3.01Å; S443-L445 PolarHBondContact O-N 2.74Å; L445-T447 VanDerWaalsContact C-N 3.32Å; L445-T447 PolarHBondContact O-N 2.74Å; L445-L448 HydrophobicContact CD2-CD2 4.22Å; L445-L448 PolarHBondContact O-N 3.35Å; L445-F449 HydrophobicContact CD2-CE2 4.19Å; L445-F449 VanDerWaalsContact O-CD2 3.28Å; L445-F449 WeakPolarHBondContact O-CD2 3.22Å; L445-F449 PolarHBondContact O-N 3.5Å; L445-L455 HydrophobicContact CB-CD1 3.97Å
446K95.4Very high95.1Very high106 Ų10666 Ų6646%0.46132%0.321SS..Hα-helixtrans-59.9-44.3171.5-80.7-178.1176.9179.40111.1I442 S443 F449 R450 L455I442-K446 HydrophobicContact CG2-CD 3.84Å; I442-K446 HydrophobicContact CG2-CG 4.33Å; I442-K446 VanDerWaalsContact O-CB 3.25Å; I442-K446 WeakPolarHBondContact O-CB 3.23Å; I442-K446 VanDerWaalsContact O-CG 3.24Å; I442-K446 WeakPolarHBondContact O-CG 3.31Å; I442-K446 PolarHBondContact O-N 3.34Å; S443-K446 PolarHBondContact O-N 2.99Å; K446-F449 CarbonylContact O-C 3.6Å; K446-F449 PolarHBondContact O-N 2.91Å; K446-R450 WeakPolarHBondContact O-CA 3.19Å; K446-R450 PolarHBondContact O-N 3.13Å; K446-L455 HydrophobicContact CG-CD1 3.92Å; K446-L455 HydrophobicContact CG-CG 4.44Å
447T93.9Very high94.9Very high54 Ų5464 Ų6433%0.33131%0.311SS..Hα-helixtrans-63.8-44.1176.2-61.80000111.5E139 S443 S444 L445 F449 R450E139-T447 HydrophobicContact CG-CG2 3.81Å; E139-T447 WeakPolarHBondContact OE1-CG2 3.46Å; S443-T447 WeakPolarHBondContact O-CB 3.45Å; S443-T447 PolarHBondContact O-N 3.42Å; S443-T447 PolarHBondContact O-OG1 2.93Å; S444-T447 PolarHBondContact O-N 3.34Å; L445-T447 VanDerWaalsContact C-N 3.32Å; L445-T447 PolarHBondContact O-N 2.74Å; T447-F449 VanDerWaalsContact C-N 3.27Å; T447-F449 PolarHBondContact O-N 2.82Å; T447-R450 WeakPolarHBondContact O-CB 3.45Å; T447-R450 WeakPolarHBondContact O-CG 3.29Å; T447-R450 PolarHBondContact O-N 3.08Å
448L92.9Very high94.8Very high26 Ų2672.5 Ų72.514%0.13634%0.343CS..Hα-helixtrans-60.7-36.7178.9-178.961.1000112.6K132 P141 I144 V397 S444 L445K132-L448 HydrophobicContact CB-CD1 4.5Å; K132-L448 HydrophobicContact CD-CD1 3.94Å; P141-L448 HydrophobicContact CG-CD1 3.89Å; I144-L448 HydrophobicContact CD1-CB 3.94Å; I144-L448 HydrophobicContact CD1-CD1 4.42Å; I144-L448 HydrophobicContact CD1-CD2 4.1Å; I144-L448 HydrophobicContact CD1-CG 4.37Å; V397-L448 HydrophobicContact CB-CD2 4.11Å; V397-L448 HydrophobicContact CG1-CD2 4.38Å; S444-L448 WeakPolarHBondContact O-CB 3.26Å; S444-L448 PolarHBondContact O-N 2.92Å; L445-L448 HydrophobicContact CD2-CD2 4.22Å; L445-L448 PolarHBondContact O-N 3.35Å
449F93.6Very high94.8Very high6 Ų677.1 Ų77.13%0.02637%0.365CS..THydrogen-bonded Turntrans-108.223.3-178.1-63.9-72.1000113.4S396 K399 A400 A403 L445 K446 T447 K451 E452 L455S396-F449 VanDerWaalsContact O-CE2 3.27Å; S396-F449 WeakPolarHBondContact O-CE2 3.17Å; K399-F449 VanDerWaalsContact C-CE1 3.43Å; A400-F449 HydrophobicContact CB-CB 4.08Å; A400-F449 HydrophobicContact CB-CD1 3.75Å; A400-F449 HydrophobicContact CB-CD2 4.45Å; A400-F449 HydrophobicContact CB-CE1 4.24Å; A400-F449 HydrophobicContact CB-CG 3.85Å; A403-F449 HydrophobicContact CB-CD2 3.87Å; A403-F449 HydrophobicContact CB-CE2 3.56Å; A403-F449 HydrophobicContact CB-CZ 4.4Å; L445-F449 HydrophobicContact CD2-CE2 4.19Å; L445-F449 VanDerWaalsContact O-CD2 3.28Å; L445-F449 WeakPolarHBondContact O-CD2 3.22Å; L445-F449 PolarHBondContact O-N 3.5Å; K446-F449 CarbonylContact O-C 3.6Å; K446-F449 PolarHBondContact O-N 2.91Å; T447-F449 VanDerWaalsContact C-N 3.27Å; T447-F449 PolarHBondContact O-N 2.82Å; F449-K451 PolarHBondContact O-N 3.2Å; F449-E452 HydrophobicContact CB-CB 4.49Å; F449-E452 WeakPolarHBondContact CD1-OE1 3.43Å; F449-E452 PolarHBondContact O-N 2.97Å; F449-L455 HydrophobicContact CB-CD2 4.09Å; F449-L455 HydrophobicContact CD2-CD2 4.34Å; F449-L455 HydrophobicContact CG-CD2 4.45Å
450R91.6Very high94.7Very high148 Ų14872.4 Ų72.456%0.55834%0.34SS*.THydrogen-bonded Turntrans-57.5-22.5-175.668.1-177.2172.5-148.6-9.8115.6E139 K446 T447E139-R450 IonicContact OE1-CZ 2.68Å; E139-R450 IonicContact OE1-NH1 2.72Å; E139-R450 PolarHBondContact OE1-NH1 2.97Å; E139-R450 IonicContact OE1-NH2 3.99Å; E139-R450 IonicContact OE2-NH2 2.72Å; K446-R450 WeakPolarHBondContact O-CA 3.19Å; K446-R450 PolarHBondContact O-N 3.13Å; T447-R450 WeakPolarHBondContact O-CB 3.45Å; T447-R450 WeakPolarHBondContact O-CG 3.29Å; T447-R450 PolarHBondContact O-N 3.08Å
451K90.8Very high94.7Very high198 Ų19872.3 Ų72.386%0.86135%0.346SS*.THydrogen-bonded Turntrans-90-8.2178.5-64.1-173.6176.6-1750113.3F449F449-K451 PolarHBondContact O-N 3.2Å
452E90.8Very high94.6Very high107 Ų10779.7 Ų79.750%0.538%0.378SS..SBendtrans-98.4179.3178.5-62.3-170-146.500110.4A400 F449A400-E452 HydrophobicContact CB-CB 4.14Å; A400-E452 WeakPolarHBondContact CB-OE2 3.37Å; F449-E452 HydrophobicContact CB-CB 4.49Å; F449-E452 WeakPolarHBondContact CD1-OE1 3.43Å; F449-E452 PolarHBondContact O-N 2.97Å
453K89.8Confident94.6Very high184 Ų18479.6 Ų79.680%0.838%0.376SS*.SBendtrans-59.9154.1176.3-67.6-177.6178.4-177.10110.9L455K453-L455 PolarHBondContact O-N 3Å
454P93.1Very high94.7Very high116 Ų11678.2 Ų78.275%0.75336%0.364SS*.  trans-48.6133.8173.3-27.434.4000111.8F456P454-F456 PolarHBondContact O-N 2.87Å
455L94Very high94.8Very high13 Ų1383.5 Ų83.57%0.06839%0.391CS..SBendtrans-65.1-26.4-177.9-66.4-175000112.9A400 A403 S404 L407 L445 K446 F449 K453A400-L455 HydrophobicContact CB-CD2 3.8Å; A403-L455 HydrophobicContact CB-CD2 4.22Å; S404-L455 WeakPolarHBondContact CB-O 3.49Å; S404-L455 PolarHBondContact OG-O 2.91Å; L407-L455 HydrophobicContact CD1-CD1 3.85Å; L445-L455 HydrophobicContact CB-CD1 3.97Å; K446-L455 HydrophobicContact CG-CD1 3.92Å; K446-L455 HydrophobicContact CG-CG 4.44Å; F449-L455 HydrophobicContact CB-CD2 4.09Å; F449-L455 HydrophobicContact CD2-CD2 4.34Å; F449-L455 HydrophobicContact CG-CD2 4.45Å; K453-L455 PolarHBondContact O-N 3Å
456F94.9Very high94.8Very high26 Ų2684.4 Ų84.411%0.11440%0.4CS..SBendtrans-122.1142.4179.2-54.2-60.8000110.9L407 I408 I442 P454 E460 T461 L464L407-F456 HydrophobicContact CB-CE1 3.69Å; L407-F456 HydrophobicContact CB-CZ 3.53Å; L407-F456 HydrophobicContact CD1-CE1 4.1Å; L407-F456 HydrophobicContact CD1-CE2 4.12Å; L407-F456 HydrophobicContact CD1-CZ 3.45Å; L407-F456 VanDerWaalsContact CD1-CZ 3.45Å; L407-F456 HydrophobicContact CG-CZ 4.07Å; I408-F456 HydrophobicContact CG1-CE1 4.2Å; I442-F456 HydrophobicContact CD1-CE2 4.46Å; I442-F456 HydrophobicContact CG1-CE2 4.28Å; I442-F456 HydrophobicContact CG1-CZ 4.31Å; I442-F456 HydrophobicContact CG2-CE2 4.16Å; P454-F456 PolarHBondContact O-N 2.87Å; F456-E460 VanDerWaalsContact CA-OE2 3.25Å; F456-E460 WeakPolarHBondContact CA-OE2 3.22Å; F456-E460 HydrophobicContact CB-CB 4.28Å; F456-E460 HydrophobicContact CD1-CB 4.4Å; F456-T461 WeakPolarHBondContact CB-OG1 3.44Å; F456-L464 HydrophobicContact CD1-CD1 4.25Å; F456-L464 HydrophobicContact CE1-CD1 3.8Å; F456-L464 HydrophobicContact CZ-CD1 3.96Å
457N94.7Very high94.9Very high64 Ų6480 Ų8034%0.34238%0.381SS..  trans-82.7172.416068.853.3000110.6M459 E460 T461N457-M459 VanDerWaalsContact C-N 3.33Å; N457-M459 PolarHBondContact O-N 2.91Å; N457-M459 WeakPolarHBondContact OD1-CA 3.49Å; N457-M459 WeakPolarHBondContact OD1-CB 3.41Å; N457-M459 PolarHBondContact OD1-N 3.48Å; N457-E460 PolarHBondContact N-OE2 3.19Å; N457-E460 WeakPolarHBondContact ND2-CG 3.46Å; N457-E460 PolarHBondContact ND2-OE1 3.34Å; N457-E460 PolarHBondContact ND2-OE2 2.97Å; N457-E460 PolarHBondContact O-N 3.35Å; N457-E460 WeakPolarHBondContact OD1-CG 3.29Å; N457-E460 PolarHBondContact OD1-N 2.82Å; N457-T461 WeakPolarHBondContact O-CB 3.03Å; N457-T461 PolarHBondContact O-N 2.95Å; N457-T461 PolarHBondContact O-OG1 3.04Å
458W95.8Very high95.1Very high187 Ų18779.3 Ų79.371%0.70839%0.385SS*.Hα-helixtrans-65.2-34.6-176.771.8-90.3000112.9T461 F462W458-T461 PolarHBondContact O-N 3.08Å; W458-F462 WeakPolarHBondContact O-CB 3.22Å; W458-F462 PolarHBondContact O-N 3.36Å
459M97.1Very high95.3Very high116 Ų11682.2 Ų82.257%0.57141%0.405SS*.Hα-helixtrans-69-44.7178-55.9-179.3-154.300111.2N457 T461 F462 Y463N457-M459 VanDerWaalsContact C-N 3.33Å; N457-M459 PolarHBondContact O-N 2.91Å; N457-M459 WeakPolarHBondContact OD1-CA 3.49Å; N457-M459 WeakPolarHBondContact OD1-CB 3.41Å; N457-M459 PolarHBondContact OD1-N 3.48Å; M459-T461 VanDerWaalsContact C-N 3.29Å; M459-T461 PolarHBondContact O-N 2.65Å; M459-F462 PolarHBondContact O-N 3.23Å; M459-Y463 WeakPolarHBondContact O-CB 3.42Å; M459-Y463 PolarHBondContact O-N 3.15Å
460E97.3Very high95.5Very high10 Ų1082.9 Ų82.95%0.04741%0.409CS..Hα-helixtrans-60.5-41.8175.1-71168.716300110.8I408 F456 N457 L464 Y505 K509I408-E460 HydrophobicContact CD1-CB 4.38Å; I408-E460 HydrophobicContact CD1-CG 3.85Å; F456-E460 VanDerWaalsContact CA-OE2 3.25Å; F456-E460 WeakPolarHBondContact CA-OE2 3.22Å; F456-E460 HydrophobicContact CB-CB 4.28Å; F456-E460 HydrophobicContact CD1-CB 4.4Å; N457-E460 PolarHBondContact N-OE2 3.19Å; N457-E460 WeakPolarHBondContact ND2-CG 3.46Å; N457-E460 PolarHBondContact ND2-OE1 3.34Å; N457-E460 PolarHBondContact ND2-OE2 2.97Å; N457-E460 PolarHBondContact O-N 3.35Å; N457-E460 WeakPolarHBondContact OD1-CG 3.29Å; N457-E460 PolarHBondContact OD1-N 2.82Å; E460-L464 WeakPolarHBondContact O-CB 3.42Å; E460-L464 VanDerWaalsContact O-CG 3.3Å; E460-L464 WeakPolarHBondContact O-CG 3.23Å; E460-L464 PolarHBondContact O-N 3.38Å; E460-Y505 HydrophobicContact CG-CE1 3.87Å; E460-Y505 WeakPolarHBondContact OE1-CE1 3.49Å; E460-Y505 PolarHBondContact OE1-OH 3.15Å; E460-K509 IonicContact OE1-NZ 3.39Å; E460-K509 PolarHBondContact OE1-NZ 3.01Å; E460-K509 IonicContact OE2-NZ 3.62Å
461T97.1Very high95.7Very high56 Ų5676.7 Ų76.734%0.34439%0.387SS..Hα-helixtrans-63.6-48.5176.7-55.10000110.9F456 N457 W458 M459 Y463 L464 L465F456-T461 WeakPolarHBondContact CB-OG1 3.44Å; N457-T461 WeakPolarHBondContact O-CB 3.03Å; N457-T461 PolarHBondContact O-N 2.95Å; N457-T461 PolarHBondContact O-OG1 3.04Å; W458-T461 PolarHBondContact O-N 3.08Å; M459-T461 VanDerWaalsContact C-N 3.29Å; M459-T461 PolarHBondContact O-N 2.65Å; T461-Y463 VanDerWaalsContact C-N 3.35Å; T461-Y463 PolarHBondContact O-N 2.79Å; T461-L464 PolarHBondContact O-N 2.93Å; T461-L465 HydrophobicContact CG2-CD1 4.07Å; T461-L465 HydrophobicContact CG2-CG 4.49Å; T461-L465 WeakPolarHBondContact O-CB 3.05Å; T461-L465 VanDerWaalsContact O-CG 3.29Å; T461-L465 WeakPolarHBondContact O-CG 3.36Å; T461-L465 PolarHBondContact O-N 3.2Å
462F97.6Very high96Very high155 Ų15571 Ų7168%0.6837%0.368SS*.Hα-helixtrans-60.5-43.8178.6-179-100.2000112.1W458 M459 L465 G466W458-F462 WeakPolarHBondContact O-CB 3.22Å; W458-F462 PolarHBondContact O-N 3.36Å; M459-F462 PolarHBondContact O-N 3.23Å; F462-L465 PolarHBondContact O-N 2.87Å; F462-G466 PolarHBondContact O-N 3.33Å
463Y98.2Very high96.2Very high37 Ų3768.6 Ų68.615%0.14536%0.362CS..Hα-helixtrans-61.3-48.1175.8171.5-95.8000112T412 M459 T461 L465 G466 Y498 V501 G502T412-Y463 HydrophobicContact CG2-CE1 3.5Å; T412-Y463 VanDerWaalsContact CG2-CE1 3.5Å; T412-Y463 WeakPolarHBondContact CG2-OH 3.35Å; M459-Y463 WeakPolarHBondContact O-CB 3.42Å; M459-Y463 PolarHBondContact O-N 3.15Å; T461-Y463 VanDerWaalsContact C-N 3.35Å; T461-Y463 PolarHBondContact O-N 2.79Å; Y463-L465 VanDerWaalsContact C-N 3.3Å; Y463-L465 PolarHBondContact O-N 2.87Å; Y463-G466 PolarHBondContact O-N 3.05Å; Y463-G466 VanDerWaalsContact O-N 3.08Å; Y463-Y498 AromaticContact CD2-CE1 3.98Å; Y463-Y498 HydrophobicContact CD2-CE1 3.98Å; Y463-Y498 AromaticContact CD2-CZ 3.81Å; Y463-Y498 AromaticContact CE2-CD1 3.91Å; Y463-Y498 HydrophobicContact CE2-CD1 3.91Å; Y463-Y498 AromaticContact CE2-CE1 3.41Å; Y463-Y498 HydrophobicContact CE2-CE1 3.41Å; Y463-Y498 VanDerWaalsContact CE2-CE1 3.41Å; Y463-Y498 HydrophobicContact CE2-CE2 4.3Å; Y463-Y498 AromaticContact CE2-CZ 3.64Å; Y463-Y498 AromaticContact CZ-CE1 3.71Å; Y463-Y498 PolarHBondContact O-OH 3.42Å; Y463-Y498 PolarHBondContact OH-O 2.95Å; Y463-V501 HydrophobicContact CE2-CB 4.41Å; Y463-V501 HydrophobicContact CE2-CG1 4.3Å; Y463-G502 WeakPolarHBondContact OH-CA 3.42Å; Y463-G502 PolarHBondContact OH-N 2.88Å
464L97.9Very high96.4Very high24 Ų2460.2 Ų60.213%0.12633%0.327CS..Hα-helixtrans-63.9-35.8178.6-69.9175.8000112.4I408 T411 T412 F456 E460 T461 G466 L467I408-L464 HydrophobicContact CG1-CD1 4.4Å; T411-L464 HydrophobicContact CG2-CD2 4.1Å; T412-L464 HydrophobicContact CG2-CD2 4.28Å; F456-L464 HydrophobicContact CD1-CD1 4.25Å; F456-L464 HydrophobicContact CE1-CD1 3.8Å; F456-L464 HydrophobicContact CZ-CD1 3.96Å; E460-L464 WeakPolarHBondContact O-CB 3.42Å; E460-L464 VanDerWaalsContact O-CG 3.3Å; E460-L464 WeakPolarHBondContact O-CG 3.23Å; E460-L464 PolarHBondContact O-N 3.38Å; T461-L464 PolarHBondContact O-N 2.93Å; L464-G466 VanDerWaalsContact C-N 3.27Å; L464-G466 PolarHBondContact O-N 3.47Å; L464-L467 HydrophobicContact CD2-CD1 4.35Å; L464-L467 WeakPolarHBondContact O-CB 3.24Å; L464-L467 PolarHBondContact O-N 2.89Å
465L97.3Very high96.4Very high121 Ų12157.5 Ų57.563%0.63430%0.304SS*.Hα-helixtrans-66.3-29.6174.5-72173.9000112.5T461 F462 Y463 L467 G468 P469T461-L465 HydrophobicContact CG2-CD1 4.07Å; T461-L465 HydrophobicContact CG2-CG 4.49Å; T461-L465 WeakPolarHBondContact O-CB 3.05Å; T461-L465 VanDerWaalsContact O-CG 3.29Å; T461-L465 WeakPolarHBondContact O-CG 3.36Å; T461-L465 PolarHBondContact O-N 3.2Å; F462-L465 PolarHBondContact O-N 2.87Å; Y463-L465 VanDerWaalsContact C-N 3.3Å; Y463-L465 PolarHBondContact O-N 2.87Å; L465-L467 PolarHBondContact O-N 3.29Å; L465-G468 PolarHBondContact O-N 3.39Å; L465-P469 WeakPolarHBondContact O-CD 3.37Å
466G97.7Very high96.3Very high19 Ų1961.5 Ų61.520%0.19632%0.321CS..Hα-helixtrans-65.4-16.5178.200000114.8F462 Y463 L464 G468 P469 L470 Y498F462-G466 PolarHBondContact O-N 3.33Å; Y463-G466 PolarHBondContact O-N 3.05Å; Y463-G466 VanDerWaalsContact O-N 3.08Å; L464-G466 VanDerWaalsContact C-N 3.27Å; L464-G466 PolarHBondContact O-N 3.47Å; G466-G468 VanDerWaalsContact C-N 3.27Å; G466-G468 PolarHBondContact O-N 3Å; G466-P469 WeakPolarHBondContact O-CD 3.46Å; G466-L470 WeakPolarHBondContact O-CB 3.07Å; G466-L470 PolarHBondContact O-N 3.3Å; G466-L470 VanDerWaalsContact O-N 3.16Å; G466-Y498 WeakPolarHBondContact CA-OH 3.5Å
467L97.8Very high96.3Very high13 Ų1363.8 Ų63.87%0.06834%0.337CS..Hα-helixtrans-63.2-32.2172.3-64.6170.6000112.4T411 Y415 L464 L465 L470 E471 Y498T411-L467 HydrophobicContact CG2-CD1 3.69Å; Y415-L467 HydrophobicContact CD1-CD2 3.52Å; Y415-L467 HydrophobicContact CE1-CD2 4.08Å; Y415-L467 HydrophobicContact CG-CD2 4Å; L464-L467 HydrophobicContact CD2-CD1 4.35Å; L464-L467 WeakPolarHBondContact O-CB 3.24Å; L464-L467 PolarHBondContact O-N 2.89Å; L465-L467 PolarHBondContact O-N 3.29Å; L467-L470 PolarHBondContact O-N 2.92Å; L467-E471 WeakPolarHBondContact O-CB 3.15Å; L467-E471 PolarHBondContact O-N 3.3Å; L467-Y498 HydrophobicContact CD2-CD1 3.55Å; L467-Y498 HydrophobicContact CD2-CE1 3.48Å; L467-Y498 VanDerWaalsContact CD2-CE1 3.48Å; L467-Y498 HydrophobicContact CG-CE1 3.99Å
468G96.7Very high96.2Very high39 Ų3961.4 Ų61.440%0.40232%0.324SS..Hα-helixtrans-65.1-57.1178.800000112.7L465 G466 L470 E471 V472L465-G468 PolarHBondContact O-N 3.39Å; G466-G468 VanDerWaalsContact C-N 3.27Å; G466-G468 PolarHBondContact O-N 3Å; G468-L470 PolarHBondContact O-N 3.49Å; G468-E471 PolarHBondContact O-N 3.39Å; G468-V472 WeakPolarHBondContact O-CG2 3.14Å; G468-V472 PolarHBondContact O-N 3.05Å
469P97.6Very high95.9Very high87 Ų8754.6 Ų54.657%0.56530%0.304SS*.Hα-helixtrans-57.8-35.3173.5-27.635.7000113.7L465 G466 V472 C473L465-P469 WeakPolarHBondContact O-CD 3.37Å; G466-P469 WeakPolarHBondContact O-CD 3.46Å; P469-V472 PolarHBondContact O-N 3.16Å; P469-C473 VanDerWaalsContact O-CB 3.24Å; P469-C473 WeakPolarHBondContact O-CB 3.28Å; P469-C473 PolarHBondContact O-N 2.88Å
470L97.4Very high95.7Very high20 Ų2057.5 Ų57.511%0.10531%0.313CS..Hα-helixtrans-61.1-48174.9177.459.6000111.2Y415 G466 L467 G468 C473 C474 L494 Y498Y415-L470 HydrophobicContact CE1-CD2 3.7Å; Y415-L470 HydrophobicContact CE1-CG 4.15Å; G466-L470 WeakPolarHBondContact O-CB 3.07Å; G466-L470 PolarHBondContact O-N 3.3Å; G466-L470 VanDerWaalsContact O-N 3.16Å; L467-L470 PolarHBondContact O-N 2.92Å; G468-L470 PolarHBondContact O-N 3.49Å; L470-C473 WeakPolarHBondContact O-CB 3.27Å; L470-C473 PolarHBondContact O-N 2.92Å; L470-C474 WeakPolarHBondContact O-CB 3.39Å; L470-C474 PolarHBondContact O-N 3.49Å; L470-C474 PolarHBondContact O-SG 3.45Å; L470-C474 VanDerWaalsContact O-SG 3.38Å; L470-L494 HydrophobicContact CD1-CB 3.95Å; L470-Y498 HydrophobicContact CD2-CD1 3.77Å; L470-Y498 HydrophobicContact CD2-CD2 4.19Å; L470-Y498 HydrophobicContact CD2-CG 3.57Å
471E96.2Very high95.4Very high19 Ų1959 Ų599%0.08932%0.324CS..Hα-helixtrans-61-47.1176.8-179.265.5174.100112.3Y415 F418 L467 G468 C473 C474 E475Y415-E471 HydrophobicContact CE2-CB 3.89Å; Y415-E471 HydrophobicContact CE2-CG 4.29Å; Y415-E471 WeakPolarHBondContact CE2-OE2 3.09Å; Y415-E471 VanDerWaalsContact OH-CA 3.27Å; Y415-E471 WeakPolarHBondContact OH-CA 3.27Å; Y415-E471 PolarHBondContact OH-N 2.95Å; Y415-E471 PolarHBondContact OH-OE2 3.36Å; F418-E471 VanDerWaalsContact CD1-OE1 3.28Å; F418-E471 WeakPolarHBondContact CD1-OE1 3.31Å; F418-E471 WeakPolarHBondContact CE1-OE1 3.47Å; L467-E471 WeakPolarHBondContact O-CB 3.15Å; L467-E471 PolarHBondContact O-N 3.3Å; G468-E471 PolarHBondContact O-N 3.39Å; E471-C473 VanDerWaalsContact C-N 3.27Å; E471-C473 PolarHBondContact O-N 3.03Å; E471-C474 PolarHBondContact O-N 2.93Å; E471-E475 PolarHBondContact O-N 3.07Å
472V96.3Very high95Very high78 Ų7861.2 Ų61.247%0.47334%0.341SS..Iπ-helixtrans-58.2-44.3176.8174.30000110.4G468 P469 F476 V477G468-V472 WeakPolarHBondContact O-CG2 3.14Å; G468-V472 PolarHBondContact O-N 3.05Å; P469-V472 PolarHBondContact O-N 3.16Å; V472-F476 CarbonylContact O-C 3.56Å; V472-F476 WeakPolarHBondContact O-CA 3.33Å; V472-F476 WeakPolarHBondContact O-CB 3.5Å; V472-F476 PolarHBondContact O-N 2.93Å; V472-V477 HydrophobicContact CG1-CG2 4.36Å; V472-V477 PolarHBondContact O-N 3.41Å
473C95.5Very high94.5Very high56 Ų5661 Ų6138%0.37834%0.336SS..Iπ-helixtrans-63.1-48.9178-173.30000111.7P469 L470 E471 V477 F478P469-C473 VanDerWaalsContact O-CB 3.24Å; P469-C473 WeakPolarHBondContact O-CB 3.28Å; P469-C473 PolarHBondContact O-N 2.88Å; L470-C473 WeakPolarHBondContact O-CB 3.27Å; L470-C473 PolarHBondContact O-N 2.92Å; E471-C473 VanDerWaalsContact C-N 3.27Å; E471-C473 PolarHBondContact O-N 3.03Å; C473-V477 PolarHBondContact O-N 3.18Å; C473-F478 VanDerWaalsContact O-CB 3.27Å; C473-F478 WeakPolarHBondContact O-CB 3.48Å; C473-F478 PolarHBondContact O-N 3.49Å
474C94.4Very high93.9Very high9 Ų964.7 Ų64.76%0.06135%0.353CS..Iπ-helixtrans-70.8-43.3-173.9-74.30000113.7L470 E471 P491L470-C474 WeakPolarHBondContact O-CB 3.39Å; L470-C474 PolarHBondContact O-N 3.49Å; L470-C474 PolarHBondContact O-SG 3.45Å; L470-C474 VanDerWaalsContact O-SG 3.38Å; E471-C474 PolarHBondContact O-N 2.93Å; C474-P491 HydrophobicContact CB-CB 3.96Å
475E92.4Very high93.3Very high58 Ų5869.9 Ų69.927%0.27139%0.385SS..Iπ-helixtrans-98.5-30-172.4-67.1-77.6-160.100113L427 K430 E471 P479L427-E475 HydrophobicContact CD1-CG 4.34Å; K430-E475 IonicContact NZ-OE1 3.63Å; K430-E475 PolarHBondContact NZ-OE1 3.08Å; E471-E475 PolarHBondContact O-N 3.07Å; E475-P479 WeakPolarHBondContact O-CG 3.3Å
476F92.8Very high92.7Very high97 Ų9771 Ų7143%0.42539%0.385SS..Iπ-helixtrans-112.8-20.2-172.1-60.9-88.5000114.6L427 I431 V472 F480L427-F476 HydrophobicContact CD2-CE1 4.18Å; L427-F476 HydrophobicContact CD2-CZ 3.87Å; L427-F476 HydrophobicContact CG-CZ 4.46Å; I431-F476 HydrophobicContact CD1-CE2 4.32Å; I431-F476 HydrophobicContact CD1-CZ 4.23Å; V472-F476 CarbonylContact O-C 3.56Å; V472-F476 WeakPolarHBondContact O-CA 3.33Å; V472-F476 WeakPolarHBondContact O-CB 3.5Å; V472-F476 PolarHBondContact O-N 2.93Å; F476-F480 WeakPolarHBondContact O-CD2 3.38Å; F476-F480 WeakPolarHBondContact O-CE2 3.38Å
477V93.7Very high92.3Very high74 Ų7475.4 Ų75.445%0.44840%0.396SS..Iπ-helixtrans-104.7-54.1178179.90000110.6V472 C473 P479 F480 T481V472-V477 HydrophobicContact CG1-CG2 4.36Å; V472-V477 PolarHBondContact O-N 3.41Å; C473-V477 PolarHBondContact O-N 3.18Å; V477-P479 VanDerWaalsContact C-CD 3.48Å; V477-F480 PolarHBondContact O-N 2.99Å; V477-T481 HydrophobicContact CG1-CG2 4.42Å
478F92.8Very high91.7Very high15 Ų1578 Ų787%0.06641%0.414CS..G310 helixtrans-55.2-41.5-172.9-170.1-91.7000113.8C473 F480 T481 W483 K484 Y487 I490 P491C473-F478 VanDerWaalsContact O-CB 3.27Å; C473-F478 WeakPolarHBondContact O-CB 3.48Å; C473-F478 PolarHBondContact O-N 3.49Å; F478-F480 PolarHBondContact O-N 3.23Å; F478-F480 VanDerWaalsContact O-N 3.15Å; F478-T481 PolarHBondContact O-N 3.16Å; F478-T481 PolarHBondContact O-OG1 3.16Å; F478-W483 HydrophobicContact CE2-CB 3.96Å; F478-W483 HydrophobicContact CE2-CE3 4.37Å; F478-W483 HydrophobicContact CZ-CB 4.12Å; F478-K484 HydrophobicContact CE1-CB 4.32Å; F478-Y487 VanDerWaalsContact CZ-O 3.31Å; F478-Y487 WeakPolarHBondContact CZ-O 3.13Å; F478-I490 HydrophobicContact CD2-CG2 4.34Å; F478-I490 HydrophobicContact CE2-CB 3.8Å; F478-I490 HydrophobicContact CE2-CD1 4.21Å; F478-I490 HydrophobicContact CE2-CG2 3.78Å; F478-I490 HydrophobicContact CZ-CB 3.84Å; F478-I490 HydrophobicContact CZ-CD1 4.44Å; F478-I490 HydrophobicContact CZ-CG2 4.33Å; F478-P491 HydrophobicContact CB-CG 4.25Å; F478-P491 HydrophobicContact CD1-CG 3.3Å; F478-P491 HydrophobicContact CD2-CG 4.27Å; F478-P491 HydrophobicContact CE1-CG 3.61Å; F478-P491 HydrophobicContact CG-CG 3.68Å; F478-P491 HydrophobicContact CZ-CG 4.24Å
479P90.7Very high91.4Very high44 Ų4479.3 Ų79.329%0.28641%0.409SS..G310 helixtrans-63.3-21.5180-26.638.8000115E475 V477 K484E475-P479 WeakPolarHBondContact O-CG 3.3Å; V477-P479 VanDerWaalsContact C-CD 3.48Å; P479-K484 HydrophobicContact CB-CD 4.49Å
480F91.8Very high91.2Very high176 Ų17677.9 Ų77.977%0.77240%0.396SS*.G310 helixtrans-93-2.4177.5-58.2-80.5000113F476 V477 F478F476-F480 WeakPolarHBondContact O-CD2 3.38Å; F476-F480 WeakPolarHBondContact O-CE2 3.38Å; V477-F480 PolarHBondContact O-N 2.99Å; F478-F480 PolarHBondContact O-N 3.23Å; F478-F480 VanDerWaalsContact O-N 3.15Å
481T91.7Very high91Very high43 Ų4377.9 Ų77.926%0.26440%0.397SS..SBendtrans-87.8151.7175.870.20000111.4V477 F478 W483 K484V477-T481 HydrophobicContact CG1-CG2 4.42Å; F478-T481 PolarHBondContact O-N 3.16Å; F478-T481 PolarHBondContact O-OG1 3.16Å; T481-W483 PolarHBondContact O-N 3.4Å; T481-W483 VanDerWaalsContact O-N 3.09Å; T481-W483 PolarHBondContact OG1-N 2.71Å; T481-K484 PolarHBondContact O-N 3.36Å
482S89Confident90.9Very high102 Ų10279.6 Ų79.671%0.71341%0.406SS*.THydrogen-bonded Turntrans-61.8-14.8170.657.40000113.2K484S482-K484 VanDerWaalsContact C-N 3.29Å; S482-K484 PolarHBondContact O-N 2.76Å
483W87Confident90.8Very high151 Ų15178 Ų7857%0.57240%0.395SS*.Hα-helixtrans-72.5-19.3178.4-60.6-9.8000113.5F478 T481 V485 K486 Y487F478-W483 HydrophobicContact CE2-CB 3.96Å; F478-W483 HydrophobicContact CE2-CE3 4.37Å; F478-W483 HydrophobicContact CZ-CB 4.12Å; T481-W483 PolarHBondContact O-N 3.4Å; T481-W483 VanDerWaalsContact O-N 3.09Å; T481-W483 PolarHBondContact OG1-N 2.71Å; W483-V485 PolarHBondContact O-N 3.07Å; W483-K486 PolarHBondContact O-N 3.09Å; W483-Y487 HydrophobicContact CB-CD2 4.33Å; W483-Y487 CarbonylContact O-C 3.58Å; W483-Y487 WeakPolarHBondContact O-CA 3.48Å; W483-Y487 PolarHBondContact O-N 2.97Å
484K85.6Confident90.9Very high113 Ų11378.6 Ų78.649%0.49139%0.394SS..Hα-helixtrans-54.7-41.9175.8-176.2-173.7-177.1175.70112F478 P479 T481 S482 P488F478-K484 HydrophobicContact CE1-CB 4.32Å; P479-K484 HydrophobicContact CB-CD 4.49Å; T481-K484 PolarHBondContact O-N 3.36Å; S482-K484 VanDerWaalsContact C-N 3.29Å; S482-K484 PolarHBondContact O-N 2.76Å; K484-P488 VanDerWaalsContact O-CA 3.31Å; K484-P488 WeakPolarHBondContact O-CA 3.37Å; K484-P488 WeakPolarHBondContact O-CB 3.47Å; K484-P488 WeakPolarHBondContact O-CD 3.41Å
485V85.6Confident91Very high134 Ų13478.4 Ų78.481%0.81239%0.393SS*.Hα-helixtrans-74.1-40.7-179.5-178.30000111W483W483-V485 PolarHBondContact O-N 3.07Å
486K85Confident91.3Very high145 Ų14575.7 Ų75.763%0.6338%0.38SS*.Hα-helixtrans-79.8-34.8-174.2-165.2173.8-178.5178.20113.3W483W483-K486 PolarHBondContact O-N 3.09Å
487Y88Confident91.5Very high110 Ų11072.8 Ų72.843%0.43137%0.37SS..  trans-139.558.6-172.3-51.6-61.4000112.3F478 W483 F489 I490F478-Y487 VanDerWaalsContact CZ-O 3.31Å; F478-Y487 WeakPolarHBondContact CZ-O 3.13Å; W483-Y487 HydrophobicContact CB-CD2 4.33Å; W483-Y487 CarbonylContact O-C 3.58Å; W483-Y487 WeakPolarHBondContact O-CA 3.48Å; W483-Y487 PolarHBondContact O-N 2.97Å; Y487-F489 PolarHBondContact O-N 3.11Å; Y487-I490 HydrophobicContact CD2-CD1 4Å; Y487-I490 HydrophobicContact CG-CD1 3.87Å; Y487-I490 PolarHBondContact O-N 3.46Å; Y487-I490 VanDerWaalsContact O-N 3.15Å
488P86.6Confident91.7Very high68 Ų6872.3 Ų72.344%0.44236%0.361SS..THydrogen-bonded Turntrans-58.1-22.2-170.414.9-26.2000115.2K484K484-P488 VanDerWaalsContact O-CA 3.31Å; K484-P488 WeakPolarHBondContact O-CA 3.37Å; K484-P488 WeakPolarHBondContact O-CB 3.47Å; K484-P488 WeakPolarHBondContact O-CD 3.41Å
489F89.7Confident92Very high67 Ų6771.6 Ų71.629%0.29436%0.358SS..THydrogen-bonded Turntrans-97.33.8-174-57.8-94.5000114.2T317 Y487 L492 L493T317-F489 HydrophobicContact CG2-CB 4.48Å; T317-F489 WeakPolarHBondContact O-CD1 3.45Å; T317-F489 WeakPolarHBondContact O-CD2 3.36Å; T317-F489 WeakPolarHBondContact O-CE2 3.34Å; T317-F489 WeakPolarHBondContact O-CG 3.28Å; T317-F489 VanDerWaalsContact O-CZ 3.29Å; T317-F489 WeakPolarHBondContact O-CZ 3.35Å; Y487-F489 PolarHBondContact O-N 3.11Å; F489-L492 HydrophobicContact CD1-CD1 4Å; F489-L492 PolarHBondContact O-N 2.52Å; F489-L493 PolarHBondContact O-N 3.41Å
490I92Very high92.4Very high56 Ų5669.5 Ų69.529%0.28734%0.344SS..Hα-helixtrans-56.7-47.4175.9-77.7176.7000112F478 Y487 L492 L493 L494F478-I490 HydrophobicContact CD2-CG2 4.34Å; F478-I490 HydrophobicContact CE2-CB 3.8Å; F478-I490 HydrophobicContact CE2-CD1 4.21Å; F478-I490 HydrophobicContact CE2-CG2 3.78Å; F478-I490 HydrophobicContact CZ-CB 3.84Å; F478-I490 HydrophobicContact CZ-CD1 4.44Å; F478-I490 HydrophobicContact CZ-CG2 4.33Å; Y487-I490 HydrophobicContact CD2-CD1 4Å; Y487-I490 HydrophobicContact CG-CD1 3.87Å; Y487-I490 PolarHBondContact O-N 3.46Å; Y487-I490 VanDerWaalsContact O-N 3.15Å; I490-L492 VanDerWaalsContact C-N 3.31Å; I490-L492 PolarHBondContact O-N 3.36Å; I490-L493 PolarHBondContact O-N 3.3Å; I490-L494 HydrophobicContact CG2-CD1 3.65Å; I490-L494 HydrophobicContact CG2-CG 4.04Å; I490-L494 WeakPolarHBondContact O-CG 3.3Å; I490-L494 PolarHBondContact O-N 2.79Å
491P94.4Very high92.7Very high21 Ų2164.5 Ų64.514%0.13633%0.328CS..Hα-helixtrans-56.2-46.3178.8-28.737.3000112.4C474 F478 L493 L494 T495C474-P491 HydrophobicContact CB-CB 3.96Å; F478-P491 HydrophobicContact CB-CG 4.25Å; F478-P491 HydrophobicContact CD1-CG 3.3Å; F478-P491 HydrophobicContact CD2-CG 4.27Å; F478-P491 HydrophobicContact CE1-CG 3.61Å; F478-P491 HydrophobicContact CG-CG 3.68Å; F478-P491 HydrophobicContact CZ-CG 4.24Å; P491-L493 PolarHBondContact O-N 3.33Å; P491-L494 PolarHBondContact O-N 3.4Å; P491-T495 PolarHBondContact O-N 2.71Å; P491-T495 PolarHBondContact O-OG1 2.87Å; P491-T495 VanDerWaalsContact O-OG1 3.07Å
492L94.6Very high93Very high54 Ų5462.5 Ų62.528%0.28332%0.316SS..Hα-helixtrans-60.3-46.7178-61.1-175.1000111.8Y280 P419 F489 I490 L494 T495 S496Y280-L492 HydrophobicContact CD2-CB 4.05Å; Y280-L492 HydrophobicContact CD2-CD2 4.09Å; Y280-L492 HydrophobicContact CD2-CG 4.46Å; Y280-L492 HydrophobicContact CE2-CB 4.27Å; Y280-L492 HydrophobicContact CE2-CD2 4.2Å; P419-L492 HydrophobicContact CB-CD2 3.48Å; P419-L492 VanDerWaalsContact CB-CD2 3.48Å; P419-L492 HydrophobicContact CG-CD2 3.93Å; F489-L492 HydrophobicContact CD1-CD1 4Å; F489-L492 PolarHBondContact O-N 2.52Å; I490-L492 VanDerWaalsContact C-N 3.31Å; I490-L492 PolarHBondContact O-N 3.36Å; L492-L494 PolarHBondContact O-N 3.5Å; L492-T495 PolarHBondContact O-N 3.3Å; L492-S496 WeakPolarHBondContact O-CB 3.29Å; L492-S496 PolarHBondContact O-N 3.13Å; L492-S496 PolarHBondContact O-OG 3.44Å
493L94.4Very high93.5Very high45 Ų4557.6 Ų57.624%0.23628%0.282CS..Hα-helixtrans-59.4-47.4176.8-178.5155.4000111.2W281 F489 I490 P491 S496 V497W281-L493 HydrophobicContact CH2-CD1 4.09Å; W281-L493 HydrophobicContact CH2-CG 4.49Å; W281-L493 HydrophobicContact CZ3-CD1 4.22Å; W281-L493 HydrophobicContact CZ3-CG 4.14Å; F489-L493 PolarHBondContact O-N 3.41Å; I490-L493 PolarHBondContact O-N 3.3Å; P491-L493 PolarHBondContact O-N 3.33Å; L493-S496 PolarHBondContact O-N 2.89Å; L493-V497 HydrophobicContact CD2-CG2 4.1Å; L493-V497 HydrophobicContact CG-CG2 4.39Å; L493-V497 WeakPolarHBondContact O-CB 3.46Å; L493-V497 VanDerWaalsContact O-CG2 3.24Å; L493-V497 WeakPolarHBondContact O-CG2 3.02Å; L493-V497 PolarHBondContact O-N 3.34Å
494L96.3Very high94Very high69 Ų6952.2 Ų52.236%0.36127%0.265SS..Hα-helixtrans-61.7-47.3-179.6-70.7175000111.2L470 I490 P491 L492 V497 Y498L470-L494 HydrophobicContact CD1-CB 3.95Å; I490-L494 HydrophobicContact CG2-CD1 3.65Å; I490-L494 HydrophobicContact CG2-CG 4.04Å; I490-L494 WeakPolarHBondContact O-CG 3.3Å; I490-L494 PolarHBondContact O-N 2.79Å; P491-L494 PolarHBondContact O-N 3.4Å; L492-L494 PolarHBondContact O-N 3.5Å; L494-V497 PolarHBondContact O-N 3.31Å; L494-Y498 WeakPolarHBondContact O-CB 3.33Å; L494-Y498 PolarHBondContact O-N 3.46Å
495T97.2Very high94.6Very high4 Ų451.3 Ų51.33%0.02526%0.26CS..Hα-helixtrans-59.4-49.4176.2-57.40000111.2Y415 P419 P491 L492 V497 C499Y415-T495 HydrophobicContact CD1-CG2 4.17Å; Y415-T495 HydrophobicContact CE1-CG2 3.83Å; P419-T495 HydrophobicContact CG-CG2 4.12Å; P491-T495 PolarHBondContact O-N 2.71Å; P491-T495 PolarHBondContact O-OG1 2.87Å; P491-T495 VanDerWaalsContact O-OG1 3.07Å; L492-T495 PolarHBondContact O-N 3.3Å; T495-V497 PolarHBondContact O-N 2.99Å; T495-C499 WeakPolarHBondContact O-CB 3.24Å; T495-C499 PolarHBondContact O-N 3.27Å; T495-C499 PolarHBondContact O-SG 3.36Å
496S97.7Very high95.2Very high1 Ų145 Ų451%0.00722%0.221CC..Hα-helixtrans-60.4-48-179.7-640000112.1Y280 W281 P283 L492 L493 A500Y280-S496 WeakPolarHBondContact CE2-OG 2.69Å; W281-S496 WeakPolarHBondContact O-CB 3.33Å; W281-S496 PolarHBondContact O-OG 3.42Å; P283-S496 WeakPolarHBondContact CA-O 3.1Å; P283-S496 WeakPolarHBondContact CB-O 2.82Å; L492-S496 WeakPolarHBondContact O-CB 3.29Å; L492-S496 PolarHBondContact O-N 3.13Å; L492-S496 PolarHBondContact O-OG 3.44Å; L493-S496 PolarHBondContact O-N 2.89Å; S496-A500 WeakPolarHBondContact O-CB 3.37Å; S496-A500 PolarHBondContact O-N 2.99Å
497V97.9Very high95.8Very high36 Ų3639.9 Ų39.922%0.21820%0.198CC..Hα-helixtrans-67.5-46.2-178.4170.90000110.9L288 A291 L493 L494 T495 C499 A500 V501L288-V497 HydrophobicContact CD2-CG1 4Å; A291-V497 HydrophobicContact CB-CG2 3.48Å; A291-V497 VanDerWaalsContact CB-CG2 3.48Å; L493-V497 HydrophobicContact CD2-CG2 4.1Å; L493-V497 HydrophobicContact CG-CG2 4.39Å; L493-V497 WeakPolarHBondContact O-CB 3.46Å; L493-V497 VanDerWaalsContact O-CG2 3.24Å; L493-V497 WeakPolarHBondContact O-CG2 3.02Å; L493-V497 PolarHBondContact O-N 3.34Å; L494-V497 PolarHBondContact O-N 3.31Å; T495-V497 PolarHBondContact O-N 2.99Å; V497-C499 PolarHBondContact O-N 2.92Å; V497-A500 WeakPolarHBondContact O-CB 3.44Å; V497-A500 PolarHBondContact O-N 2.65Å; V497-V501 PolarHBondContact O-N 3.38Å
498Y98.4Very high96.3Very high64 Ų6440.7 Ų40.725%0.25120%0.204SC..Hα-helixtrans-62.8-46.5-178.6-166.9-86.2000111.5Y463 G466 L467 L470 L494 A500 V501Y463-Y498 AromaticContact CD2-CE1 3.98Å; Y463-Y498 HydrophobicContact CD2-CE1 3.98Å; Y463-Y498 AromaticContact CD2-CZ 3.81Å; Y463-Y498 AromaticContact CE2-CD1 3.91Å; Y463-Y498 HydrophobicContact CE2-CD1 3.91Å; Y463-Y498 AromaticContact CE2-CE1 3.41Å; Y463-Y498 HydrophobicContact CE2-CE1 3.41Å; Y463-Y498 VanDerWaalsContact CE2-CE1 3.41Å; Y463-Y498 HydrophobicContact CE2-CE2 4.3Å; Y463-Y498 AromaticContact CE2-CZ 3.64Å; Y463-Y498 AromaticContact CZ-CE1 3.71Å; Y463-Y498 PolarHBondContact O-OH 3.42Å; Y463-Y498 PolarHBondContact OH-O 2.95Å; G466-Y498 WeakPolarHBondContact CA-OH 3.5Å; L467-Y498 HydrophobicContact CD2-CD1 3.55Å; L467-Y498 HydrophobicContact CD2-CE1 3.48Å; L467-Y498 VanDerWaalsContact CD2-CE1 3.48Å; L467-Y498 HydrophobicContact CG-CE1 3.99Å; L470-Y498 HydrophobicContact CD2-CD1 3.77Å; L470-Y498 HydrophobicContact CD2-CD2 4.19Å; L470-Y498 HydrophobicContact CD2-CG 3.57Å; L494-Y498 WeakPolarHBondContact O-CB 3.33Å; L494-Y498 PolarHBondContact O-N 3.46Å; Y498-A500 VanDerWaalsContact C-N 3.34Å; Y498-V501 PolarHBondContact O-N 2.79Å
499C98.6Very high96.8Very high0 Ų039.8 Ų39.80%019%0.193CC..Hα-helixtrans-66.3-35.9175.9-74.20000112.5P283 T412 Y415 T495 V497 V501 G502 I503P283-C499 HydrophobicContact CB-CB 3.46Å; P283-C499 VanDerWaalsContact CB-CB 3.46Å; P283-C499 HydrophobicContact CG-CB 4.19Å; T412-C499 PolarHBondContact O-SG 2.76Å; Y415-C499 VanDerWaalsContact CD1-SG 3.58Å; T495-C499 WeakPolarHBondContact O-CB 3.24Å; T495-C499 PolarHBondContact O-N 3.27Å; T495-C499 PolarHBondContact O-SG 3.36Å; V497-C499 PolarHBondContact O-N 2.92Å; C499-V501 PolarHBondContact O-N 2.77Å; C499-G502 PolarHBondContact O-N 3.02Å; C499-G502 VanDerWaalsContact O-N 3.11Å; C499-I503 WeakPolarHBondContact O-CG1 3.44Å; C499-I503 PolarHBondContact O-N 3.49Å
500A98.5Very high97.1Very high0 Ų036.6 Ų36.60%018%0.179CC..Hα-helixtrans-59.5-36.9178.100000112P283 N284 A287 L288 S496 V497 Y498 T504P283-A500 VanDerWaalsContact C-CB 3.47Å; P283-A500 HydrophobicContact CB-CB 4.29Å; P283-A500 WeakPolarHBondContact O-CA 3.35Å; N284-A500 WeakPolarHBondContact O-CB 3.29Å; A287-A500 HydrophobicContact CB-CB 4.32Å; L288-A500 HydrophobicContact CD1-CB 4.3Å; L288-A500 HydrophobicContact CD2-CB 3.74Å; L288-A500 HydrophobicContact CG-CB 3.77Å; S496-A500 WeakPolarHBondContact O-CB 3.37Å; S496-A500 PolarHBondContact O-N 2.99Å; V497-A500 WeakPolarHBondContact O-CB 3.44Å; V497-A500 PolarHBondContact O-N 2.65Å; Y498-A500 VanDerWaalsContact C-N 3.34Å; A500-T504 VanDerWaalsContact O-CB 3.22Å; A500-T504 WeakPolarHBondContact O-CB 3.37Å; A500-T504 PolarHBondContact O-N 3.34Å; A500-T504 PolarHBondContact O-OG1 3.01Å
501V98.3Very high97.3Very high71 Ų7135.3 Ų35.343%0.4317%0.171SC..Hα-helixtrans-59.8-49174.1175.20000111.1L288 Y463 V497 Y498 C499 T504 Y505L288-V501 HydrophobicContact CD2-CG2 4.01Å; Y463-V501 HydrophobicContact CE2-CB 4.41Å; Y463-V501 HydrophobicContact CE2-CG1 4.3Å; V497-V501 PolarHBondContact O-N 3.38Å; Y498-V501 PolarHBondContact O-N 2.79Å; C499-V501 PolarHBondContact O-N 2.77Å; V501-T504 PolarHBondContact O-N 3.26Å; V501-Y505 WeakPolarHBondContact O-CB 3.42Å; V501-Y505 PolarHBondContact O-N 3.45Å
502G98.2Very high97.3Very high1 Ų136.9 Ų36.91%0.0118%0.18CC..Hα-helixtrans-68-38.8-178.500000113.5Y463 C499 Y505 A506Y463-G502 WeakPolarHBondContact OH-CA 3.42Å; Y463-G502 PolarHBondContact OH-N 2.88Å; C499-G502 PolarHBondContact O-N 3.02Å; C499-G502 VanDerWaalsContact O-N 3.11Å; G502-Y505 PolarHBondContact O-N 3.21Å; G502-A506 WeakPolarHBondContact O-CB 3.32Å; G502-A506 PolarHBondContact O-N 3.38Å
503I98.6Very high97.2Very high0 Ų035.4 Ų35.40%017%0.174CC..Hα-helixtrans-68.2-42.7175.9-66.2168.5000110.4P283 L371 F374 M375 I385 L409 C499 Y505 A506 W507P283-I503 HydrophobicContact CB-CD1 3.88Å; P283-I503 HydrophobicContact CG-CD1 3.45Å; P283-I503 VanDerWaalsContact CG-CD1 3.45Å; P283-I503 WeakPolarHBondContact O-CD1 3.19Å; L371-I503 HydrophobicContact CD2-CG2 4.45Å; F374-I503 HydrophobicContact CD1-CG2 4.21Å; F374-I503 HydrophobicContact CE1-CD1 4.11Å; F374-I503 HydrophobicContact CE1-CG2 4.08Å; M375-I503 HydrophobicContact SD-CG2 3.79Å; I385-I503 HydrophobicContact CD1-CD1 3.97Å; I385-I503 HydrophobicContact CD1-CG1 4.36Å; I385-I503 HydrophobicContact CD1-CG2 3.99Å; I385-I503 HydrophobicContact CG1-CD1 4.13Å; L409-I503 HydrophobicContact CD1-CG1 4.24Å; L409-I503 HydrophobicContact CD1-CG2 4.16Å; C499-I503 WeakPolarHBondContact O-CG1 3.44Å; C499-I503 PolarHBondContact O-N 3.49Å; I503-Y505 VanDerWaalsContact C-N 3.3Å; I503-Y505 PolarHBondContact O-N 3.35Å; I503-A506 PolarHBondContact O-N 2.87Å; I503-W507 WeakPolarHBondContact O-CB 3.4Å; I503-W507 PolarHBondContact O-N 3.26Å
504T98.5Very high97Very high37 Ų3733.8 Ų33.823%0.22717%0.166CC..Hα-helixtrans-58.7-44.8173.8-570000110.8M375 A500 V501 W507 F508M375-T504 HydrophobicContact CE-CG2 4.17Å; M375-T504 WeakPolarHBondContact CE-OG1 3.38Å; A500-T504 VanDerWaalsContact O-CB 3.22Å; A500-T504 WeakPolarHBondContact O-CB 3.37Å; A500-T504 PolarHBondContact O-N 3.34Å; A500-T504 PolarHBondContact O-OG1 3.01Å; V501-T504 PolarHBondContact O-N 3.26Å; T504-W507 PolarHBondContact O-N 3.24Å; T504-F508 PolarHBondContact O-N 3.33Å
505Y98.3Very high96.6Very high95 Ų9534.1 Ų34.137%0.37317%0.168SC..Hα-helixtrans-61.4-47.2176.9-179-100.1000112I408 E460 V501 G502 I503 W507 F508 K509I408-Y505 HydrophobicContact CD1-CD1 4.03Å; I408-Y505 HydrophobicContact CD1-CE1 3.75Å; I408-Y505 HydrophobicContact CG2-CD1 4.37Å; E460-Y505 HydrophobicContact CG-CE1 3.87Å; E460-Y505 WeakPolarHBondContact OE1-CE1 3.49Å; E460-Y505 PolarHBondContact OE1-OH 3.15Å; V501-Y505 WeakPolarHBondContact O-CB 3.42Å; V501-Y505 PolarHBondContact O-N 3.45Å; G502-Y505 PolarHBondContact O-N 3.21Å; I503-Y505 VanDerWaalsContact C-N 3.3Å; I503-Y505 PolarHBondContact O-N 3.35Å; Y505-W507 VanDerWaalsContact C-N 3.35Å; Y505-W507 PolarHBondContact O-N 3.35Å; Y505-F508 PolarHBondContact O-N 2.89Å; Y505-K509 HydrophobicContact CE1-CD 4.06Å; Y505-K509 WeakPolarHBondContact O-CB 3.49Å; Y505-K509 PolarHBondContact O-N 3.49Å
506A98.3Very high96.1Very high0 Ų038.4 Ų38.40%019%0.189CC..Hα-helixtrans-62.7-40.4177.300000112.3I405 I408 L409 G502 I503 K509 L510I405-A506 HydrophobicContact CG2-CB 4.39Å; I408-A506 HydrophobicContact CG2-CB 4.22Å; L409-A506 HydrophobicContact CB-CB 3.96Å; L409-A506 HydrophobicContact CD1-CB 4.3Å; G502-A506 WeakPolarHBondContact O-CB 3.32Å; G502-A506 PolarHBondContact O-N 3.38Å; I503-A506 PolarHBondContact O-N 2.87Å; A506-K509 PolarHBondContact O-N 2.92Å; A506-L510 WeakPolarHBondContact O-CB 3.4Å; A506-L510 PolarHBondContact O-N 3.19Å
507W98.3Very high95.1Very high39 Ų3940.4 Ų40.415%0.14820%0.2CC..Hα-helixtrans-60.2-50.2174.3171.773.2000111.7A344 L371 S372 M375 F376 I503 T504 Y505 K509 L510 Y511A344-W507 HydrophobicContact CB-CZ2 4.14Å; L371-W507 HydrophobicContact CB-CG 4.36Å; L371-W507 HydrophobicContact CD1-CB 4.33Å; S372-W507 PolarHBondContact OG-NE1 3.43Å; M375-W507 HydrophobicContact CG-CD2 4.48Å; M375-W507 HydrophobicContact CG-CG 4.27Å; F376-W507 AromaticContact CE2-CH2 3.94Å; F376-W507 HydrophobicContact CE2-CH2 3.94Å; F376-W507 AromaticContact CE2-CZ2 3.93Å; F376-W507 HydrophobicContact CE2-CZ2 3.93Å; F376-W507 HydrophobicContact CZ-CH2 4.2Å; I503-W507 WeakPolarHBondContact O-CB 3.4Å; I503-W507 PolarHBondContact O-N 3.26Å; T504-W507 PolarHBondContact O-N 3.24Å; Y505-W507 VanDerWaalsContact C-N 3.35Å; Y505-W507 PolarHBondContact O-N 3.35Å; W507-K509 PolarHBondContact O-N 3.27Å; W507-L510 PolarHBondContact O-N 3.26Å; W507-Y511 HydrophobicContact CZ2-CD2 4.08Å; W507-Y511 HydrophobicContact CZ2-CE2 4.13Å; W507-Y511 PolarHBondContact O-N 3.02Å
508F97.6Very high93.4Very high126 Ų12639 Ų3955%0.55319%0.192SC*.Hα-helixtrans-60.7-44.5177.4-176.1-100.3000111.8T504 Y505 L510 Y511 V512T504-F508 PolarHBondContact O-N 3.33Å; Y505-F508 PolarHBondContact O-N 2.89Å; F508-L510 VanDerWaalsContact C-N 3.35Å; F508-L510 PolarHBondContact O-N 2.86Å; F508-Y511 VanDerWaalsContact O-CB 3.24Å; F508-Y511 WeakPolarHBondContact O-CB 3.38Å; F508-Y511 PolarHBondContact O-N 3.07Å; F508-Y511 VanDerWaalsContact O-N 3.12Å; F508-V512 HydrophobicContact CD1-CG2 4.09Å; F508-V512 HydrophobicContact CE1-CG2 3.68Å; F508-V512 HydrophobicContact CE2-CG2 4.38Å; F508-V512 HydrophobicContact CZ-CG2 3.85Å; F508-V512 WeakPolarHBondContact O-CG2 3.31Å; F508-V512 PolarHBondContact O-N 3.48Å
509K96.9Very high91.5Very high49 Ų4938.3 Ų38.321%0.21320%0.2CC..Hα-helixtrans-62.5-39.6178.5-167.1176.5179.61770112.2S404 I405 E460 Y505 A506 W507 S513S404-K509 PolarHBondContact OG-NZ 3.36Å; I405-K509 HydrophobicContact CD1-CB 4.48Å; I405-K509 HydrophobicContact CD1-CG 4.06Å; I405-K509 HydrophobicContact CG1-CB 4.06Å; I405-K509 HydrophobicContact CG1-CD 3.69Å; I405-K509 HydrophobicContact CG1-CG 3.66Å; E460-K509 IonicContact OE1-NZ 3.39Å; E460-K509 PolarHBondContact OE1-NZ 3.01Å; E460-K509 IonicContact OE2-NZ 3.62Å; Y505-K509 HydrophobicContact CE1-CD 4.06Å; Y505-K509 WeakPolarHBondContact O-CB 3.49Å; Y505-K509 PolarHBondContact O-N 3.49Å; A506-K509 PolarHBondContact O-N 2.92Å; W507-K509 PolarHBondContact O-N 3.27Å; K509-S513 WeakPolarHBondContact O-CB 3.31Å; K509-S513 PolarHBondContact O-N 2.88Å
510L97Very high89.5Confident0 Ų042.1 Ų42.10%022%0.219CC..Hα-helixtrans-64.4-41172.9-175.758.7000111.7T367 L368 L371 M392 I405 A506 W507 F508 S513 V514T367-L510 HydrophobicContact CG2-CD2 3.7Å; L368-L510 HydrophobicContact CD1-CG 4.49Å; L368-L510 HydrophobicContact CD2-CB 4.08Å; L368-L510 HydrophobicContact CD2-CD2 3.76Å; L368-L510 HydrophobicContact CD2-CG 3.77Å; L368-L510 HydrophobicContact CG-CD2 3.79Å; L368-L510 HydrophobicContact CG-CG 3.91Å; L371-L510 HydrophobicContact CD1-CD2 3.9Å; M392-L510 HydrophobicContact CE-CD1 4.45Å; M392-L510 HydrophobicContact SD-CD1 4.41Å; M392-L510 HydrophobicContact SD-CD2 4.36Å; I405-L510 HydrophobicContact CD1-CB 4.3Å; I405-L510 HydrophobicContact CD1-CD1 4.25Å; I405-L510 HydrophobicContact CG2-CB 4.15Å; A506-L510 WeakPolarHBondContact O-CB 3.4Å; A506-L510 PolarHBondContact O-N 3.19Å; W507-L510 PolarHBondContact O-N 3.26Å; F508-L510 VanDerWaalsContact C-N 3.35Å; F508-L510 PolarHBondContact O-N 2.86Å; L510-S513 WeakPolarHBondContact O-CB 3.48Å; L510-S513 PolarHBondContact O-N 3.2Å; L510-V514 WeakPolarHBondContact O-CG2 3.47Å; L510-V514 PolarHBondContact O-N 3.17Å
511Y94.8Very high87.2Confident29 Ų2944.7 Ų44.711%0.11425%0.246CC..Hα-helixtrans-58.6-51.5176.6-136.7-77000111.8A344 P347 L368 W507 F508 S513 V514 L515A344-Y511 WeakPolarHBondContact O-CE2 3.44Å; A344-Y511 PolarHBondContact O-OH 3.43Å; P347-Y511 HydrophobicContact CB-CE1 3.86Å; P347-Y511 WeakPolarHBondContact CB-OH 3.45Å; P347-Y511 WeakPolarHBondContact CD-OH 3.35Å; P347-Y511 HydrophobicContact CG-CE1 4.24Å; P347-Y511 WeakPolarHBondContact CG-OH 3.43Å; L368-Y511 HydrophobicContact CD1-CD2 4.38Å; L368-Y511 HydrophobicContact CD2-CD2 3.73Å; L368-Y511 HydrophobicContact CD2-CE2 4.32Å; L368-Y511 HydrophobicContact CD2-CG 4.44Å; W507-Y511 HydrophobicContact CZ2-CD2 4.08Å; W507-Y511 HydrophobicContact CZ2-CE2 4.13Å; W507-Y511 PolarHBondContact O-N 3.02Å; F508-Y511 VanDerWaalsContact O-CB 3.24Å; F508-Y511 WeakPolarHBondContact O-CB 3.38Å; F508-Y511 PolarHBondContact O-N 3.07Å; F508-Y511 VanDerWaalsContact O-N 3.12Å; Y511-S513 VanDerWaalsContact C-N 3.32Å; Y511-S513 PolarHBondContact O-N 2.97Å; Y511-V514 PolarHBondContact O-N 3.02Å; Y511-L515 HydrophobicContact CD1-CD1 3.75Å; Y511-L515 HydrophobicContact CD1-CG 4.08Å; Y511-L515 HydrophobicContact CE1-CD1 4.1Å; Y511-L515 HydrophobicContact CE1-CG 4.4Å; Y511-L515 WeakPolarHBondContact O-CG 3.27Å; Y511-L515 PolarHBondContact O-N 2.81Å
512V94.4Very high84.6Confident54 Ų5448.5 Ų48.533%0.32726%0.256SS..Hα-helixtrans-59.7-43.7177.91720000110.6F508 V514 L515 I516F508-V512 HydrophobicContact CD1-CG2 4.09Å; F508-V512 HydrophobicContact CE1-CG2 3.68Å; F508-V512 HydrophobicContact CE2-CG2 4.38Å; F508-V512 HydrophobicContact CZ-CG2 3.85Å; F508-V512 WeakPolarHBondContact O-CG2 3.31Å; F508-V512 PolarHBondContact O-N 3.48Å; V512-V514 PolarHBondContact O-N 2.95Å; V512-L515 PolarHBondContact O-N 3.42Å; V512-I516 HydrophobicContact CG1-CD1 3.46Å; V512-I516 VanDerWaalsContact CG1-CD1 3.46Å; V512-I516 HydrophobicContact CG1-CG1 4.16Å; V512-I516 WeakPolarHBondContact O-CB 3.35Å; V512-I516 VanDerWaalsContact O-CG1 3.31Å; V512-I516 WeakPolarHBondContact O-CG1 3.2Å; V512-I516 PolarHBondContact O-N 3.03Å
513S92.5Very high81.9Confident24 Ų2452.9 Ų52.917%0.16828%0.283CS..Hα-helixtrans-57-46175.81800000112.2K509 L510 Y511 D517K509-S513 WeakPolarHBondContact O-CB 3.31Å; K509-S513 PolarHBondContact O-N 2.88Å; L510-S513 WeakPolarHBondContact O-CB 3.48Å; L510-S513 PolarHBondContact O-N 3.2Å; Y511-S513 VanDerWaalsContact C-N 3.32Å; Y511-S513 PolarHBondContact O-N 2.97Å; S513-D517 WeakPolarHBondContact O-CB 3.07Å; S513-D517 PolarHBondContact O-N 3.32Å
514V90.8Very high79Confident10 Ų1061.6 Ų61.66%0.06132%0.321CS..Hα-helixtrans-65.1-42178.5169.40000112C351 R364 L368 L510 Y511 V512 S518C351-V514 HydrophobicContact CB-CG1 4.3Å; R364-V514 HydrophobicContact CB-CG2 3.89Å; R364-V514 HydrophobicContact CG-CG2 4.39Å; L368-V514 HydrophobicContact CD1-CB 4.13Å; L368-V514 HydrophobicContact CD1-CG1 4.34Å; L368-V514 HydrophobicContact CD1-CG2 3.77Å; L510-V514 WeakPolarHBondContact O-CG2 3.47Å; L510-V514 PolarHBondContact O-N 3.17Å; Y511-V514 PolarHBondContact O-N 3.02Å; V512-V514 PolarHBondContact O-N 2.95Å; V514-S518 WeakPolarHBondContact O-CB 3.42Å; V514-S518 PolarHBondContact O-N 3.02Å; V514-S518 PolarHBondContact O-OG 2.76Å
515L88.1Confident76.1Confident77 Ų7767.2 Ų67.240%0.40334%0.342SS..Hα-helixtrans-69.7-40.8-180-67.3178.9000112.5Y511 V512 S518 A519Y511-L515 HydrophobicContact CD1-CD1 3.75Å; Y511-L515 HydrophobicContact CD1-CG 4.08Å; Y511-L515 HydrophobicContact CE1-CD1 4.1Å; Y511-L515 HydrophobicContact CE1-CG 4.4Å; Y511-L515 WeakPolarHBondContact O-CG 3.27Å; Y511-L515 PolarHBondContact O-N 2.81Å; V512-L515 PolarHBondContact O-N 3.42Å; L515-S518 WeakPolarHBondContact O-CB 3.35Å; L515-S518 PolarHBondContact O-N 3.06Å; L515-A519 PolarHBondContact O-N 3.27Å; L515-A519 VanDerWaalsContact O-N 3.17Å
516I86.4Confident73Confident93 Ų9374 Ų7448%0.47738%0.377SS..Hα-helixtrans-70.9-47.9179.3-67.4174.9000111.5V512 S518 A519 I520V512-I516 HydrophobicContact CG1-CD1 3.46Å; V512-I516 VanDerWaalsContact CG1-CD1 3.46Å; V512-I516 HydrophobicContact CG1-CG1 4.16Å; V512-I516 WeakPolarHBondContact O-CB 3.35Å; V512-I516 VanDerWaalsContact O-CG1 3.31Å; V512-I516 WeakPolarHBondContact O-CG1 3.2Å; V512-I516 PolarHBondContact O-N 3.03Å; I516-S518 PolarHBondContact O-N 3.13Å; I516-A519 WeakPolarHBondContact O-CA 3.44Å; I516-A519 WeakPolarHBondContact O-CB 3.37Å; I516-A519 PolarHBondContact O-N 3.44Å; I516-I520 HydrophobicContact CG2-CD1 4.13Å; I516-I520 PolarHBondContact O-N 3.11Å
517D77.6Confident71.7Confident44 Ų4477.7 Ų77.724%0.23540%0.396CS..Hα-helixtrans-59.3-31.5176.7-85.6-15.2000110.7R364 K399 S513 A519R364-D517 IonicContact CZ-OD2 2.75Å; R364-D517 VanDerWaalsContact CZ-OD2 3.31Å; R364-D517 IonicContact NH1-OD2 2.8Å; R364-D517 PolarHBondContact NH1-OD2 2.96Å; R364-D517 IonicContact NH2-OD2 3.76Å; R364-D517 PolarHBondContact NH2-OD2 3.4Å; K399-D517 IonicContact NZ-OD1 3.66Å; K399-D517 IonicContact NZ-OD2 3.94Å; K399-D517 PolarHBondContact NZ-OD2 3.41Å; S513-D517 WeakPolarHBondContact O-CB 3.07Å; S513-D517 PolarHBondContact O-N 3.32Å; D517-A519 VanDerWaalsContact C-N 3.34Å
518S61.1Low70.3Confident5 Ų579.7 Ų79.74%0.03541%0.409CS..Hα-helixtrans-70.5-23.7172.8-65.90000113.8K355 Q357 V514 L515 I516K355-S518 VanDerWaalsContact CD-O 3.3Å; K355-S518 WeakPolarHBondContact CD-O 3.03Å; K355-S518 WeakPolarHBondContact CE-O 3.22Å; K355-S518 PolarHBondContact NZ-O 2.9Å; Q357-S518 PolarHBondContact NE2-OG 3.19Å; Q357-S518 VanDerWaalsContact NE2-OG 3.09Å; V514-S518 WeakPolarHBondContact O-CB 3.42Å; V514-S518 PolarHBondContact O-N 3.02Å; V514-S518 PolarHBondContact O-OG 2.76Å; L515-S518 WeakPolarHBondContact O-CB 3.35Å; L515-S518 PolarHBondContact O-N 3.06Å; I516-S518 PolarHBondContact O-N 3.13Å
519A58.3Low68.8Low51 Ų5177.1 Ų77.142%0.42140%0.401SS..Hα-helixtrans-80-43.2176.800000111.8L515 I516 D517 G521 K522L515-A519 PolarHBondContact O-N 3.27Å; L515-A519 VanDerWaalsContact O-N 3.17Å; I516-A519 WeakPolarHBondContact O-CA 3.44Å; I516-A519 WeakPolarHBondContact O-CB 3.37Å; I516-A519 PolarHBondContact O-N 3.44Å; D517-A519 VanDerWaalsContact C-N 3.34Å; A519-G521 VanDerWaalsContact C-N 3.26Å; A519-G521 PolarHBondContact O-N 3.09Å; A519-K522 PolarHBondContact O-N 3.45Å; A519-K522 VanDerWaalsContact O-N 3.07Å
520I57.2Low67.1Low79 Ų7978.8 Ų78.841%0.40541%0.412SS..Hα-helixtrans-64.1-30-177.7-61.6168.5000112.2I516 K522 T523 K524I516-I520 HydrophobicContact CG2-CD1 4.13Å; I516-I520 PolarHBondContact O-N 3.11Å; I520-K522 PolarHBondContact O-N 2.72Å; I520-K522 VanDerWaalsContact O-N 3.14Å; I520-T523 PolarHBondContact O-N 3.02Å; I520-T523 PolarHBondContact O-OG1 3.22Å; I520-K524 PolarHBondContact O-N 3.15Å
521G49.7Very low65.3Low54 Ų5483.7 Ų83.756%0.55744%0.438SS*.Hα-helixtrans-60.1-19.9174.600000114.6A519A519-G521 VanDerWaalsContact C-N 3.26Å; A519-G521 PolarHBondContact O-N 3.09Å
522K45.1Very low63.3Low151 Ų15187.3 Ų87.366%0.65746%0.46SS*.Hα-helixtrans-85.1-32.7174.9-73.5-171.5169.1-171.60113.3A519 I520A519-K522 PolarHBondContact O-N 3.45Å; A519-K522 VanDerWaalsContact O-N 3.07Å; I520-K522 PolarHBondContact O-N 2.72Å; I520-K522 VanDerWaalsContact O-N 3.14Å
523T39.7Very low61.1Low94 Ų9489.7 Ų89.758%0.57747%0.469SS*.Hα-helixtrans-86.4-24.9-172.534.90000114.4I520 K525I520-T523 PolarHBondContact O-N 3.02Å; I520-T523 PolarHBondContact O-OG1 3.22Å; T523-K525 PolarHBondContact O-N 3.06Å
524K39.1Very low58.7Low183 Ų18394.8 Ų94.880%0.79649%0.492SS*.THydrogen-bonded Turntrans-766.5175.6-80.9-168.5174.7-1730115.1I520I520-K524 PolarHBondContact O-N 3.15Å
525K37.6Very low56Low154 Ų154101.8 Ų101.867%0.6753%0.528SS*.THydrogen-bonded Turntrans-123.510.7-175.4-86.1-166.8173.6-171.40114.4P224 T523P224-K525 PolarHBondContact O-NZ 2.78Å; P224-K525 VanDerWaalsContact O-NZ 3.16Å; T523-K525 PolarHBondContact O-N 3.06Å
526Q32.1Very low53.1Low237 Ų237104.1 Ų104.1100%1.10754%0.54SS*.  trans-98.50158.9-73.2179.6-29.200107.2

Retrieved 526 of 526 residues in 180.7 ms (Link to these results)

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