G4V5D9_SCHMA Loading...

Defective in cullin neddylation protein

Neddylation of cullins play an essential role in the regulation of SCF-type complexes activity.

AlphaFold DB , UniProt , Accession G4V5D9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 263 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
1M34.2Very low69.7Low242 Ų242114.1 Ų114.1100%1.19262%0.616SS**  01120-75.1-177.5-121.800108.1T3M1-T3 PolarHBondContact O-N 2.87Å
2A38.5Very low71.8Confident105 Ų105116.7 Ų116.787%0.86861%0.61SS**  trans-80.8107.1175.500000108.6Q4A2-Q4 PolarHBondContact O-N 3.43Å
3T43.9Very low73.5Confident106 Ų106113.8 Ų113.865%0.6560%0.596SS**  trans-71.695.1172.3-29.10000107.5M1 Y5M1-T3 PolarHBondContact O-N 2.87Å; T3-Y5 VanDerWaalsContact C-N 3.31Å; T3-Y5 WeakPolarHBondContact O-CD2 3.48Å; T3-Y5 PolarHBondContact O-N 3.05Å
4Q54.7Low75.1Confident185 Ų185112.4 Ų112.486%0.86458%0.579SS**  trans-69.792.3173-157.4176.323.700107.3A2 K6A2-Q4 PolarHBondContact O-N 3.43Å; Q4-K6 PolarHBondContact O-N 3.03Å
5Y58.4Low76.4Confident127 Ų127105.4 Ų105.450%0.49854%0.543SS..  trans-58.2115.1176.4-73.3-82.2000108.6T3 L7T3-Y5 VanDerWaalsContact C-N 3.31Å; T3-Y5 WeakPolarHBondContact O-CD2 3.48Å; T3-Y5 PolarHBondContact O-N 3.05Å; Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.36Å
6K80.5Confident77.5Confident211 Ų211108.1 Ų108.192%0.91755%0.55SS*.  trans-6888.3169.9-81.6-174.5177.3179.10108.5Q4Q4-K6 PolarHBondContact O-N 3.03Å
7L86.6Confident78.5Confident32 Ų32109.4 Ų109.417%0.16855%0.551CS.*  trans-75.1133.6175.4-61.3-175.8000110.7Y5 Q11 R12 V15 I30 W38Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.36Å; L7-Q11 HydrophobicContact CB-CB 3.96Å; L7-Q11 HydrophobicContact CD2-CB 4.23Å; L7-R12 HydrophobicContact CB-CG 3.82Å; L7-R12 HydrophobicContact CD1-CG 4.3Å; L7-V15 HydrophobicContact CD1-CG2 4.04Å; L7-I30 HydrophobicContact CD1-CD1 3.92Å; L7-I30 HydrophobicContact CD1-CG1 3.99Å; L7-W38 HydrophobicContact CD1-CH2 4.17Å; L7-W38 HydrophobicContact CD2-CH2 3.38Å; L7-W38 HydrophobicContact CD2-CZ2 3.67Å; L7-W38 HydrophobicContact CD2-CZ3 4.47Å; L7-W38 HydrophobicContact CG-CH2 4.36Å
8S91.4Very high79.3Confident58 Ų58103.3 Ų103.341%0.40652%0.52SS..  trans-60.6164.9167.666.20000111.4S10 Q11 R12S8-S10 VanDerWaalsContact C-N 3.29Å; S8-S10 PolarHBondContact O-N 2.91Å; S8-Q11 PolarHBondContact O-N 2.5Å; S8-Q11 VanDerWaalsContact OG-CG 3.24Å; S8-Q11 WeakPolarHBondContact OG-CG 3.34Å; S8-Q11 PolarHBondContact OG-N 3.46Å; S8-Q11 PolarHBondContact OG-OE1 3.39Å; S8-R12 PolarHBondContact O-N 3.13Å
9S91.2Very high79.9Confident78 Ų7899.4 Ų99.455%0.54550%0.501SS..Hα-helixtrans-56.2-44.9176.4-161.80000111.8Q11 R12 D13S9-Q11 VanDerWaalsContact C-N 3.32Å; S9-Q11 PolarHBondContact O-N 2.78Å; S9-R12 PolarHBondContact O-N 3.27Å; S9-D13 PolarHBondContact O-N 3.5Å; S9-D13 VanDerWaalsContact O-N 3.08Å
10S92.8Very high80.4Confident64 Ų6498.4 Ų98.445%0.44851%0.509SS..Hα-helixtrans-62.1-38178.4179.60000112.8S8 D13 R14S8-S10 VanDerWaalsContact C-N 3.29Å; S8-S10 PolarHBondContact O-N 2.91Å; S10-D13 PolarHBondContact O-N 3.27Å; S10-R14 WeakPolarHBondContact O-CG 3.5Å; S10-R14 PolarHBondContact O-N 3.41Å; S10-R14 VanDerWaalsContact O-N 3.11Å
11Q94.5Very high80.8Confident47 Ų4797.7 Ų97.722%0.2251%0.505CS..Hα-helixtrans-67.5-40.8176.7-74.2171.5-44.100111.8L7 S8 S9 D13 R14 V15 W38L7-Q11 HydrophobicContact CB-CB 3.96Å; L7-Q11 HydrophobicContact CD2-CB 4.23Å; S8-Q11 PolarHBondContact O-N 2.5Å; S8-Q11 VanDerWaalsContact OG-CG 3.24Å; S8-Q11 WeakPolarHBondContact OG-CG 3.34Å; S8-Q11 PolarHBondContact OG-N 3.46Å; S8-Q11 PolarHBondContact OG-OE1 3.39Å; S9-Q11 VanDerWaalsContact C-N 3.32Å; S9-Q11 PolarHBondContact O-N 2.78Å; Q11-D13 VanDerWaalsContact C-N 3.35Å; Q11-D13 PolarHBondContact O-N 3.24Å; Q11-R14 PolarHBondContact O-N 2.79Å; Q11-V15 WeakPolarHBondContact O-CG2 3.46Å; Q11-V15 PolarHBondContact O-N 3.37Å; Q11-W38 HydrophobicContact CB-CD2 4.36Å; Q11-W38 HydrophobicContact CB-CE3 3.78Å; Q11-W38 HydrophobicContact CB-CH2 3.72Å; Q11-W38 HydrophobicContact CB-CZ2 4.28Å; Q11-W38 HydrophobicContact CB-CZ3 3.43Å; Q11-W38 VanDerWaalsContact CB-CZ3 3.43Å; Q11-W38 HydrophobicContact CG-CD2 3.65Å; Q11-W38 HydrophobicContact CG-CE3 3.54Å; Q11-W38 HydrophobicContact CG-CG 4.35Å; Q11-W38 HydrophobicContact CG-CH2 3.9Å; Q11-W38 HydrophobicContact CG-CZ2 3.97Å; Q11-W38 HydrophobicContact CG-CZ3 3.67Å
12R94.4Very high83.3Confident145 Ų14586.8 Ų86.855%0.54745%0.452SS..Hα-helixtrans-62.3-40.5175.1-75.3-175.5-82.9173.5-1.8112.4L7 S8 S9 R14 V15 K16L7-R12 HydrophobicContact CB-CG 3.82Å; L7-R12 HydrophobicContact CD1-CG 4.3Å; S8-R12 PolarHBondContact O-N 3.13Å; S9-R12 PolarHBondContact O-N 3.27Å; R12-R14 VanDerWaalsContact C-N 3.32Å; R12-R14 PolarHBondContact O-N 3.44Å; R12-V15 PolarHBondContact O-N 2.97Å; R12-K16 WeakPolarHBondContact O-CG 3.45Å; R12-K16 PolarHBondContact O-N 2.94Å
13D94.5Very high85.5Confident80 Ų8092.9 Ų92.943%0.42845%0.452SS..Hα-helixtrans-65-36.8175.7-70-23.1000112.2S9 S10 Q11 K16 K17S9-D13 PolarHBondContact O-N 3.5Å; S9-D13 VanDerWaalsContact O-N 3.08Å; S10-D13 PolarHBondContact O-N 3.27Å; Q11-D13 VanDerWaalsContact C-N 3.35Å; Q11-D13 PolarHBondContact O-N 3.24Å; D13-K16 PolarHBondContact O-N 2.78Å; D13-K17 WeakPolarHBondContact O-CG 3.49Å; D13-K17 PolarHBondContact O-N 3.45Å
14R95.4Very high87.5Confident94 Ų9489 Ų8936%0.35543%0.429SS..Hα-helixtrans-67-39.8174.8-72.7177.7176.7165.78.4112.4S10 Q11 R12 K17 F18 L33 W38S10-R14 WeakPolarHBondContact O-CG 3.5Å; S10-R14 PolarHBondContact O-N 3.41Å; S10-R14 VanDerWaalsContact O-N 3.11Å; Q11-R14 PolarHBondContact O-N 2.79Å; R12-R14 VanDerWaalsContact C-N 3.32Å; R12-R14 PolarHBondContact O-N 3.44Å; R14-K17 PolarHBondContact O-N 3.11Å; R14-F18 VanDerWaalsContact O-CB 3.29Å; R14-F18 WeakPolarHBondContact O-CB 3.45Å; R14-F18 PolarHBondContact O-N 3.01Å; R14-L33 HydrophobicContact CB-CD1 4.09Å; R14-L33 HydrophobicContact CB-CD2 4.23Å; R14-W38 HydrophobicContact CB-CE3 4.42Å; R14-W38 WeakPolarHBondContact CD-O 3.24Å; R14-W38 PolarHBondContact NE-O 2.81Å; R14-W38 VanDerWaalsContact NH1-CB 3.25Å; R14-W38 PolarHBondContact NH1-O 3.13Å
15V95.3Very high89.1Confident7 Ų783.3 Ų83.34%0.04241%0.41CS..Hα-helixtrans-60.1-47.3173.8171.30000110.7L7 Q11 R12 K17 F18 N19 D26 A29 I30 L33 W38L7-V15 HydrophobicContact CD1-CG2 4.04Å; Q11-V15 WeakPolarHBondContact O-CG2 3.46Å; Q11-V15 PolarHBondContact O-N 3.37Å; R12-V15 PolarHBondContact O-N 2.97Å; V15-K17 PolarHBondContact O-N 3.07Å; V15-F18 PolarHBondContact O-N 3.41Å; V15-N19 PolarHBondContact O-N 3.35Å; V15-N19 PolarHBondContact O-ND2 2.76Å; V15-D26 HydrophobicContact CG1-CB 4.34Å; V15-A29 HydrophobicContact CG1-CB 3.98Å; V15-I30 HydrophobicContact CG2-CG1 3.76Å; V15-L33 HydrophobicContact CB-CD1 4.41Å; V15-L33 HydrophobicContact CG2-CD1 3.77Å; V15-W38 HydrophobicContact CG2-CH2 4.4Å; V15-W38 HydrophobicContact CG2-CZ3 4.02Å
16K93.9Very high90.6Very high149 Ų14982 Ų8265%0.64841%0.412SS*.Hα-helixtrans-59-47.1176.8-72.1179.5179-179.90112.4R12 D13 F18 N19 A20R12-K16 WeakPolarHBondContact O-CG 3.45Å; R12-K16 PolarHBondContact O-N 2.94Å; D13-K16 PolarHBondContact O-N 2.78Å; K16-F18 VanDerWaalsContact C-N 3.35Å; K16-N19 PolarHBondContact O-N 2.67Å; K16-A20 WeakPolarHBondContact O-CB 3.14Å; K16-A20 PolarHBondContact O-N 3.05Å
17K93.5Very high91.1Very high130 Ų13079.2 Ų79.257%0.56540%0.4SS*.Hα-helixtrans-63.3-40.7177.8-73.2179.3179.2-175.20112.1D13 R14 V15 A20 I21 L40D13-K17 WeakPolarHBondContact O-CG 3.49Å; D13-K17 PolarHBondContact O-N 3.45Å; R14-K17 PolarHBondContact O-N 3.11Å; V15-K17 PolarHBondContact O-N 3.07Å; K17-A20 PolarHBondContact O-N 3.26Å; K17-I21 WeakPolarHBondContact O-CG1 3.3Å; K17-I21 PolarHBondContact O-N 3.39Å; K17-L40 HydrophobicContact CB-CD1 4.28Å; K17-L40 HydrophobicContact CB-CD2 3.73Å; K17-L40 HydrophobicContact CD-CD2 4.16Å
18F94.2Very high91.2Very high0 Ų080 Ų800%041%0.406CS..Hα-helixtrans-61.2-52.6176.5-175.3-81.9000111.1R14 V15 K16 A20 I21 T22 S24 A29 C32 L33 L40 A43 V44 F47R14-F18 VanDerWaalsContact O-CB 3.29Å; R14-F18 WeakPolarHBondContact O-CB 3.45Å; R14-F18 PolarHBondContact O-N 3.01Å; V15-F18 PolarHBondContact O-N 3.41Å; K16-F18 VanDerWaalsContact C-N 3.35Å; F18-A20 PolarHBondContact O-N 2.61Å; F18-I21 PolarHBondContact O-N 2.94Å; F18-T22 HydrophobicContact CD1-CG2 4.02Å; F18-T22 VanDerWaalsContact CD1-OG1 3.31Å; F18-T22 WeakPolarHBondContact CD1-OG1 3.44Å; F18-T22 HydrophobicContact CE1-CG2 3.68Å; F18-T22 VanDerWaalsContact CE1-OG1 3.25Å; F18-T22 WeakPolarHBondContact CE1-OG1 3.26Å; F18-T22 HydrophobicContact CE2-CG2 4.19Å; F18-T22 HydrophobicContact CG-CG2 4.44Å; F18-T22 HydrophobicContact CZ-CG2 3.79Å; F18-T22 PolarHBondContact O-N 3.31Å; F18-T22 PolarHBondContact O-OG1 2.95Å; F18-S24 VanDerWaalsContact CE1-OG 3.22Å; F18-S24 WeakPolarHBondContact CE1-OG 3.49Å; F18-A29 HydrophobicContact CB-CB 4.23Å; F18-A29 HydrophobicContact CD1-CB 3.36Å; F18-A29 HydrophobicContact CE1-CB 3.89Å; F18-A29 HydrophobicContact CG-CB 3.98Å; F18-C32 HydrophobicContact CE2-CB 3.79Å; F18-C32 HydrophobicContact CZ-CB 3.59Å; F18-L33 HydrophobicContact CB-CD1 4.23Å; F18-L33 HydrophobicContact CD2-CD2 4.48Å; F18-L33 HydrophobicContact CD2-CG 4.31Å; F18-L40 HydrophobicContact CB-CD1 3.72Å; F18-L40 HydrophobicContact CD2-CD1 4.1Å; F18-L40 HydrophobicContact CG-CD1 4.41Å; F18-A43 HydrophobicContact CD2-CB 3.9Å; F18-A43 VanDerWaalsContact CE2-C 3.49Å; F18-A43 HydrophobicContact CE2-CB 3.63Å; F18-A43 WeakPolarHBondContact CE2-O 3.32Å; F18-V44 HydrophobicContact CD2-CG2 3.81Å; F18-V44 HydrophobicContact CE2-CG2 4.04Å; F18-F47 HydrophobicContact CE1-CD2 4.48Å; F18-F47 HydrophobicContact CE1-CG 4.5Å; F18-F47 HydrophobicContact CE2-CB 4.28Å; F18-F47 HydrophobicContact CZ-CB 3.69Å; F18-F47 HydrophobicContact CZ-CD2 4.18Å; F18-F47 AromaticContact CZ-CG 3.95Å; F18-F47 HydrophobicContact CZ-CG 3.95Å
19N91Very high91.3Very high28 Ų2877.2 Ų77.215%0.1539%0.386CS..Hα-helixtrans-60.4-34.6178.9-72.3-22.1000112.7V15 K16 I21 R23 S24 S25 D26 A29V15-N19 PolarHBondContact O-N 3.35Å; V15-N19 PolarHBondContact O-ND2 2.76Å; K16-N19 PolarHBondContact O-N 2.67Å; N19-I21 PolarHBondContact O-N 3.38Å; N19-R23 WeakPolarHBondContact O-CA 3.45Å; N19-R23 PolarHBondContact O-N 2.78Å; N19-S24 PolarHBondContact OD1-O 3.24Å; N19-S24 PolarHBondContact OD1-OG 3.47Å; N19-S24 VanDerWaalsContact OD1-OG 3.14Å; N19-S25 PolarHBondContact OD1-O 2.92Å; N19-D26 PolarHBondContact ND2-OD1 3.06Å; N19-A29 VanDerWaalsContact OD1-CB 3.28Å; N19-A29 WeakPolarHBondContact OD1-CB 3.36Å
20A89.6Confident91.4Very high80 Ų8074.8 Ų74.866%0.66137%0.367SS*.Hα-helixtrans-62.7-31175.400000112.5K16 K17 F18K16-A20 WeakPolarHBondContact O-CB 3.14Å; K16-A20 PolarHBondContact O-N 3.05Å; K17-A20 PolarHBondContact O-N 3.26Å; F18-A20 PolarHBondContact O-N 2.61Å
21I88.5Confident91.3Very high84 Ų8475.1 Ų75.143%0.43136%0.364SS..Hα-helixtrans-85.1-50.6179.3-62.3164.5000110.7K17 F18 N19 L40 V44 Y48K17-I21 WeakPolarHBondContact O-CG1 3.3Å; K17-I21 PolarHBondContact O-N 3.39Å; F18-I21 PolarHBondContact O-N 2.94Å; N19-I21 PolarHBondContact O-N 3.38Å; I21-L40 HydrophobicContact CD1-CD2 4.32Å; I21-V44 HydrophobicContact CB-CG2 4.48Å; I21-V44 HydrophobicContact CD1-CG2 4.07Å; I21-V44 HydrophobicContact CG2-CG1 3.87Å; I21-V44 HydrophobicContact CG2-CG2 4.24Å; I21-Y48 HydrophobicContact CG2-CE2 4.48Å; I21-Y48 PolarHBondContact O-OH 3.44Å
22T86.3Confident91.2Very high13 Ų1373.2 Ų73.28%0.0836%0.356CS..Hα-helixtrans-91.7-14.7-168.661.70000113.9F18 S24 V44 F47F18-T22 HydrophobicContact CD1-CG2 4.02Å; F18-T22 VanDerWaalsContact CD1-OG1 3.31Å; F18-T22 WeakPolarHBondContact CD1-OG1 3.44Å; F18-T22 HydrophobicContact CE1-CG2 3.68Å; F18-T22 VanDerWaalsContact CE1-OG1 3.25Å; F18-T22 WeakPolarHBondContact CE1-OG1 3.26Å; F18-T22 HydrophobicContact CE2-CG2 4.19Å; F18-T22 HydrophobicContact CG-CG2 4.44Å; F18-T22 HydrophobicContact CZ-CG2 3.79Å; F18-T22 PolarHBondContact O-N 3.31Å; F18-T22 PolarHBondContact O-OG1 2.95Å; T22-S24 PolarHBondContact O-N 3.33Å; T22-S24 WeakPolarHBondContact OG1-CB 3.45Å; T22-S24 PolarHBondContact OG1-N 3.24Å; T22-S24 PolarHBondContact OG1-OG 3.06Å; T22-V44 HydrophobicContact CG2-CG2 4.29Å; T22-F47 HydrophobicContact CG2-CB 4.46Å; T22-F47 HydrophobicContact CG2-CD1 3.49Å; T22-F47 VanDerWaalsContact CG2-CD1 3.49Å; T22-F47 HydrophobicContact CG2-CE1 3.9Å; T22-F47 HydrophobicContact CG2-CG 4.01Å
23R85.2Confident91.2Very high233 Ų23366.3 Ų66.388%0.87933%0.33SS*.  trans53.428-169.6-55.5-171.7179.3-158.91.2113.5N19N19-R23 WeakPolarHBondContact O-CA 3.45Å; N19-R23 PolarHBondContact O-N 2.78Å
24S85.6Confident91.2Very high24 Ų2465.7 Ų65.717%0.16832%0.324CS..  trans-83.5173.9177.969.40000113F18 N19 T22F18-S24 VanDerWaalsContact CE1-OG 3.22Å; F18-S24 WeakPolarHBondContact CE1-OG 3.49Å; N19-S24 PolarHBondContact OD1-O 3.24Å; N19-S24 PolarHBondContact OD1-OG 3.47Å; N19-S24 VanDerWaalsContact OD1-OG 3.14Å; T22-S24 PolarHBondContact O-N 3.33Å; T22-S24 WeakPolarHBondContact OG1-CB 3.45Å; T22-S24 PolarHBondContact OG1-N 3.24Å; T22-S24 PolarHBondContact OG1-OG 3.06Å
25S88.3Confident90.9Very high66 Ų6667 Ų6746%0.46234%0.335SS..  trans-79.4157170.367.40000112.2N19 K27 V28 A29N19-S25 PolarHBondContact OD1-O 2.92Å; S25-K27 PolarHBondContact O-N 3.28Å; S25-K27 VanDerWaalsContact O-N 3.11Å; S25-V28 PolarHBondContact O-N 2.92Å; S25-A29 PolarHBondContact O-N 3.45Å
26D90.8Very high90.7Very high100 Ų10067 Ų6754%0.53534%0.336SS..Hα-helixtrans-51.3-36.1174.7-78.312.8000112.8V15 N19 A29 I30V15-D26 HydrophobicContact CG1-CB 4.34Å; N19-D26 PolarHBondContact ND2-OD1 3.06Å; D26-A29 PolarHBondContact O-N 3.11Å; D26-I30 WeakPolarHBondContact O-CB 3.47Å; D26-I30 WeakPolarHBondContact O-CD1 3.43Å; D26-I30 WeakPolarHBondContact O-CG1 3.35Å; D26-I30 PolarHBondContact O-N 3.32Å
27K89.9Confident90.7Very high152 Ų15266.1 Ų66.166%0.66134%0.339SS*.Hα-helixtrans-62-51177.6-175179.6177.2-175.80111.3S25 A29 I30 D31S25-K27 PolarHBondContact O-N 3.28Å; S25-K27 VanDerWaalsContact O-N 3.11Å; K27-A29 VanDerWaalsContact C-N 3.31Å; K27-A29 PolarHBondContact O-N 3.09Å; K27-I30 PolarHBondContact O-N 3.39Å; K27-D31 VanDerWaalsContact O-CG 3.25Å; K27-D31 PolarHBondContact O-N 3.48Å
28V89.1Confident90.7Very high48 Ų4861.5 Ų61.529%0.29132%0.317SS..Hα-helixtrans-62.8-40.6178.8173.70000110.9S25 D31 C32 F47S25-V28 PolarHBondContact O-N 2.92Å; V28-D31 PolarHBondContact O-N 3.17Å; V28-C32 WeakPolarHBondContact O-CB 3.31Å; V28-C32 PolarHBondContact O-N 3.33Å; V28-C32 PolarHBondContact O-SG 3.18Å; V28-F47 HydrophobicContact CG1-CD2 3.71Å; V28-F47 HydrophobicContact CG1-CE2 3.63Å
29A92.2Very high90.7Very high0 Ų068.6 Ų68.60%034%0.344CS..Hα-helixtrans-61.9-46.617600000112.4V15 F18 N19 S25 D26 K27 C32 L33V15-A29 HydrophobicContact CG1-CB 3.98Å; F18-A29 HydrophobicContact CB-CB 4.23Å; F18-A29 HydrophobicContact CD1-CB 3.36Å; F18-A29 HydrophobicContact CE1-CB 3.89Å; F18-A29 HydrophobicContact CG-CB 3.98Å; N19-A29 VanDerWaalsContact OD1-CB 3.28Å; N19-A29 WeakPolarHBondContact OD1-CB 3.36Å; S25-A29 PolarHBondContact O-N 3.45Å; D26-A29 PolarHBondContact O-N 3.11Å; K27-A29 VanDerWaalsContact C-N 3.31Å; K27-A29 PolarHBondContact O-N 3.09Å; A29-C32 PolarHBondContact O-N 2.98Å; A29-L33 WeakPolarHBondContact O-CB 3.14Å; A29-L33 WeakPolarHBondContact O-CD1 3.37Å; A29-L33 WeakPolarHBondContact O-CG 3.31Å; A29-L33 PolarHBondContact O-N 2.98Å
30I93.4Very high90.8Very high27 Ų2769.3 Ų69.314%0.13835%0.348CS..Hα-helixtrans-61.2-45.9177.7-69.9164.1000110.3L7 V15 D26 K27 L33 Q34L7-I30 HydrophobicContact CD1-CD1 3.92Å; L7-I30 HydrophobicContact CD1-CG1 3.99Å; V15-I30 HydrophobicContact CG2-CG1 3.76Å; D26-I30 WeakPolarHBondContact O-CB 3.47Å; D26-I30 WeakPolarHBondContact O-CD1 3.43Å; D26-I30 WeakPolarHBondContact O-CG1 3.35Å; D26-I30 PolarHBondContact O-N 3.32Å; K27-I30 PolarHBondContact O-N 3.39Å; I30-L33 PolarHBondContact O-N 3.31Å; I30-Q34 HydrophobicContact CG2-CG 4.3Å; I30-Q34 WeakPolarHBondContact O-CB 3.39Å; I30-Q34 VanDerWaalsContact O-CG 3.25Å; I30-Q34 WeakPolarHBondContact O-CG 3.4Å; I30-Q34 PolarHBondContact O-N 3.01Å
31D91.8Very high90.9Very high70 Ų7073.6 Ų73.637%0.37435%0.354SS..Hα-helixtrans-62.2-49.2-179.9-66.6-19.2000111K27 V28 L33 Q34 M35K27-D31 VanDerWaalsContact O-CG 3.25Å; K27-D31 PolarHBondContact O-N 3.48Å; V28-D31 PolarHBondContact O-N 3.17Å; D31-L33 PolarHBondContact O-N 3.13Å; D31-Q34 PolarHBondContact O-N 2.66Å; D31-M35 WeakPolarHBondContact O-CG 3.48Å; D31-M35 PolarHBondContact O-N 3.01Å
32C92.3Very high91.1Very high8 Ų873.9 Ų73.95%0.05435%0.354CS..Hα-helixtrans-64.1-40.9178.7-64.40000112.4F18 V28 A29 M35 S36 A43 Y46F18-C32 HydrophobicContact CE2-CB 3.79Å; F18-C32 HydrophobicContact CZ-CB 3.59Å; V28-C32 WeakPolarHBondContact O-CB 3.31Å; V28-C32 PolarHBondContact O-N 3.33Å; V28-C32 PolarHBondContact O-SG 3.18Å; A29-C32 PolarHBondContact O-N 2.98Å; C32-M35 PolarHBondContact O-N 3.39Å; C32-S36 WeakPolarHBondContact O-CB 3.4Å; C32-S36 PolarHBondContact O-N 3.28Å; C32-S36 VanDerWaalsContact O-N 3.1Å; C32-S36 PolarHBondContact O-OG 3.12Å; C32-A43 HydrophobicContact CB-CB 4.21Å; C32-Y46 HydrophobicContact CB-CD1 4.27Å
33L95Very high91.4Very high0 Ų073.2 Ų73.20%035%0.35CS..Hα-helixtrans-67.3-39.9177.5-75.2165.1000111.1R14 V15 F18 A29 I30 D31 S36 N37 W38 A43R14-L33 HydrophobicContact CB-CD1 4.09Å; R14-L33 HydrophobicContact CB-CD2 4.23Å; V15-L33 HydrophobicContact CB-CD1 4.41Å; V15-L33 HydrophobicContact CG2-CD1 3.77Å; F18-L33 HydrophobicContact CB-CD1 4.23Å; F18-L33 HydrophobicContact CD2-CD2 4.48Å; F18-L33 HydrophobicContact CD2-CG 4.31Å; A29-L33 WeakPolarHBondContact O-CB 3.14Å; A29-L33 WeakPolarHBondContact O-CD1 3.37Å; A29-L33 WeakPolarHBondContact O-CG 3.31Å; A29-L33 PolarHBondContact O-N 2.98Å; I30-L33 PolarHBondContact O-N 3.31Å; D31-L33 PolarHBondContact O-N 3.13Å; L33-S36 CarbonylContact O-C 3.52Å; L33-S36 PolarHBondContact O-N 3.38Å; L33-N37 PolarHBondContact O-N 3.06Å; L33-W38 HydrophobicContact CB-CD2 4.07Å; L33-W38 HydrophobicContact CB-CE3 3.69Å; L33-W38 HydrophobicContact CB-CH2 4.47Å; L33-W38 HydrophobicContact CB-CZ3 3.92Å; L33-W38 HydrophobicContact CD1-CE3 4.04Å; L33-W38 HydrophobicContact CD1-CZ3 3.85Å; L33-W38 HydrophobicContact CD2-CE3 4.48Å; L33-W38 HydrophobicContact CG-CE3 4.29Å; L33-W38 HydrophobicContact CG-CZ3 4.47Å; L33-W38 WeakPolarHBondContact O-CA 3.31Å; L33-W38 PolarHBondContact O-N 2.97Å; L33-A43 HydrophobicContact CD2-CB 3.77Å; L33-A43 HydrophobicContact CG-CB 4.13Å
34Q93.4Very high91.7Very high66 Ų6663.1 Ų63.131%0.30831%0.314SS..Hα-helixtrans-62.5-45.4175.1-78.2179.7-12.900111.6I30 D31 S36 N37 W38I30-Q34 HydrophobicContact CG2-CG 4.3Å; I30-Q34 WeakPolarHBondContact O-CB 3.39Å; I30-Q34 VanDerWaalsContact O-CG 3.25Å; I30-Q34 WeakPolarHBondContact O-CG 3.4Å; I30-Q34 PolarHBondContact O-N 3.01Å; D31-Q34 PolarHBondContact O-N 2.66Å; Q34-S36 PolarHBondContact O-N 3.4Å; Q34-N37 PolarHBondContact O-N 2.91Å; Q34-W38 HydrophobicContact CG-CZ2 3.87Å
35M90.4Very high91.8Very high121 Ų12165.6 Ų65.660%0.59633%0.325SS*.Hα-helixtrans-62.8-26177.1-68.7-171.471.800113.2D31 C32 Y46D31-M35 WeakPolarHBondContact O-CG 3.48Å; D31-M35 PolarHBondContact O-N 3.01Å; C32-M35 PolarHBondContact O-N 3.39Å; M35-Y46 HydrophobicContact CE-CE1 4.15Å; M35-Y46 HydrophobicContact CE-CE2 3.91Å; M35-Y46 VanDerWaalsContact CE-CZ 3.44Å; M35-Y46 WeakPolarHBondContact CE-OH 3.39Å; M35-Y46 HydrophobicContact SD-CE1 3.61Å; M35-Y46 HydrophobicContact SD-CE2 4.46Å; M35-Y46 VanDerWaalsContact SD-CZ 3.52Å; M35-Y46 PolarHBondContact SD-OH 3.27Å
36S90.9Very high91.8Very high9 Ų965.5 Ų65.56%0.06332%0.315CS..THydrogen-bonded Turntrans-102.221.8-177.1-52.30000113.4C32 L33 Q34 W38 R39 A43C32-S36 WeakPolarHBondContact O-CB 3.4Å; C32-S36 PolarHBondContact O-N 3.28Å; C32-S36 VanDerWaalsContact O-N 3.1Å; C32-S36 PolarHBondContact O-OG 3.12Å; L33-S36 CarbonylContact O-C 3.52Å; L33-S36 PolarHBondContact O-N 3.38Å; Q34-S36 PolarHBondContact O-N 3.4Å; S36-W38 PolarHBondContact O-N 3.25Å; S36-W38 VanDerWaalsContact O-N 3.1Å; S36-R39 WeakPolarHBondContact O-CB 3.22Å; S36-R39 PolarHBondContact O-N 2.88Å; S36-A43 WeakPolarHBondContact OG-CA 3.33Å; S36-A43 PolarHBondContact OG-N 3.45Å
37N92.7Very high91.7Very high130 Ų13061.7 Ų61.770%0.69529%0.294SS*.THydrogen-bonded Turntrans49.938.3-176-69.6-40000113L33 Q34 R39L33-N37 PolarHBondContact O-N 3.06Å; Q34-N37 PolarHBondContact O-N 2.91Å; N37-R39 PolarHBondContact O-N 3.05Å
38W93.8Very high91.5Very high32 Ų3258.4 Ų58.412%0.12128%0.278CS..THydrogen-bonded Turntrans58.224.7-176.6-65.384.9000114.7L7 Q11 R14 V15 L33 Q34 S36L7-W38 HydrophobicContact CD1-CH2 4.17Å; L7-W38 HydrophobicContact CD2-CH2 3.38Å; L7-W38 HydrophobicContact CD2-CZ2 3.67Å; L7-W38 HydrophobicContact CD2-CZ3 4.47Å; L7-W38 HydrophobicContact CG-CH2 4.36Å; Q11-W38 HydrophobicContact CB-CD2 4.36Å; Q11-W38 HydrophobicContact CB-CE3 3.78Å; Q11-W38 HydrophobicContact CB-CH2 3.72Å; Q11-W38 HydrophobicContact CB-CZ2 4.28Å; Q11-W38 HydrophobicContact CB-CZ3 3.43Å; Q11-W38 VanDerWaalsContact CB-CZ3 3.43Å; Q11-W38 HydrophobicContact CG-CD2 3.65Å; Q11-W38 HydrophobicContact CG-CE3 3.54Å; Q11-W38 HydrophobicContact CG-CG 4.35Å; Q11-W38 HydrophobicContact CG-CH2 3.9Å; Q11-W38 HydrophobicContact CG-CZ2 3.97Å; Q11-W38 HydrophobicContact CG-CZ3 3.67Å; R14-W38 HydrophobicContact CB-CE3 4.42Å; R14-W38 WeakPolarHBondContact CD-O 3.24Å; R14-W38 PolarHBondContact NE-O 2.81Å; R14-W38 VanDerWaalsContact NH1-CB 3.25Å; R14-W38 PolarHBondContact NH1-O 3.13Å; V15-W38 HydrophobicContact CG2-CH2 4.4Å; V15-W38 HydrophobicContact CG2-CZ3 4.02Å; L33-W38 HydrophobicContact CB-CD2 4.07Å; L33-W38 HydrophobicContact CB-CE3 3.69Å; L33-W38 HydrophobicContact CB-CH2 4.47Å; L33-W38 HydrophobicContact CB-CZ3 3.92Å; L33-W38 HydrophobicContact CD1-CE3 4.04Å; L33-W38 HydrophobicContact CD1-CZ3 3.85Å; L33-W38 HydrophobicContact CD2-CE3 4.48Å; L33-W38 HydrophobicContact CG-CE3 4.29Å; L33-W38 HydrophobicContact CG-CZ3 4.47Å; L33-W38 WeakPolarHBondContact O-CA 3.31Å; L33-W38 PolarHBondContact O-N 2.97Å; Q34-W38 HydrophobicContact CG-CZ2 3.87Å; S36-W38 PolarHBondContact O-N 3.25Å; S36-W38 VanDerWaalsContact O-N 3.1Å
39R94.7Very high91.3Very high149 Ų14965 Ų6556%0.56230%0.298SS*.  trans-87.1115.1172.7-63.1177.8179.2-167.81.8109.4S36 N37 E41 Q42 A43S36-R39 WeakPolarHBondContact O-CB 3.22Å; S36-R39 PolarHBondContact O-N 2.88Å; N37-R39 PolarHBondContact O-N 3.05Å; R39-E41 PolarHBondContact O-N 3.47Å; R39-Q42 HydrophobicContact CB-CB 4.1Å; R39-Q42 HydrophobicContact CB-CG 4.09Å; R39-Q42 VanDerWaalsContact NH1-NE2 3.16Å; R39-Q42 PolarHBondContact O-N 3.42Å; R39-A43 WeakPolarHBondContact O-CB 3.4Å; R39-A43 PolarHBondContact O-N 3.5Å
40L92.2Very high90.7Very high43 Ų4370.6 Ų70.623%0.22532%0.324CS..Hα-helixtrans-58.3-50.6-172.4178.763.8000112.5K17 F18 I21 Q42 A43 V44K17-L40 HydrophobicContact CB-CD1 4.28Å; K17-L40 HydrophobicContact CB-CD2 3.73Å; K17-L40 HydrophobicContact CD-CD2 4.16Å; F18-L40 HydrophobicContact CB-CD1 3.72Å; F18-L40 HydrophobicContact CD2-CD1 4.1Å; F18-L40 HydrophobicContact CG-CD1 4.41Å; I21-L40 HydrophobicContact CD1-CD2 4.32Å; L40-Q42 PolarHBondContact O-N 3.36Å; L40-A43 PolarHBondContact O-N 3.11Å; L40-V44 HydrophobicContact CD1-CG2 4.16Å; L40-V44 HydrophobicContact CG-CG2 4.49Å; L40-V44 VanDerWaalsContact O-CG2 3.32Å; L40-V44 WeakPolarHBondContact O-CG2 3.14Å; L40-V44 PolarHBondContact O-N 3.46Å
41E91.4Very high89.6Confident171 Ų17173.2 Ų73.280%0.79934%0.338SS*.Hα-helixtrans-60.8-43.6-178.2-67.2171.7-174.800112.2R39 A43 V44 D45R39-E41 PolarHBondContact O-N 3.47Å; E41-A43 VanDerWaalsContact C-N 3.35Å; E41-V44 PolarHBondContact O-N 3Å; E41-D45 WeakPolarHBondContact O-CB 3.36Å; E41-D45 PolarHBondContact O-N 3.32Å
42Q93Very high88.2Confident89 Ų8974.5 Ų74.542%0.41635%0.35SS..Hα-helixtrans-66.7-38177.6-63.2-174.68.700111.7R39 L40 Y46R39-Q42 HydrophobicContact CB-CB 4.1Å; R39-Q42 HydrophobicContact CB-CG 4.09Å; R39-Q42 VanDerWaalsContact NH1-NE2 3.16Å; R39-Q42 PolarHBondContact O-N 3.42Å; L40-Q42 PolarHBondContact O-N 3.36Å; Q42-Y46 VanDerWaalsContact O-CB 3.23Å; Q42-Y46 WeakPolarHBondContact O-CB 3.24Å; Q42-Y46 PolarHBondContact O-N 3.37Å
43A93.7Very high86.3Confident0 Ų077.1 Ų77.10%037%0.366CS..Hα-helixtrans-65.6-41.8176.100000111.5F18 C32 L33 S36 R39 L40 E41 Y46 F47F18-A43 HydrophobicContact CD2-CB 3.9Å; F18-A43 VanDerWaalsContact CE2-C 3.49Å; F18-A43 HydrophobicContact CE2-CB 3.63Å; F18-A43 WeakPolarHBondContact CE2-O 3.32Å; C32-A43 HydrophobicContact CB-CB 4.21Å; L33-A43 HydrophobicContact CD2-CB 3.77Å; L33-A43 HydrophobicContact CG-CB 4.13Å; S36-A43 WeakPolarHBondContact OG-CA 3.33Å; S36-A43 PolarHBondContact OG-N 3.45Å; R39-A43 WeakPolarHBondContact O-CB 3.4Å; R39-A43 PolarHBondContact O-N 3.5Å; L40-A43 PolarHBondContact O-N 3.11Å; E41-A43 VanDerWaalsContact C-N 3.35Å; A43-Y46 PolarHBondContact O-N 3.05Å; A43-F47 WeakPolarHBondContact O-CB 3.5Å; A43-F47 PolarHBondContact O-N 2.86Å
44V90.1Very high83.9Confident21 Ų2183.1 Ų83.113%0.12741%0.405CS..Hα-helixtrans-65.4-45.5178.2170.80000110.3F18 I21 T22 L40 E41 F47 Y48F18-V44 HydrophobicContact CD2-CG2 3.81Å; F18-V44 HydrophobicContact CE2-CG2 4.04Å; I21-V44 HydrophobicContact CB-CG2 4.48Å; I21-V44 HydrophobicContact CD1-CG2 4.07Å; I21-V44 HydrophobicContact CG2-CG1 3.87Å; I21-V44 HydrophobicContact CG2-CG2 4.24Å; T22-V44 HydrophobicContact CG2-CG2 4.29Å; L40-V44 HydrophobicContact CD1-CG2 4.16Å; L40-V44 HydrophobicContact CG-CG2 4.49Å; L40-V44 VanDerWaalsContact O-CG2 3.32Å; L40-V44 WeakPolarHBondContact O-CG2 3.14Å; L40-V44 PolarHBondContact O-N 3.46Å; E41-V44 PolarHBondContact O-N 3Å; V44-F47 PolarHBondContact O-N 3.16Å; V44-Y48 HydrophobicContact CG1-CD2 3.68Å; V44-Y48 HydrophobicContact CG1-CE2 3.47Å; V44-Y48 VanDerWaalsContact CG1-CE2 3.47Å; V44-Y48 WeakPolarHBondContact O-CD2 3.4Å; V44-Y48 PolarHBondContact O-N 3Å
45D87.7Confident81.6Confident76 Ų7686.9 Ų86.941%0.40642%0.423SS..Hα-helixtrans-60.4-45.4174-176.743.3000111.3E41 F47 Y48 R49E41-D45 WeakPolarHBondContact O-CB 3.36Å; E41-D45 PolarHBondContact O-N 3.32Å; D45-F47 VanDerWaalsContact C-N 3.34Å; D45-F47 PolarHBondContact O-N 3.22Å; D45-Y48 PolarHBondContact O-N 3.05Å; D45-R49 WeakPolarHBondContact O-CB 3.32Å; D45-R49 VanDerWaalsContact O-CG 3.28Å; D45-R49 WeakPolarHBondContact O-CG 3.36Å; D45-R49 PolarHBondContact O-N 3.38Å; D45-R49 IonicContact OD1-CZ 3.19Å; D45-R49 IonicContact OD1-NE 2.77Å; D45-R49 PolarHBondContact OD1-NE 3.2Å; D45-R49 IonicContact OD1-NH2 2.69Å; D45-R49 IonicContact OD2-CZ 3.59Å; D45-R49 IonicContact OD2-NE 3.27Å; D45-R49 PolarHBondContact OD2-NE 3.08Å; D45-R49 IonicContact OD2-NH2 2.72Å; D45-R49 PolarHBondContact OD2-NH2 3.48Å
46Y89.6Confident79.6Confident64 Ų6483.8 Ų83.825%0.25142%0.422SS..Hα-helixtrans-58.2-44174.6179.2-97.9000112.3C32 M35 Q42 A43 R49 Q50C32-Y46 HydrophobicContact CB-CD1 4.27Å; M35-Y46 HydrophobicContact CE-CE1 4.15Å; M35-Y46 HydrophobicContact CE-CE2 3.91Å; M35-Y46 VanDerWaalsContact CE-CZ 3.44Å; M35-Y46 WeakPolarHBondContact CE-OH 3.39Å; M35-Y46 HydrophobicContact SD-CE1 3.61Å; M35-Y46 HydrophobicContact SD-CE2 4.46Å; M35-Y46 VanDerWaalsContact SD-CZ 3.52Å; M35-Y46 PolarHBondContact SD-OH 3.27Å; Q42-Y46 VanDerWaalsContact O-CB 3.23Å; Q42-Y46 WeakPolarHBondContact O-CB 3.24Å; Q42-Y46 PolarHBondContact O-N 3.37Å; A43-Y46 PolarHBondContact O-N 3.05Å; Y46-R49 PolarHBondContact O-N 3.32Å; Y46-Q50 HydrophobicContact CD1-CG 4.32Å; Y46-Q50 HydrophobicContact CD2-CG 4.36Å; Y46-Q50 HydrophobicContact CE1-CG 3.84Å; Y46-Q50 HydrophobicContact CE2-CG 3.88Å; Y46-Q50 WeakPolarHBondContact O-CB 3.28Å; Y46-Q50 WeakPolarHBondContact O-CG 3.35Å; Y46-Q50 PolarHBondContact O-N 2.92Å; Y46-Q50 PolarHBondContact OH-NE2 2.68Å
47F89Confident77.8Confident20 Ų2088.1 Ų88.19%0.08845%0.449CS..Hα-helixtrans-62.1-46.3178.3173.3-96.2000112.3F18 T22 V28 A43 V44 D45 R49 Q50 N51F18-F47 HydrophobicContact CE1-CD2 4.48Å; F18-F47 HydrophobicContact CE1-CG 4.5Å; F18-F47 HydrophobicContact CE2-CB 4.28Å; F18-F47 HydrophobicContact CZ-CB 3.69Å; F18-F47 HydrophobicContact CZ-CD2 4.18Å; F18-F47 AromaticContact CZ-CG 3.95Å; F18-F47 HydrophobicContact CZ-CG 3.95Å; T22-F47 HydrophobicContact CG2-CB 4.46Å; T22-F47 HydrophobicContact CG2-CD1 3.49Å; T22-F47 VanDerWaalsContact CG2-CD1 3.49Å; T22-F47 HydrophobicContact CG2-CE1 3.9Å; T22-F47 HydrophobicContact CG2-CG 4.01Å; V28-F47 HydrophobicContact CG1-CD2 3.71Å; V28-F47 HydrophobicContact CG1-CE2 3.63Å; A43-F47 WeakPolarHBondContact O-CB 3.5Å; A43-F47 PolarHBondContact O-N 2.86Å; V44-F47 PolarHBondContact O-N 3.16Å; D45-F47 VanDerWaalsContact C-N 3.34Å; D45-F47 PolarHBondContact O-N 3.22Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-Q50 PolarHBondContact O-N 3Å; F47-N51 HydrophobicContact CE2-CB 4.22Å; F47-N51 WeakPolarHBondContact CE2-ND2 3.41Å; F47-N51 HydrophobicContact CZ-CB 4.22Å; F47-N51 WeakPolarHBondContact O-CA 3.04Å; F47-N51 WeakPolarHBondContact O-CB 3.32Å; F47-N51 PolarHBondContact O-N 2.86Å; F47-N51 PolarHBondContact O-ND2 3.06Å
48Y84.4Confident76.6Confident83 Ų8386.6 Ų86.633%0.32545%0.445SS..Hα-helixtrans-71.8-26.4179.1-74.1-62000113.4I21 V44 D45 N51 P52 T53I21-Y48 HydrophobicContact CG2-CE2 4.48Å; I21-Y48 PolarHBondContact O-OH 3.44Å; V44-Y48 HydrophobicContact CG1-CD2 3.68Å; V44-Y48 HydrophobicContact CG1-CE2 3.47Å; V44-Y48 VanDerWaalsContact CG1-CE2 3.47Å; V44-Y48 WeakPolarHBondContact O-CD2 3.4Å; V44-Y48 PolarHBondContact O-N 3Å; D45-Y48 PolarHBondContact O-N 3.05Å; Y48-N51 WeakPolarHBondContact CA-O 3.19Å; Y48-N51 CarbonylContact O-C 3.59Å; Y48-N51 VanDerWaalsContact O-C 3.31Å; Y48-P52 WeakPolarHBondContact O-CA 3.23Å; Y48-T53 HydrophobicContact CD1-CG2 4.04Å; Y48-T53 HydrophobicContact CE1-CG2 3.67Å
49R85Confident76.1Confident185 Ų18587.5 Ų87.570%0.69845%0.452SS*.Hα-helixtrans-70.2-38.7171.2-73.3177.7-169.4-159.35.8112.6D45 Y46 F47D45-R49 WeakPolarHBondContact O-CB 3.32Å; D45-R49 VanDerWaalsContact O-CG 3.28Å; D45-R49 WeakPolarHBondContact O-CG 3.36Å; D45-R49 PolarHBondContact O-N 3.38Å; D45-R49 IonicContact OD1-CZ 3.19Å; D45-R49 IonicContact OD1-NE 2.77Å; D45-R49 PolarHBondContact OD1-NE 3.2Å; D45-R49 IonicContact OD1-NH2 2.69Å; D45-R49 IonicContact OD2-CZ 3.59Å; D45-R49 IonicContact OD2-NE 3.27Å; D45-R49 PolarHBondContact OD2-NE 3.08Å; D45-R49 IonicContact OD2-NH2 2.72Å; D45-R49 PolarHBondContact OD2-NH2 3.48Å; Y46-R49 PolarHBondContact O-N 3.32Å; F47-R49 VanDerWaalsContact C-N 3.34Å
50Q81Confident75.8Confident118 Ų11883.7 Ų83.755%0.55144%0.443SS*.Hα-helixtrans-82.6-38.8-178.9-73.2-76.5-13.900112.6Y46 F47 P52Y46-Q50 HydrophobicContact CD1-CG 4.32Å; Y46-Q50 HydrophobicContact CD2-CG 4.36Å; Y46-Q50 HydrophobicContact CE1-CG 3.84Å; Y46-Q50 HydrophobicContact CE2-CG 3.88Å; Y46-Q50 WeakPolarHBondContact O-CB 3.28Å; Y46-Q50 WeakPolarHBondContact O-CG 3.35Å; Y46-Q50 PolarHBondContact O-N 2.92Å; Y46-Q50 PolarHBondContact OH-NE2 2.68Å; F47-Q50 PolarHBondContact O-N 3Å; Q50-P52 VanDerWaalsContact C-CD 3.43Å; Q50-P52 VanDerWaalsContact O-CD 3.3Å; Q50-P52 WeakPolarHBondContact O-CD 3.43Å
51N70.5Confident75.8Confident82 Ų8285.1 Ų85.144%0.43945%0.448SS..SBendtrans-115.282.6173.4-57.4-82.8000105.4F47 Y48 T53F47-N51 HydrophobicContact CE2-CB 4.22Å; F47-N51 WeakPolarHBondContact CE2-ND2 3.41Å; F47-N51 HydrophobicContact CZ-CB 4.22Å; F47-N51 WeakPolarHBondContact O-CA 3.04Å; F47-N51 WeakPolarHBondContact O-CB 3.32Å; F47-N51 PolarHBondContact O-N 2.86Å; F47-N51 PolarHBondContact O-ND2 3.06Å; Y48-N51 WeakPolarHBondContact CA-O 3.19Å; Y48-N51 CarbonylContact O-C 3.59Å; Y48-N51 VanDerWaalsContact O-C 3.31Å; N51-T53 PolarHBondContact O-N 3.35Å
52P61Low76Confident97 Ų9780.3 Ų80.363%0.6344%0.437SS*.  trans-54.1103.2161.423.1-29.5000104.7Y48 Q50Y48-P52 WeakPolarHBondContact O-CA 3.23Å; Q50-P52 VanDerWaalsContact C-CD 3.43Å; Q50-P52 VanDerWaalsContact O-CD 3.3Å; Q50-P52 WeakPolarHBondContact O-CD 3.43Å
53T52.4Low76.2Confident64 Ų6480.7 Ų80.739%0.39344%0.438SS..  trans-45.9138.4164.430.10000104.8Y48 N51 Q55Y48-T53 HydrophobicContact CD1-CG2 4.04Å; Y48-T53 HydrophobicContact CE1-CG2 3.67Å; N51-T53 PolarHBondContact O-N 3.35Å; T53-Q55 PolarHBondContact O-N 3.27Å
54P45.2Very low76.3Confident126 Ų12680.7 Ų80.782%0.81844%0.438SS*.  trans-53.499.2166.922.7-30000104.8G56P54-G56 PolarHBondContact O-N 3.1Å
55Q45.2Very low76.7Confident145 Ų14581.9 Ų81.968%0.67844%0.444SS*.  trans-59.8107.6170-74.1179.1-9.90099.4T53 T58T53-Q55 PolarHBondContact O-N 3.27Å; Q55-T58 HydrophobicContact CB-CG2 3.98Å; Q55-T58 VanDerWaalsContact OE1-CG2 3.31Å
56G48.6Very low77.1Confident55 Ų5584.9 Ų84.957%0.56746%0.455SS*.SBendtrans-42.2138.7170.500000106.5P54 T58P54-G56 PolarHBondContact O-N 3.1Å; G56-T58 PolarHBondContact O-N 2.94Å
57P53.2Low77.5Confident100 Ų10082.8 Ų82.865%0.64945%0.448SS*.SBendtrans-33.8113.1-159.914-31000110.2I59P57-I59 WeakPolarHBondContact O-CG1 3.29Å; P57-I59 PolarHBondContact O-N 3.46Å
58T66.6Low78Confident99 Ų9981.9 Ų81.961%0.60744%0.444SS*.  trans-56.6104.5-173.348.10000108Q55 G56 N60Q55-T58 HydrophobicContact CB-CG2 3.98Å; Q55-T58 VanDerWaalsContact OE1-CG2 3.31Å; G56-T58 PolarHBondContact O-N 2.94Å; T58-N60 PolarHBondContact O-N 3.38Å
59I83.3Confident78.6Confident50 Ų5081.6 Ų81.626%0.25645%0.445SS..  trans-67.5126.1-174.2-59.7-178.7000107.3P57 E61 I64 R127 D132P57-I59 WeakPolarHBondContact O-CG1 3.29Å; P57-I59 PolarHBondContact O-N 3.46Å; I59-E61 PolarHBondContact O-N 3.42Å; I59-I64 HydrophobicContact CG2-CD1 3.47Å; I59-I64 VanDerWaalsContact CG2-CD1 3.47Å; I59-I64 HydrophobicContact CG2-CG1 4.46Å; I59-R127 HydrophobicContact CD1-CB 4.39Å; I59-R127 VanDerWaalsContact CD1-O 3.25Å; I59-R127 WeakPolarHBondContact CD1-O 3.38Å; I59-D132 HydrophobicContact CG2-CB 4.12Å
60N89.8Confident79.2Confident70 Ų7078.9 Ų78.937%0.37444%0.435SS..  trans-85.395.1178.5-170.5-32.6000110.1T58 A62 K63 I64 D132T58-N60 PolarHBondContact O-N 3.38Å; N60-A62 PolarHBondContact O-N 3.17Å; N60-A62 VanDerWaalsContact O-N 3.15Å; N60-A62 WeakPolarHBondContact OD1-CB 3.35Å; N60-A62 PolarHBondContact OD1-N 2.9Å; N60-A62 VanDerWaalsContact OD1-N 3.07Å; N60-K63 HydrophobicContact CB-CB 4.36Å; N60-K63 HydrophobicContact CB-CD 4.02Å; N60-K63 HydrophobicContact CB-CG 3.94Å; N60-K63 WeakPolarHBondContact O-CB 3.26Å; N60-K63 PolarHBondContact O-N 2.87Å; N60-K63 PolarHBondContact OD1-N 2.96Å; N60-I64 PolarHBondContact O-N 2.98Å; N60-D132 HydrophobicContact CB-CB 4.49Å
61E91.7Very high80.1Confident73 Ų7373.4 Ų73.434%0.34141%0.409SS..Hα-helixtrans-53.6-32.3178-67.1-70.3157.700113.4I59 K63 I64 D65 F123 R127I59-E61 PolarHBondContact O-N 3.42Å; E61-K63 VanDerWaalsContact C-N 3.32Å; E61-K63 PolarHBondContact O-N 3.14Å; E61-I64 PolarHBondContact O-N 2.77Å; E61-D65 PolarHBondContact O-N 2.97Å; E61-F123 VanDerWaalsContact OE2-CD1 3.27Å; E61-F123 WeakPolarHBondContact OE2-CD1 3.44Å; E61-R127 IonicContact OE1-CZ 2.78Å; E61-R127 IonicContact OE1-NE 2.85Å; E61-R127 PolarHBondContact OE1-NE 3.32Å; E61-R127 IonicContact OE1-NH2 3.69Å; E61-R127 IonicContact OE2-CZ 2.84Å; E61-R127 IonicContact OE2-NE 3.49Å; E61-R127 PolarHBondContact OE2-NE 2.84Å; E61-R127 IonicContact OE2-NH2 3.02Å; E61-R127 PolarHBondContact OE2-NH2 3.24Å
62A94.8Very high81.4Confident69 Ų6974.4 Ų74.457%0.5741%0.407SS*.Hα-helixtrans-69.7-30.6178.200000112.2N60 H66N60-A62 PolarHBondContact O-N 3.17Å; N60-A62 VanDerWaalsContact O-N 3.15Å; N60-A62 WeakPolarHBondContact OD1-CB 3.35Å; N60-A62 PolarHBondContact OD1-N 2.9Å; N60-A62 VanDerWaalsContact OD1-N 3.07Å; A62-H66 PolarHBondContact O-N 3.33Å
63K96.5Very high83.1Confident97 Ų9771.4 Ų71.442%0.42239%0.386SS..Hα-helixtrans-70-40.6172.5-65.2-175.1-166.71610111.5N60 E61 D65 H66 L67 D132N60-K63 HydrophobicContact CB-CB 4.36Å; N60-K63 HydrophobicContact CB-CD 4.02Å; N60-K63 HydrophobicContact CB-CG 3.94Å; N60-K63 WeakPolarHBondContact O-CB 3.26Å; N60-K63 PolarHBondContact O-N 2.87Å; N60-K63 PolarHBondContact OD1-N 2.96Å; E61-K63 VanDerWaalsContact C-N 3.32Å; E61-K63 PolarHBondContact O-N 3.14Å; K63-D65 VanDerWaalsContact C-N 3.3Å; K63-D65 PolarHBondContact O-N 3.4Å; K63-H66 PolarHBondContact O-N 2.85Å; K63-L67 WeakPolarHBondContact O-CG 3.2Å; K63-L67 PolarHBondContact O-N 2.86Å; K63-D132 HydrophobicContact CB-CB 4.49Å; K63-D132 WeakPolarHBondContact CB-O 3.41Å; K63-D132 HydrophobicContact CD-CB 4.35Å; K63-D132 WeakPolarHBondContact CD-OD2 3.23Å; K63-D132 IonicContact NZ-OD1 3.67Å; K63-D132 IonicContact NZ-OD2 2.78Å; K63-D132 PolarHBondContact NZ-OD2 2.92Å
64I96.9Very high85.2Confident0 Ų073.7 Ų73.70%041%0.405CS..Hα-helixtrans-62.2-41.7174.8-59.1171.3000109.9I59 N60 E61 L67 F68 F122 F123 F126I59-I64 HydrophobicContact CG2-CD1 3.47Å; I59-I64 VanDerWaalsContact CG2-CD1 3.47Å; I59-I64 HydrophobicContact CG2-CG1 4.46Å; N60-I64 PolarHBondContact O-N 2.98Å; E61-I64 PolarHBondContact O-N 2.77Å; I64-L67 WeakPolarHBondContact O-CB 3.28Å; I64-L67 PolarHBondContact O-N 3.28Å; I64-F68 PolarHBondContact O-N 3.39Å; I64-F122 HydrophobicContact CG2-CD1 4.03Å; I64-F122 HydrophobicContact CG2-CE1 4.04Å; I64-F123 HydrophobicContact CB-CD1 4.15Å; I64-F123 HydrophobicContact CB-CE1 3.98Å; I64-F123 HydrophobicContact CB-CZ 4.45Å; I64-F123 HydrophobicContact CG2-CD1 3.6Å; I64-F123 HydrophobicContact CG2-CD2 3.99Å; I64-F123 HydrophobicContact CG2-CE1 3.75Å; I64-F123 HydrophobicContact CG2-CE2 4.13Å; I64-F123 HydrophobicContact CG2-CG 3.78Å; I64-F123 HydrophobicContact CG2-CZ 4.04Å; I64-F126 HydrophobicContact CD1-CB 3.61Å; I64-F126 HydrophobicContact CD1-CG 4.44Å; I64-F126 HydrophobicContact CG1-CB 3.99Å; I64-F126 HydrophobicContact CG1-CD1 4.4Å; I64-F126 HydrophobicContact CG1-CG 4.29Å; I64-F126 HydrophobicContact CG2-CB 4.19Å; I64-F126 HydrophobicContact CG2-CD2 4.45Å; I64-F126 HydrophobicContact CG2-CG 4.32Å
65D97.6Very high87.7Confident47 Ų4775.8 Ų75.825%0.25140%0.403SS..Hα-helixtrans-59.4-48.3174.3-170.863.3000111.8E61 K63 L67 F68 Q69 R119 F123E61-D65 PolarHBondContact O-N 2.97Å; K63-D65 VanDerWaalsContact C-N 3.3Å; K63-D65 PolarHBondContact O-N 3.4Å; D65-L67 VanDerWaalsContact C-N 3.28Å; D65-L67 PolarHBondContact O-N 3.17Å; D65-F68 WeakPolarHBondContact O-CB 3.43Å; D65-F68 PolarHBondContact O-N 2.85Å; D65-Q69 VanDerWaalsContact O-CG 3.29Å; D65-Q69 WeakPolarHBondContact O-CG 3.49Å; D65-Q69 PolarHBondContact O-N 2.91Å; D65-R119 IonicContact OD1-CZ 2.93Å; D65-R119 IonicContact OD1-NH1 3.95Å; D65-R119 PolarHBondContact OD1-NH1 2.93Å; D65-R119 IonicContact OD1-NH2 2.67Å; D65-R119 PolarHBondContact OD1-NH2 2.94Å; D65-F123 HydrophobicContact CB-CE1 4.46Å; D65-F123 HydrophobicContact CB-CZ 3.81Å
66H97.6Very high90.1Very high138 Ų13871 Ų7164%0.63939%0.386SS*.Hα-helixtrans-58.1-39.8177.1-175.5-77.5000112.6A62 K63 R70A62-H66 PolarHBondContact O-N 3.33Å; K63-H66 PolarHBondContact O-N 2.85Å; H66-R70 PolarHBondContact O-N 3.42Å
67L98Very high92.3Very high20 Ų2071.4 Ų71.411%0.10538%0.378CS..Hα-helixtrans-63.2-47.4172.7-69.5177.5000111.5K63 I64 D65 Q69 R70 Y71 F122 F126 I134K63-L67 WeakPolarHBondContact O-CG 3.2Å; K63-L67 PolarHBondContact O-N 2.86Å; I64-L67 WeakPolarHBondContact O-CB 3.28Å; I64-L67 PolarHBondContact O-N 3.28Å; D65-L67 VanDerWaalsContact C-N 3.28Å; D65-L67 PolarHBondContact O-N 3.17Å; L67-Q69 VanDerWaalsContact C-N 3.31Å; L67-Q69 PolarHBondContact O-N 3.22Å; L67-R70 WeakPolarHBondContact O-CB 3.42Å; L67-R70 PolarHBondContact O-N 2.86Å; L67-Y71 HydrophobicContact CB-CE2 4.16Å; L67-Y71 HydrophobicContact CD2-CE2 4.38Å; L67-Y71 WeakPolarHBondContact O-CD2 3.34Å; L67-Y71 WeakPolarHBondContact O-CE2 3.48Å; L67-Y71 PolarHBondContact O-N 3.08Å; L67-F122 HydrophobicContact CB-CE1 4.03Å; L67-F122 HydrophobicContact CB-CZ 4.06Å; L67-F126 HydrophobicContact CD1-CE1 3.8Å; L67-F126 HydrophobicContact CD1-CZ 3.84Å; L67-I134 HydrophobicContact CD1-CD1 4.44Å; L67-I134 HydrophobicContact CD2-CD1 4.28Å; L67-I134 HydrophobicContact CD2-CG1 3.85Å
68F98.5Very high94.3Very high1 Ų170.5 Ų70.50%0.00437%0.368CS..Hα-helixtrans-59.1-43.2177.8-178.8-92.7000111.7I64 D65 R70 Y71 R72 P77 I80 R119 F122 F123I64-F68 PolarHBondContact O-N 3.39Å; D65-F68 WeakPolarHBondContact O-CB 3.43Å; D65-F68 PolarHBondContact O-N 2.85Å; F68-R70 PolarHBondContact O-N 3.25Å; F68-Y71 PolarHBondContact O-N 3.47Å; F68-Y71 VanDerWaalsContact O-N 3.15Å; F68-R72 HydrophobicContact CD1-CB 4.27Å; F68-R72 HydrophobicContact CE1-CB 3.78Å; F68-R72 HydrophobicContact CZ-CB 3.94Å; F68-R72 WeakPolarHBondContact O-CB 3.38Å; F68-R72 PolarHBondContact O-N 2.86Å; F68-P77 WeakPolarHBondContact CE1-O 3.36Å; F68-I80 HydrophobicContact CD2-CD1 3.88Å; F68-I80 HydrophobicContact CD2-CG1 4.07Å; F68-I80 HydrophobicContact CE2-CD1 4.1Å; F68-I80 HydrophobicContact CE2-CG1 3.83Å; F68-R119 HydrophobicContact CD1-CG 4.24Å; F68-R119 HydrophobicContact CD2-CB 4.35Å; F68-R119 HydrophobicContact CD2-CG 4.27Å; F68-R119 HydrophobicContact CE1-CB 4.08Å; F68-R119 HydrophobicContact CE1-CG 3.97Å; F68-R119 HydrophobicContact CE2-CB 3.66Å; F68-R119 HydrophobicContact CE2-CG 4.03Å; F68-R119 HydrophobicContact CG-CG 4.38Å; F68-R119 HydrophobicContact CZ-CB 3.51Å; F68-R119 HydrophobicContact CZ-CG 3.88Å; F68-F122 HydrophobicContact CB-CD1 3.98Å; F68-F122 HydrophobicContact CB-CE1 4.04Å; F68-F122 HydrophobicContact CD2-CB 4.08Å; F68-F122 AromaticContact CD2-CD1 3.99Å; F68-F122 HydrophobicContact CD2-CD1 3.99Å; F68-F122 HydrophobicContact CD2-CG 4.08Å; F68-F122 HydrophobicContact CG-CD1 4.49Å; F68-F123 HydrophobicContact CB-CE2 3.94Å; F68-F123 HydrophobicContact CG-CE2 4.16Å
69Q97.9Very high95.8Very high77 Ų7769.3 Ų69.336%0.3635%0.352SS..Hα-helixtrans-59.9-31.1176.5-64.7-57.4-2800112.9D65 L67D65-Q69 VanDerWaalsContact O-CG 3.29Å; D65-Q69 WeakPolarHBondContact O-CG 3.49Å; D65-Q69 PolarHBondContact O-N 2.91Å; L67-Q69 VanDerWaalsContact C-N 3.31Å; L67-Q69 PolarHBondContact O-N 3.22Å
70R97.9Very high96.6Very high129 Ų12967 Ų6749%0.48734%0.34SS..Hα-helixtrans-70.5-35.3177.1174.4179.2171.974.7-3.7112.6H66 L67 F68 D92H66-R70 PolarHBondContact O-N 3.42Å; L67-R70 WeakPolarHBondContact O-CB 3.42Å; L67-R70 PolarHBondContact O-N 2.86Å; F68-R70 PolarHBondContact O-N 3.25Å; R70-D92 IonicContact CZ-OD2 3.45Å; R70-D92 IonicContact NE-OD2 2.8Å; R70-D92 PolarHBondContact NE-OD2 3.03Å; R70-D92 IonicContact NH2-OD1 3.1Å; R70-D92 PolarHBondContact NH2-OD1 3.14Å; R70-D92 VanDerWaalsContact NH2-OD1 3.1Å; R70-D92 IonicContact NH2-OD2 3.22Å; R70-D92 PolarHBondContact NH2-OD2 3.47Å
71Y98.3Very high96.9Very high2 Ų265.9 Ų65.91%0.00833%0.334CS..Hα-helixtrans-102.6-18-173.3-52.8-55.2000114.3L67 F68 I80 G84 L87 F88 D92 F122 I134L67-Y71 HydrophobicContact CB-CE2 4.16Å; L67-Y71 HydrophobicContact CD2-CE2 4.38Å; L67-Y71 WeakPolarHBondContact O-CD2 3.34Å; L67-Y71 WeakPolarHBondContact O-CE2 3.48Å; L67-Y71 PolarHBondContact O-N 3.08Å; F68-Y71 PolarHBondContact O-N 3.47Å; F68-Y71 VanDerWaalsContact O-N 3.15Å; Y71-I80 HydrophobicContact CD2-CD1 4.43Å; Y71-G84 WeakPolarHBondContact O-CA 3.42Å; Y71-L87 HydrophobicContact CD1-CB 3.91Å; Y71-L87 HydrophobicContact CE1-CB 4.15Å; Y71-F88 HydrophobicContact CD1-CB 3.99Å; Y71-F88 HydrophobicContact CD2-CB 4.18Å; Y71-F88 HydrophobicContact CD2-CD2 4.02Å; Y71-F88 HydrophobicContact CD2-CG 4.38Å; Y71-F88 HydrophobicContact CE1-CB 4.07Å; Y71-F88 HydrophobicContact CE2-CB 4.27Å; Y71-F88 AromaticContact CE2-CD2 3.54Å; Y71-F88 HydrophobicContact CE2-CD2 3.54Å; Y71-F88 HydrophobicContact CE2-CE2 4.32Å; Y71-F88 HydrophobicContact CE2-CG 4.28Å; Y71-F88 HydrophobicContact CG-CB 4.07Å; Y71-F88 AromaticContact CZ-CD2 3.84Å; Y71-D92 WeakPolarHBondContact CE1-OD2 3.11Å; Y71-D92 VanDerWaalsContact CZ-OD2 3.24Å; Y71-D92 WeakPolarHBondContact OH-CB 3.29Å; Y71-D92 PolarHBondContact OH-OD2 3.35Å; Y71-F122 HydrophobicContact CD2-CE2 4.19Å; Y71-F122 AromaticContact CD2-CZ 3.97Å; Y71-F122 HydrophobicContact CD2-CZ 3.97Å; Y71-F122 HydrophobicContact CE2-CZ 4.19Å; Y71-I134 HydrophobicContact CE2-CD1 4.3Å; Y71-I134 VanDerWaalsContact OH-CD1 3.31Å; Y71-I134 WeakPolarHBondContact OH-CD1 3Å
72R98.2Very high97.1Very high103 Ų10365.9 Ų65.939%0.38935%0.347SS..SBendtrans-59.6150.3-176.169.4174.8-175.4148.4-4112.2F68 R79F68-R72 HydrophobicContact CD1-CB 4.27Å; F68-R72 HydrophobicContact CE1-CB 3.78Å; F68-R72 HydrophobicContact CZ-CB 3.94Å; F68-R72 WeakPolarHBondContact O-CB 3.38Å; F68-R72 PolarHBondContact O-N 2.86Å; R72-R79 CarbonylContact C-O 3.54Å; R72-R79 WeakPolarHBondContact CA-O 3.28Å; R72-R79 WeakPolarHBondContact CB-O 3.38Å
73D98.1Very high97.3Very high35 Ų3567.1 Ų67.119%0.18735%0.347CS..  trans-73.2141.7173.8-173.6-90.9000111.2Q75 C76 P77 R79 L81D73-Q75 VanDerWaalsContact C-N 3.33Å; D73-Q75 PolarHBondContact O-N 3.49Å; D73-Q75 WeakPolarHBondContact OD1-CA 3.46Å; D73-Q75 WeakPolarHBondContact OD1-CB 3.32Å; D73-Q75 PolarHBondContact OD1-N 3.31Å; D73-C76 HydrophobicContact CB-CB 4.19Å; D73-C76 CarbonylContact O-C 3.5Å; D73-C76 PolarHBondContact OD1-N 2.95Å; D73-P77 WeakPolarHBondContact O-CA 3.44Å; D73-R79 PolarHBondContact N-O 2.87Å; D73-L81 HydrophobicContact CB-CB 4.2Å; D73-L81 HydrophobicContact CB-CD1 3.84Å; D73-L81 HydrophobicContact CB-CG 3.77Å
74S96.3Very high97.3Very high112 Ų11262.8 Ų62.878%0.78333%0.33SS*.SBendtrans-70.7-28-178.364.60000113.6
75Q96.3Very high97.4Very high169 Ų16963.8 Ų63.879%0.7934%0.335SS*.SBendtrans-93.3-30.4179.9-54.9-178.99.500111.2D73 P77D73-Q75 VanDerWaalsContact C-N 3.33Å; D73-Q75 PolarHBondContact O-N 3.49Å; D73-Q75 WeakPolarHBondContact OD1-CA 3.46Å; D73-Q75 WeakPolarHBondContact OD1-CB 3.32Å; D73-Q75 PolarHBondContact OD1-N 3.31Å; Q75-P77 WeakPolarHBondContact O-CD 3.27Å
76C95.9Very high97.4Very high46 Ų4667.1 Ų67.131%0.31135%0.349SS..  trans-118.377.3177.1-64.10000110.9D73 D78 R79 L81D73-C76 HydrophobicContact CB-CB 4.19Å; D73-C76 CarbonylContact O-C 3.5Å; D73-C76 PolarHBondContact OD1-N 2.95Å; C76-D78 PolarHBondContact O-N 3.3Å; C76-R79 HydrophobicContact CB-CB 4.29Å; C76-R79 PolarHBondContact O-N 2.89Å; C76-R79 VanDerWaalsContact O-O 3.14Å; C76-L81 HydrophobicContact CB-CD1 4.25Å
77P94.6Very high97.4Very high62 Ų6263.6 Ų63.640%0.40333%0.334SS..THydrogen-bonded Turntrans-66.9-10.9-16927.1-36.7000115.1F68 D73 Q75F68-P77 WeakPolarHBondContact CE1-O 3.36Å; D73-P77 WeakPolarHBondContact O-CA 3.44Å; Q75-P77 WeakPolarHBondContact O-CD 3.27Å
78D96.8Very high97.4Very high81 Ų8162.6 Ų62.643%0.43333%0.329SS..THydrogen-bonded Turntrans-91.52174.966.1-49.3000113.1C76 T118 R119C76-D78 PolarHBondContact O-N 3.3Å; D78-T118 CarbonylContact O-C 3.37Å; D78-R119 PolarHBondContact O-N 3.4Å
79R98Very high97.4Very high75 Ų7563 Ų6328%0.28333%0.331SS..EExtended strand (participates in β ladder)trans-136.9153.5-174.4-63.2175.9179-98.6-5.7112.6R72 D73 C76 L81 E116 F117 T118R72-R79 CarbonylContact C-O 3.54Å; R72-R79 WeakPolarHBondContact CA-O 3.28Å; R72-R79 WeakPolarHBondContact CB-O 3.38Å; D73-R79 PolarHBondContact N-O 2.87Å; C76-R79 HydrophobicContact CB-CB 4.29Å; C76-R79 PolarHBondContact O-N 2.89Å; C76-R79 VanDerWaalsContact O-O 3.14Å; R79-L81 HydrophobicContact CB-CD2 4Å; R79-L81 HydrophobicContact CB-CG 4.43Å; R79-E116 IonicContact CZ-OE1 2.75Å; R79-E116 IonicContact CZ-OE2 2.66Å; R79-E116 IonicContact NH1-OE1 3.6Å; R79-E116 PolarHBondContact NH1-OE1 3.33Å; R79-E116 IonicContact NH1-OE2 2.85Å; R79-E116 PolarHBondContact NH1-OE2 3.29Å; R79-F117 CarbonylContact C-O 3.45Å; R79-F117 WeakPolarHBondContact CA-O 3.42Å; R79-T118 HydrophobicContact CG-CG2 4.46Å
80I98.4Very high97.4Very high0 Ų062.1 Ų62.10%033%0.331CS..EExtended strand (participates in β ladder)trans-104115.9164.1-61.9172000105.2F68 Y71 G84 M85 E116 F117 F122F68-I80 HydrophobicContact CD2-CD1 3.88Å; F68-I80 HydrophobicContact CD2-CG1 4.07Å; F68-I80 HydrophobicContact CE2-CD1 4.1Å; F68-I80 HydrophobicContact CE2-CG1 3.83Å; Y71-I80 HydrophobicContact CD2-CD1 4.43Å; I80-G84 VanDerWaalsContact CG2-C 3.42Å; I80-M85 HydrophobicContact CB-SD 4.44Å; I80-M85 HydrophobicContact CG2-CG 3.97Å; I80-M85 HydrophobicContact CG2-SD 3.73Å; I80-E116 CarbonylContact O-C 3.5Å; I80-E116 WeakPolarHBondContact O-CA 3.18Å; I80-E116 VanDerWaalsContact O-CB 3.27Å; I80-E116 WeakPolarHBondContact O-CB 3.45Å; I80-F117 HydrophobicContact CB-CB 4.46Å; I80-F117 PolarHBondContact N-O 2.85Å; I80-F117 PolarHBondContact O-N 3.49Å; I80-F122 HydrophobicContact CD1-CB 4.43Å; I80-F122 HydrophobicContact CD1-CD2 3.39Å; I80-F122 HydrophobicContact CD1-CE2 3.64Å; I80-F122 HydrophobicContact CD1-CG 3.93Å; I80-F122 HydrophobicContact CD1-CZ 4.37Å
81L97.6Very high97.4Very high48 Ų4859.2 Ų59.225%0.25133%0.328SS..  trans-103.2-168.2178.3-57.6-176000110.5D73 C76 R79 T83 G84 M85 E116D73-L81 HydrophobicContact CB-CB 4.2Å; D73-L81 HydrophobicContact CB-CD1 3.84Å; D73-L81 HydrophobicContact CB-CG 3.77Å; C76-L81 HydrophobicContact CB-CD1 4.25Å; R79-L81 HydrophobicContact CB-CD2 4Å; R79-L81 HydrophobicContact CB-CG 4.43Å; L81-T83 PolarHBondContact O-N 3.25Å; L81-G84 CarbonylContact O-C 3.31Å; L81-G84 WeakPolarHBondContact O-CA 3.13Å; L81-G84 PolarHBondContact O-N 3.04Å; L81-M85 WeakPolarHBondContact O-CG 3.39Å; L81-M85 PolarHBondContact O-N 2.92Å; L81-E116 HydrophobicContact CD2-CB 3.85Å; L81-E116 WeakPolarHBondContact CD2-OE2 3.31Å
82A96.1Very high97.4Very high73 Ų7360.4 Ų60.460%0.60333%0.334SS*.Hα-helixtrans-44.5-52.5-172.800000114.8G84 M85 E86A82-G84 VanDerWaalsContact C-N 3.35Å; A82-G84 PolarHBondContact O-N 3.44Å; A82-M85 PolarHBondContact O-N 2.91Å; A82-E86 PolarHBondContact O-N 3.24Å
83T97.2Very high97.4Very high94 Ų9455.6 Ų55.658%0.57732%0.316SS*.Hα-helixtrans-63.1-40.8179.5-53.20000112.3L81 E86 L87L81-T83 PolarHBondContact O-N 3.25Å; T83-E86 PolarHBondContact O-N 2.75Å; T83-L87 WeakPolarHBondContact O-CG 3.44Å; T83-L87 PolarHBondContact O-N 3.22Å; T83-L87 VanDerWaalsContact O-N 3.11Å
84G98.2Very high97.4Very high6 Ų660.5 Ų60.56%0.06234%0.338CS..Hα-helixtrans-67.8-39.2176.800000112.8Y71 I80 L81 A82 L87 F88Y71-G84 WeakPolarHBondContact O-CA 3.42Å; I80-G84 VanDerWaalsContact CG2-C 3.42Å; L81-G84 CarbonylContact O-C 3.31Å; L81-G84 WeakPolarHBondContact O-CA 3.13Å; L81-G84 PolarHBondContact O-N 3.04Å; A82-G84 VanDerWaalsContact C-N 3.35Å; A82-G84 PolarHBondContact O-N 3.44Å; G84-L87 PolarHBondContact O-N 2.87Å; G84-F88 WeakPolarHBondContact O-CB 3.32Å; G84-F88 PolarHBondContact O-N 3.39Å
85M98Very high97.4Very high21 Ų2155.7 Ų55.710%0.10330%0.303CS..Hα-helixtrans-63.8-41.4175.5-71-57.5-65.500111.4I80 L81 A82 F88 L89 F117I80-M85 HydrophobicContact CB-SD 4.44Å; I80-M85 HydrophobicContact CG2-CG 3.97Å; I80-M85 HydrophobicContact CG2-SD 3.73Å; L81-M85 WeakPolarHBondContact O-CG 3.39Å; L81-M85 PolarHBondContact O-N 2.92Å; A82-M85 PolarHBondContact O-N 2.91Å; M85-F88 PolarHBondContact O-N 3.47Å; M85-L89 HydrophobicContact CE-CD1 3.78Å; M85-L89 HydrophobicContact CE-CG 4.31Å; M85-L89 WeakPolarHBondContact O-CB 3.43Å; M85-L89 WeakPolarHBondContact O-CG 2.93Å; M85-L89 PolarHBondContact O-N 3.23Å; M85-F117 HydrophobicContact CE-CD2 3.94Å; M85-F117 HydrophobicContact CE-CE2 3.65Å; M85-F117 HydrophobicContact CE-CZ 3.97Å; M85-F117 HydrophobicContact SD-CD2 3.62Å; M85-F117 HydrophobicContact SD-CE2 3.97Å; M85-F117 HydrophobicContact SD-CG 4.11Å
86E97.8Very high97.5Very high118 Ų11852.4 Ų52.455%0.55129%0.291SS*.Hα-helixtrans-62.9-45.7175.2-174.6179.2-17700111.7A82 T83 F88 V90 T91A82-E86 PolarHBondContact O-N 3.24Å; T83-E86 PolarHBondContact O-N 2.75Å; E86-F88 VanDerWaalsContact C-N 3.34Å; E86-F88 PolarHBondContact O-N 3.45Å; E86-V90 HydrophobicContact CG-CB 4.45Å; E86-V90 HydrophobicContact CG-CG2 4.23Å; E86-V90 WeakPolarHBondContact O-CA 3.27Å; E86-V90 VanDerWaalsContact O-CB 3.28Å; E86-V90 WeakPolarHBondContact O-CB 3.29Å; E86-V90 PolarHBondContact O-N 3.27Å; E86-T91 PolarHBondContact O-N 3.33Å
87L98.1Very high97.5Very high63 Ų6353.5 Ų53.533%0.3330%0.297SS..Iπ-helixtrans-61-43.1174.4-70.6175.9000111.8Y71 T83 G84 T91 D92Y71-L87 HydrophobicContact CD1-CB 3.91Å; Y71-L87 HydrophobicContact CE1-CB 4.15Å; T83-L87 WeakPolarHBondContact O-CG 3.44Å; T83-L87 PolarHBondContact O-N 3.22Å; T83-L87 VanDerWaalsContact O-N 3.11Å; G84-L87 PolarHBondContact O-N 2.87Å; L87-T91 VanDerWaalsContact O-CB 3.31Å; L87-T91 WeakPolarHBondContact O-CB 3.45Å; L87-T91 PolarHBondContact O-N 3.41Å; L87-D92 WeakPolarHBondContact O-CB 3.47Å; L87-D92 PolarHBondContact O-N 3.46Å
88F98.4Very high97.5Very high0 Ų058 Ų580%031%0.313CS..Iπ-helixtrans-68.3-53.2-178.6176.4-122000112.6Y71 G84 M85 E86 L93 F117 F122 F126 I134 L137Y71-F88 HydrophobicContact CD1-CB 3.99Å; Y71-F88 HydrophobicContact CD2-CB 4.18Å; Y71-F88 HydrophobicContact CD2-CD2 4.02Å; Y71-F88 HydrophobicContact CD2-CG 4.38Å; Y71-F88 HydrophobicContact CE1-CB 4.07Å; Y71-F88 HydrophobicContact CE2-CB 4.27Å; Y71-F88 AromaticContact CE2-CD2 3.54Å; Y71-F88 HydrophobicContact CE2-CD2 3.54Å; Y71-F88 HydrophobicContact CE2-CE2 4.32Å; Y71-F88 HydrophobicContact CE2-CG 4.28Å; Y71-F88 HydrophobicContact CG-CB 4.07Å; Y71-F88 AromaticContact CZ-CD2 3.84Å; G84-F88 WeakPolarHBondContact O-CB 3.32Å; G84-F88 PolarHBondContact O-N 3.39Å; M85-F88 PolarHBondContact O-N 3.47Å; E86-F88 VanDerWaalsContact C-N 3.34Å; E86-F88 PolarHBondContact O-N 3.45Å; F88-L93 HydrophobicContact CD1-CD1 4.3Å; F88-L93 HydrophobicContact CD2-CD1 4.17Å; F88-L93 HydrophobicContact CE1-CD1 3.84Å; F88-L93 HydrophobicContact CE2-CD1 3.72Å; F88-L93 HydrophobicContact CE2-CG 4.29Å; F88-L93 HydrophobicContact CG-CD1 4.46Å; F88-L93 HydrophobicContact CZ-CD1 3.55Å; F88-L93 WeakPolarHBondContact O-CB 3.42Å; F88-L93 WeakPolarHBondContact O-CG 3.48Å; F88-L93 PolarHBondContact O-N 3.02Å; F88-F117 HydrophobicContact CD1-CE2 4.33Å; F88-F117 AromaticContact CE1-CE2 3.98Å; F88-F117 HydrophobicContact CE1-CE2 3.98Å; F88-F122 HydrophobicContact CD2-CE2 4.24Å; F88-F122 HydrophobicContact CE1-CE2 4.38Å; F88-F122 AromaticContact CE2-CE2 3.95Å; F88-F122 HydrophobicContact CE2-CE2 3.95Å; F88-F122 HydrophobicContact CE2-CZ 4.31Å; F88-F122 HydrophobicContact CZ-CE2 4.01Å; F88-F126 HydrophobicContact CE2-CE2 4.21Å; F88-F126 HydrophobicContact CE2-CZ 4.05Å; F88-F126 HydrophobicContact CZ-CE2 4.16Å; F88-F126 HydrophobicContact CZ-CZ 4.31Å; F88-I134 HydrophobicContact CD2-CD1 3.83Å; F88-I134 HydrophobicContact CE2-CD1 3.61Å; F88-L137 HydrophobicContact CE2-CD2 4.06Å; F88-L137 HydrophobicContact CZ-CD2 3.64Å
89L98.2Very high97.5Very high8 Ų855.5 Ų55.54%0.04230%0.302CS..Iπ-helixtrans-78.4-54.2-174.2-66.3172.7000112M85 L93 H94 I95 T102 L105M85-L89 HydrophobicContact CE-CD1 3.78Å; M85-L89 HydrophobicContact CE-CG 4.31Å; M85-L89 WeakPolarHBondContact O-CB 3.43Å; M85-L89 WeakPolarHBondContact O-CG 2.93Å; M85-L89 PolarHBondContact O-N 3.23Å; L89-L93 HydrophobicContact CD2-CD1 4.3Å; L89-L93 CarbonylContact O-C 3.59Å; L89-L93 WeakPolarHBondContact O-CB 3.11Å; L89-H94 PolarHBondContact O-N 3.46Å; L89-I95 PolarHBondContact O-N 2.92Å; L89-T102 HydrophobicContact CD1-CG2 3.66Å; L89-T102 HydrophobicContact CD2-CG2 4.33Å; L89-L105 HydrophobicContact CD2-CD1 4.13Å
90V98Very high97.5Very high59 Ų5954.2 Ų54.236%0.35830%0.301SS..Iπ-helixtrans-81.2-52.1-170.9-172.80000110.7E86 H94 P97E86-V90 HydrophobicContact CG-CB 4.45Å; E86-V90 HydrophobicContact CG-CG2 4.23Å; E86-V90 WeakPolarHBondContact O-CA 3.27Å; E86-V90 VanDerWaalsContact O-CB 3.28Å; E86-V90 WeakPolarHBondContact O-CB 3.29Å; E86-V90 PolarHBondContact O-N 3.27Å; V90-H94 WeakPolarHBondContact O-CA 3.32Å; V90-H94 PolarHBondContact O-N 3.34Å; V90-P97 HydrophobicContact CG2-CG 3.52Å
91T97.9Very high97.5Very high68 Ų6855.2 Ų55.242%0.41731%0.306SS..Iπ-helixtrans-75.5-53-172.6-57.10000111.5E86 L87 H94E86-T91 PolarHBondContact O-N 3.33Å; L87-T91 VanDerWaalsContact O-CB 3.31Å; L87-T91 WeakPolarHBondContact O-CB 3.45Å; L87-T91 PolarHBondContact O-N 3.41Å; T91-H94 PolarHBondContact O-CE1 3.27Å; T91-H94 PolarHBondContact O-ND1 2.99Å; T91-H94 VanDerWaalsContact O-ND1 3.16Å
92D97.7Very high97.5Very high27 Ų2753.9 Ų53.914%0.14430%0.3CS..Iπ-helixtrans-91.2-38.5-170.9-71.2-12.3000112.1R70 Y71 L87 I134 R138R70-D92 IonicContact CZ-OD2 3.45Å; R70-D92 IonicContact NE-OD2 2.8Å; R70-D92 PolarHBondContact NE-OD2 3.03Å; R70-D92 IonicContact NH2-OD1 3.1Å; R70-D92 PolarHBondContact NH2-OD1 3.14Å; R70-D92 VanDerWaalsContact NH2-OD1 3.1Å; R70-D92 IonicContact NH2-OD2 3.22Å; R70-D92 PolarHBondContact NH2-OD2 3.47Å; Y71-D92 WeakPolarHBondContact CE1-OD2 3.11Å; Y71-D92 VanDerWaalsContact CZ-OD2 3.24Å; Y71-D92 WeakPolarHBondContact OH-CB 3.29Å; Y71-D92 PolarHBondContact OH-OD2 3.35Å; L87-D92 WeakPolarHBondContact O-CB 3.47Å; L87-D92 PolarHBondContact O-N 3.46Å; D92-I134 HydrophobicContact CB-CD1 4.41Å; D92-I134 HydrophobicContact CB-CG1 4.3Å; D92-I134 HydrophobicContact CB-CG2 4.19Å; D92-I134 VanDerWaalsContact O-CG2 3.25Å; D92-I134 WeakPolarHBondContact O-CG2 3.48Å; D92-R138 PolarHBondContact O-NH2 3.12Å
93L97.9Very high97.6Very high3 Ų350.6 Ų50.62%0.01627%0.272CS..Iπ-helixtrans-87.7-21177.2-74.6170.6000114.6F88 L89 I95 L105 I134 L137 R138F88-L93 HydrophobicContact CD1-CD1 4.3Å; F88-L93 HydrophobicContact CD2-CD1 4.17Å; F88-L93 HydrophobicContact CE1-CD1 3.84Å; F88-L93 HydrophobicContact CE2-CD1 3.72Å; F88-L93 HydrophobicContact CE2-CG 4.29Å; F88-L93 HydrophobicContact CG-CD1 4.46Å; F88-L93 HydrophobicContact CZ-CD1 3.55Å; F88-L93 WeakPolarHBondContact O-CB 3.42Å; F88-L93 WeakPolarHBondContact O-CG 3.48Å; F88-L93 PolarHBondContact O-N 3.02Å; L89-L93 HydrophobicContact CD2-CD1 4.3Å; L89-L93 CarbonylContact O-C 3.59Å; L89-L93 WeakPolarHBondContact O-CB 3.11Å; L93-I95 HydrophobicContact CB-CD1 3.76Å; L93-I95 HydrophobicContact CB-CG1 3.91Å; L93-I95 HydrophobicContact CD1-CD1 4.05Å; L93-I95 HydrophobicContact CG-CD1 4.42Å; L93-L105 HydrophobicContact CD1-CD1 4.04Å; L93-I134 HydrophobicContact CD2-CG2 3.98Å; L93-I134 HydrophobicContact CG-CG2 4.44Å; L93-L137 HydrophobicContact CD1-CD2 3.97Å; L93-L137 HydrophobicContact CD2-CB 4.27Å; L93-L137 HydrophobicContact CD2-CD2 4.06Å; L93-L137 HydrophobicContact CD2-CG 4.06Å; L93-R138 HydrophobicContact CD2-CB 4.38Å
94H97.5Very high97.7Very high138 Ų13846.1 Ų46.164%0.63924%0.244SC*.  trans62.243.1-173.3-48.9-50.6000113.5L89 V90 T91L89-H94 PolarHBondContact O-N 3.46Å; V90-H94 WeakPolarHBondContact O-CA 3.32Å; V90-H94 PolarHBondContact O-N 3.34Å; T91-H94 PolarHBondContact O-CE1 3.27Å; T91-H94 PolarHBondContact O-ND1 2.99Å; T91-H94 VanDerWaalsContact O-ND1 3.16Å
95I97.7Very high97.7Very high11 Ų1145.9 Ų45.96%0.05624%0.242CC..  trans-112.6138.8-179.8-63.3174.1000109.4L89 L93 S99 I101 T102 L105 L141L89-I95 PolarHBondContact O-N 2.92Å; L93-I95 HydrophobicContact CB-CD1 3.76Å; L93-I95 HydrophobicContact CB-CG1 3.91Å; L93-I95 HydrophobicContact CD1-CD1 4.05Å; L93-I95 HydrophobicContact CG-CD1 4.42Å; I95-S99 WeakPolarHBondContact CG2-OG 3.38Å; I95-I101 HydrophobicContact CD1-CG1 4.38Å; I95-I101 HydrophobicContact CD1-CG2 4.37Å; I95-I101 HydrophobicContact CG1-CG2 4.39Å; I95-I101 HydrophobicContact CG2-CG2 3.57Å; I95-T102 WeakPolarHBondContact CG2-OG1 3.32Å; I95-L105 HydrophobicContact CD1-CD1 3.67Å; I95-L141 HydrophobicContact CD1-CD1 3.62Å; I95-L141 HydrophobicContact CD1-CD2 3.97Å; I95-L141 HydrophobicContact CD1-CG 4.45Å; I95-L141 HydrophobicContact CG1-CD1 4.06Å
96D97Very high97.7Very high99 Ų9945 Ų4553%0.52924%0.238SC..  trans-70.1122.9168.5178.6-3.2000110.4E98 S99 T102D96-E98 PolarHBondContact O-N 2.94Å; D96-E98 VanDerWaalsContact O-N 3.1Å; D96-E98 PolarHBondContact OD1-N 2.88Å; D96-S99 VanDerWaalsContact O-CB 3.29Å; D96-S99 WeakPolarHBondContact O-CB 3.48Å; D96-S99 PolarHBondContact O-N 3.44Å; D96-S99 PolarHBondContact O-OG 2.68Å; D96-T102 PolarHBondContact O-OG1 2.94Å
97P96Very high97.7Very high69 Ų6940.9 Ų40.945%0.44822%0.217SC..THydrogen-bonded Turntrans-56.2-25.1178.8-25.336.4000114.3V90 T102V90-P97 HydrophobicContact CG2-CG 3.52Å; P97-T102 WeakPolarHBondContact O-CG2 3.26Å
98E95.2Very high97.7Very high157 Ų15739.7 Ų39.773%0.73421%0.21SC*.THydrogen-bonded Turntrans-93.47.3180-62.1-176.1-167.200113.1D96 I186D96-E98 PolarHBondContact O-N 2.94Å; D96-E98 VanDerWaalsContact O-N 3.1Å; D96-E98 PolarHBondContact OD1-N 2.88Å; E98-I186 VanDerWaalsContact O-CD1 3.25Å; E98-I186 WeakPolarHBondContact O-CD1 3.46Å; E98-I186 WeakPolarHBondContact O-CG1 3.45Å
99S96.9Very high97.7Very high28 Ų2839.7 Ų39.720%0.19621%0.21CC..SBendtrans-85.2158.1-178.769.60000114.2I95 D96 I101 T102 L103I95-S99 WeakPolarHBondContact CG2-OG 3.38Å; D96-S99 VanDerWaalsContact O-CB 3.29Å; D96-S99 WeakPolarHBondContact O-CB 3.48Å; D96-S99 PolarHBondContact O-N 3.44Å; D96-S99 PolarHBondContact O-OG 2.68Å; S99-I101 VanDerWaalsContact C-N 3.26Å; S99-I101 PolarHBondContact O-N 3.4Å; S99-I101 WeakPolarHBondContact OG-CG2 3.38Å; S99-T102 WeakPolarHBondContact O-CB 3.29Å; S99-T102 PolarHBondContact O-N 2.87Å; S99-T102 VanDerWaalsContact O-N 3.12Å; S99-T102 PolarHBondContact OG-N 2.86Å; S99-T102 PolarHBondContact OG-OG1 2.82Å; S99-L103 PolarHBondContact O-N 3.39Å
100L97.9Very high97.6Very high49 Ų4942 Ų4226%0.25723%0.226SC..Hα-helixtrans-57.4-36.7174-178.258.5000112.9T102 L103 I104 I148 L157 I186 L187L100-T102 VanDerWaalsContact C-N 3.32Å; L100-T102 PolarHBondContact O-N 2.79Å; L100-L103 PolarHBondContact O-N 3.16Å; L100-I104 HydrophobicContact CD1-CD1 4.48Å; L100-I104 HydrophobicContact CD1-CG1 4.48Å; L100-I104 HydrophobicContact CG-CD1 3.97Å; L100-I104 HydrophobicContact CG-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.49Å; L100-I104 PolarHBondContact O-N 3.48Å; L100-I148 HydrophobicContact CD1-CD1 4.42Å; L100-I148 HydrophobicContact CD2-CD1 3.49Å; L100-I148 VanDerWaalsContact CD2-CD1 3.49Å; L100-I148 HydrophobicContact CG-CD1 4.09Å; L100-L157 HydrophobicContact CD1-CD2 4.13Å; L100-I186 HydrophobicContact CB-CG2 4.01Å; L100-I186 HydrophobicContact CD1-CG2 3.87Å; L100-L187 HydrophobicContact CD1-CD2 4.38Å
101I98Very high97.6Very high20 Ų2039.3 Ų39.310%0.10321%0.21CC..Hα-helixtrans-68-31.3178.8-173.556.5000112.3I95 S99 I104 L105 L141 L144 L145I95-I101 HydrophobicContact CD1-CG1 4.38Å; I95-I101 HydrophobicContact CD1-CG2 4.37Å; I95-I101 HydrophobicContact CG1-CG2 4.39Å; I95-I101 HydrophobicContact CG2-CG2 3.57Å; S99-I101 VanDerWaalsContact C-N 3.26Å; S99-I101 PolarHBondContact O-N 3.4Å; S99-I101 WeakPolarHBondContact OG-CG2 3.38Å; I101-I104 HydrophobicContact CD1-CB 4.2Å; I101-I104 HydrophobicContact CD1-CD1 4.4Å; I101-I104 HydrophobicContact CD1-CG2 4.24Å; I101-I104 PolarHBondContact O-N 2.98Å; I101-L105 WeakPolarHBondContact O-CG 3.36Å; I101-L105 PolarHBondContact O-N 3.16Å; I101-L141 HydrophobicContact CD1-CB 4.21Å; I101-L141 HydrophobicContact CD1-CD2 3.99Å; I101-L141 HydrophobicContact CG1-CB 4.21Å; I101-L141 HydrophobicContact CG1-CD2 3.89Å; I101-L141 HydrophobicContact CG1-CG 4.46Å; I101-L144 HydrophobicContact CD1-CB 4.14Å; I101-L145 HydrophobicContact CB-CD2 4.2Å; I101-L145 HydrophobicContact CB-CG 4.48Å; I101-L145 HydrophobicContact CD1-CD2 4.47Å; I101-L145 HydrophobicContact CD1-CG 4.14Å
102T98.1Very high97.4Very high21 Ų2142.8 Ų42.813%0.12922%0.22CC..Hα-helixtrans-61.9-46171.4-63.90000111.1L89 I95 D96 P97 S99 L100 L105 A106L89-T102 HydrophobicContact CD1-CG2 3.66Å; L89-T102 HydrophobicContact CD2-CG2 4.33Å; I95-T102 WeakPolarHBondContact CG2-OG1 3.32Å; D96-T102 PolarHBondContact O-OG1 2.94Å; P97-T102 WeakPolarHBondContact O-CG2 3.26Å; S99-T102 WeakPolarHBondContact O-CB 3.29Å; S99-T102 PolarHBondContact O-N 2.87Å; S99-T102 VanDerWaalsContact O-N 3.12Å; S99-T102 PolarHBondContact OG-N 2.86Å; S99-T102 PolarHBondContact OG-OG1 2.82Å; L100-T102 VanDerWaalsContact C-N 3.32Å; L100-T102 PolarHBondContact O-N 2.79Å; T102-L105 PolarHBondContact O-N 3Å; T102-A106 PolarHBondContact O-N 3.28Å
103L98.4Very high97.2Very high4 Ų442 Ų422%0.02122%0.216CC..Hα-helixtrans-64.5-39.9176.9-17855.5000112.1S99 L100 L105 A106 W107 L157 T161 F164 Y183 I186 L187S99-L103 PolarHBondContact O-N 3.39Å; L100-L103 PolarHBondContact O-N 3.16Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 2.97Å; L103-A106 PolarHBondContact O-N 2.87Å; L103-W107 PolarHBondContact O-N 3.21Å; L103-L157 HydrophobicContact CG-CD1 4.08Å; L103-T161 HydrophobicContact CD1-CG2 4.09Å; L103-T161 HydrophobicContact CD2-CG2 4.04Å; L103-F164 HydrophobicContact CD1-CD1 3.84Å; L103-F164 HydrophobicContact CD1-CE1 3.96Å; L103-Y183 HydrophobicContact CD1-CD1 4.21Å; L103-Y183 HydrophobicContact CD1-CE1 3.88Å; L103-Y183 HydrophobicContact CD2-CD1 4.01Å; L103-Y183 HydrophobicContact CD2-CE1 4.42Å; L103-I186 HydrophobicContact CB-CG2 4.5Å; L103-I186 HydrophobicContact CD2-CG2 3.96Å; L103-L187 HydrophobicContact CD2-CD1 4.35Å; L103-L187 HydrophobicContact CD2-CD2 3.78Å; L103-L187 HydrophobicContact CD2-CG 3.92Å
104I98.4Very high97Very high0 Ų043.8 Ų43.80%022%0.224CC..Hα-helixtrans-61.1-42.3174.1-69.3166.5000111L100 I101 W107 K108 L144 L145 I148 L157L100-I104 HydrophobicContact CD1-CD1 4.48Å; L100-I104 HydrophobicContact CD1-CG1 4.48Å; L100-I104 HydrophobicContact CG-CD1 3.97Å; L100-I104 HydrophobicContact CG-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.49Å; L100-I104 PolarHBondContact O-N 3.48Å; I101-I104 HydrophobicContact CD1-CB 4.2Å; I101-I104 HydrophobicContact CD1-CD1 4.4Å; I101-I104 HydrophobicContact CD1-CG2 4.24Å; I101-I104 PolarHBondContact O-N 2.98Å; I104-W107 HydrophobicContact CG2-CE3 4.3Å; I104-W107 PolarHBondContact O-N 2.99Å; I104-K108 HydrophobicContact CG2-CG 4.21Å; I104-K108 VanDerWaalsContact O-CG 3.32Å; I104-K108 WeakPolarHBondContact O-CG 3.44Å; I104-K108 PolarHBondContact O-N 3.31Å; I104-L144 HydrophobicContact CG2-CB 3.79Å; I104-L145 HydrophobicContact CD1-CD2 3.88Å; I104-I148 HydrophobicContact CD1-CD1 3.81Å; I104-I148 HydrophobicContact CD1-CG1 3.9Å; I104-I148 HydrophobicContact CD1-CG2 3.87Å; I104-I148 HydrophobicContact CG1-CG2 3.98Å; I104-L157 HydrophobicContact CG1-CD1 4.5Å; I104-L157 HydrophobicContact CG1-CD2 3.81Å
105L98.4Very high96.9Very high1 Ų139.5 Ų39.51%0.00522%0.217CC..Hα-helixtrans-61.7-46.1175.8-74.7174.5000111.2L89 L93 I95 I101 T102 L103 W107 K108 F109 L129 L137 L141 L144L89-L105 HydrophobicContact CD2-CD1 4.13Å; L93-L105 HydrophobicContact CD1-CD1 4.04Å; I95-L105 HydrophobicContact CD1-CD1 3.67Å; I101-L105 WeakPolarHBondContact O-CG 3.36Å; I101-L105 PolarHBondContact O-N 3.16Å; T102-L105 PolarHBondContact O-N 3Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 2.97Å; L105-W107 VanDerWaalsContact C-N 3.29Å; L105-W107 PolarHBondContact O-N 3.39Å; L105-K108 PolarHBondContact O-N 3.08Å; L105-F109 HydrophobicContact CD2-CE2 4.28Å; L105-F109 WeakPolarHBondContact O-CB 3.27Å; L105-F109 WeakPolarHBondContact O-CD2 3.35Å; L105-F109 PolarHBondContact O-N 2.97Å; L105-L129 HydrophobicContact CD2-CD1 4.47Å; L105-L137 HydrophobicContact CD2-CD1 3.97Å; L105-L141 HydrophobicContact CD1-CD2 4.04Å; L105-L141 HydrophobicContact CD2-CD2 3.97Å; L105-L141 HydrophobicContact CG-CD2 4.26Å; L105-L144 HydrophobicContact CD2-CD1 3.99Å
106A98.3Very high96.8Very high3 Ų340.6 Ų40.63%0.02522%0.222CC..Hα-helixtrans-57.4-42.1175.600000112.4T102 L103 F109 S110 A111 F117 F160 F164T102-A106 PolarHBondContact O-N 3.28Å; L103-A106 PolarHBondContact O-N 2.87Å; A106-F109 PolarHBondContact O-N 3.45Å; A106-S110 PolarHBondContact O-N 3.44Å; A106-S110 VanDerWaalsContact O-N 3.1Å; A106-A111 HydrophobicContact CB-CB 4.26Å; A106-A111 WeakPolarHBondContact O-CB 3.32Å; A106-A111 PolarHBondContact O-N 3.48Å; A106-F117 HydrophobicContact CB-CE1 4.35Å; A106-F160 HydrophobicContact CB-CE1 4.43Å; A106-F164 HydrophobicContact CB-CD2 4.25Å; A106-F164 HydrophobicContact CB-CE1 4.04Å; A106-F164 HydrophobicContact CB-CE2 3.59Å; A106-F164 HydrophobicContact CB-CZ 3.46Å; A106-F164 VanDerWaalsContact CB-CZ 3.46Å
107W98.3Very high96.8Very high30 Ų3036.1 Ų36.111%0.11420%0.198CC..Hα-helixtrans-63.9-48.3175.1168.962.7000113L103 I104 L105 F109 S110 I148 N153 S156 L157 F160L103-W107 PolarHBondContact O-N 3.21Å; I104-W107 HydrophobicContact CG2-CE3 4.3Å; I104-W107 PolarHBondContact O-N 2.99Å; L105-W107 VanDerWaalsContact C-N 3.29Å; L105-W107 PolarHBondContact O-N 3.39Å; W107-F109 PolarHBondContact O-N 3.47Å; W107-S110 WeakPolarHBondContact O-CA 3.41Å; W107-S110 PolarHBondContact O-N 2.92Å; W107-I148 HydrophobicContact CZ3-CG2 4.23Å; W107-N153 HydrophobicContact CH2-CB 4.18Å; W107-S156 PolarHBondContact NE1-OG 2.85Å; W107-L157 HydrophobicContact CB-CD1 3.39Å; W107-L157 HydrophobicContact CD2-CB 4.28Å; W107-L157 HydrophobicContact CD2-CD1 3.98Å; W107-L157 HydrophobicContact CE3-CB 4.48Å; W107-L157 HydrophobicContact CE3-CD1 4.15Å; W107-L157 HydrophobicContact CG-CB 4.5Å; W107-L157 HydrophobicContact CG-CD1 3.66Å; W107-F160 VanDerWaalsContact CA-CE1 3.48Å; W107-F160 HydrophobicContact CB-CD1 3.71Å; W107-F160 HydrophobicContact CB-CE1 3.77Å; W107-F160 HydrophobicContact CB-CG 4.28Å; W107-F160 HydrophobicContact CB-CZ 4.38Å; W107-F160 AromaticContact CD1-CD1 3.98Å; W107-F160 AromaticContact CD1-CG 3.68Å; W107-F160 HydrophobicContact CG-CD1 4.23Å; W107-F160 HydrophobicContact CG-CG 4.37Å
108K97.7Very high96.9Very high39 Ų3934 Ų3417%0.1718%0.184CC..Hα-helixtrans-65-26.5177.5-66.5-66-165179.60112.4I104 L105 S110 L129 L144 D147I104-K108 HydrophobicContact CG2-CG 4.21Å; I104-K108 VanDerWaalsContact O-CG 3.32Å; I104-K108 WeakPolarHBondContact O-CG 3.44Å; I104-K108 PolarHBondContact O-N 3.31Å; L105-K108 PolarHBondContact O-N 3.08Å; K108-S110 VanDerWaalsContact C-N 3.26Å; K108-L129 HydrophobicContact CB-CD1 4.37Å; K108-L129 HydrophobicContact CB-CD2 4.16Å; K108-L129 HydrophobicContact CD-CD2 4.35Å; K108-L129 HydrophobicContact CG-CD2 4.22Å; K108-L144 HydrophobicContact CD-CD2 4.43Å; K108-L144 HydrophobicContact CG-CD2 4.33Å; K108-D147 IonicContact NZ-OD2 3.09Å; K108-D147 PolarHBondContact NZ-OD2 3.04Å
109F98Very high97.1Very high0 Ų030.9 Ų30.90%017%0.165CC..THydrogen-bonded Turntrans-84-6.7173.9-78.5-127.8000111.9L105 A106 W107 A111 F117 E121 F122 R124 F126 L129 L137L105-F109 HydrophobicContact CD2-CE2 4.28Å; L105-F109 WeakPolarHBondContact O-CB 3.27Å; L105-F109 WeakPolarHBondContact O-CD2 3.35Å; L105-F109 PolarHBondContact O-N 2.97Å; A106-F109 PolarHBondContact O-N 3.45Å; W107-F109 PolarHBondContact O-N 3.47Å; F109-A111 PolarHBondContact O-N 3.05Å; F109-F117 HydrophobicContact CB-CE1 4.26Å; F109-F117 HydrophobicContact CB-CZ 4.4Å; F109-F117 HydrophobicContact CD1-CD2 4.39Å; F109-F117 HydrophobicContact CD1-CE2 4.18Å; F109-F117 HydrophobicContact CD1-CZ 4.34Å; F109-F117 HydrophobicContact CG-CZ 4.41Å; F109-E121 WeakPolarHBondContact CD1-O 3.34Å; F109-F122 HydrophobicContact CE1-CD2 4.09Å; F109-F122 HydrophobicContact CE1-CG 4.48Å; F109-F122 WeakPolarHBondContact CE1-O 3.25Å; F109-R124 PolarHBondContact O-NE 3.43Å; F109-R124 PolarHBondContact O-NH2 2.98Å; F109-F126 AromaticContact CE1-CD2 3.8Å; F109-F126 HydrophobicContact CE1-CD2 3.8Å; F109-F126 AromaticContact CE1-CE2 3.98Å; F109-F126 HydrophobicContact CE1-CE2 3.98Å; F109-F126 AromaticContact CZ-CD2 3.71Å; F109-F126 HydrophobicContact CZ-CD2 3.71Å; F109-F126 AromaticContact CZ-CE2 3.82Å; F109-F126 HydrophobicContact CZ-CE2 3.82Å; F109-L129 HydrophobicContact CD2-CD1 4.35Å; F109-L129 HydrophobicContact CE2-CD1 3.68Å; F109-L137 HydrophobicContact CZ-CD2 4.37Å
110S96.9Very high97.1Very high56 Ų5636 Ų3639%0.39219%0.186SC..THydrogen-bonded Turntrans50.746.6-172.7-62.80000111.7A106 W107 K108 R124A106-S110 PolarHBondContact O-N 3.44Å; A106-S110 VanDerWaalsContact O-N 3.1Å; W107-S110 WeakPolarHBondContact O-CA 3.41Å; W107-S110 PolarHBondContact O-N 2.92Å; K108-S110 VanDerWaalsContact C-N 3.26Å; S110-R124 PolarHBondContact O-NH2 2.98Å
111A96.8Very high97.1Very high2 Ų234 Ų342%0.01718%0.175CC..  trans-69.6133.9-178.400000111.5A106 F109 F117 E121 F160 F164A106-A111 HydrophobicContact CB-CB 4.26Å; A106-A111 WeakPolarHBondContact O-CB 3.32Å; A106-A111 PolarHBondContact O-N 3.48Å; F109-A111 PolarHBondContact O-N 3.05Å; A111-F117 HydrophobicContact CB-CD1 3.63Å; A111-F117 HydrophobicContact CB-CE1 3.42Å; A111-F117 VanDerWaalsContact CB-CE1 3.42Å; A111-E121 WeakPolarHBondContact CA-OE1 3.39Å; A111-F160 WeakPolarHBondContact O-CE2 3.37Å; A111-F160 WeakPolarHBondContact O-CZ 3.26Å; A111-F164 HydrophobicContact CB-CD2 4.13Å; A111-F164 HydrophobicContact CB-CE2 3.88Å
112K94.4Very high97.1Very high142 Ų14233 Ų3362%0.61717%0.17SC*.SBendtrans-79.4-27.8-175.4-72.3179.2178.9178.50114.3E121 H170K112-E121 WeakPolarHBondContact CG-OE1 3.2Å; K112-E121 PolarHBondContact N-OE1 3.1Å; K112-H170 PolarHBondContact O-CE1 3.41Å; K112-H170 PolarHBondContact O-ND1 2.9Å
113T93.7Very high97.1Very high11 Ų1132.6 Ų32.67%0.06717%0.167CC..SBendtrans-151.2152.6-178.3-160.70000111.3E116 F164 L167T113-E116 HydrophobicContact CG2-CG 3.52Å; T113-E116 WeakPolarHBondContact CG2-OE1 3.25Å; T113-F164 VanDerWaalsContact C-CE2 3.42Å; T113-F164 WeakPolarHBondContact CA-O 3.46Å; T113-F164 VanDerWaalsContact O-CE2 3.26Å; T113-F164 WeakPolarHBondContact O-CE2 3.22Å; T113-L167 WeakPolarHBondContact OG1-CD2 3.43Å
114Q94.5Very high97Very high40 Ų4035.2 Ų35.219%0.18718%0.176CC..THydrogen-bonded Turntrans-70.2153.1-179.964.9178.7-43.700113.1E116 F164 A165 L167 Y183Q114-E116 VanDerWaalsContact C-N 3.28Å; Q114-E116 PolarHBondContact O-N 2.95Å; Q114-F164 VanDerWaalsContact CA-CE2 3.49Å; Q114-F164 VanDerWaalsContact CA-CZ 3.44Å; Q114-F164 HydrophobicContact CB-CD1 4.24Å; Q114-F164 HydrophobicContact CB-CE1 3.72Å; Q114-F164 HydrophobicContact CB-CE2 4.11Å; Q114-F164 HydrophobicContact CB-CZ 3.65Å; Q114-F164 PolarHBondContact N-O 2.87Å; Q114-A165 PolarHBondContact NE2-O 2.85Å; Q114-L167 HydrophobicContact CG-CD1 4.31Å; Q114-L167 HydrophobicContact CG-CD2 3.49Å; Q114-L167 VanDerWaalsContact CG-CD2 3.49Å; Q114-L167 HydrophobicContact CG-CG 3.87Å; Q114-Y183 WeakPolarHBondContact CB-OH 3.17Å; Q114-Y183 PolarHBondContact OE1-OH 3.26Å
115G94.3Very high96.9Very high47 Ų4735.2 Ų35.249%0.48518%0.176SC..THydrogen-bonded Turntrans81.9-1.9175.600000115.2
116E95.8Very high96.9Very high35 Ų3535.2 Ų35.216%0.16418%0.176CC..  trans-146.4161.2175.859.2167.3-155.900113.5R79 I80 L81 T113 Q114R79-E116 IonicContact CZ-OE1 2.75Å; R79-E116 IonicContact CZ-OE2 2.66Å; R79-E116 IonicContact NH1-OE1 3.6Å; R79-E116 PolarHBondContact NH1-OE1 3.33Å; R79-E116 IonicContact NH1-OE2 2.85Å; R79-E116 PolarHBondContact NH1-OE2 3.29Å; I80-E116 CarbonylContact O-C 3.5Å; I80-E116 WeakPolarHBondContact O-CA 3.18Å; I80-E116 VanDerWaalsContact O-CB 3.27Å; I80-E116 WeakPolarHBondContact O-CB 3.45Å; L81-E116 HydrophobicContact CD2-CB 3.85Å; L81-E116 WeakPolarHBondContact CD2-OE2 3.31Å; T113-E116 HydrophobicContact CG2-CG 3.52Å; T113-E116 WeakPolarHBondContact CG2-OE1 3.25Å; Q114-E116 VanDerWaalsContact C-N 3.28Å; Q114-E116 PolarHBondContact O-N 2.95Å
117F97.9Very high96.7Very high5 Ų540.3 Ų40.32%0.02220%0.195CC..EExtended strand (participates in β ladder)trans-129.3134.2157.7-68.7-39.2000109.9R79 I80 M85 F88 A106 F109 A111 F122R79-F117 CarbonylContact C-O 3.45Å; R79-F117 WeakPolarHBondContact CA-O 3.42Å; I80-F117 HydrophobicContact CB-CB 4.46Å; I80-F117 PolarHBondContact N-O 2.85Å; I80-F117 PolarHBondContact O-N 3.49Å; M85-F117 HydrophobicContact CE-CD2 3.94Å; M85-F117 HydrophobicContact CE-CE2 3.65Å; M85-F117 HydrophobicContact CE-CZ 3.97Å; M85-F117 HydrophobicContact SD-CD2 3.62Å; M85-F117 HydrophobicContact SD-CE2 3.97Å; M85-F117 HydrophobicContact SD-CG 4.11Å; F88-F117 HydrophobicContact CD1-CE2 4.33Å; F88-F117 AromaticContact CE1-CE2 3.98Å; F88-F117 HydrophobicContact CE1-CE2 3.98Å; A106-F117 HydrophobicContact CB-CE1 4.35Å; F109-F117 HydrophobicContact CB-CE1 4.26Å; F109-F117 HydrophobicContact CB-CZ 4.4Å; F109-F117 HydrophobicContact CD1-CD2 4.39Å; F109-F117 HydrophobicContact CD1-CE2 4.18Å; F109-F117 HydrophobicContact CD1-CZ 4.34Å; F109-F117 HydrophobicContact CG-CZ 4.41Å; A111-F117 HydrophobicContact CB-CD1 3.63Å; A111-F117 HydrophobicContact CB-CE1 3.42Å; A111-F117 VanDerWaalsContact CB-CE1 3.42Å; F117-F122 HydrophobicContact CD2-CD2 4.27Å
118T97.8Very high96.4Very high25 Ų2544.9 Ų44.915%0.15322%0.217CC..EExtended strand (participates in β ladder)trans-69.6159.3162.863.10000110.7D78 R79 E120 E121 F122D78-T118 CarbonylContact O-C 3.37Å; R79-T118 HydrophobicContact CG-CG2 4.46Å; T118-E120 PolarHBondContact O-N 3.35Å; T118-E121 WeakPolarHBondContact CB-OE2 3.25Å; T118-E121 WeakPolarHBondContact CG2-OE2 3.49Å; T118-E121 PolarHBondContact N-OE2 2.92Å; T118-E121 PolarHBondContact O-N 2.72Å; T118-E121 WeakPolarHBondContact OG1-CB 3.22Å; T118-E121 VanDerWaalsContact OG1-CG 3.26Å; T118-E121 WeakPolarHBondContact OG1-CG 3.21Å; T118-E121 PolarHBondContact OG1-N 3.18Å; T118-E121 PolarHBondContact OG1-OE2 3.25Å; T118-F122 PolarHBondContact O-N 3.49Å
119R98.3Very high96.2Very high91 Ų9143.8 Ų43.834%0.34321%0.213SC..Hα-helixtrans-53.2-42.6171.4-173.8178.7172.685.2-0.3112D65 F68 D78 F122 F123D65-R119 IonicContact OD1-CZ 2.93Å; D65-R119 IonicContact OD1-NH1 3.95Å; D65-R119 PolarHBondContact OD1-NH1 2.93Å; D65-R119 IonicContact OD1-NH2 2.67Å; D65-R119 PolarHBondContact OD1-NH2 2.94Å; F68-R119 HydrophobicContact CD1-CG 4.24Å; F68-R119 HydrophobicContact CD2-CB 4.35Å; F68-R119 HydrophobicContact CD2-CG 4.27Å; F68-R119 HydrophobicContact CE1-CB 4.08Å; F68-R119 HydrophobicContact CE1-CG 3.97Å; F68-R119 HydrophobicContact CE2-CB 3.66Å; F68-R119 HydrophobicContact CE2-CG 4.03Å; F68-R119 HydrophobicContact CG-CG 4.38Å; F68-R119 HydrophobicContact CZ-CB 3.51Å; F68-R119 HydrophobicContact CZ-CG 3.88Å; D78-R119 PolarHBondContact O-N 3.4Å; R119-F122 PolarHBondContact O-N 2.96Å; R119-F123 HydrophobicContact CG-CD2 3.85Å; R119-F123 HydrophobicContact CG-CE2 3.82Å; R119-F123 WeakPolarHBondContact O-CD2 3.25Å; R119-F123 PolarHBondContact O-N 3.39Å
120E97.7Very high96Very high136 Ų13645.5 Ų45.564%0.63623%0.231SC*.Hα-helixtrans-63.3-47.4-179.4-171.7-176.7163.900111.7T118 F123 R124T118-E120 PolarHBondContact O-N 3.35Å; E120-F123 PolarHBondContact O-N 2.97Å; E120-R124 VanDerWaalsContact O-CB 3.26Å; E120-R124 WeakPolarHBondContact O-CB 3.36Å; E120-R124 PolarHBondContact O-N 3.21Å; E120-R124 IonicContact OE1-NH1 3.43Å
121E98.2Very high95.9Very high5 Ų543 Ų432%0.02321%0.213CC..Hα-helixtrans-60.6-46176.9-75.1155.5164.100111.8F109 A111 K112 T118 R124 G125F109-E121 WeakPolarHBondContact CD1-O 3.34Å; A111-E121 WeakPolarHBondContact CA-OE1 3.39Å; K112-E121 WeakPolarHBondContact CG-OE1 3.2Å; K112-E121 PolarHBondContact N-OE1 3.1Å; T118-E121 WeakPolarHBondContact CB-OE2 3.25Å; T118-E121 WeakPolarHBondContact CG2-OE2 3.49Å; T118-E121 PolarHBondContact N-OE2 2.92Å; T118-E121 PolarHBondContact O-N 2.72Å; T118-E121 WeakPolarHBondContact OG1-CB 3.22Å; T118-E121 VanDerWaalsContact OG1-CG 3.26Å; T118-E121 WeakPolarHBondContact OG1-CG 3.21Å; T118-E121 PolarHBondContact OG1-N 3.18Å; T118-E121 PolarHBondContact OG1-OE2 3.25Å; E121-R124 PolarHBondContact O-N 2.9Å; E121-G125 PolarHBondContact O-N 3.25Å
122F98.3Very high95.8Very high0 Ų044.3 Ų44.30%022%0.22CC..Hα-helixtrans-59.2-51.2179.2-169.2-95.8000111.4I64 L67 F68 Y71 I80 F88 F109 F117 T118 R119 G125 F126I64-F122 HydrophobicContact CG2-CD1 4.03Å; I64-F122 HydrophobicContact CG2-CE1 4.04Å; L67-F122 HydrophobicContact CB-CE1 4.03Å; L67-F122 HydrophobicContact CB-CZ 4.06Å; F68-F122 HydrophobicContact CB-CD1 3.98Å; F68-F122 HydrophobicContact CB-CE1 4.04Å; F68-F122 HydrophobicContact CD2-CB 4.08Å; F68-F122 AromaticContact CD2-CD1 3.99Å; F68-F122 HydrophobicContact CD2-CD1 3.99Å; F68-F122 HydrophobicContact CD2-CG 4.08Å; F68-F122 HydrophobicContact CG-CD1 4.49Å; Y71-F122 HydrophobicContact CD2-CE2 4.19Å; Y71-F122 AromaticContact CD2-CZ 3.97Å; Y71-F122 HydrophobicContact CD2-CZ 3.97Å; Y71-F122 HydrophobicContact CE2-CZ 4.19Å; I80-F122 HydrophobicContact CD1-CB 4.43Å; I80-F122 HydrophobicContact CD1-CD2 3.39Å; I80-F122 HydrophobicContact CD1-CE2 3.64Å; I80-F122 HydrophobicContact CD1-CG 3.93Å; I80-F122 HydrophobicContact CD1-CZ 4.37Å; F88-F122 HydrophobicContact CD2-CE2 4.24Å; F88-F122 HydrophobicContact CE1-CE2 4.38Å; F88-F122 AromaticContact CE2-CE2 3.95Å; F88-F122 HydrophobicContact CE2-CE2 3.95Å; F88-F122 HydrophobicContact CE2-CZ 4.31Å; F88-F122 HydrophobicContact CZ-CE2 4.01Å; F109-F122 HydrophobicContact CE1-CD2 4.09Å; F109-F122 HydrophobicContact CE1-CG 4.48Å; F109-F122 WeakPolarHBondContact CE1-O 3.25Å; F117-F122 HydrophobicContact CD2-CD2 4.27Å; T118-F122 PolarHBondContact O-N 3.49Å; R119-F122 PolarHBondContact O-N 2.96Å; F122-G125 PolarHBondContact O-N 3.36Å; F122-F126 HydrophobicContact CD1-CD2 4.05Å; F122-F126 HydrophobicContact CD1-CE2 4.15Å; F122-F126 HydrophobicContact CD2-CE2 4.15Å; F122-F126 AromaticContact CE1-CD2 3.8Å; F122-F126 HydrophobicContact CE1-CD2 3.8Å; F122-F126 AromaticContact CE1-CE2 3.55Å; F122-F126 HydrophobicContact CE1-CE2 3.55Å; F122-F126 HydrophobicContact CE1-CZ 4.37Å; F122-F126 HydrophobicContact CE2-CD2 4.31Å; F122-F126 AromaticContact CE2-CE2 3.56Å; F122-F126 HydrophobicContact CE2-CE2 3.56Å; F122-F126 HydrophobicContact CE2-CZ 4.46Å; F122-F126 HydrophobicContact CG-CD2 4.41Å; F122-F126 HydrophobicContact CG-CE2 4.44Å; F122-F126 AromaticContact CZ-CD2 3.96Å; F122-F126 HydrophobicContact CZ-CD2 3.96Å; F122-F126 AromaticContact CZ-CE2 3.23Å; F122-F126 HydrophobicContact CZ-CE2 3.23Å; F122-F126 AromaticContact CZ-CZ 3.92Å; F122-F126 HydrophobicContact CZ-CZ 3.92Å; F122-F126 WeakPolarHBondContact O-CD2 3.17Å; F122-F126 PolarHBondContact O-N 2.85Å
123F97.4Very high95.9Very high13 Ų1339.2 Ų39.26%0.05720%0.202CC..Hα-helixtrans-65.1-42.6179.3-86.9-103.4000112.5E61 I64 D65 F68 R119 E120 G125 F126 R127E61-F123 VanDerWaalsContact OE2-CD1 3.27Å; E61-F123 WeakPolarHBondContact OE2-CD1 3.44Å; I64-F123 HydrophobicContact CB-CD1 4.15Å; I64-F123 HydrophobicContact CB-CE1 3.98Å; I64-F123 HydrophobicContact CB-CZ 4.45Å; I64-F123 HydrophobicContact CG2-CD1 3.6Å; I64-F123 HydrophobicContact CG2-CD2 3.99Å; I64-F123 HydrophobicContact CG2-CE1 3.75Å; I64-F123 HydrophobicContact CG2-CE2 4.13Å; I64-F123 HydrophobicContact CG2-CG 3.78Å; I64-F123 HydrophobicContact CG2-CZ 4.04Å; D65-F123 HydrophobicContact CB-CE1 4.46Å; D65-F123 HydrophobicContact CB-CZ 3.81Å; F68-F123 HydrophobicContact CB-CE2 3.94Å; F68-F123 HydrophobicContact CG-CE2 4.16Å; R119-F123 HydrophobicContact CG-CD2 3.85Å; R119-F123 HydrophobicContact CG-CE2 3.82Å; R119-F123 WeakPolarHBondContact O-CD2 3.25Å; R119-F123 PolarHBondContact O-N 3.39Å; E120-F123 PolarHBondContact O-N 2.97Å; F123-G125 PolarHBondContact O-N 3.36Å; F123-F126 PolarHBondContact O-N 3.46Å; F123-R127 WeakPolarHBondContact O-CB 3.22Å; F123-R127 VanDerWaalsContact O-CG 3.26Å; F123-R127 WeakPolarHBondContact O-CG 3.41Å; F123-R127 PolarHBondContact O-N 2.7Å
124R96.2Very high96.1Very high59 Ų5939.6 Ų39.622%0.22320%0.204CC..Hα-helixtrans-58.3-48.3176.417817656.5-138.6-2.3111.2F109 S110 E120 E121 F126 R127 E128F109-R124 PolarHBondContact O-NE 3.43Å; F109-R124 PolarHBondContact O-NH2 2.98Å; S110-R124 PolarHBondContact O-NH2 2.98Å; E120-R124 VanDerWaalsContact O-CB 3.26Å; E120-R124 WeakPolarHBondContact O-CB 3.36Å; E120-R124 PolarHBondContact O-N 3.21Å; E120-R124 IonicContact OE1-NH1 3.43Å; E121-R124 PolarHBondContact O-N 2.9Å; R124-F126 PolarHBondContact O-N 3.47Å; R124-R127 PolarHBondContact O-N 2.92Å; R124-E128 WeakPolarHBondContact CD-OE1 3.48Å; R124-E128 HydrophobicContact CG-CG 4.14Å; R124-E128 WeakPolarHBondContact CG-OE1 3.31Å; R124-E128 WeakPolarHBondContact O-CB 3.27Å; R124-E128 WeakPolarHBondContact O-CG 3.15Å; R124-E128 PolarHBondContact O-N 3.21Å
125G96.9Very high96.2Very high0 Ų041 Ų410%022%0.217CC..Hα-helixtrans-58.9-47.118000000113.1E121 F122 F123 R127 L129E121-G125 PolarHBondContact O-N 3.25Å; F122-G125 PolarHBondContact O-N 3.36Å; F123-G125 PolarHBondContact O-N 3.36Å; G125-R127 PolarHBondContact O-N 3.3Å; G125-L129 VanDerWaalsContact O-CB 3.28Å; G125-L129 WeakPolarHBondContact O-CB 3.41Å; G125-L129 WeakPolarHBondContact O-CG 3.08Å; G125-L129 PolarHBondContact O-N 3.45Å
126F97.1Very high96.2Very high0 Ų040.2 Ų40.20%021%0.205CC..Hα-helixtrans-61.6-42.7175.2-87.5-91.8000112.3I64 L67 F88 F109 F122 F123 R124 G130 C131 L137I64-F126 HydrophobicContact CD1-CB 3.61Å; I64-F126 HydrophobicContact CD1-CG 4.44Å; I64-F126 HydrophobicContact CG1-CB 3.99Å; I64-F126 HydrophobicContact CG1-CD1 4.4Å; I64-F126 HydrophobicContact CG1-CG 4.29Å; I64-F126 HydrophobicContact CG2-CB 4.19Å; I64-F126 HydrophobicContact CG2-CD2 4.45Å; I64-F126 HydrophobicContact CG2-CG 4.32Å; L67-F126 HydrophobicContact CD1-CE1 3.8Å; L67-F126 HydrophobicContact CD1-CZ 3.84Å; F88-F126 HydrophobicContact CE2-CE2 4.21Å; F88-F126 HydrophobicContact CE2-CZ 4.05Å; F88-F126 HydrophobicContact CZ-CE2 4.16Å; F88-F126 HydrophobicContact CZ-CZ 4.31Å; F109-F126 AromaticContact CE1-CD2 3.8Å; F109-F126 HydrophobicContact CE1-CD2 3.8Å; F109-F126 AromaticContact CE1-CE2 3.98Å; F109-F126 HydrophobicContact CE1-CE2 3.98Å; F109-F126 AromaticContact CZ-CD2 3.71Å; F109-F126 HydrophobicContact CZ-CD2 3.71Å; F109-F126 AromaticContact CZ-CE2 3.82Å; F109-F126 HydrophobicContact CZ-CE2 3.82Å; F122-F126 HydrophobicContact CD1-CD2 4.05Å; F122-F126 HydrophobicContact CD1-CE2 4.15Å; F122-F126 HydrophobicContact CD2-CE2 4.15Å; F122-F126 AromaticContact CE1-CD2 3.8Å; F122-F126 HydrophobicContact CE1-CD2 3.8Å; F122-F126 AromaticContact CE1-CE2 3.55Å; F122-F126 HydrophobicContact CE1-CE2 3.55Å; F122-F126 HydrophobicContact CE1-CZ 4.37Å; F122-F126 HydrophobicContact CE2-CD2 4.31Å; F122-F126 AromaticContact CE2-CE2 3.56Å; F122-F126 HydrophobicContact CE2-CE2 3.56Å; F122-F126 HydrophobicContact CE2-CZ 4.46Å; F122-F126 HydrophobicContact CG-CD2 4.41Å; F122-F126 HydrophobicContact CG-CE2 4.44Å; F122-F126 AromaticContact CZ-CD2 3.96Å; F122-F126 HydrophobicContact CZ-CD2 3.96Å; F122-F126 AromaticContact CZ-CE2 3.23Å; F122-F126 HydrophobicContact CZ-CE2 3.23Å; F122-F126 AromaticContact CZ-CZ 3.92Å; F122-F126 HydrophobicContact CZ-CZ 3.92Å; F122-F126 WeakPolarHBondContact O-CD2 3.17Å; F122-F126 PolarHBondContact O-N 2.85Å; F123-F126 PolarHBondContact O-N 3.46Å; R124-F126 PolarHBondContact O-N 3.47Å; F126-G130 PolarHBondContact O-N 2.88Å; F126-G130 VanDerWaalsContact O-N 3.11Å; F126-C131 CarbonylContact C-O 3.58Å; F126-C131 HydrophobicContact CD1-CB 3.8Å; F126-C131 WeakPolarHBondContact CD1-O 3.5Å; F126-C131 HydrophobicContact CE1-CB 4.32Å; F126-C131 PolarHBondContact O-N 3.49Å; F126-L137 HydrophobicContact CE1-CB 4.26Å; F126-L137 HydrophobicContact CE1-CD2 4.12Å; F126-L137 HydrophobicContact CE2-CD2 4.21Å; F126-L137 HydrophobicContact CZ-CD2 3.69Å
127R93.9Very high96.3Very high111 Ų11138.5 Ų38.542%0.41920%0.197SC..Hα-helixtrans-61.7-52177.6-73.4174-167.2137.34.8112.6I59 E61 F123 R124 G125 L129 G130I59-R127 HydrophobicContact CD1-CB 4.39Å; I59-R127 VanDerWaalsContact CD1-O 3.25Å; I59-R127 WeakPolarHBondContact CD1-O 3.38Å; E61-R127 IonicContact OE1-CZ 2.78Å; E61-R127 IonicContact OE1-NE 2.85Å; E61-R127 PolarHBondContact OE1-NE 3.32Å; E61-R127 IonicContact OE1-NH2 3.69Å; E61-R127 IonicContact OE2-CZ 2.84Å; E61-R127 IonicContact OE2-NE 3.49Å; E61-R127 PolarHBondContact OE2-NE 2.84Å; E61-R127 IonicContact OE2-NH2 3.02Å; E61-R127 PolarHBondContact OE2-NH2 3.24Å; F123-R127 WeakPolarHBondContact O-CB 3.22Å; F123-R127 VanDerWaalsContact O-CG 3.26Å; F123-R127 WeakPolarHBondContact O-CG 3.41Å; F123-R127 PolarHBondContact O-N 2.7Å; R124-R127 PolarHBondContact O-N 2.92Å; G125-R127 PolarHBondContact O-N 3.3Å; R127-L129 VanDerWaalsContact C-N 3.27Å; R127-L129 PolarHBondContact O-N 3.37Å; R127-G130 PolarHBondContact O-N 3.23Å
128E92.3Very high96.3Very high125 Ų12542.2 Ų42.258%0.58421%0.211SC*.Hα-helixtrans-65.8-32.5-177.1-71.5-178.4-172.600112R124 G130R124-E128 WeakPolarHBondContact CD-OE1 3.48Å; R124-E128 HydrophobicContact CG-CG 4.14Å; R124-E128 WeakPolarHBondContact CG-OE1 3.31Å; R124-E128 WeakPolarHBondContact O-CB 3.27Å; R124-E128 WeakPolarHBondContact O-CG 3.15Å; R124-E128 PolarHBondContact O-N 3.21Å; E128-G130 VanDerWaalsContact C-N 3.3Å
129L94.2Very high96.2Very high16 Ų1647.3 Ų47.38%0.08424%0.237CC..THydrogen-bonded Turntrans-81.3-6.1174.8-64.8179.1000114L105 K108 F109 G125 R127 C131 L137 L144L105-L129 HydrophobicContact CD2-CD1 4.47Å; K108-L129 HydrophobicContact CB-CD1 4.37Å; K108-L129 HydrophobicContact CB-CD2 4.16Å; K108-L129 HydrophobicContact CD-CD2 4.35Å; K108-L129 HydrophobicContact CG-CD2 4.22Å; F109-L129 HydrophobicContact CD2-CD1 4.35Å; F109-L129 HydrophobicContact CE2-CD1 3.68Å; G125-L129 VanDerWaalsContact O-CB 3.28Å; G125-L129 WeakPolarHBondContact O-CB 3.41Å; G125-L129 WeakPolarHBondContact O-CG 3.08Å; G125-L129 PolarHBondContact O-N 3.45Å; R127-L129 VanDerWaalsContact C-N 3.27Å; R127-L129 PolarHBondContact O-N 3.37Å; L129-C131 VanDerWaalsContact C-N 3.32Å; L129-C131 PolarHBondContact O-SG 3.42Å; L129-L137 HydrophobicContact CD1-CD1 3.57Å; L129-L144 HydrophobicContact CD1-CD1 4.27Å; L129-L144 HydrophobicContact CD2-CD1 4.31Å; L129-L144 HydrophobicContact CD2-CD2 3.63Å
130G92.9Very high96.1Very high36 Ų3646.9 Ų46.937%0.37124%0.238SC..THydrogen-bonded Turntrans67.331.8-17800000113.4F126 R127 E128F126-G130 PolarHBondContact O-N 2.88Å; F126-G130 VanDerWaalsContact O-N 3.11Å; R127-G130 PolarHBondContact O-N 3.23Å; E128-G130 VanDerWaalsContact C-N 3.3Å
131C95Very high96Very high4 Ų441.3 Ų41.33%0.02721%0.212CC..  trans-114.2147.6-174.8-660000110.9F126 L129 S136 L137F126-C131 CarbonylContact C-O 3.58Å; F126-C131 HydrophobicContact CD1-CB 3.8Å; F126-C131 WeakPolarHBondContact CD1-O 3.5Å; F126-C131 HydrophobicContact CE1-CB 4.32Å; F126-C131 PolarHBondContact O-N 3.49Å; L129-C131 VanDerWaalsContact C-N 3.32Å; L129-C131 PolarHBondContact O-SG 3.42Å; C131-S136 WeakPolarHBondContact CA-OG 3.44Å; C131-S136 WeakPolarHBondContact CB-OG 3.48Å; C131-L137 HydrophobicContact CB-CB 4.39Å
132D94.6Very high95.9Very high30 Ų3045.2 Ų45.216%0.1624%0.238CC..SBendtrans-135.15.7175.774.9-7.1000113.1I59 N60 K63 S136I59-D132 HydrophobicContact CG2-CB 4.12Å; N60-D132 HydrophobicContact CB-CB 4.49Å; K63-D132 HydrophobicContact CB-CB 4.49Å; K63-D132 WeakPolarHBondContact CB-O 3.41Å; K63-D132 HydrophobicContact CD-CB 4.35Å; K63-D132 WeakPolarHBondContact CD-OD2 3.23Å; K63-D132 IonicContact NZ-OD1 3.67Å; K63-D132 IonicContact NZ-OD2 2.78Å; K63-D132 PolarHBondContact NZ-OD2 2.92Å; D132-S136 PolarHBondContact N-OG 3.03Å; D132-S136 VanDerWaalsContact N-OG 3.13Å
133S96.4Very high95.8Very high34 Ų3447.4 Ų47.424%0.23825%0.253CS..SBendtrans-152.2157.1-177.463.40000111.5S135 S136 L137S133-S135 PolarHBondContact O-N 2.91Å; S133-S136 PolarHBondContact N-OG 3.32Å; S133-S136 PolarHBondContact O-N 3.2Å; S133-S136 PolarHBondContact O-OG 2.87Å; S133-S136 WeakPolarHBondContact OG-CB 3.17Å; S133-S136 PolarHBondContact OG-N 3.19Å; S133-S136 VanDerWaalsContact OG-N 3.13Å; S133-S136 PolarHBondContact OG-OG 3.11Å; S133-L137 PolarHBondContact O-N 3.43Å
134I97.9Very high95.8Very high20 Ų2046.8 Ų46.810%0.10325%0.251CS..Hα-helixtrans-56.7-39.2172.4-62.8-59.4000111.4L67 Y71 F88 D92 L93 L137 R138L67-I134 HydrophobicContact CD1-CD1 4.44Å; L67-I134 HydrophobicContact CD2-CD1 4.28Å; L67-I134 HydrophobicContact CD2-CG1 3.85Å; Y71-I134 HydrophobicContact CE2-CD1 4.3Å; Y71-I134 VanDerWaalsContact OH-CD1 3.31Å; Y71-I134 WeakPolarHBondContact OH-CD1 3Å; F88-I134 HydrophobicContact CD2-CD1 3.83Å; F88-I134 HydrophobicContact CE2-CD1 3.61Å; D92-I134 HydrophobicContact CB-CD1 4.41Å; D92-I134 HydrophobicContact CB-CG1 4.3Å; D92-I134 HydrophobicContact CB-CG2 4.19Å; D92-I134 VanDerWaalsContact O-CG2 3.25Å; D92-I134 WeakPolarHBondContact O-CG2 3.48Å; L93-I134 HydrophobicContact CD2-CG2 3.98Å; L93-I134 HydrophobicContact CG-CG2 4.44Å; I134-L137 PolarHBondContact O-N 2.97Å; I134-R138 WeakPolarHBondContact O-CB 3.2Å; I134-R138 PolarHBondContact O-N 2.95Å
135S96.6Very high95.8Very high68 Ų6847.6 Ų47.648%0.47626%0.259SS..Hα-helixtrans-62.5-45.2176.7-550000112.3S133 L137 R138 N139S133-S135 PolarHBondContact O-N 2.91Å; S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 3.49Å; S135-R138 PolarHBondContact O-N 3.28Å; S135-N139 PolarHBondContact O-N 3.43Å; S135-N139 PolarHBondContact O-ND2 2.99Å
136S96Very high95.8Very high31 Ų3150.5 Ų50.522%0.21728%0.279CS..Hα-helixtrans-63-40.8176.2580000112.2C131 D132 S133 N139 K140C131-S136 WeakPolarHBondContact CA-OG 3.44Å; C131-S136 WeakPolarHBondContact CB-OG 3.48Å; D132-S136 PolarHBondContact N-OG 3.03Å; D132-S136 VanDerWaalsContact N-OG 3.13Å; S133-S136 PolarHBondContact N-OG 3.32Å; S133-S136 PolarHBondContact O-N 3.2Å; S133-S136 PolarHBondContact O-OG 2.87Å; S133-S136 WeakPolarHBondContact OG-CB 3.17Å; S133-S136 PolarHBondContact OG-N 3.19Å; S133-S136 VanDerWaalsContact OG-N 3.13Å; S133-S136 PolarHBondContact OG-OG 3.11Å; S136-N139 PolarHBondContact O-N 3.04Å; S136-K140 PolarHBondContact O-N 3.22Å
137L97.5Very high95.6Very high0 Ų053.4 Ų53.40%030%0.295CS..Hα-helixtrans-67.4-43.6178.3-176.157.8000111.4F88 L93 L105 F109 F126 L129 C131 S133 I134 S135 N139 K140 L141F88-L137 HydrophobicContact CE2-CD2 4.06Å; F88-L137 HydrophobicContact CZ-CD2 3.64Å; L93-L137 HydrophobicContact CD1-CD2 3.97Å; L93-L137 HydrophobicContact CD2-CB 4.27Å; L93-L137 HydrophobicContact CD2-CD2 4.06Å; L93-L137 HydrophobicContact CD2-CG 4.06Å; L105-L137 HydrophobicContact CD2-CD1 3.97Å; F109-L137 HydrophobicContact CZ-CD2 4.37Å; F126-L137 HydrophobicContact CE1-CB 4.26Å; F126-L137 HydrophobicContact CE1-CD2 4.12Å; F126-L137 HydrophobicContact CE2-CD2 4.21Å; F126-L137 HydrophobicContact CZ-CD2 3.69Å; L129-L137 HydrophobicContact CD1-CD1 3.57Å; C131-L137 HydrophobicContact CB-CB 4.39Å; S133-L137 PolarHBondContact O-N 3.43Å; I134-L137 PolarHBondContact O-N 2.97Å; S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 3.49Å; L137-N139 VanDerWaalsContact C-N 3.31Å; L137-N139 PolarHBondContact O-N 3.27Å; L137-K140 WeakPolarHBondContact O-CA 3.35Å; L137-K140 VanDerWaalsContact O-CB 3.28Å; L137-K140 WeakPolarHBondContact O-CB 3.38Å; L137-K140 PolarHBondContact O-N 3.33Å; L137-L141 PolarHBondContact O-N 3.41Å
138R97.1Very high95.7Very high83 Ų8348.4 Ų48.431%0.31328%0.276SS..Hα-helixtrans-58.6-42.6176.1-165.2-175.7-61.1118.6-8.6112D92 L93 I134 S135 K140 L141D92-R138 PolarHBondContact O-NH2 3.12Å; L93-R138 HydrophobicContact CD2-CB 4.38Å; I134-R138 WeakPolarHBondContact O-CB 3.2Å; I134-R138 PolarHBondContact O-N 2.95Å; S135-R138 PolarHBondContact O-N 3.28Å; R138-K140 PolarHBondContact O-N 3.19Å; R138-L141 HydrophobicContact CG-CD1 4.11Å; R138-L141 WeakPolarHBondContact O-CG 3.44Å; R138-L141 PolarHBondContact O-N 2.82Å
139N96Very high95.9Very high132 Ų13249.3 Ų49.371%0.70628%0.281SS*.Hα-helixtrans-64.9-22.4176.4-69.2-14000112.8S135 S136 L137S135-N139 PolarHBondContact O-N 3.43Å; S135-N139 PolarHBondContact O-ND2 2.99Å; S136-N139 PolarHBondContact O-N 3.04Å; L137-N139 VanDerWaalsContact C-N 3.31Å; L137-N139 PolarHBondContact O-N 3.27Å
140K95.4Very high96Very high82 Ų8252.4 Ų52.436%0.35730%0.297SS..Hα-helixtrans-81.7-27.5178.1-159.872.4-179.8-174.20112.7S136 L137 R138 P142 S143 L144S136-K140 PolarHBondContact O-N 3.22Å; L137-K140 WeakPolarHBondContact O-CA 3.35Å; L137-K140 VanDerWaalsContact O-CB 3.28Å; L137-K140 WeakPolarHBondContact O-CB 3.38Å; L137-K140 PolarHBondContact O-N 3.33Å; R138-K140 PolarHBondContact O-N 3.19Å; K140-P142 VanDerWaalsContact C-CD 3.47Å; K140-S143 PolarHBondContact O-N 3.42Å; K140-S143 PolarHBondContact O-OG 3.32Å; K140-L144 HydrophobicContact CG-CD1 4.33Å; K140-L144 HydrophobicContact CG-CD2 4.11Å; K140-L144 HydrophobicContact CG-CG 4.09Å; K140-L144 PolarHBondContact O-N 3.4Å
141L96.9Very high96.1Very high19 Ų1957.5 Ų57.510%0.09931%0.309CS..Hα-helixtrans-50.6-44.8-172.7-54.8174.3000114.3I95 I101 L105 L137 R138 S143 L144 L145I95-L141 HydrophobicContact CD1-CD1 3.62Å; I95-L141 HydrophobicContact CD1-CD2 3.97Å; I95-L141 HydrophobicContact CD1-CG 4.45Å; I95-L141 HydrophobicContact CG1-CD1 4.06Å; I101-L141 HydrophobicContact CD1-CB 4.21Å; I101-L141 HydrophobicContact CD1-CD2 3.99Å; I101-L141 HydrophobicContact CG1-CB 4.21Å; I101-L141 HydrophobicContact CG1-CD2 3.89Å; I101-L141 HydrophobicContact CG1-CG 4.46Å; L105-L141 HydrophobicContact CD1-CD2 4.04Å; L105-L141 HydrophobicContact CD2-CD2 3.97Å; L105-L141 HydrophobicContact CG-CD2 4.26Å; L137-L141 PolarHBondContact O-N 3.41Å; R138-L141 HydrophobicContact CG-CD1 4.11Å; R138-L141 WeakPolarHBondContact O-CG 3.44Å; R138-L141 PolarHBondContact O-N 2.82Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 2.89Å; L141-L144 HydrophobicContact CD2-CD1 4.49Å; L141-L144 PolarHBondContact O-N 3.39Å; L141-L144 VanDerWaalsContact O-N 3.12Å; L141-L145 PolarHBondContact O-N 3.17Å; L141-L145 VanDerWaalsContact O-N 3.07Å
142P96.5Very high96.2Very high87 Ų8763.8 Ų63.857%0.56534%0.338SS*.Hα-helixtrans-61.3-37.9178.5-23.535.5000112.9K140 L144 L145 S146K140-P142 VanDerWaalsContact C-CD 3.47Å; P142-L144 VanDerWaalsContact C-N 3.34Å; P142-L145 PolarHBondContact O-N 3.01Å; P142-S146 PolarHBondContact O-N 3.24Å; P142-S146 VanDerWaalsContact O-N 3.12Å
143S95.7Very high96.4Very high45 Ų4564.9 Ų64.932%0.31534%0.344SS..Hα-helixtrans-67.1-35.6176.367.20000112.2K140 L141 L145 S146 D147K140-S143 PolarHBondContact O-N 3.42Å; K140-S143 PolarHBondContact O-OG 3.32Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 2.89Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 2.98Å; S143-S146 PolarHBondContact O-N 3.03Å; S143-D147 PolarHBondContact O-N 3.33Å
144L96.9Very high96.5Very high1 Ų163.4 Ų63.41%0.00533%0.333CS..Hα-helixtrans-69.7-31.5177.5-54.4176.2000112.2I101 I104 L105 K108 L129 K140 L141 P142I101-L144 HydrophobicContact CD1-CB 4.14Å; I104-L144 HydrophobicContact CG2-CB 3.79Å; L105-L144 HydrophobicContact CD2-CD1 3.99Å; K108-L144 HydrophobicContact CD-CD2 4.43Å; K108-L144 HydrophobicContact CG-CD2 4.33Å; L129-L144 HydrophobicContact CD1-CD1 4.27Å; L129-L144 HydrophobicContact CD2-CD1 4.31Å; L129-L144 HydrophobicContact CD2-CD2 3.63Å; K140-L144 HydrophobicContact CG-CD1 4.33Å; K140-L144 HydrophobicContact CG-CD2 4.11Å; K140-L144 HydrophobicContact CG-CG 4.09Å; K140-L144 PolarHBondContact O-N 3.4Å; L141-L144 HydrophobicContact CD2-CD1 4.49Å; L141-L144 PolarHBondContact O-N 3.39Å; L141-L144 VanDerWaalsContact O-N 3.12Å; P142-L144 VanDerWaalsContact C-N 3.34Å
145L96.6Very high96.5Very high75 Ų7565.6 Ų65.639%0.39334%0.34SS..Hα-helixtrans-68.2-38.7170.9-76.4167.9000111.9I101 I104 L141 P142 S143 I148I101-L145 HydrophobicContact CB-CD2 4.2Å; I101-L145 HydrophobicContact CB-CG 4.48Å; I101-L145 HydrophobicContact CD1-CD2 4.47Å; I101-L145 HydrophobicContact CD1-CG 4.14Å; I104-L145 HydrophobicContact CD1-CD2 3.88Å; L141-L145 PolarHBondContact O-N 3.17Å; L141-L145 VanDerWaalsContact O-N 3.07Å; P142-L145 PolarHBondContact O-N 3.01Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 2.98Å; L145-I148 WeakPolarHBondContact O-CG1 3.33Å
146S96.5Very high96.6Very high62 Ų6265 Ų6543%0.43434%0.336SS..Hα-helixtrans-71.2-34.1175.7-174.50000112.1P142 S143 I148 E149P142-S146 PolarHBondContact O-N 3.24Å; P142-S146 VanDerWaalsContact O-N 3.12Å; S143-S146 PolarHBondContact O-N 3.03Å; S146-I148 PolarHBondContact O-N 3.04Å; S146-I148 VanDerWaalsContact O-N 3.12Å; S146-E149 VanDerWaalsContact O-CB 3.3Å; S146-E149 WeakPolarHBondContact O-CB 3.5Å; S146-E149 WeakPolarHBondContact O-CG 3.3Å; S146-E149 PolarHBondContact O-N 2.89Å
147D93.8Very high96.7Very high60 Ų6063.5 Ų63.532%0.32133%0.326SS..Hα-helixtrans-53.6-34.7177.3-82.51.3000112.8K108 S143 E149 N153K108-D147 IonicContact NZ-OD2 3.09Å; K108-D147 PolarHBondContact NZ-OD2 3.04Å; S143-D147 PolarHBondContact O-N 3.33Å; D147-E149 VanDerWaalsContact C-N 3.32Å; D147-N153 WeakPolarHBondContact O-CB 3.26Å; D147-N153 PolarHBondContact O-ND2 2.78Å
148I96.3Very high96.7Very high7 Ų763.5 Ų63.54%0.03633%0.326CS..THydrogen-bonded Turntrans-86.92.4-177.963.9139.4000113.8L100 I104 W107 L145 S146 L157 R191L100-I148 HydrophobicContact CD1-CD1 4.42Å; L100-I148 HydrophobicContact CD2-CD1 3.49Å; L100-I148 VanDerWaalsContact CD2-CD1 3.49Å; L100-I148 HydrophobicContact CG-CD1 4.09Å; I104-I148 HydrophobicContact CD1-CD1 3.81Å; I104-I148 HydrophobicContact CD1-CG1 3.9Å; I104-I148 HydrophobicContact CD1-CG2 3.87Å; I104-I148 HydrophobicContact CG1-CG2 3.98Å; W107-I148 HydrophobicContact CZ3-CG2 4.23Å; L145-I148 WeakPolarHBondContact O-CG1 3.33Å; S146-I148 PolarHBondContact O-N 3.04Å; S146-I148 VanDerWaalsContact O-N 3.12Å; I148-L157 HydrophobicContact CG2-CD2 4.03Å; I148-R191 PolarHBondContact O-NH2 3.26Å
149E94.8Very high96.8Very high144 Ų14462.2 Ų62.267%0.67333%0.325SS*.THydrogen-bonded Turntrans-71.3-27.7166-63.5177.7169.500110.5S146 D147S146-E149 VanDerWaalsContact O-CB 3.3Å; S146-E149 WeakPolarHBondContact O-CB 3.5Å; S146-E149 WeakPolarHBondContact O-CG 3.3Å; S146-E149 PolarHBondContact O-N 2.89Å; D147-E149 VanDerWaalsContact C-N 3.32Å
150D96.3Very high96.8Very high81 Ų8158.1 Ų58.143%0.43330%0.3SS..SBendtrans-65.9130.8169.3175.573.5000111.1Q152 N153 F154D150-Q152 VanDerWaalsContact C-N 3.32Å; D150-Q152 PolarHBondContact O-N 3.29Å; D150-Q152 WeakPolarHBondContact OD2-CA 3.49Å; D150-Q152 WeakPolarHBondContact OD2-CB 3.12Å; D150-Q152 PolarHBondContact OD2-N 2.94Å; D150-N153 HydrophobicContact CB-CB 4.24Å; D150-N153 PolarHBondContact O-N 3.49Å; D150-N153 PolarHBondContact OD2-N 3.4Å; D150-F154 PolarHBondContact O-N 3.02Å
151K95.9Very high96.9Very high143 Ų14354.2 Ų54.262%0.62228%0.284SS*.Hα-helixtrans-62.2-36.5-175.8-67.7-170.3175.2-166.90112.9R155K151-R155 WeakPolarHBondContact O-CB 3.42Å; K151-R155 PolarHBondContact O-N 2.91Å
152Q97.3Very high96.9Very high135 Ų13553.7 Ų53.763%0.63128%0.28SS*.Hα-helixtrans-73.1-40.6-178.3-62.3-60.9-36.500111.1D150 R155 S156D150-Q152 VanDerWaalsContact C-N 3.32Å; D150-Q152 PolarHBondContact O-N 3.29Å; D150-Q152 WeakPolarHBondContact OD2-CA 3.49Å; D150-Q152 WeakPolarHBondContact OD2-CB 3.12Å; D150-Q152 PolarHBondContact OD2-N 2.94Å; Q152-R155 PolarHBondContact O-N 3.37Å; Q152-S156 WeakPolarHBondContact O-CB 3.42Å; Q152-S156 PolarHBondContact O-N 3.3Å
153N97.7Very high96.8Very high54 Ų5450.8 Ų50.829%0.28927%0.267SS..Hα-helixtrans-64.1-44.1173.3-73.2-23.2000111.7W107 D147 D150 S156 L157W107-N153 HydrophobicContact CH2-CB 4.18Å; D147-N153 WeakPolarHBondContact O-CB 3.26Å; D147-N153 PolarHBondContact O-ND2 2.78Å; D150-N153 HydrophobicContact CB-CB 4.24Å; D150-N153 PolarHBondContact O-N 3.49Å; D150-N153 PolarHBondContact OD2-N 3.4Å; N153-S156 WeakPolarHBondContact O-CB 3.38Å; N153-S156 PolarHBondContact O-N 2.93Å; N153-L157 PolarHBondContact O-N 2.96Å
154F98.3Very high96.8Very high2 Ų249.5 Ų49.51%0.00926%0.255CS..Hα-helixtrans-61.3-45.4175.5-174.9-98.9000111.8D150 S156 L157 Y158 L187 L188 R191 L219D150-F154 PolarHBondContact O-N 3.02Å; F154-S156 VanDerWaalsContact C-N 3.3Å; F154-S156 PolarHBondContact O-N 3.31Å; F154-L157 WeakPolarHBondContact O-CB 3.44Å; F154-L157 PolarHBondContact O-N 3.25Å; F154-Y158 WeakPolarHBondContact O-CB 3.5Å; F154-Y158 PolarHBondContact O-N 3.35Å; F154-L187 HydrophobicContact CE2-CD2 4.28Å; F154-L187 HydrophobicContact CZ-CB 4.4Å; F154-L187 HydrophobicContact CZ-CD2 4.46Å; F154-L187 VanDerWaalsContact CZ-O 3.27Å; F154-L187 WeakPolarHBondContact CZ-O 3.4Å; F154-L188 HydrophobicContact CZ-CD2 4.43Å; F154-R191 VanDerWaalsContact CZ-CD 3.49Å; F154-L219 HydrophobicContact CD1-CD1 4.25Å; F154-L219 HydrophobicContact CE1-CD1 3.76Å
155R98.4Very high96.7Very high66 Ų6649.4 Ų49.425%0.24926%0.255CS..Hα-helixtrans-57.9-44174.6-175.3177.5-165.685.3-3.6111.4K151 Q152 Y158 L159 L219 D220K151-R155 WeakPolarHBondContact O-CB 3.42Å; K151-R155 PolarHBondContact O-N 2.91Å; Q152-R155 PolarHBondContact O-N 3.37Å; R155-Y158 PolarHBondContact O-N 2.84Å; R155-L159 HydrophobicContact CG-CD1 3.95Å; R155-L159 HydrophobicContact CG-CG 4.3Å; R155-L159 VanDerWaalsContact O-CG 3.28Å; R155-L159 WeakPolarHBondContact O-CG 3.26Å; R155-L159 PolarHBondContact O-N 3.49Å; R155-L219 HydrophobicContact CB-CD2 4.08Å; R155-L219 HydrophobicContact CG-CD2 3.9Å; R155-D220 IonicContact CZ-OD1 2.61Å; R155-D220 IonicContact NH1-OD1 3.03Å; R155-D220 PolarHBondContact NH1-OD1 3.4Å; R155-D220 IonicContact NH2-OD1 3.18Å; R155-D220 PolarHBondContact NH2-OD1 2.85Å; R155-D220 VanDerWaalsContact NH2-OD1 3.09Å; R155-D220 IonicContact NH2-OD2 3.1Å; R155-D220 PolarHBondContact NH2-OD2 3.33Å
156S98.3Very high96.3Very high56 Ų5646.2 Ų46.239%0.39224%0.238SC..Hα-helixtrans-59.6-47.6177-175.20000112W107 Q152 N153 F154 L159 F160W107-S156 PolarHBondContact NE1-OG 2.85Å; Q152-S156 WeakPolarHBondContact O-CB 3.42Å; Q152-S156 PolarHBondContact O-N 3.3Å; N153-S156 WeakPolarHBondContact O-CB 3.38Å; N153-S156 PolarHBondContact O-N 2.93Å; F154-S156 VanDerWaalsContact C-N 3.3Å; F154-S156 PolarHBondContact O-N 3.31Å; S156-L159 PolarHBondContact O-N 3.29Å; S156-F160 VanDerWaalsContact O-CB 3.29Å; S156-F160 WeakPolarHBondContact O-CB 3.41Å; S156-F160 PolarHBondContact O-N 2.88Å
157L98.6Very high95.5Very high0 Ų047 Ų470%024%0.238CC..Hα-helixtrans-59.3-46.1174.5177.466000112L100 L103 I104 W107 I148 N153 F154 F160 T161 L187L100-L157 HydrophobicContact CD1-CD2 4.13Å; L103-L157 HydrophobicContact CG-CD1 4.08Å; I104-L157 HydrophobicContact CG1-CD1 4.5Å; I104-L157 HydrophobicContact CG1-CD2 3.81Å; W107-L157 HydrophobicContact CB-CD1 3.39Å; W107-L157 HydrophobicContact CD2-CB 4.28Å; W107-L157 HydrophobicContact CD2-CD1 3.98Å; W107-L157 HydrophobicContact CE3-CB 4.48Å; W107-L157 HydrophobicContact CE3-CD1 4.15Å; W107-L157 HydrophobicContact CG-CB 4.5Å; W107-L157 HydrophobicContact CG-CD1 3.66Å; I148-L157 HydrophobicContact CG2-CD2 4.03Å; N153-L157 PolarHBondContact O-N 2.96Å; F154-L157 WeakPolarHBondContact O-CB 3.44Å; F154-L157 PolarHBondContact O-N 3.25Å; L157-F160 PolarHBondContact O-N 2.99Å; L157-T161 PolarHBondContact O-N 3.1Å; L157-T161 VanDerWaalsContact O-N 3.08Å; L157-T161 PolarHBondContact O-OG1 3.02Å; L157-L187 HydrophobicContact CD2-CD2 4.02Å; L157-L187 HydrophobicContact CG-CD2 4.06Å
158Y98.6Very high94.2Very high0 Ų049.7 Ų49.70%025%0.252CS..Hα-helixtrans-60.3-48.4-179.7-178.2-86.4000111.8F154 R155 T161 W184 L187 L188 W215 L219F154-Y158 WeakPolarHBondContact O-CB 3.5Å; F154-Y158 PolarHBondContact O-N 3.35Å; R155-Y158 PolarHBondContact O-N 2.84Å; Y158-T161 PolarHBondContact O-N 3.46Å; Y158-W184 AromaticContact CE2-CD1 3.98Å; Y158-W184 AromaticContact CZ-NE1 3.82Å; Y158-W184 PolarHBondContact OH-NE1 3.02Å; Y158-L187 HydrophobicContact CD2-CB 4.35Å; Y158-L187 HydrophobicContact CD2-CD1 3.86Å; Y158-L187 HydrophobicContact CE2-CD1 4.35Å; Y158-L188 HydrophobicContact CD2-CD2 4.28Å; Y158-L188 HydrophobicContact CE2-CD1 4.27Å; Y158-L188 HydrophobicContact CE2-CD2 3.92Å; Y158-L188 HydrophobicContact CE2-CG 4.25Å; Y158-W215 AromaticContact CD1-NE1 3.56Å; Y158-W215 AromaticContact CE1-CD1 3.43Å; Y158-W215 VanDerWaalsContact CE1-CD1 3.43Å; Y158-W215 HydrophobicContact CE1-CD2 4.48Å; Y158-W215 AromaticContact CE1-CE2 3.95Å; Y158-W215 HydrophobicContact CE1-CG 4.18Å; Y158-W215 AromaticContact CE1-NE1 3.25Å; Y158-W215 VanDerWaalsContact CE1-NE1 3.25Å; Y158-W215 WeakPolarHBondContact CE1-O 3.44Å; Y158-W215 HydrophobicContact CE2-CZ2 4.4Å; Y158-W215 AromaticContact CZ-CE2 3.93Å; Y158-W215 AromaticContact CZ-NE1 3.72Å; Y158-W215 PolarHBondContact O-NE1 2.89Å; Y158-W215 PolarHBondContact OH-O 3.03Å; Y158-L219 HydrophobicContact CD1-CB 3.87Å; Y158-L219 HydrophobicContact CD1-CD2 3.81Å; Y158-L219 HydrophobicContact CD1-CG 4.38Å; Y158-L219 HydrophobicContact CD2-CD1 4.39Å; Y158-L219 HydrophobicContact CE1-CB 3.65Å; Y158-L219 HydrophobicContact CE1-CD2 4.46Å; Y158-L219 HydrophobicContact CE2-CB 4.34Å; Y158-L219 HydrophobicContact CG-CB 4.32Å; Y158-L219 HydrophobicContact CG-CD2 3.85Å; Y158-L219 HydrophobicContact CG-CG 4.47Å
159L97.3Very high92.5Very high55 Ų5556.2 Ų56.229%0.28828%0.28SS..Hα-helixtrans-68.9-35.4179.9-64.6176.7000112.4R155 S156 T161 D216R155-L159 HydrophobicContact CG-CD1 3.95Å; R155-L159 HydrophobicContact CG-CG 4.3Å; R155-L159 VanDerWaalsContact O-CG 3.28Å; R155-L159 WeakPolarHBondContact O-CG 3.26Å; R155-L159 PolarHBondContact O-N 3.49Å; S156-L159 PolarHBondContact O-N 3.29Å; L159-T161 VanDerWaalsContact C-N 3.3Å; L159-T161 PolarHBondContact O-N 3.12Å; L159-D216 HydrophobicContact CD2-CB 3.86Å; L159-D216 VanDerWaalsContact CD2-CG 3.49Å; L159-D216 VanDerWaalsContact CD2-OD1 3.23Å; L159-D216 WeakPolarHBondContact CD2-OD1 3.41Å
160F96.9Very high90.8Very high46 Ų4655 Ų5520%0.20227%0.274CS..Hα-helixtrans-59.5-41.4173.3163.5-94.9000112A106 W107 A111 S156 L157 F162 G163 F164A106-F160 HydrophobicContact CB-CE1 4.43Å; W107-F160 VanDerWaalsContact CA-CE1 3.48Å; W107-F160 HydrophobicContact CB-CD1 3.71Å; W107-F160 HydrophobicContact CB-CE1 3.77Å; W107-F160 HydrophobicContact CB-CG 4.28Å; W107-F160 HydrophobicContact CB-CZ 4.38Å; W107-F160 AromaticContact CD1-CD1 3.98Å; W107-F160 AromaticContact CD1-CG 3.68Å; W107-F160 HydrophobicContact CG-CD1 4.23Å; W107-F160 HydrophobicContact CG-CG 4.37Å; A111-F160 WeakPolarHBondContact O-CE2 3.37Å; A111-F160 WeakPolarHBondContact O-CZ 3.26Å; S156-F160 VanDerWaalsContact O-CB 3.29Å; S156-F160 WeakPolarHBondContact O-CB 3.41Å; S156-F160 PolarHBondContact O-N 2.88Å; L157-F160 PolarHBondContact O-N 2.99Å; F160-F162 VanDerWaalsContact C-N 3.28Å; F160-F162 PolarHBondContact O-N 2.87Å; F160-G163 PolarHBondContact O-N 3.25Å; F160-G163 VanDerWaalsContact O-N 3.16Å; F160-F164 HydrophobicContact CD1-CB 4.26Å; F160-F164 HydrophobicContact CE1-CB 3.68Å; F160-F164 HydrophobicContact CE1-CD1 4.38Å; F160-F164 HydrophobicContact CE1-CD2 4.18Å; F160-F164 AromaticContact CE1-CG 3.83Å; F160-F164 HydrophobicContact CE1-CG 3.83Å; F160-F164 HydrophobicContact CE2-CB 4.45Å; F160-F164 HydrophobicContact CZ-CB 3.79Å; F160-F164 AromaticContact CZ-CD2 3.9Å; F160-F164 HydrophobicContact CZ-CD2 3.9Å; F160-F164 AromaticContact CZ-CG 3.97Å; F160-F164 HydrophobicContact CZ-CG 3.97Å; F160-F164 PolarHBondContact O-N 2.74Å
161T97.6Very high89.4Confident0 Ų060 Ų600%030%0.295CS..Hα-helixtrans-60.7-33.8-169.9-60.40000113.1L103 L157 Y158 L159 G163 F164 A165 Y183 L187 W215L103-T161 HydrophobicContact CD1-CG2 4.09Å; L103-T161 HydrophobicContact CD2-CG2 4.04Å; L157-T161 PolarHBondContact O-N 3.1Å; L157-T161 VanDerWaalsContact O-N 3.08Å; L157-T161 PolarHBondContact O-OG1 3.02Å; Y158-T161 PolarHBondContact O-N 3.46Å; L159-T161 VanDerWaalsContact C-N 3.3Å; L159-T161 PolarHBondContact O-N 3.12Å; T161-G163 VanDerWaalsContact C-N 3.35Å; T161-G163 PolarHBondContact O-N 3.02Å; T161-F164 PolarHBondContact O-N 2.76Å; T161-A165 VanDerWaalsContact O-CB 3.25Å; T161-A165 WeakPolarHBondContact O-CB 3.28Å; T161-A165 PolarHBondContact O-N 3.41Å; T161-Y183 HydrophobicContact CG2-CD1 3.34Å; T161-Y183 HydrophobicContact CG2-CD2 4.45Å; T161-Y183 HydrophobicContact CG2-CE1 4.05Å; T161-Y183 HydrophobicContact CG2-CG 3.59Å; T161-L187 HydrophobicContact CG2-CD1 3.85Å; T161-W215 HydrophobicContact CG2-CH2 4.23Å; T161-W215 HydrophobicContact CG2-CZ2 3.98Å
162F96.2Very high88.4Confident8 Ų854.6 Ų54.64%0.03528%0.275CS..Hα-helixtrans-57.3-46.8177.6-178.3-87.2000112.4F160 N166 L175 K212 W215F160-F162 VanDerWaalsContact C-N 3.28Å; F160-F162 PolarHBondContact O-N 2.87Å; F162-N166 PolarHBondContact O-N 2.86Å; F162-L175 HydrophobicContact CD2-CB 4.02Å; F162-L175 HydrophobicContact CD2-CD2 4.19Å; F162-L175 HydrophobicContact CE2-CB 3.52Å; F162-L175 HydrophobicContact CZ-CB 4.01Å; F162-K212 HydrophobicContact CD1-CB 4.36Å; F162-K212 HydrophobicContact CD1-CG 3.98Å; F162-K212 HydrophobicContact CE1-CB 3.82Å; F162-K212 HydrophobicContact CE1-CG 3.94Å; F162-K212 HydrophobicContact CE2-CB 4.28Å; F162-K212 HydrophobicContact CG-CG 4.38Å; F162-K212 HydrophobicContact CZ-CB 3.76Å; F162-K212 HydrophobicContact CZ-CG 4.27Å; F162-W215 HydrophobicContact CB-CD2 4.11Å; F162-W215 HydrophobicContact CB-CG 4.01Å; F162-W215 HydrophobicContact CD2-CB 3.61Å; F162-W215 AromaticContact CD2-CD2 3.81Å; F162-W215 HydrophobicContact CD2-CD2 3.81Å; F162-W215 HydrophobicContact CD2-CE3 4.1Å; F162-W215 AromaticContact CD2-CG 3.59Å; F162-W215 HydrophobicContact CD2-CG 3.59Å; F162-W215 HydrophobicContact CE2-CB 4.1Å; F162-W215 HydrophobicContact CG-CB 4.49Å; F162-W215 HydrophobicContact CG-CD2 4.47Å; F162-W215 HydrophobicContact CG-CG 4.21Å
163G94.2Very high87.9Confident27 Ų2756.6 Ų56.628%0.27828%0.281SS..Hα-helixtrans-69.9-43179.400000111.8F160 T161 A165 N166F160-G163 PolarHBondContact O-N 3.25Å; F160-G163 VanDerWaalsContact O-N 3.16Å; T161-G163 VanDerWaalsContact C-N 3.35Å; T161-G163 PolarHBondContact O-N 3.02Å; G163-A165 VanDerWaalsContact C-N 3.33Å; G163-A165 PolarHBondContact O-N 2.67Å; G163-N166 PolarHBondContact O-N 3.21Å
164F95.6Very high87.7Confident17 Ų1756.3 Ų56.38%0.07528%0.284CS..Hα-helixtrans-60.5-39.9178175.9-107.4000113L103 A106 A111 T113 Q114 F160 T161 N166 Y183L103-F164 HydrophobicContact CD1-CD1 3.84Å; L103-F164 HydrophobicContact CD1-CE1 3.96Å; A106-F164 HydrophobicContact CB-CD2 4.25Å; A106-F164 HydrophobicContact CB-CE1 4.04Å; A106-F164 HydrophobicContact CB-CE2 3.59Å; A106-F164 HydrophobicContact CB-CZ 3.46Å; A106-F164 VanDerWaalsContact CB-CZ 3.46Å; A111-F164 HydrophobicContact CB-CD2 4.13Å; A111-F164 HydrophobicContact CB-CE2 3.88Å; T113-F164 VanDerWaalsContact C-CE2 3.42Å; T113-F164 WeakPolarHBondContact CA-O 3.46Å; T113-F164 VanDerWaalsContact O-CE2 3.26Å; T113-F164 WeakPolarHBondContact O-CE2 3.22Å; Q114-F164 VanDerWaalsContact CA-CE2 3.49Å; Q114-F164 VanDerWaalsContact CA-CZ 3.44Å; Q114-F164 HydrophobicContact CB-CD1 4.24Å; Q114-F164 HydrophobicContact CB-CE1 3.72Å; Q114-F164 HydrophobicContact CB-CE2 4.11Å; Q114-F164 HydrophobicContact CB-CZ 3.65Å; Q114-F164 PolarHBondContact N-O 2.87Å; F160-F164 HydrophobicContact CD1-CB 4.26Å; F160-F164 HydrophobicContact CE1-CB 3.68Å; F160-F164 HydrophobicContact CE1-CD1 4.38Å; F160-F164 HydrophobicContact CE1-CD2 4.18Å; F160-F164 AromaticContact CE1-CG 3.83Å; F160-F164 HydrophobicContact CE1-CG 3.83Å; F160-F164 HydrophobicContact CE2-CB 4.45Å; F160-F164 HydrophobicContact CZ-CB 3.79Å; F160-F164 AromaticContact CZ-CD2 3.9Å; F160-F164 HydrophobicContact CZ-CD2 3.9Å; F160-F164 AromaticContact CZ-CG 3.97Å; F160-F164 HydrophobicContact CZ-CG 3.97Å; F160-F164 PolarHBondContact O-N 2.74Å; T161-F164 PolarHBondContact O-N 2.76Å; F164-N166 VanDerWaalsContact C-N 3.28Å; F164-N166 PolarHBondContact O-N 2.9Å; F164-Y183 HydrophobicContact CD1-CE1 4.07Å; F164-Y183 HydrophobicContact CE1-CE1 4.06Å; F164-Y183 AromaticContact CE1-CZ 3.99Å; F164-Y183 VanDerWaalsContact CE1-OH 3.28Å; F164-Y183 WeakPolarHBondContact CE1-OH 3.39Å
165A95.2Very high87.5Confident0 Ų056.2 Ų56.20%028%0.283CS..Hα-helixtrans-71.9-18.8179.100000113.7Q114 T161 G163 L167 L175 Y183Q114-A165 PolarHBondContact NE2-O 2.85Å; T161-A165 VanDerWaalsContact O-CB 3.25Å; T161-A165 WeakPolarHBondContact O-CB 3.28Å; T161-A165 PolarHBondContact O-N 3.41Å; G163-A165 VanDerWaalsContact C-N 3.33Å; G163-A165 PolarHBondContact O-N 2.67Å; A165-L167 PolarHBondContact O-N 3.48Å; A165-L167 VanDerWaalsContact O-N 3.12Å; A165-L175 HydrophobicContact CB-CD1 3.89Å; A165-L175 HydrophobicContact CB-CD2 3.95Å; A165-Y183 HydrophobicContact CB-CD2 3.38Å; A165-Y183 HydrophobicContact CB-CE2 3.32Å; A165-Y183 HydrophobicContact CB-CG 4.26Å
166N89.2Confident87.3Confident8 Ų855.3 Ų55.34%0.04329%0.285CS..  trans-85.688.1-171.5-153.4-28.2000111.8F162 G163 F164 S172 S174 L175F162-N166 PolarHBondContact O-N 2.86Å; G163-N166 PolarHBondContact O-N 3.21Å; F164-N166 VanDerWaalsContact C-N 3.28Å; F164-N166 PolarHBondContact O-N 2.9Å; N166-S172 WeakPolarHBondContact ND2-CB 3.47Å; N166-S172 PolarHBondContact ND2-O 3.18Å; N166-S174 PolarHBondContact ND2-O 3.28Å; N166-L175 HydrophobicContact CB-CD1 4.21Å
167L79.7Confident87.2Confident79 Ų7954 Ų5441%0.41427%0.273SS..  trans-66.2-35.4-179.7-72.6177.8000113.4T113 Q114 A165 Y179T113-L167 WeakPolarHBondContact OG1-CD2 3.43Å; Q114-L167 HydrophobicContact CG-CD1 4.31Å; Q114-L167 HydrophobicContact CG-CD2 3.49Å; Q114-L167 VanDerWaalsContact CG-CD2 3.49Å; Q114-L167 HydrophobicContact CG-CG 3.87Å; A165-L167 PolarHBondContact O-N 3.48Å; A165-L167 VanDerWaalsContact O-N 3.12Å; L167-Y179 HydrophobicContact CD1-CE1 4.22Å; L167-Y179 HydrophobicContact CD1-CE2 4.39Å
168D64.9Low87Confident115 Ų11560 Ų6062%0.61530%0.301SS*.SBendtrans-78.3-30.4-165.6-68.3-43.8000112.7
169K61.5Low86.8Confident144 Ų14462.6 Ų62.663%0.62631%0.311SS*.  trans-161.5113-178.1-55.5177.2-176.4169.60109.2E171 S172K169-E171 PolarHBondContact O-N 2.94Å; K169-S172 PolarHBondContact O-N 3.41Å
170H59.8Low86.8Confident119 Ų11960 Ų6055%0.55130%0.298SS*.THydrogen-bonded Turntrans-53.7-17.2175.3-67.3-76.1000114.3K112K112-H170 PolarHBondContact O-CE1 3.41Å; K112-H170 PolarHBondContact O-ND1 2.9Å
171E65.7Low86.8Confident186 Ų18658.9 Ų58.987%0.86929%0.294SS*.THydrogen-bonded Turntrans-114.910.3178.7-59.2-177.5171.900113.7K169 K173K169-E171 PolarHBondContact O-N 2.94Å; E171-K173 PolarHBondContact O-N 3.49Å
172S75.6Confident86.8Confident29 Ų2962 Ų6220%0.20331%0.314CS..  trans-64.7132.3174.91680000110.1N166 K169 S174N166-S172 WeakPolarHBondContact ND2-CB 3.47Å; N166-S172 PolarHBondContact ND2-O 3.18Å; K169-S172 PolarHBondContact O-N 3.41Å; S172-S174 PolarHBondContact O-N 3.1Å; S172-S174 PolarHBondContact OG-N 3.39Å; S172-S174 VanDerWaalsContact OG-N 3.1Å; S172-S174 PolarHBondContact OG-O 3.45Å; S172-S174 PolarHBondContact OG-OG 2.9Å
173K86.9Confident86.9Confident178 Ų17862.8 Ų62.877%0.77432%0.317SS*.SBendtrans-78.85.3175.9-60.8-173.8178.9-176.30112.9E171 S211 K212E171-K173 PolarHBondContact O-N 3.49Å; K173-S211 CarbonylContact O-C 3.59Å; K173-S211 WeakPolarHBondContact O-CA 3.11Å; K173-K212 PolarHBondContact O-N 2.86Å
174S92.6Very high87.1Confident48 Ų4861.5 Ų61.534%0.33630%0.304SS..EExtended strand (participates in β ladder)trans-140.9146.1179.762.40000113.4N166 S172 I210N166-S174 PolarHBondContact ND2-O 3.28Å; S172-S174 PolarHBondContact O-N 3.1Å; S172-S174 PolarHBondContact OG-N 3.39Å; S172-S174 VanDerWaalsContact OG-N 3.1Å; S172-S174 PolarHBondContact OG-O 3.45Å; S172-S174 PolarHBondContact OG-OG 2.9Å; S174-I210 CarbonylContact C-O 3.53Å; S174-I210 WeakPolarHBondContact CA-O 3.36Å
175L94.5Very high87.3Confident0 Ų063.1 Ų63.10%031%0.312CS..EExtended strand (participates in β ladder)trans-117.8126176.4-175.864.4000109.9F162 A165 N166 Y179 A180 P209 I210 W215F162-L175 HydrophobicContact CD2-CB 4.02Å; F162-L175 HydrophobicContact CD2-CD2 4.19Å; F162-L175 HydrophobicContact CE2-CB 3.52Å; F162-L175 HydrophobicContact CZ-CB 4.01Å; A165-L175 HydrophobicContact CB-CD1 3.89Å; A165-L175 HydrophobicContact CB-CD2 3.95Å; N166-L175 HydrophobicContact CB-CD1 4.21Å; L175-Y179 HydrophobicContact CD1-CD2 4.21Å; L175-Y179 HydrophobicContact CD1-CG 4.44Å; L175-A180 HydrophobicContact CD2-CB 3.87Å; L175-A180 HydrophobicContact CG-CB 4.14Å; L175-P209 CarbonylContact O-C 3.52Å; L175-P209 WeakPolarHBondContact O-CA 3.35Å; L175-I210 PolarHBondContact N-O 3.27Å; L175-I210 PolarHBondContact O-N 2.9Å; L175-W215 HydrophobicContact CD2-CE3 4.17Å; L175-W215 HydrophobicContact CD2-CZ3 3.94Å
176V94.3Very high87.4Confident46 Ų4665 Ų6528%0.27932%0.321SS..  trans-65.7147.8178.5-70.70000111.5Q178 Y179 A180 P209V176-Q178 HydrophobicContact CB-CG 4.17Å; V176-Q178 HydrophobicContact CG2-CG 3.51Å; V176-Q178 PolarHBondContact O-N 2.87Å; V176-Q178 VanDerWaalsContact O-N 3.16Å; V176-Y179 HydrophobicContact CG2-CD2 3.24Å; V176-Y179 HydrophobicContact CG2-CE2 3.61Å; V176-Y179 HydrophobicContact CG2-CG 4.07Å; V176-Y179 PolarHBondContact O-N 3.35Å; V176-A180 PolarHBondContact O-N 3.3Å; V176-P209 HydrophobicContact CG1-CG 4.16Å
177L96.1Very high87.8Confident28 Ų2864.8 Ų64.815%0.14732%0.32CS..Hα-helixtrans-57.4-33.9-175.3-65.6-179.1000113.5Y179 A180 I181 L202 R208 I210L177-Y179 PolarHBondContact O-N 3.28Å; L177-A180 PolarHBondContact O-N 2.92Å; L177-I181 HydrophobicContact CB-CD1 4.34Å; L177-I181 WeakPolarHBondContact O-CB 3.32Å; L177-I181 PolarHBondContact O-N 2.97Å; L177-L202 HydrophobicContact CD1-CB 4.48Å; L177-L202 WeakPolarHBondContact CD1-O 3.26Å; L177-L202 HydrophobicContact CD2-CB 4.21Å; L177-L202 HydrophobicContact CD2-CD1 4.21Å; L177-L202 HydrophobicContact CD2-CD2 4.43Å; L177-R208 WeakPolarHBondContact CD2-O 3.42Å; L177-R208 VanDerWaalsContact CG-O 3.28Å; L177-R208 WeakPolarHBondContact CG-O 3.47Å; L177-I210 HydrophobicContact CD2-CD1 3.6Å; L177-I210 HydrophobicContact CD2-CG1 3.74Å
178Q94.8Very high88.7Confident126 Ų12661 Ų6159%0.58930%0.3SS*.Hα-helixtrans-58.7-2617768179.717.600113.5V176 P182V176-Q178 HydrophobicContact CB-CG 4.17Å; V176-Q178 HydrophobicContact CG2-CG 3.51Å; V176-Q178 PolarHBondContact O-N 2.87Å; V176-Q178 VanDerWaalsContact O-N 3.16Å; Q178-P182 VanDerWaalsContact O-CD 3.27Å; Q178-P182 WeakPolarHBondContact O-CD 3.34Å; Q178-P182 WeakPolarHBondContact O-CG 3.25Å
179Y94.5Very high90.2Very high55 Ų5563.6 Ų63.622%0.21630%0.301CS..Hα-helixtrans-99.6-40.6174.5-60.3-43.5000111.2L167 L175 V176 L177 I181 P182 Y183L167-Y179 HydrophobicContact CD1-CE1 4.22Å; L167-Y179 HydrophobicContact CD1-CE2 4.39Å; L175-Y179 HydrophobicContact CD1-CD2 4.21Å; L175-Y179 HydrophobicContact CD1-CG 4.44Å; V176-Y179 HydrophobicContact CG2-CD2 3.24Å; V176-Y179 HydrophobicContact CG2-CE2 3.61Å; V176-Y179 HydrophobicContact CG2-CG 4.07Å; V176-Y179 PolarHBondContact O-N 3.35Å; L177-Y179 PolarHBondContact O-N 3.28Å; Y179-I181 PolarHBondContact O-N 3.03Å; Y179-P182 WeakPolarHBondContact O-CD 3.41Å; Y179-Y183 VanDerWaalsContact O-CD2 3.25Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.25Å; Y179-Y183 PolarHBondContact O-N 3.47Å
180A96.7Very high91.8Very high0 Ų060.8 Ų60.80%031%0.314CS..Hα-helixtrans-59.9-44.8-17800000113L175 V176 L177 Y183 W184 I210 W215L175-A180 HydrophobicContact CD2-CB 3.87Å; L175-A180 HydrophobicContact CG-CB 4.14Å; V176-A180 PolarHBondContact O-N 3.3Å; L177-A180 PolarHBondContact O-N 2.92Å; A180-Y183 PolarHBondContact O-N 3.25Å; A180-W184 HydrophobicContact CB-CE3 4.01Å; A180-W184 HydrophobicContact CB-CH2 4.27Å; A180-W184 HydrophobicContact CB-CZ3 3.78Å; A180-W184 PolarHBondContact O-N 3.38Å; A180-I210 HydrophobicContact CB-CG1 3.91Å; A180-W215 HydrophobicContact CB-CZ3 4.19Å
181I97.8Very high93.5Very high23 Ų2360.8 Ų60.812%0.11831%0.309CS..Hα-helixtrans-63.7-52.7-175.6-69.8172.9000112.1L177 Y179 Y183 W184 E185 F199 L202 Q203L177-I181 HydrophobicContact CB-CD1 4.34Å; L177-I181 WeakPolarHBondContact O-CB 3.32Å; L177-I181 PolarHBondContact O-N 2.97Å; Y179-I181 PolarHBondContact O-N 3.03Å; I181-Y183 VanDerWaalsContact C-N 3.32Å; I181-Y183 PolarHBondContact O-N 3.12Å; I181-W184 PolarHBondContact O-N 3.06Å; I181-E185 PolarHBondContact O-N 2.9Å; I181-F199 HydrophobicContact CB-CD1 4.44Å; I181-F199 HydrophobicContact CB-CE1 4.45Å; I181-F199 HydrophobicContact CG1-CD1 4.1Å; I181-F199 HydrophobicContact CG1-CE1 4.45Å; I181-F199 HydrophobicContact CG2-CD1 3.95Å; I181-F199 HydrophobicContact CG2-CD2 4.12Å; I181-F199 HydrophobicContact CG2-CE1 4.04Å; I181-F199 HydrophobicContact CG2-CE2 4.19Å; I181-F199 HydrophobicContact CG2-CG 3.99Å; I181-F199 HydrophobicContact CG2-CZ 4.15Å; I181-L202 HydrophobicContact CG1-CD1 4.45Å; I181-Q203 HydrophobicContact CD1-CG 3.67Å
182P97.4Very high95Very high67 Ų6752.3 Ų52.344%0.43527%0.269SS..Hα-helixtrans-57.5-40.3177.2-2835.7000114Q178 Y179 E185 I186Q178-P182 VanDerWaalsContact O-CD 3.27Å; Q178-P182 WeakPolarHBondContact O-CD 3.34Å; Q178-P182 WeakPolarHBondContact O-CG 3.25Å; Y179-P182 WeakPolarHBondContact O-CD 3.41Å; P182-E185 WeakPolarHBondContact O-CB 3.2Å; P182-E185 PolarHBondContact O-N 3.24Å; P182-I186 WeakPolarHBondContact O-CG1 3.26Å; P182-I186 PolarHBondContact O-N 3.37Å
183Y98.3Very high96Very high23 Ų2355 Ų559%0.0929%0.287CS..Hα-helixtrans-70.1-37.4178.4-80.6-69.6000112.9L103 Q114 T161 F164 A165 Y179 A180 I181 E185 I186 L187L103-Y183 HydrophobicContact CD1-CD1 4.21Å; L103-Y183 HydrophobicContact CD1-CE1 3.88Å; L103-Y183 HydrophobicContact CD2-CD1 4.01Å; L103-Y183 HydrophobicContact CD2-CE1 4.42Å; Q114-Y183 WeakPolarHBondContact CB-OH 3.17Å; Q114-Y183 PolarHBondContact OE1-OH 3.26Å; T161-Y183 HydrophobicContact CG2-CD1 3.34Å; T161-Y183 HydrophobicContact CG2-CD2 4.45Å; T161-Y183 HydrophobicContact CG2-CE1 4.05Å; T161-Y183 HydrophobicContact CG2-CG 3.59Å; F164-Y183 HydrophobicContact CD1-CE1 4.07Å; F164-Y183 HydrophobicContact CE1-CE1 4.06Å; F164-Y183 AromaticContact CE1-CZ 3.99Å; F164-Y183 VanDerWaalsContact CE1-OH 3.28Å; F164-Y183 WeakPolarHBondContact CE1-OH 3.39Å; A165-Y183 HydrophobicContact CB-CD2 3.38Å; A165-Y183 HydrophobicContact CB-CE2 3.32Å; A165-Y183 HydrophobicContact CB-CG 4.26Å; Y179-Y183 VanDerWaalsContact O-CD2 3.25Å; Y179-Y183 WeakPolarHBondContact O-CD2 3.25Å; Y179-Y183 PolarHBondContact O-N 3.47Å; A180-Y183 PolarHBondContact O-N 3.25Å; I181-Y183 VanDerWaalsContact C-N 3.32Å; I181-Y183 PolarHBondContact O-N 3.12Å; Y183-E185 VanDerWaalsContact C-N 3.3Å; Y183-I186 HydrophobicContact CD1-CD1 4.49Å; Y183-I186 PolarHBondContact O-N 3.28Å; Y183-L187 WeakPolarHBondContact O-CB 3.38Å; Y183-L187 VanDerWaalsContact O-CG 3.31Å; Y183-L187 WeakPolarHBondContact O-CG 3.43Å; Y183-L187 PolarHBondContact O-N 3.34Å
184W98.5Very high96.4Very high0 Ų047.2 Ų47.20%025%0.253CS..Hα-helixtrans-65.5-34.3170.8-78.4-35.9000112.5Y158 A180 I181 I186 L187 L188 L195 W198 F199 L202 I210 W215 L218Y158-W184 AromaticContact CE2-CD1 3.98Å; Y158-W184 AromaticContact CZ-NE1 3.82Å; Y158-W184 PolarHBondContact OH-NE1 3.02Å; A180-W184 HydrophobicContact CB-CE3 4.01Å; A180-W184 HydrophobicContact CB-CH2 4.27Å; A180-W184 HydrophobicContact CB-CZ3 3.78Å; A180-W184 PolarHBondContact O-N 3.38Å; I181-W184 PolarHBondContact O-N 3.06Å; W184-I186 VanDerWaalsContact C-N 3.31Å; W184-I186 PolarHBondContact O-N 2.96Å; W184-L187 PolarHBondContact O-N 2.65Å; W184-L188 HydrophobicContact CB-CD1 4.26Å; W184-L188 HydrophobicContact CG-CD1 4.08Å; W184-L188 WeakPolarHBondContact O-CA 3.28Å; W184-L188 VanDerWaalsContact O-CB 3.26Å; W184-L188 WeakPolarHBondContact O-CB 3.05Å; W184-L188 PolarHBondContact O-N 3.39Å; W184-L195 HydrophobicContact CB-CD1 4.5Å; W184-W198 AromaticContact CE3-NE1 3.52Å; W184-W198 AromaticContact CH2-CZ2 3.85Å; W184-W198 HydrophobicContact CH2-CZ2 3.85Å; W184-W198 AromaticContact CH2-NE1 3.69Å; W184-W198 HydrophobicContact CZ2-CZ2 4.46Å; W184-W198 HydrophobicContact CZ3-CZ2 4.27Å; W184-W198 AromaticContact CZ3-NE1 3.37Å; W184-F199 HydrophobicContact CB-CE1 3.79Å; W184-F199 HydrophobicContact CB-CZ 3.99Å; W184-F199 HydrophobicContact CE3-CE1 4.33Å; W184-L202 HydrophobicContact CE3-CD1 4.16Å; W184-L202 HydrophobicContact CH2-CD1 4.19Å; W184-L202 HydrophobicContact CZ3-CD1 3.4Å; W184-I210 HydrophobicContact CH2-CB 4.17Å; W184-I210 HydrophobicContact CH2-CD1 3.76Å; W184-I210 HydrophobicContact CH2-CG1 3.53Å; W184-I210 HydrophobicContact CH2-CG2 3.68Å; W184-I210 HydrophobicContact CZ2-CG2 3.97Å; W184-I210 HydrophobicContact CZ3-CD1 4.15Å; W184-I210 HydrophobicContact CZ3-CG1 3.91Å; W184-W215 AromaticContact CD1-CH2 3.59Å; W184-W215 AromaticContact CD1-CZ3 3.61Å; W184-W215 HydrophobicContact CD2-CE3 4.24Å; W184-W215 HydrophobicContact CD2-CH2 4.47Å; W184-W215 AromaticContact CD2-CZ3 3.8Å; W184-W215 HydrophobicContact CD2-CZ3 3.8Å; W184-W215 AromaticContact CE2-CE3 3.37Å; W184-W215 AromaticContact CE2-CZ3 3.38Å; W184-W215 HydrophobicContact CG-CH2 4.18Å; W184-W215 AromaticContact CG-CZ3 3.98Å; W184-W215 HydrophobicContact CG-CZ3 3.98Å; W184-W215 HydrophobicContact CH2-CE3 4.4Å; W184-W215 HydrophobicContact CZ2-CD2 4.29Å; W184-W215 AromaticContact CZ2-CE3 3.49Å; W184-W215 HydrophobicContact CZ2-CE3 3.49Å; W184-W215 VanDerWaalsContact CZ2-CE3 3.49Å; W184-W215 AromaticContact CZ2-CZ3 3.93Å; W184-W215 HydrophobicContact CZ2-CZ3 3.93Å; W184-W215 AromaticContact NE1-CD2 3.7Å; W184-W215 AromaticContact NE1-CE3 3.28Å; W184-W215 VanDerWaalsContact NE1-CE3 3.28Å; W184-W215 AromaticContact NE1-CH2 3.55Å; W184-W215 AromaticContact NE1-CZ2 3.95Å; W184-W215 AromaticContact NE1-CZ3 3.19Å; W184-L218 HydrophobicContact CD2-CD2 4.19Å; W184-L218 HydrophobicContact CH2-CD2 4.17Å; W184-L218 HydrophobicContact CZ2-CD2 3.49Å; W184-L218 VanDerWaalsContact CZ2-CD2 3.49Å
185E98.2Very high96.7Very high52 Ų5245.4 Ų45.424%0.24324%0.24CC..Hα-helixtrans-61.4-42.9173.4-175.863.5-95.600110.8I181 P182 Y183 R189 F199I181-E185 PolarHBondContact O-N 2.9Å; P182-E185 WeakPolarHBondContact O-CB 3.2Å; P182-E185 PolarHBondContact O-N 3.24Å; Y183-E185 VanDerWaalsContact C-N 3.3Å; E185-R189 VanDerWaalsContact CG-NH2 3.31Å; E185-R189 WeakPolarHBondContact O-CB 3.48Å; E185-R189 PolarHBondContact O-N 3.42Å; E185-R189 WeakPolarHBondContact OE1-CB 3.34Å; E185-R189 IonicContact OE1-CZ 3.74Å; E185-R189 IonicContact OE1-NE 2.93Å; E185-R189 PolarHBondContact OE1-NE 3.03Å; E185-R189 IonicContact OE1-NH1 3.95Å; E185-R189 PolarHBondContact OE1-NH1 2.73Å; E185-R189 IonicContact OE1-NH2 3.22Å; E185-R189 PolarHBondContact OE1-NH2 3.22Å; E185-R189 IonicContact OE2-CZ 3.92Å; E185-R189 IonicContact OE2-NH2 2.73Å; E185-R189 PolarHBondContact OE2-NH2 3.4Å; E185-F199 HydrophobicContact CB-CE2 4.03Å; E185-F199 HydrophobicContact CB-CZ 4Å; E185-F199 HydrophobicContact CG-CE2 4.5Å; E185-F199 WeakPolarHBondContact OE2-CE2 3.1Å
186I98Very high96.8Very high40 Ų4050 Ų5021%0.20527%0.272CS..Hα-helixtrans-65.1-44.7175.8-67.2169000111.9E98 L100 L103 P182 Y183 W184E98-I186 VanDerWaalsContact O-CD1 3.25Å; E98-I186 WeakPolarHBondContact O-CD1 3.46Å; E98-I186 WeakPolarHBondContact O-CG1 3.45Å; L100-I186 HydrophobicContact CB-CG2 4.01Å; L100-I186 HydrophobicContact CD1-CG2 3.87Å; L103-I186 HydrophobicContact CB-CG2 4.5Å; L103-I186 HydrophobicContact CD2-CG2 3.96Å; P182-I186 WeakPolarHBondContact O-CG1 3.26Å; P182-I186 PolarHBondContact O-N 3.37Å; Y183-I186 HydrophobicContact CD1-CD1 4.49Å; Y183-I186 PolarHBondContact O-N 3.28Å; W184-I186 VanDerWaalsContact C-N 3.31Å; W184-I186 PolarHBondContact O-N 2.96Å
187L98.4Very high97Very high3 Ų349.7 Ų49.72%0.01627%0.269CS..Hα-helixtrans-81.8-41.2-171.1-73166.3000113.5L100 L103 F154 L157 Y158 T161 Y183 W184 W215L100-L187 HydrophobicContact CD1-CD2 4.38Å; L103-L187 HydrophobicContact CD2-CD1 4.35Å; L103-L187 HydrophobicContact CD2-CD2 3.78Å; L103-L187 HydrophobicContact CD2-CG 3.92Å; F154-L187 HydrophobicContact CE2-CD2 4.28Å; F154-L187 HydrophobicContact CZ-CB 4.4Å; F154-L187 HydrophobicContact CZ-CD2 4.46Å; F154-L187 VanDerWaalsContact CZ-O 3.27Å; F154-L187 WeakPolarHBondContact CZ-O 3.4Å; L157-L187 HydrophobicContact CD2-CD2 4.02Å; L157-L187 HydrophobicContact CG-CD2 4.06Å; Y158-L187 HydrophobicContact CD2-CB 4.35Å; Y158-L187 HydrophobicContact CD2-CD1 3.86Å; Y158-L187 HydrophobicContact CE2-CD1 4.35Å; T161-L187 HydrophobicContact CG2-CD1 3.85Å; Y183-L187 WeakPolarHBondContact O-CB 3.38Å; Y183-L187 VanDerWaalsContact O-CG 3.31Å; Y183-L187 WeakPolarHBondContact O-CG 3.43Å; Y183-L187 PolarHBondContact O-N 3.34Å; W184-L187 PolarHBondContact O-N 2.65Å; L187-W215 HydrophobicContact CD1-CH2 4.29Å; L187-W215 HydrophobicContact CD1-CZ2 3.86Å
188L98.1Very high97.1Very high0 Ų048.3 Ų48.30%026%0.262CS..Hα-helixtrans-107-5.4-165.6-58-178.9000113.5F154 Y158 W184 G190 R191 F192 L195 L218 V222F154-L188 HydrophobicContact CZ-CD2 4.43Å; Y158-L188 HydrophobicContact CD2-CD2 4.28Å; Y158-L188 HydrophobicContact CE2-CD1 4.27Å; Y158-L188 HydrophobicContact CE2-CD2 3.92Å; Y158-L188 HydrophobicContact CE2-CG 4.25Å; W184-L188 HydrophobicContact CB-CD1 4.26Å; W184-L188 HydrophobicContact CG-CD1 4.08Å; W184-L188 WeakPolarHBondContact O-CA 3.28Å; W184-L188 VanDerWaalsContact O-CB 3.26Å; W184-L188 WeakPolarHBondContact O-CB 3.05Å; W184-L188 PolarHBondContact O-N 3.39Å; L188-G190 PolarHBondContact O-N 3.48Å; L188-R191 PolarHBondContact O-N 3.07Å; L188-F192 HydrophobicContact CB-CB 4.17Å; L188-F192 PolarHBondContact O-N 3.12Å; L188-L195 HydrophobicContact CB-CD1 3.88Å; L188-L195 HydrophobicContact CB-CD2 4.24Å; L188-L195 HydrophobicContact CD1-CD1 4.32Å; L188-L218 HydrophobicContact CD1-CD2 4.31Å; L188-V222 HydrophobicContact CD1-CG2 4.36Å
189R96.3Very high97.2Very high168 Ų16843.1 Ų43.163%0.63424%0.237SC*.THydrogen-bonded Turntrans-56.6124.9173-177.8-178.4-66.8-85.79110E185 R191 L195E185-R189 VanDerWaalsContact CG-NH2 3.31Å; E185-R189 WeakPolarHBondContact O-CB 3.48Å; E185-R189 PolarHBondContact O-N 3.42Å; E185-R189 WeakPolarHBondContact OE1-CB 3.34Å; E185-R189 IonicContact OE1-CZ 3.74Å; E185-R189 IonicContact OE1-NE 2.93Å; E185-R189 PolarHBondContact OE1-NE 3.03Å; E185-R189 IonicContact OE1-NH1 3.95Å; E185-R189 PolarHBondContact OE1-NH1 2.73Å; E185-R189 IonicContact OE1-NH2 3.22Å; E185-R189 PolarHBondContact OE1-NH2 3.22Å; E185-R189 IonicContact OE2-CZ 3.92Å; E185-R189 IonicContact OE2-NH2 2.73Å; E185-R189 PolarHBondContact OE2-NH2 3.4Å; R189-R191 PolarHBondContact O-N 3.36Å; R189-L195 HydrophobicContact CB-CD2 4.37Å
190G94.5Very high97.4Very high86 Ų8644.3 Ų44.389%0.88724%0.243SC*.THydrogen-bonded Turntrans76.9-4.3-176.300000115.3L188L188-G190 PolarHBondContact O-N 3.48Å
191R95.9Very high97.5Very high118 Ų11844.6 Ų44.645%0.44525%0.245SC..THydrogen-bonded Turntrans-104.8-37.4174.5-63.7-176.4178.4-93.24.4112.4I148 F154 L188 R189I148-R191 PolarHBondContact O-NH2 3.26Å; F154-R191 VanDerWaalsContact CZ-CD 3.49Å; L188-R191 PolarHBondContact O-N 3.07Å; R189-R191 PolarHBondContact O-N 3.36Å
192F97.6Very high97.5Very high8 Ų843.5 Ų43.54%0.03524%0.239CC..  trans-107.5108.8178.2-175.3-153.4000110.9L188 H194 L195 W198 F221 V222 I225 F245L188-F192 HydrophobicContact CB-CB 4.17Å; L188-F192 PolarHBondContact O-N 3.12Å; F192-H194 HydrophobicContact CD2-CB 4.31Å; F192-H194 HydrophobicContact CE1-CB 4.37Å; F192-H194 HydrophobicContact CE2-CB 3.66Å; F192-H194 HydrophobicContact CZ-CB 3.69Å; F192-H194 PolarHBondContact O-N 3.18Å; F192-L195 HydrophobicContact CB-CB 4.24Å; F192-L195 HydrophobicContact CD1-CB 4.03Å; F192-L195 HydrophobicContact CD1-CD1 3.93Å; F192-L195 HydrophobicContact CG-CB 4.4Å; F192-L195 VanDerWaalsContact O-CB 3.32Å; F192-L195 WeakPolarHBondContact O-CB 3.48Å; F192-L195 PolarHBondContact O-N 3.12Å; F192-W198 HydrophobicContact CD1-CB 4.5Å; F192-W198 HydrophobicContact CE1-CB 3.66Å; F192-W198 HydrophobicContact CE1-CG 4.02Å; F192-W198 HydrophobicContact CZ-CB 4.45Å; F192-F221 HydrophobicContact CE2-CD1 4.43Å; F192-F221 AromaticContact CE2-CE1 3.9Å; F192-F221 HydrophobicContact CE2-CE1 3.9Å; F192-F221 HydrophobicContact CZ-CD1 4.36Å; F192-F221 AromaticContact CZ-CE1 3.79Å; F192-F221 HydrophobicContact CZ-CE1 3.79Å; F192-V222 HydrophobicContact CB-CG1 3.77Å; F192-V222 HydrophobicContact CB-CG2 3.88Å; F192-V222 HydrophobicContact CD1-CG2 3.9Å; F192-V222 HydrophobicContact CD2-CB 4.42Å; F192-V222 HydrophobicContact CD2-CG1 4.28Å; F192-V222 HydrophobicContact CD2-CG2 3.74Å; F192-V222 HydrophobicContact CE1-CG2 4.32Å; F192-V222 HydrophobicContact CE2-CG2 4.18Å; F192-V222 HydrophobicContact CG-CG1 4.23Å; F192-V222 HydrophobicContact CG-CG2 3.6Å; F192-V222 HydrophobicContact CZ-CG2 4.46Å; F192-I225 HydrophobicContact CE2-CG2 4.33Å; F192-F245 AromaticContact CZ-CE1 3.97Å; F192-F245 HydrophobicContact CZ-CE1 3.97Å; F192-F245 HydrophobicContact CZ-CZ 4.16Å
193C95.9Very high97.5Very high86 Ų8645.8 Ų45.858%0.58124%0.244SC*.THydrogen-bonded Turntrans-63.8-25-178.158.50000113.5
194H96.9Very high97.4Very high14 Ų1449.5 Ų49.57%0.06526%0.262CS..THydrogen-bonded Turntrans-99.618.4178-54-60.9000113.8F192 S196 L197 W198 P227 M229 F245F192-H194 HydrophobicContact CD2-CB 4.31Å; F192-H194 HydrophobicContact CE1-CB 4.37Å; F192-H194 HydrophobicContact CE2-CB 3.66Å; F192-H194 HydrophobicContact CZ-CB 3.69Å; F192-H194 PolarHBondContact O-N 3.18Å; H194-S196 VanDerWaalsContact C-N 3.3Å; H194-S196 PolarHBondContact O-N 3.23Å; H194-L197 HydrophobicContact CB-CB 4.39Å; H194-L197 HydrophobicContact CB-CD1 4.5Å; H194-L197 WeakPolarHBondContact O-CB 3.3Å; H194-L197 PolarHBondContact O-N 3.34Å; H194-W198 PolarHBondContact O-N 3.37Å; H194-P227 PolarHBondContact CE1-O 3.33Å; H194-P227 PolarHBondContact NE2-O 2.79Å; H194-M229 HydrophobicContact CB-CE 4.07Å; H194-M229 WeakPolarHBondContact CD2-CE 3.43Å; H194-F245 HydrophobicContact CB-CZ 4.11Å
195L97.9Very high97.3Very high10 Ų1054.4 Ų54.45%0.05229%0.285CS..Hα-helixtrans-54.6-43.3-176.8-171.762.9000113.1W184 L188 R189 F192 L197 W198 F199W184-L195 HydrophobicContact CB-CD1 4.5Å; L188-L195 HydrophobicContact CB-CD1 3.88Å; L188-L195 HydrophobicContact CB-CD2 4.24Å; L188-L195 HydrophobicContact CD1-CD1 4.32Å; R189-L195 HydrophobicContact CB-CD2 4.37Å; F192-L195 HydrophobicContact CB-CB 4.24Å; F192-L195 HydrophobicContact CD1-CB 4.03Å; F192-L195 HydrophobicContact CD1-CD1 3.93Å; F192-L195 HydrophobicContact CG-CB 4.4Å; F192-L195 VanDerWaalsContact O-CB 3.32Å; F192-L195 WeakPolarHBondContact O-CB 3.48Å; F192-L195 PolarHBondContact O-N 3.12Å; L195-L197 PolarHBondContact O-N 3.04Å; L195-W198 WeakPolarHBondContact O-CB 3.35Å; L195-W198 PolarHBondContact O-N 2.7Å; L195-F199 HydrophobicContact CD1-CD1 4.41Å; L195-F199 HydrophobicContact CD1-CE1 3.6Å; L195-F199 HydrophobicContact CD1-CE2 4.08Å; L195-F199 HydrophobicContact CD1-CZ 3.41Å; L195-F199 VanDerWaalsContact CD1-CZ 3.41Å; L195-F199 HydrophobicContact CD2-CE2 4.17Å; L195-F199 HydrophobicContact CD2-CZ 4.08Å; L195-F199 HydrophobicContact CG-CD2 4.39Å; L195-F199 HydrophobicContact CG-CE1 4.15Å; L195-F199 HydrophobicContact CG-CE2 3.71Å; L195-F199 HydrophobicContact CG-CZ 3.58Å; L195-F199 WeakPolarHBondContact O-CG 3.27Å; L195-F199 PolarHBondContact O-N 2.59Å
196S97.1Very high97.2Very high98 Ų9852.9 Ų52.969%0.68528%0.277SS*.Hα-helixtrans-64.8-39.3177.4-54.20000112.7H194 F199 K200H194-S196 VanDerWaalsContact C-N 3.3Å; H194-S196 PolarHBondContact O-N 3.23Å; S196-F199 PolarHBondContact O-N 3.24Å; S196-K200 WeakPolarHBondContact O-CB 3.27Å; S196-K200 PolarHBondContact O-N 3.29Å
197L97.3Very high97.1Very high38 Ų3857.9 Ų57.920%0.19930%0.298CS..Hα-helixtrans-66.7-40.8175.3-75.3175.2000110.8H194 L195 K200 F201 F245 W248 V253H194-L197 HydrophobicContact CB-CB 4.39Å; H194-L197 HydrophobicContact CB-CD1 4.5Å; H194-L197 WeakPolarHBondContact O-CB 3.3Å; H194-L197 PolarHBondContact O-N 3.34Å; L195-L197 PolarHBondContact O-N 3.04Å; L197-K200 PolarHBondContact O-N 3.36Å; L197-F201 WeakPolarHBondContact O-CB 3.22Å; L197-F201 PolarHBondContact O-N 2.8Å; L197-F245 HydrophobicContact CB-CE2 4.2Å; L197-F245 HydrophobicContact CB-CZ 4.44Å; L197-W248 HydrophobicContact CB-CZ3 4.33Å; L197-W248 HydrophobicContact CD2-CH2 4.4Å; L197-W248 HydrophobicContact CD2-CZ3 4.3Å; L197-W248 WeakPolarHBondContact O-CZ3 3.44Å; L197-V253 HydrophobicContact CD1-CG2 3.75Å
198W98.4Very high96.9Very high0 Ų064.3 Ų64.30%032%0.322CS..Hα-helixtrans-59-47.2175.2176.2-111.5000111.6W184 F192 H194 L195 K200 F201 L202 L218 L241 F245W184-W198 AromaticContact CE3-NE1 3.52Å; W184-W198 AromaticContact CH2-CZ2 3.85Å; W184-W198 HydrophobicContact CH2-CZ2 3.85Å; W184-W198 AromaticContact CH2-NE1 3.69Å; W184-W198 HydrophobicContact CZ2-CZ2 4.46Å; W184-W198 HydrophobicContact CZ3-CZ2 4.27Å; W184-W198 AromaticContact CZ3-NE1 3.37Å; F192-W198 HydrophobicContact CD1-CB 4.5Å; F192-W198 HydrophobicContact CE1-CB 3.66Å; F192-W198 HydrophobicContact CE1-CG 4.02Å; F192-W198 HydrophobicContact CZ-CB 4.45Å; H194-W198 PolarHBondContact O-N 3.37Å; L195-W198 WeakPolarHBondContact O-CB 3.35Å; L195-W198 PolarHBondContact O-N 2.7Å; W198-K200 PolarHBondContact O-N 3.48Å; W198-F201 HydrophobicContact CE3-CD1 4.3Å; W198-F201 HydrophobicContact CZ3-CD1 4.22Å; W198-F201 HydrophobicContact CZ3-CE1 4.41Å; W198-F201 PolarHBondContact O-N 2.76Å; W198-L202 HydrophobicContact CD2-CD1 4.18Å; W198-L202 HydrophobicContact CD2-CG 4.26Å; W198-L202 HydrophobicContact CG-CD1 4.36Å; W198-L202 HydrophobicContact CH2-CD2 4.17Å; W198-L202 HydrophobicContact CZ2-CD1 3.93Å; W198-L202 HydrophobicContact CZ2-CD2 3.95Å; W198-L202 HydrophobicContact CZ2-CG 4.22Å; W198-L202 VanDerWaalsContact O-CG 3.26Å; W198-L202 WeakPolarHBondContact O-CG 3.47Å; W198-L202 PolarHBondContact O-N 2.76Å; W198-L218 HydrophobicContact CD2-CD1 4.46Å; W198-L218 HydrophobicContact CH2-CD1 4.24Å; W198-L218 HydrophobicContact CZ2-CD1 4.09Å; W198-L218 HydrophobicContact CZ2-CD2 3.82Å; W198-L218 HydrophobicContact CZ3-CD1 4.48Å; W198-L241 HydrophobicContact CH2-CD2 3.91Å; W198-L241 HydrophobicContact CH2-CG 3.9Å; W198-L241 HydrophobicContact CZ2-CD2 4.36Å; W198-F245 HydrophobicContact CB-CE2 4.1Å; W198-F245 HydrophobicContact CB-CZ 4.16Å; W198-F245 HydrophobicContact CE3-CB 3.89Å; W198-F245 AromaticContact CE3-CD1 3.72Å; W198-F245 HydrophobicContact CE3-CD1 3.72Å; W198-F245 AromaticContact CE3-CD2 3.59Å; W198-F245 HydrophobicContact CE3-CD2 3.59Å; W198-F245 HydrophobicContact CE3-CE1 4.12Å; W198-F245 AromaticContact CE3-CE2 4Å; W198-F245 HydrophobicContact CE3-CE2 4Å; W198-F245 AromaticContact CE3-CG 3.43Å; W198-F245 HydrophobicContact CE3-CG 3.43Å; W198-F245 VanDerWaalsContact CE3-CG 3.43Å; W198-F245 HydrophobicContact CE3-CZ 4.24Å; W198-F245 HydrophobicContact CZ3-CB 3.54Å; W198-F245 AromaticContact CZ3-CD1 3.98Å; W198-F245 HydrophobicContact CZ3-CD1 3.98Å; W198-F245 HydrophobicContact CZ3-CD2 4.17Å; W198-F245 AromaticContact CZ3-CG 3.62Å; W198-F245 HydrophobicContact CZ3-CG 3.62Å
199F98.3Very high96.8Very high17 Ų1767.3 Ų67.38%0.07534%0.341CS..Hα-helixtrans-62.1-44.2176.2-64-17.8000112.6I181 W184 E185 L195 S196 F201 L202 Q203I181-F199 HydrophobicContact CB-CD1 4.44Å; I181-F199 HydrophobicContact CB-CE1 4.45Å; I181-F199 HydrophobicContact CG1-CD1 4.1Å; I181-F199 HydrophobicContact CG1-CE1 4.45Å; I181-F199 HydrophobicContact CG2-CD1 3.95Å; I181-F199 HydrophobicContact CG2-CD2 4.12Å; I181-F199 HydrophobicContact CG2-CE1 4.04Å; I181-F199 HydrophobicContact CG2-CE2 4.19Å; I181-F199 HydrophobicContact CG2-CG 3.99Å; I181-F199 HydrophobicContact CG2-CZ 4.15Å; W184-F199 HydrophobicContact CB-CE1 3.79Å; W184-F199 HydrophobicContact CB-CZ 3.99Å; W184-F199 HydrophobicContact CE3-CE1 4.33Å; E185-F199 HydrophobicContact CB-CE2 4.03Å; E185-F199 HydrophobicContact CB-CZ 4Å; E185-F199 HydrophobicContact CG-CE2 4.5Å; E185-F199 WeakPolarHBondContact OE2-CE2 3.1Å; L195-F199 HydrophobicContact CD1-CD1 4.41Å; L195-F199 HydrophobicContact CD1-CE1 3.6Å; L195-F199 HydrophobicContact CD1-CE2 4.08Å; L195-F199 HydrophobicContact CD1-CZ 3.41Å; L195-F199 VanDerWaalsContact CD1-CZ 3.41Å; L195-F199 HydrophobicContact CD2-CE2 4.17Å; L195-F199 HydrophobicContact CD2-CZ 4.08Å; L195-F199 HydrophobicContact CG-CD2 4.39Å; L195-F199 HydrophobicContact CG-CE1 4.15Å; L195-F199 HydrophobicContact CG-CE2 3.71Å; L195-F199 HydrophobicContact CG-CZ 3.58Å; L195-F199 WeakPolarHBondContact O-CG 3.27Å; L195-F199 PolarHBondContact O-N 2.59Å; S196-F199 PolarHBondContact O-N 3.24Å; F199-F201 PolarHBondContact O-N 2.97Å; F199-L202 PolarHBondContact O-N 2.97Å; F199-Q203 WeakPolarHBondContact O-CB 3.36Å; F199-Q203 VanDerWaalsContact O-CG 3.29Å; F199-Q203 WeakPolarHBondContact O-CG 3.48Å; F199-Q203 PolarHBondContact O-N 3.05Å; F199-Q203 PolarHBondContact O-OE1 2.93Å
200K97.9Very high96.8Very high80 Ų8059.3 Ų59.335%0.34831%0.311SS..Hα-helixtrans-58.4-48.9175.7-175.9179.5172.4-164.60111.5S196 L197 W198 L202 Q203 E204 W248S196-K200 WeakPolarHBondContact O-CB 3.27Å; S196-K200 PolarHBondContact O-N 3.29Å; L197-K200 PolarHBondContact O-N 3.36Å; W198-K200 PolarHBondContact O-N 3.48Å; K200-L202 VanDerWaalsContact C-N 3.34Å; K200-L202 PolarHBondContact O-N 2.75Å; K200-Q203 PolarHBondContact O-N 3.48Å; K200-E204 VanDerWaalsContact CE-OE1 3.32Å; K200-E204 WeakPolarHBondContact CE-OE1 3.32Å; K200-E204 WeakPolarHBondContact CE-OE2 3.37Å; K200-E204 HydrophobicContact CG-CG 4.25Å; K200-E204 WeakPolarHBondContact CG-OE1 3.29Å; K200-E204 WeakPolarHBondContact O-CB 3.09Å; K200-E204 WeakPolarHBondContact O-CG 3.45Å; K200-E204 PolarHBondContact O-N 3.39Å; K200-W248 HydrophobicContact CB-CH2 4.07Å; K200-W248 HydrophobicContact CD-CH2 3.91Å; K200-W248 HydrophobicContact CD-CZ2 4.28Å; K200-W248 HydrophobicContact CG-CH2 3.88Å; K200-W248 HydrophobicContact CG-CZ2 4.27Å
201F98.3Very high96.9Very high6 Ų657.3 Ų57.33%0.02628%0.284CS..Hα-helixtrans-55.7-48176.3172.7-110000112L197 W198 F199 Q203 H205 H206 L241 E244 F245 W248L197-F201 WeakPolarHBondContact O-CB 3.22Å; L197-F201 PolarHBondContact O-N 2.8Å; W198-F201 HydrophobicContact CE3-CD1 4.3Å; W198-F201 HydrophobicContact CZ3-CD1 4.22Å; W198-F201 HydrophobicContact CZ3-CE1 4.41Å; W198-F201 PolarHBondContact O-N 2.76Å; F199-F201 PolarHBondContact O-N 2.97Å; F201-Q203 VanDerWaalsContact C-N 3.35Å; F201-Q203 PolarHBondContact O-N 3.27Å; F201-H205 HydrophobicContact CD2-CB 3.81Å; F201-H205 HydrophobicContact CE2-CB 3.82Å; F201-H205 WeakPolarHBondContact O-CA 3.46Å; F201-H205 VanDerWaalsContact O-CB 3.32Å; F201-H205 WeakPolarHBondContact O-CB 3.28Å; F201-H205 PolarHBondContact O-N 3.27Å; F201-H206 HydrophobicContact CE1-CB 4.45Å; F201-H206 PolarHBondContact O-N 3.46Å; F201-H206 VanDerWaalsContact O-N 3.17Å; F201-L241 HydrophobicContact CE1-CD1 3.5Å; F201-L241 HydrophobicContact CE1-CG 4.21Å; F201-L241 HydrophobicContact CZ-CD1 4.01Å; F201-E244 HydrophobicContact CE2-CB 4.4Å; F201-E244 HydrophobicContact CZ-CB 3.74Å; F201-F245 HydrophobicContact CB-CD2 3.82Å; F201-F245 HydrophobicContact CB-CE2 4.34Å; F201-F245 HydrophobicContact CD1-CB 3.78Å; F201-F245 AromaticContact CD1-CD2 3.86Å; F201-F245 HydrophobicContact CD1-CD2 3.86Å; F201-F245 HydrophobicContact CD1-CG 4.26Å; F201-F245 HydrophobicContact CE1-CB 3.68Å; F201-F245 HydrophobicContact CG-CB 4.33Å; F201-F245 AromaticContact CG-CD2 3.84Å; F201-F245 HydrophobicContact CG-CD2 3.84Å; F201-F245 HydrophobicContact CZ-CB 4.17Å; F201-W248 HydrophobicContact CB-CD2 4.28Å; F201-W248 HydrophobicContact CB-CE3 3.67Å; F201-W248 HydrophobicContact CB-CH2 4.07Å; F201-W248 HydrophobicContact CB-CZ3 3.57Å; F201-W248 HydrophobicContact CD2-CB 4.02Å; F201-W248 AromaticContact CD2-CD2 3.74Å; F201-W248 HydrophobicContact CD2-CD2 3.74Å; F201-W248 AromaticContact CD2-CE3 3.84Å; F201-W248 HydrophobicContact CD2-CE3 3.84Å; F201-W248 AromaticContact CD2-CG 3.84Å; F201-W248 HydrophobicContact CD2-CG 3.84Å; F201-W248 HydrophobicContact CE2-CB 4.11Å; F201-W248 HydrophobicContact CE2-CG 4.32Å; F201-W248 HydrophobicContact CG-CD2 4.44Å; F201-W248 HydrophobicContact CG-CE3 4.1Å; F201-W248 HydrophobicContact CG-CZ3 4.48Å
202L98.4Very high96.8Very high0 Ų055.9 Ų55.90%028%0.281CS..Iπ-helixtrans-63.8-40.4-179-69.1179.1000112.8L177 I181 W184 W198 F199 K200 H206 K207 I210 L241L177-L202 HydrophobicContact CD1-CB 4.48Å; L177-L202 WeakPolarHBondContact CD1-O 3.26Å; L177-L202 HydrophobicContact CD2-CB 4.21Å; L177-L202 HydrophobicContact CD2-CD1 4.21Å; L177-L202 HydrophobicContact CD2-CD2 4.43Å; I181-L202 HydrophobicContact CG1-CD1 4.45Å; W184-L202 HydrophobicContact CE3-CD1 4.16Å; W184-L202 HydrophobicContact CH2-CD1 4.19Å; W184-L202 HydrophobicContact CZ3-CD1 3.4Å; W198-L202 HydrophobicContact CD2-CD1 4.18Å; W198-L202 HydrophobicContact CD2-CG 4.26Å; W198-L202 HydrophobicContact CG-CD1 4.36Å; W198-L202 HydrophobicContact CH2-CD2 4.17Å; W198-L202 HydrophobicContact CZ2-CD1 3.93Å; W198-L202 HydrophobicContact CZ2-CD2 3.95Å; W198-L202 HydrophobicContact CZ2-CG 4.22Å; W198-L202 VanDerWaalsContact O-CG 3.26Å; W198-L202 WeakPolarHBondContact O-CG 3.47Å; W198-L202 PolarHBondContact O-N 2.76Å; F199-L202 PolarHBondContact O-N 2.97Å; K200-L202 VanDerWaalsContact C-N 3.34Å; K200-L202 PolarHBondContact O-N 2.75Å; L202-H206 HydrophobicContact CD2-CB 4Å; L202-K207 PolarHBondContact O-N 3.18Å; L202-I210 HydrophobicContact CD1-CD1 4.34Å; L202-I210 HydrophobicContact CD2-CD1 3.89Å; L202-L241 HydrophobicContact CD2-CD1 4.35Å; L202-L241 HydrophobicContact CD2-CD2 3.85Å; L202-L241 HydrophobicContact CD2-CG 4.42Å
203Q97.6Very high96.8Very high115 Ų11559.9 Ų59.954%0.53730%0.303SS..Iπ-helixtrans-77.1-35.9-177.9-70173.5-4100112.7I181 F199 K200 F201 K207I181-Q203 HydrophobicContact CD1-CG 3.67Å; F199-Q203 WeakPolarHBondContact O-CB 3.36Å; F199-Q203 VanDerWaalsContact O-CG 3.29Å; F199-Q203 WeakPolarHBondContact O-CG 3.48Å; F199-Q203 PolarHBondContact O-N 3.05Å; F199-Q203 PolarHBondContact O-OE1 2.93Å; K200-Q203 PolarHBondContact O-N 3.48Å; F201-Q203 VanDerWaalsContact C-N 3.35Å; F201-Q203 PolarHBondContact O-N 3.27Å; Q203-K207 WeakPolarHBondContact O-CE 3.28Å; Q203-K207 VanDerWaalsContact O-CG 3.27Å; Q203-K207 WeakPolarHBondContact O-CG 3.41Å
204E96.3Very high96.9Very high101 Ų10156.3 Ų56.347%0.47228%0.278SS..Iπ-helixtrans-92.3-36.6-175.3-67.2-179.2-176.600112.9K200 K207K200-E204 VanDerWaalsContact CE-OE1 3.32Å; K200-E204 WeakPolarHBondContact CE-OE1 3.32Å; K200-E204 WeakPolarHBondContact CE-OE2 3.37Å; K200-E204 HydrophobicContact CG-CG 4.25Å; K200-E204 WeakPolarHBondContact CG-OE1 3.29Å; K200-E204 WeakPolarHBondContact O-CB 3.09Å; K200-E204 WeakPolarHBondContact O-CG 3.45Å; K200-E204 PolarHBondContact O-N 3.39Å; E204-K207 WeakPolarHBondContact O-CE 3.33Å; E204-K207 PolarHBondContact O-NZ 2.91Å
205H95.3Very high96.9Very high103 Ų10355.7 Ų55.748%0.47728%0.275SS..Iπ-helixtrans-111-55.8-171-65.1-89.1000113.5F201 W248F201-H205 HydrophobicContact CD2-CB 3.81Å; F201-H205 HydrophobicContact CE2-CB 3.82Å; F201-H205 WeakPolarHBondContact O-CA 3.46Å; F201-H205 VanDerWaalsContact O-CB 3.32Å; F201-H205 WeakPolarHBondContact O-CB 3.28Å; F201-H205 PolarHBondContact O-N 3.27Å; H205-W248 AromaticContact CD2-CD1 3.98Å; H205-W248 AromaticContact CD2-CE2 3.64Å; H205-W248 AromaticContact CD2-CZ2 3.93Å; H205-W248 AromaticContact CD2-NE1 3.33Å; H205-W248 PolarHBondContact CD2-NE1 2.72Å; H205-W248 VanDerWaalsContact CD2-NE1 3.33Å; H205-W248 AromaticContact CE1-CD1 3.8Å; H205-W248 AromaticContact CE1-NE1 3.39Å; H205-W248 PolarHBondContact CE1-NE1 3Å; H205-W248 AromaticContact NE2-CD1 3.68Å; H205-W248 AromaticContact NE2-CE2 3.54Å; H205-W248 AromaticContact NE2-CZ2 3.89Å; H205-W248 AromaticContact NE2-NE1 2.86Å; H205-W248 PolarHBondContact NE2-NE1 3.46Å
206H96.2Very high96.9Very high19 Ų1957 Ų579%0.08828%0.282CS..Iπ-helixtrans-73.5-51.1-172.6178.654.9000114F201 L202 R208 P209 L241F201-H206 HydrophobicContact CE1-CB 4.45Å; F201-H206 PolarHBondContact O-N 3.46Å; F201-H206 VanDerWaalsContact O-N 3.17Å; L202-H206 HydrophobicContact CD2-CB 4Å; H206-R208 PolarHBondContact CD2-O 2.78Å; H206-R208 PolarHBondContact CE1-NE 2.98Å; H206-R208 PolarHBondContact ND1-NE 3Å; H206-R208 PolarHBondContact ND1-NH2 3.1Å; H206-R208 PolarHBondContact NE2-O 3.45Å; H206-R208 VanDerWaalsContact NE2-O 3.14Å; H206-R208 WeakPolarHBondContact O-CG 3.37Å; H206-R208 PolarHBondContact O-N 3.36Å; H206-R208 PolarHBondContact O-NE 3.5Å; H206-P209 PolarHBondContact NE2-O 2.67Å; H206-L241 HydrophobicContact CB-CD1 3.8Å; H206-L241 VanDerWaalsContact CG-CD1 3.43Å; H206-L241 WeakPolarHBondContact ND1-CD1 3.22Å
207K96.3Very high96.9Very high146 Ų14654.2 Ų54.264%0.63526%0.259SS*.  trans51.117176-62.6177.8-179.6155.70116.8L202 Q203 E204L202-K207 PolarHBondContact O-N 3.18Å; Q203-K207 WeakPolarHBondContact O-CE 3.28Å; Q203-K207 VanDerWaalsContact O-CG 3.27Å; Q203-K207 WeakPolarHBondContact O-CG 3.41Å; E204-K207 WeakPolarHBondContact O-CE 3.33Å; E204-K207 PolarHBondContact O-NZ 2.91Å
208R95.5Very high97Very high138 Ų13852.4 Ų52.452%0.52125%0.25SC..SBendtrans-120160.4-177.7-67.5171.4-64.21772110.7L177 H206L177-R208 WeakPolarHBondContact CD2-O 3.42Å; L177-R208 VanDerWaalsContact CG-O 3.28Å; L177-R208 WeakPolarHBondContact CG-O 3.47Å; H206-R208 PolarHBondContact CD2-O 2.78Å; H206-R208 PolarHBondContact CE1-NE 2.98Å; H206-R208 PolarHBondContact ND1-NE 3Å; H206-R208 PolarHBondContact ND1-NH2 3.1Å; H206-R208 PolarHBondContact NE2-O 3.45Å; H206-R208 VanDerWaalsContact NE2-O 3.14Å; H206-R208 WeakPolarHBondContact O-CG 3.37Å; H206-R208 PolarHBondContact O-N 3.36Å; H206-R208 PolarHBondContact O-NE 3.5Å
209P95.1Very high97Very high62 Ų6252.5 Ų52.540%0.40325%0.25SS..PPolyproline II helixtrans-54.4151.5171.4-25.735.6000112.9L175 V176 H206L175-P209 CarbonylContact O-C 3.52Å; L175-P209 WeakPolarHBondContact O-CA 3.35Å; V176-P209 HydrophobicContact CG1-CG 4.16Å; H206-P209 PolarHBondContact NE2-O 2.67Å
210I96.6Very high96.9Very high0 Ų053.7 Ų53.70%026%0.257CS..EExtended strand (participates in β ladder)trans-89.4128177.3-55.9-58.9000108.6S174 L175 L177 A180 W184 L202 T214 W215 L241S174-I210 CarbonylContact C-O 3.53Å; S174-I210 WeakPolarHBondContact CA-O 3.36Å; L175-I210 PolarHBondContact N-O 3.27Å; L175-I210 PolarHBondContact O-N 2.9Å; L177-I210 HydrophobicContact CD2-CD1 3.6Å; L177-I210 HydrophobicContact CD2-CG1 3.74Å; A180-I210 HydrophobicContact CB-CG1 3.91Å; W184-I210 HydrophobicContact CH2-CB 4.17Å; W184-I210 HydrophobicContact CH2-CD1 3.76Å; W184-I210 HydrophobicContact CH2-CG1 3.53Å; W184-I210 HydrophobicContact CH2-CG2 3.68Å; W184-I210 HydrophobicContact CZ2-CG2 3.97Å; W184-I210 HydrophobicContact CZ3-CD1 4.15Å; W184-I210 HydrophobicContact CZ3-CG1 3.91Å; L202-I210 HydrophobicContact CD1-CD1 4.34Å; L202-I210 HydrophobicContact CD2-CD1 3.89Å; I210-T214 HydrophobicContact CG2-CG2 4.23Å; I210-W215 HydrophobicContact CG2-CB 4.29Å; I210-L241 HydrophobicContact CD1-CD2 3.72Å
211S95.8Very high96.9Very high45 Ų4549.9 Ų49.932%0.31524%0.241SC..EExtended strand (participates in β ladder)trans-71.6154.7174.183.90000111.1K173 D213 T214 W215K173-S211 CarbonylContact O-C 3.59Å; K173-S211 WeakPolarHBondContact O-CA 3.11Å; S211-D213 VanDerWaalsContact C-N 3.26Å; S211-D213 PolarHBondContact O-N 3.45Å; S211-T214 PolarHBondContact O-N 2.97Å; S211-T214 WeakPolarHBondContact OG-CB 3.49Å; S211-T214 PolarHBondContact OG-N 3.27Å; S211-T214 PolarHBondContact OG-OG1 3.38Å; S211-W215 PolarHBondContact O-N 3.11Å
212K95.2Very high96.9Very high87 Ų8750.4 Ų50.438%0.37825%0.245SC..Hα-helixtrans-56.7-42.5174.8-169.2-169.3-174.9-46.90112.1F162 K173 T214 W215 D216F162-K212 HydrophobicContact CD1-CB 4.36Å; F162-K212 HydrophobicContact CD1-CG 3.98Å; F162-K212 HydrophobicContact CE1-CB 3.82Å; F162-K212 HydrophobicContact CE1-CG 3.94Å; F162-K212 HydrophobicContact CE2-CB 4.28Å; F162-K212 HydrophobicContact CG-CG 4.38Å; F162-K212 HydrophobicContact CZ-CB 3.76Å; F162-K212 HydrophobicContact CZ-CG 4.27Å; K173-K212 PolarHBondContact O-N 2.86Å; K212-T214 VanDerWaalsContact C-N 3.34Å; K212-T214 PolarHBondContact O-N 3.25Å; K212-W215 WeakPolarHBondContact O-CB 3.48Å; K212-W215 PolarHBondContact O-N 2.98Å; K212-D216 IonicContact NZ-OD1 3.32Å; K212-D216 PolarHBondContact NZ-OD1 2.83Å; K212-D216 IonicContact NZ-OD2 3.99Å; K212-D216 PolarHBondContact NZ-OD2 2.94Å; K212-D216 VanDerWaalsContact O-CG 3.26Å; K212-D216 PolarHBondContact O-N 2.77Å
213D96.1Very high96.8Very high93 Ų9354.8 Ų54.850%0.49727%0.265SS..Hα-helixtrans-60.1-45.2179-176.472.2000111.6S211 W215 D216 L217S211-D213 VanDerWaalsContact C-N 3.26Å; S211-D213 PolarHBondContact O-N 3.45Å; D213-W215 PolarHBondContact O-N 3.25Å; D213-D216 PolarHBondContact O-N 3.26Å; D213-L217 WeakPolarHBondContact O-CB 3.46Å; D213-L217 PolarHBondContact O-N 2.82Å
214T97.9Very high96.7Very high11 Ų1152.8 Ų52.87%0.06726%0.261CS..Hα-helixtrans-62.8-39.7174.8-49.70000113I210 S211 K212 L218 P239 L241I210-T214 HydrophobicContact CG2-CG2 4.23Å; S211-T214 PolarHBondContact O-N 2.97Å; S211-T214 WeakPolarHBondContact OG-CB 3.49Å; S211-T214 PolarHBondContact OG-N 3.27Å; S211-T214 PolarHBondContact OG-OG1 3.38Å; K212-T214 VanDerWaalsContact C-N 3.34Å; K212-T214 PolarHBondContact O-N 3.25Å; T214-L218 VanDerWaalsContact O-CB 3.29Å; T214-L218 WeakPolarHBondContact O-CB 3.22Å; T214-L218 PolarHBondContact O-N 2.96Å; T214-L218 VanDerWaalsContact O-N 3.08Å; T214-P239 HydrophobicContact CG2-CB 4.21Å; T214-P239 HydrophobicContact CG2-CG 4.43Å; T214-L241 HydrophobicContact CG2-CB 4.05Å; T214-L241 HydrophobicContact CG2-CD2 3.75Å; T214-L241 HydrophobicContact CG2-CG 4.37Å
215W97.9Very high96.8Very high0 Ų048.9 Ų48.90%024%0.243CC..Hα-helixtrans-59.8-56.1173.3178.8-81.5000110.1Y158 T161 F162 L175 A180 W184 L187 I210 S211 K212 D213 L217 L218Y158-W215 AromaticContact CD1-NE1 3.56Å; Y158-W215 AromaticContact CE1-CD1 3.43Å; Y158-W215 VanDerWaalsContact CE1-CD1 3.43Å; Y158-W215 HydrophobicContact CE1-CD2 4.48Å; Y158-W215 AromaticContact CE1-CE2 3.95Å; Y158-W215 HydrophobicContact CE1-CG 4.18Å; Y158-W215 AromaticContact CE1-NE1 3.25Å; Y158-W215 VanDerWaalsContact CE1-NE1 3.25Å; Y158-W215 WeakPolarHBondContact CE1-O 3.44Å; Y158-W215 HydrophobicContact CE2-CZ2 4.4Å; Y158-W215 AromaticContact CZ-CE2 3.93Å; Y158-W215 AromaticContact CZ-NE1 3.72Å; Y158-W215 PolarHBondContact O-NE1 2.89Å; Y158-W215 PolarHBondContact OH-O 3.03Å; T161-W215 HydrophobicContact CG2-CH2 4.23Å; T161-W215 HydrophobicContact CG2-CZ2 3.98Å; F162-W215 HydrophobicContact CB-CD2 4.11Å; F162-W215 HydrophobicContact CB-CG 4.01Å; F162-W215 HydrophobicContact CD2-CB 3.61Å; F162-W215 AromaticContact CD2-CD2 3.81Å; F162-W215 HydrophobicContact CD2-CD2 3.81Å; F162-W215 HydrophobicContact CD2-CE3 4.1Å; F162-W215 AromaticContact CD2-CG 3.59Å; F162-W215 HydrophobicContact CD2-CG 3.59Å; F162-W215 HydrophobicContact CE2-CB 4.1Å; F162-W215 HydrophobicContact CG-CB 4.49Å; F162-W215 HydrophobicContact CG-CD2 4.47Å; F162-W215 HydrophobicContact CG-CG 4.21Å; L175-W215 HydrophobicContact CD2-CE3 4.17Å; L175-W215 HydrophobicContact CD2-CZ3 3.94Å; A180-W215 HydrophobicContact CB-CZ3 4.19Å; W184-W215 AromaticContact CD1-CH2 3.59Å; W184-W215 AromaticContact CD1-CZ3 3.61Å; W184-W215 HydrophobicContact CD2-CE3 4.24Å; W184-W215 HydrophobicContact CD2-CH2 4.47Å; W184-W215 AromaticContact CD2-CZ3 3.8Å; W184-W215 HydrophobicContact CD2-CZ3 3.8Å; W184-W215 AromaticContact CE2-CE3 3.37Å; W184-W215 AromaticContact CE2-CZ3 3.38Å; W184-W215 HydrophobicContact CG-CH2 4.18Å; W184-W215 AromaticContact CG-CZ3 3.98Å; W184-W215 HydrophobicContact CG-CZ3 3.98Å; W184-W215 HydrophobicContact CH2-CE3 4.4Å; W184-W215 HydrophobicContact CZ2-CD2 4.29Å; W184-W215 AromaticContact CZ2-CE3 3.49Å; W184-W215 HydrophobicContact CZ2-CE3 3.49Å; W184-W215 VanDerWaalsContact CZ2-CE3 3.49Å; W184-W215 AromaticContact CZ2-CZ3 3.93Å; W184-W215 HydrophobicContact CZ2-CZ3 3.93Å; W184-W215 AromaticContact NE1-CD2 3.7Å; W184-W215 AromaticContact NE1-CE3 3.28Å; W184-W215 VanDerWaalsContact NE1-CE3 3.28Å; W184-W215 AromaticContact NE1-CH2 3.55Å; W184-W215 AromaticContact NE1-CZ2 3.95Å; W184-W215 AromaticContact NE1-CZ3 3.19Å; L187-W215 HydrophobicContact CD1-CH2 4.29Å; L187-W215 HydrophobicContact CD1-CZ2 3.86Å; I210-W215 HydrophobicContact CG2-CB 4.29Å; S211-W215 PolarHBondContact O-N 3.11Å; K212-W215 WeakPolarHBondContact O-CB 3.48Å; K212-W215 PolarHBondContact O-N 2.98Å; D213-W215 PolarHBondContact O-N 3.25Å; W215-L217 PolarHBondContact O-N 3.17Å; W215-L218 PolarHBondContact O-N 2.96Å
216D97.2Very high96.8Very high37 Ų3750.4 Ų50.420%0.19825%0.245CC..Hα-helixtrans-57.5-47.6-176.1-65.8-2000112.1L159 K212 D213 L219L159-D216 HydrophobicContact CD2-CB 3.86Å; L159-D216 VanDerWaalsContact CD2-CG 3.49Å; L159-D216 VanDerWaalsContact CD2-OD1 3.23Å; L159-D216 WeakPolarHBondContact CD2-OD1 3.41Å; K212-D216 IonicContact NZ-OD1 3.32Å; K212-D216 PolarHBondContact NZ-OD1 2.83Å; K212-D216 IonicContact NZ-OD2 3.99Å; K212-D216 PolarHBondContact NZ-OD2 2.94Å; K212-D216 VanDerWaalsContact O-CG 3.26Å; K212-D216 PolarHBondContact O-N 2.77Å; D213-D216 PolarHBondContact O-N 3.26Å; D216-L219 PolarHBondContact O-N 2.81Å
217L97.9Very high96.7Very high40 Ų4053.8 Ų53.821%0.20927%0.269CS..Hα-helixtrans-75.4-20.8-177.3-71.5174.7000113.8D213 W215 L219 D220 F221 W238 P239D213-L217 WeakPolarHBondContact O-CB 3.46Å; D213-L217 PolarHBondContact O-N 2.82Å; W215-L217 PolarHBondContact O-N 3.17Å; L217-L219 PolarHBondContact O-N 2.94Å; L217-D220 PolarHBondContact O-N 2.69Å; L217-D220 VanDerWaalsContact O-N 3.17Å; L217-F221 PolarHBondContact O-N 2.85Å; L217-W238 HydrophobicContact CB-CE3 4.42Å; L217-W238 HydrophobicContact CB-CZ3 4.43Å; L217-P239 HydrophobicContact CB-CG 3.9Å; L217-P239 HydrophobicContact CD1-CG 3.77Å; L217-P239 HydrophobicContact CG-CG 4.44Å
218L98.6Very high96.7Very high0 Ų050 Ų500%026%0.256CS..Hα-helixtrans-61.9-33.7174.3-17867.6000111.3W184 L188 W198 T214 W215 F221 V222 I242W184-L218 HydrophobicContact CD2-CD2 4.19Å; W184-L218 HydrophobicContact CH2-CD2 4.17Å; W184-L218 HydrophobicContact CZ2-CD2 3.49Å; W184-L218 VanDerWaalsContact CZ2-CD2 3.49Å; L188-L218 HydrophobicContact CD1-CD2 4.31Å; W198-L218 HydrophobicContact CD2-CD1 4.46Å; W198-L218 HydrophobicContact CH2-CD1 4.24Å; W198-L218 HydrophobicContact CZ2-CD1 4.09Å; W198-L218 HydrophobicContact CZ2-CD2 3.82Å; W198-L218 HydrophobicContact CZ3-CD1 4.48Å; T214-L218 VanDerWaalsContact O-CB 3.29Å; T214-L218 WeakPolarHBondContact O-CB 3.22Å; T214-L218 PolarHBondContact O-N 2.96Å; T214-L218 VanDerWaalsContact O-N 3.08Å; W215-L218 PolarHBondContact O-N 2.96Å; L218-F221 HydrophobicContact CD1-CD1 3.98Å; L218-F221 PolarHBondContact O-N 2.91Å; L218-V222 HydrophobicContact CD1-CG2 4.46Å; L218-V222 HydrophobicContact CG-CG2 4.34Å; L218-V222 WeakPolarHBondContact O-CB 3.32Å; L218-V222 WeakPolarHBondContact O-CG2 3.48Å; L218-V222 PolarHBondContact O-N 3.43Å; L218-I242 HydrophobicContact CB-CD1 4.41Å; L218-I242 HydrophobicContact CD1-CD1 4.28Å
219L98.4Very high96.7Very high2 Ų243.4 Ų43.41%0.0123%0.231CC..Hα-helixtrans-63-44.1175179.360.5000111.7F154 R155 Y158 D216 L217 F221 V222 E223F154-L219 HydrophobicContact CD1-CD1 4.25Å; F154-L219 HydrophobicContact CE1-CD1 3.76Å; R155-L219 HydrophobicContact CB-CD2 4.08Å; R155-L219 HydrophobicContact CG-CD2 3.9Å; Y158-L219 HydrophobicContact CD1-CB 3.87Å; Y158-L219 HydrophobicContact CD1-CD2 3.81Å; Y158-L219 HydrophobicContact CD1-CG 4.38Å; Y158-L219 HydrophobicContact CD2-CD1 4.39Å; Y158-L219 HydrophobicContact CE1-CB 3.65Å; Y158-L219 HydrophobicContact CE1-CD2 4.46Å; Y158-L219 HydrophobicContact CE2-CB 4.34Å; Y158-L219 HydrophobicContact CG-CB 4.32Å; Y158-L219 HydrophobicContact CG-CD2 3.85Å; Y158-L219 HydrophobicContact CG-CG 4.47Å; D216-L219 PolarHBondContact O-N 2.81Å; L217-L219 PolarHBondContact O-N 2.94Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 3.49Å; L219-V222 PolarHBondContact O-N 3.28Å; L219-E223 HydrophobicContact CD1-CG 4.32Å; L219-E223 WeakPolarHBondContact O-CG 3.36Å; L219-E223 PolarHBondContact O-N 3.31Å
220D97.6Very high96.7Very high42 Ų4243.6 Ų43.623%0.22523%0.234CC..Hα-helixtrans-64-40.4178.1-65-25.5000111R155 L217 E223 T224 W238R155-D220 IonicContact CZ-OD1 2.61Å; R155-D220 IonicContact NH1-OD1 3.03Å; R155-D220 PolarHBondContact NH1-OD1 3.4Å; R155-D220 IonicContact NH2-OD1 3.18Å; R155-D220 PolarHBondContact NH2-OD1 2.85Å; R155-D220 VanDerWaalsContact NH2-OD1 3.09Å; R155-D220 IonicContact NH2-OD2 3.1Å; R155-D220 PolarHBondContact NH2-OD2 3.33Å; L217-D220 PolarHBondContact O-N 2.69Å; L217-D220 VanDerWaalsContact O-N 3.17Å; D220-E223 PolarHBondContact O-N 3.34Å; D220-T224 WeakPolarHBondContact O-CB 3.48Å; D220-T224 VanDerWaalsContact O-CG2 3.3Å; D220-T224 WeakPolarHBondContact O-CG2 3.4Å; D220-T224 PolarHBondContact O-N 2.9Å; D220-T224 PolarHBondContact O-OG1 3.26Å; D220-W238 HydrophobicContact CB-CH2 4.14Å; D220-W238 HydrophobicContact CB-CZ3 4.1Å
221F98.1Very high96.7Very high1 Ų146.3 Ų46.30%0.00425%0.249CC..Hα-helixtrans-58.8-50.6171.6174.2-98.1000111.8F192 L217 L218 L219 E223 T224 I225 Y232 W238 I242 F245 V246F192-F221 HydrophobicContact CE2-CD1 4.43Å; F192-F221 AromaticContact CE2-CE1 3.9Å; F192-F221 HydrophobicContact CE2-CE1 3.9Å; F192-F221 HydrophobicContact CZ-CD1 4.36Å; F192-F221 AromaticContact CZ-CE1 3.79Å; F192-F221 HydrophobicContact CZ-CE1 3.79Å; L217-F221 PolarHBondContact O-N 2.85Å; L218-F221 HydrophobicContact CD1-CD1 3.98Å; L218-F221 PolarHBondContact O-N 2.91Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 3.49Å; F221-E223 VanDerWaalsContact C-N 3.26Å; F221-E223 PolarHBondContact O-N 3.48Å; F221-T224 PolarHBondContact O-N 3.21Å; F221-T224 VanDerWaalsContact O-N 3.12Å; F221-T224 PolarHBondContact O-OG1 2.97Å; F221-I225 HydrophobicContact CD1-CG2 4.17Å; F221-I225 HydrophobicContact CD2-CB 4.2Å; F221-I225 HydrophobicContact CD2-CD1 4.5Å; F221-I225 HydrophobicContact CD2-CG1 4.48Å; F221-I225 HydrophobicContact CE1-CB 4.27Å; F221-I225 HydrophobicContact CE1-CG1 4.35Å; F221-I225 HydrophobicContact CE1-CG2 3.87Å; F221-I225 HydrophobicContact CE2-CB 3.89Å; F221-I225 HydrophobicContact CE2-CD1 3.69Å; F221-I225 HydrophobicContact CE2-CG1 3.7Å; F221-I225 HydrophobicContact CE2-CG2 4.41Å; F221-I225 HydrophobicContact CZ-CB 3.94Å; F221-I225 HydrophobicContact CZ-CD1 4.07Å; F221-I225 HydrophobicContact CZ-CG1 3.63Å; F221-I225 HydrophobicContact CZ-CG2 4.01Å; F221-I225 WeakPolarHBondContact O-CB 3.39Å; F221-I225 WeakPolarHBondContact O-CG2 3.38Å; F221-I225 PolarHBondContact O-N 3.01Å; F221-Y232 HydrophobicContact CD2-CD2 4.27Å; F221-Y232 HydrophobicContact CD2-CE2 4Å; F221-Y232 AromaticContact CE2-CD2 3.74Å; F221-Y232 HydrophobicContact CE2-CD2 3.74Å; F221-Y232 AromaticContact CE2-CE2 3.71Å; F221-Y232 HydrophobicContact CE2-CE2 3.71Å; F221-W238 HydrophobicContact CB-CH2 4.27Å; F221-W238 HydrophobicContact CB-CZ3 4.04Å; F221-I242 HydrophobicContact CB-CD1 4.04Å; F221-I242 HydrophobicContact CB-CG2 4.48Å; F221-I242 HydrophobicContact CD1-CG2 4.43Å; F221-I242 HydrophobicContact CD2-CG2 3.53Å; F221-I242 HydrophobicContact CE2-CG2 3.72Å; F221-I242 HydrophobicContact CG-CD1 4.41Å; F221-I242 HydrophobicContact CG-CG2 3.9Å; F221-I242 HydrophobicContact CZ-CG2 4.26Å; F221-F245 HydrophobicContact CE1-CD1 4.32Å; F221-F245 HydrophobicContact CE1-CE1 4.03Å; F221-F245 HydrophobicContact CZ-CD1 4.26Å; F221-F245 HydrophobicContact CZ-CE1 4.14Å; F221-V246 HydrophobicContact CE2-CG2 3.75Å; F221-V246 HydrophobicContact CZ-CG2 3.78Å
222V97.9Very high96.7Very high17 Ų1745.4 Ų45.410%0.10324%0.238CC..Hα-helixtrans-58.3-36.8179.2168.90000112.4L188 F192 L218 L219 T224L188-V222 HydrophobicContact CD1-CG2 4.36Å; F192-V222 HydrophobicContact CB-CG1 3.77Å; F192-V222 HydrophobicContact CB-CG2 3.88Å; F192-V222 HydrophobicContact CD1-CG2 3.9Å; F192-V222 HydrophobicContact CD2-CB 4.42Å; F192-V222 HydrophobicContact CD2-CG1 4.28Å; F192-V222 HydrophobicContact CD2-CG2 3.74Å; F192-V222 HydrophobicContact CE1-CG2 4.32Å; F192-V222 HydrophobicContact CE2-CG2 4.18Å; F192-V222 HydrophobicContact CG-CG1 4.23Å; F192-V222 HydrophobicContact CG-CG2 3.6Å; F192-V222 HydrophobicContact CZ-CG2 4.46Å; L218-V222 HydrophobicContact CD1-CG2 4.46Å; L218-V222 HydrophobicContact CG-CG2 4.34Å; L218-V222 WeakPolarHBondContact O-CB 3.32Å; L218-V222 WeakPolarHBondContact O-CG2 3.48Å; L218-V222 PolarHBondContact O-N 3.43Å; L219-V222 PolarHBondContact O-N 3.28Å; V222-T224 VanDerWaalsContact C-N 3.32Å
223E95.7Very high96.8Very high91 Ų9145.5 Ų45.543%0.42524%0.243SC..Hα-helixtrans-76.6-16.9-179.3-71.7-173.6164.700113.9L219 D220 F221L219-E223 HydrophobicContact CD1-CG 4.32Å; L219-E223 WeakPolarHBondContact O-CG 3.36Å; L219-E223 PolarHBondContact O-N 3.31Å; D220-E223 PolarHBondContact O-N 3.34Å; F221-E223 VanDerWaalsContact C-N 3.26Å; F221-E223 PolarHBondContact O-N 3.48Å
224T95.8Very high96.5Very high74 Ų7448.2 Ų48.245%0.45425%0.253SS..Hα-helixtrans-116-30.7-171.656.30000114.1D220 F221 V222 N231D220-T224 WeakPolarHBondContact O-CB 3.48Å; D220-T224 VanDerWaalsContact O-CG2 3.3Å; D220-T224 WeakPolarHBondContact O-CG2 3.4Å; D220-T224 PolarHBondContact O-N 2.9Å; D220-T224 PolarHBondContact O-OG1 3.26Å; F221-T224 PolarHBondContact O-N 3.21Å; F221-T224 VanDerWaalsContact O-N 3.12Å; F221-T224 PolarHBondContact O-OG1 2.97Å; V222-T224 VanDerWaalsContact C-N 3.32Å; T224-N231 PolarHBondContact O-ND2 3.01Å
225I97.2Very high96.3Very high18 Ų1856.5 Ų56.59%0.09229%0.291CS..  trans-69.9137.8-174.3-16566.4000112.2F192 F221 M229 Y232F192-I225 HydrophobicContact CE2-CG2 4.33Å; F221-I225 HydrophobicContact CD1-CG2 4.17Å; F221-I225 HydrophobicContact CD2-CB 4.2Å; F221-I225 HydrophobicContact CD2-CD1 4.5Å; F221-I225 HydrophobicContact CD2-CG1 4.48Å; F221-I225 HydrophobicContact CE1-CB 4.27Å; F221-I225 HydrophobicContact CE1-CG1 4.35Å; F221-I225 HydrophobicContact CE1-CG2 3.87Å; F221-I225 HydrophobicContact CE2-CB 3.89Å; F221-I225 HydrophobicContact CE2-CD1 3.69Å; F221-I225 HydrophobicContact CE2-CG1 3.7Å; F221-I225 HydrophobicContact CE2-CG2 4.41Å; F221-I225 HydrophobicContact CZ-CB 3.94Å; F221-I225 HydrophobicContact CZ-CD1 4.07Å; F221-I225 HydrophobicContact CZ-CG1 3.63Å; F221-I225 HydrophobicContact CZ-CG2 4.01Å; F221-I225 WeakPolarHBondContact O-CB 3.39Å; F221-I225 WeakPolarHBondContact O-CG2 3.38Å; F221-I225 PolarHBondContact O-N 3.01Å; I225-M229 HydrophobicContact CD1-CB 4.2Å; I225-M229 HydrophobicContact CD1-CG 4.42Å; I225-M229 HydrophobicContact CG1-CB 4.44Å; I225-M229 HydrophobicContact CG1-CG 4.16Å; I225-Y232 HydrophobicContact CD1-CD2 4.02Å; I225-Y232 HydrophobicContact CD1-CG 4.47Å
226Y96.5Very high96Very high135 Ų13557.4 Ų57.453%0.52930%0.3SS..  trans-78154.4173.1-67.7-8.1000111.6D228 M229 N231Y226-D228 WeakPolarHBondContact CB-OD1 3.42Å; Y226-D228 PolarHBondContact O-N 2.86Å; Y226-M229 PolarHBondContact O-N 2.78Å; Y226-N231 WeakPolarHBondContact CB-OD1 3.46Å; Y226-N231 HydrophobicContact CD1-CB 4.45Å; Y226-N231 HydrophobicContact CD2-CB 3.65Å; Y226-N231 HydrophobicContact CE2-CB 3.72Å; Y226-N231 HydrophobicContact CG-CB 4.03Å; Y226-N231 VanDerWaalsContact CG-CG 3.48Å; Y226-N231 VanDerWaalsContact CG-OD1 3.31Å; Y226-N231 PolarHBondContact N-OD1 3.17Å
227P94.6Very high95.9Very high91 Ų9160.6 Ų60.659%0.59133%0.332SS*.THydrogen-bonded Turntrans-60.2-16.4177.7-25.235000115.4H194 V253H194-P227 PolarHBondContact CE1-O 3.33Å; H194-P227 PolarHBondContact NE2-O 2.79Å; P227-V253 VanDerWaalsContact O-CG1 3.31Å; P227-V253 WeakPolarHBondContact O-CG1 3.21Å
228D94.6Very high95.9Very high65 Ų6561.5 Ų61.535%0.34833%0.332SS..THydrogen-bonded Turntrans-103.42.6175.367.8-7.5000112.9Y226 S230Y226-D228 WeakPolarHBondContact CB-OD1 3.42Å; Y226-D228 PolarHBondContact O-N 2.86Å; D228-S230 VanDerWaalsContact CG-OG 3.23Å; D228-S230 PolarHBondContact O-N 3.02Å; D228-S230 VanDerWaalsContact O-N 3.11Å; D228-S230 VanDerWaalsContact OD1-CB 3.26Å; D228-S230 WeakPolarHBondContact OD1-CB 3.47Å; D228-S230 PolarHBondContact OD1-N 3.13Å; D228-S230 PolarHBondContact OD1-OG 3.32Å; D228-S230 WeakPolarHBondContact OD2-CB 3.36Å; D228-S230 PolarHBondContact OD2-OG 2.83Å; D228-S230 VanDerWaalsContact OD2-OG 3.13Å
229M95.8Very high95.8Very high0 Ų062 Ų620%034%0.335CS..  trans54.522-175.4-53.1-179.3178.500114.4H194 I225 Y226 N231 Y232 F245 V246 A249 K250 V253H194-M229 HydrophobicContact CB-CE 4.07Å; H194-M229 WeakPolarHBondContact CD2-CE 3.43Å; I225-M229 HydrophobicContact CD1-CB 4.2Å; I225-M229 HydrophobicContact CD1-CG 4.42Å; I225-M229 HydrophobicContact CG1-CB 4.44Å; I225-M229 HydrophobicContact CG1-CG 4.16Å; Y226-M229 PolarHBondContact O-N 2.78Å; M229-N231 VanDerWaalsContact C-N 3.31Å; M229-N231 PolarHBondContact O-N 3.31Å; M229-Y232 PolarHBondContact O-N 2.7Å; M229-F245 HydrophobicContact CE-CE1 3.74Å; M229-F245 HydrophobicContact CE-CZ 3.82Å; M229-V246 HydrophobicContact CB-CG1 4.46Å; M229-V246 HydrophobicContact SD-CG1 4.29Å; M229-V246 HydrophobicContact SD-CG2 4.42Å; M229-A249 HydrophobicContact CE-CB 3.66Å; M229-A249 HydrophobicContact SD-CB 3.96Å; M229-K250 HydrophobicContact CB-CG 4.42Å; M229-K250 HydrophobicContact SD-CB 4.32Å; M229-V253 HydrophobicContact CE-CG2 4.29Å
230S95.2Very high95.7Very high67 Ų6766.5 Ų66.547%0.46936%0.363SS..THydrogen-bonded Turntrans-71.9-24.4-176.259.90000113.7D228D228-S230 VanDerWaalsContact CG-OG 3.23Å; D228-S230 PolarHBondContact O-N 3.02Å; D228-S230 VanDerWaalsContact O-N 3.11Å; D228-S230 VanDerWaalsContact OD1-CB 3.26Å; D228-S230 WeakPolarHBondContact OD1-CB 3.47Å; D228-S230 PolarHBondContact OD1-N 3.13Å; D228-S230 PolarHBondContact OD1-OG 3.32Å; D228-S230 WeakPolarHBondContact OD2-CB 3.36Å; D228-S230 PolarHBondContact OD2-OG 2.83Å; D228-S230 VanDerWaalsContact OD2-OG 3.13Å
231N96.1Very high95.7Very high57 Ų5765 Ų6531%0.30536%0.355SS..THydrogen-bonded Turntrans-93.311.2179.373.8-43.3000114T224 Y226 M229 D233T224-N231 PolarHBondContact O-ND2 3.01Å; Y226-N231 WeakPolarHBondContact CB-OD1 3.46Å; Y226-N231 HydrophobicContact CD1-CB 4.45Å; Y226-N231 HydrophobicContact CD2-CB 3.65Å; Y226-N231 HydrophobicContact CE2-CB 3.72Å; Y226-N231 HydrophobicContact CG-CB 4.03Å; Y226-N231 VanDerWaalsContact CG-CG 3.48Å; Y226-N231 VanDerWaalsContact CG-OD1 3.31Å; Y226-N231 PolarHBondContact N-OD1 3.17Å; M229-N231 VanDerWaalsContact C-N 3.31Å; M229-N231 PolarHBondContact O-N 3.31Å; N231-D233 PolarHBondContact O-N 3.49Å
232Y97.2Very high95.8Very high25 Ų2565 Ų6510%0.09836%0.355CS..  trans-65.7131.9176.1-169.2-112.2000111.2F221 I225 M229 E234 W238 I242 D243 V246F221-Y232 HydrophobicContact CD2-CD2 4.27Å; F221-Y232 HydrophobicContact CD2-CE2 4Å; F221-Y232 AromaticContact CE2-CD2 3.74Å; F221-Y232 HydrophobicContact CE2-CD2 3.74Å; F221-Y232 AromaticContact CE2-CE2 3.71Å; F221-Y232 HydrophobicContact CE2-CE2 3.71Å; I225-Y232 HydrophobicContact CD1-CD2 4.02Å; I225-Y232 HydrophobicContact CD1-CG 4.47Å; M229-Y232 PolarHBondContact O-N 2.7Å; Y232-E234 HydrophobicContact CD1-CG 3.91Å; Y232-E234 HydrophobicContact CE1-CG 4.13Å; Y232-W238 AromaticContact CE2-CD1 3.66Å; Y232-W238 HydrophobicContact CE2-CG 4.2Å; Y232-W238 AromaticContact CE2-NE1 3.84Å; Y232-W238 AromaticContact CZ-CD1 3.72Å; Y232-I242 HydrophobicContact CE2-CG2 4.04Å; Y232-D243 WeakPolarHBondContact OH-CA 3.33Å; Y232-D243 PolarHBondContact OH-N 3.03Å; Y232-D243 PolarHBondContact OH-OD1 3.28Å; Y232-V246 HydrophobicContact CD1-CB 4.06Å; Y232-V246 HydrophobicContact CD1-CG1 3.65Å; Y232-V246 HydrophobicContact CD1-CG2 4.18Å; Y232-V246 HydrophobicContact CD2-CG1 4.47Å; Y232-V246 HydrophobicContact CD2-CG2 3.83Å; Y232-V246 HydrophobicContact CE1-CB 4.08Å; Y232-V246 HydrophobicContact CE1-CG1 4.18Å; Y232-V246 HydrophobicContact CE1-CG2 4.16Å; Y232-V246 HydrophobicContact CE2-CG2 3.8Å; Y232-V246 HydrophobicContact CG-CB 4.3Å; Y232-V246 HydrophobicContact CG-CG1 3.8Å; Y232-V246 HydrophobicContact CG-CG2 4Å
233D95.9Very high95.7Very high89 Ų8966.4 Ų66.448%0.47636%0.362SS..  trans-102102.3176.6-179.712000109.6N231 E235 G236N231-D233 PolarHBondContact O-N 3.49Å; D233-E235 PolarHBondContact O-N 3.44Å; D233-E235 PolarHBondContact OD1-N 3.13Å; D233-G236 PolarHBondContact O-N 3.38Å; D233-G236 PolarHBondContact OD1-N 3.06Å
234E91.5Very high95.8Very high150 Ų15065.6 Ų65.670%0.70136%0.358SS*.THydrogen-bonded Turntrans-68.5-17.9178.3-65.2176-166.500112.8Y232 G236Y232-E234 HydrophobicContact CD1-CG 3.91Å; Y232-E234 HydrophobicContact CE1-CG 4.13Å; E234-G236 VanDerWaalsContact C-N 3.31Å
235E92.2Very high95.9Very high185 Ų18562.1 Ų62.186%0.86434%0.336SS*.THydrogen-bonded Turntrans-90.7-0.9172.9-59.9-171.4167.400112D233D233-E235 PolarHBondContact O-N 3.44Å; D233-E235 PolarHBondContact OD1-N 3.13Å
236G92.5Very high96Very high20 Ų2061.4 Ų61.421%0.20633%0.333CS..SBendtrans-63.8151.5174.700000111.9D233 E234 W238D233-G236 PolarHBondContact O-N 3.38Å; D233-G236 PolarHBondContact OD1-N 3.06Å; E234-G236 VanDerWaalsContact C-N 3.31Å; G236-W238 PolarHBondContact O-N 3.44Å
237A95.3Very high95.9Very high103 Ų10362.3 Ų62.385%0.85134%0.342SS*.  trans-77.743.7175.100000112.1
238W97.2Very high96.1Very high60 Ų6060.4 Ų60.423%0.22732%0.323CS..  trans-73.6154.2178.3-64.6115.2000110.9L217 D220 F221 Y232 G236 V240 I242L217-W238 HydrophobicContact CB-CE3 4.42Å; L217-W238 HydrophobicContact CB-CZ3 4.43Å; D220-W238 HydrophobicContact CB-CH2 4.14Å; D220-W238 HydrophobicContact CB-CZ3 4.1Å; F221-W238 HydrophobicContact CB-CH2 4.27Å; F221-W238 HydrophobicContact CB-CZ3 4.04Å; Y232-W238 AromaticContact CE2-CD1 3.66Å; Y232-W238 HydrophobicContact CE2-CG 4.2Å; Y232-W238 AromaticContact CE2-NE1 3.84Å; Y232-W238 AromaticContact CZ-CD1 3.72Å; G236-W238 PolarHBondContact O-N 3.44Å; W238-V240 PolarHBondContact O-N 2.87Å; W238-I242 HydrophobicContact CB-CB 4.46Å; W238-I242 HydrophobicContact CE3-CD1 4.33Å
239P97.1Very high96.2Very high10 Ų1057.3 Ų57.37%0.06531%0.307CS..  trans-61.2137.9167.6-15.828.1000109.9T214 L217 L241 I242 D243T214-P239 HydrophobicContact CG2-CB 4.21Å; T214-P239 HydrophobicContact CG2-CG 4.43Å; L217-P239 HydrophobicContact CB-CG 3.9Å; L217-P239 HydrophobicContact CD1-CG 3.77Å; L217-P239 HydrophobicContact CG-CG 4.44Å; P239-L241 PolarHBondContact O-N 3.38Å; P239-I242 HydrophobicContact CB-CG1 4.44Å; P239-I242 HydrophobicContact CG-CD1 4.09Å; P239-I242 HydrophobicContact CG-CG1 4.26Å; P239-I242 WeakPolarHBondContact O-CA 3.33Å; P239-I242 WeakPolarHBondContact O-CB 3.38Å; P239-I242 PolarHBondContact O-N 2.76Å; P239-D243 PolarHBondContact O-N 3.5Å
240V96.7Very high96.1Very high97 Ų9759.9 Ų59.959%0.58832%0.318SS*.Hα-helixtrans-48.2-33177.31780000113W238 I242 D243 E244W238-V240 PolarHBondContact O-N 2.87Å; V240-I242 VanDerWaalsContact C-N 3.32Å; V240-I242 PolarHBondContact O-N 3.11Å; V240-D243 WeakPolarHBondContact CA-OD2 3.16Å; V240-D243 WeakPolarHBondContact O-CB 3.38Å; V240-D243 PolarHBondContact O-N 3.49Å; V240-E244 HydrophobicContact CG1-CG 4.16Å; V240-E244 WeakPolarHBondContact O-CB 3.29Å; V240-E244 WeakPolarHBondContact O-CG 3.34Å; V240-E244 PolarHBondContact O-N 2.83Å
241L97.9Very high96Very high11 Ų1159.8 Ų59.86%0.05832%0.315CS..Hα-helixtrans-64.2-34.3177.4-173.161.2000113.6W198 F201 L202 H206 I210 T214 P239 F245W198-L241 HydrophobicContact CH2-CD2 3.91Å; W198-L241 HydrophobicContact CH2-CG 3.9Å; W198-L241 HydrophobicContact CZ2-CD2 4.36Å; F201-L241 HydrophobicContact CE1-CD1 3.5Å; F201-L241 HydrophobicContact CE1-CG 4.21Å; F201-L241 HydrophobicContact CZ-CD1 4.01Å; L202-L241 HydrophobicContact CD2-CD1 4.35Å; L202-L241 HydrophobicContact CD2-CD2 3.85Å; L202-L241 HydrophobicContact CD2-CG 4.42Å; H206-L241 HydrophobicContact CB-CD1 3.8Å; H206-L241 VanDerWaalsContact CG-CD1 3.43Å; H206-L241 WeakPolarHBondContact ND1-CD1 3.22Å; I210-L241 HydrophobicContact CD1-CD2 3.72Å; T214-L241 HydrophobicContact CG2-CB 4.05Å; T214-L241 HydrophobicContact CG2-CD2 3.75Å; T214-L241 HydrophobicContact CG2-CG 4.37Å; P239-L241 PolarHBondContact O-N 3.38Å; L241-F245 WeakPolarHBondContact O-CB 3.47Å; L241-F245 PolarHBondContact O-N 3.01Å
242I98.3Very high95.9Very high0 Ų059.5 Ų59.50%031%0.312CS..Hα-helixtrans-72.3-41.1175.7-59.8-169.7000109.4L218 F221 Y232 W238 P239 V240 F245 V246L218-I242 HydrophobicContact CB-CD1 4.41Å; L218-I242 HydrophobicContact CD1-CD1 4.28Å; F221-I242 HydrophobicContact CB-CD1 4.04Å; F221-I242 HydrophobicContact CB-CG2 4.48Å; F221-I242 HydrophobicContact CD1-CG2 4.43Å; F221-I242 HydrophobicContact CD2-CG2 3.53Å; F221-I242 HydrophobicContact CE2-CG2 3.72Å; F221-I242 HydrophobicContact CG-CD1 4.41Å; F221-I242 HydrophobicContact CG-CG2 3.9Å; F221-I242 HydrophobicContact CZ-CG2 4.26Å; Y232-I242 HydrophobicContact CE2-CG2 4.04Å; W238-I242 HydrophobicContact CB-CB 4.46Å; W238-I242 HydrophobicContact CE3-CD1 4.33Å; P239-I242 HydrophobicContact CB-CG1 4.44Å; P239-I242 HydrophobicContact CG-CD1 4.09Å; P239-I242 HydrophobicContact CG-CG1 4.26Å; P239-I242 WeakPolarHBondContact O-CA 3.33Å; P239-I242 WeakPolarHBondContact O-CB 3.38Å; P239-I242 PolarHBondContact O-N 2.76Å; V240-I242 VanDerWaalsContact C-N 3.32Å; V240-I242 PolarHBondContact O-N 3.11Å; I242-F245 WeakPolarHBondContact O-CB 3.17Å; I242-F245 PolarHBondContact O-N 3.3Å; I242-V246 WeakPolarHBondContact O-CG2 3.03Å; I242-V246 PolarHBondContact O-N 3.15Å
243D97.6Very high95.5Very high47 Ų4759.2 Ų59.225%0.25131%0.313SS..Hα-helixtrans-57.2-53.3173.5-61-48.3000111.3Y232 P239 V240 F245 V246 E247Y232-D243 WeakPolarHBondContact OH-CA 3.33Å; Y232-D243 PolarHBondContact OH-N 3.03Å; Y232-D243 PolarHBondContact OH-OD1 3.28Å; P239-D243 PolarHBondContact O-N 3.5Å; V240-D243 WeakPolarHBondContact CA-OD2 3.16Å; V240-D243 WeakPolarHBondContact O-CB 3.38Å; V240-D243 PolarHBondContact O-N 3.49Å; D243-F245 PolarHBondContact O-N 3.06Å; D243-V246 PolarHBondContact O-N 2.88Å; D243-V246 VanDerWaalsContact O-N 3.13Å; D243-E247 PolarHBondContact O-N 3.23Å
244E97.5Very high94.8Very high74 Ų7460.3 Ų60.335%0.34632%0.315SS..Hα-helixtrans-58.5-37178.3-71.8175.4171.600111.7F201 V240 W248F201-E244 HydrophobicContact CE2-CB 4.4Å; F201-E244 HydrophobicContact CZ-CB 3.74Å; V240-E244 HydrophobicContact CG1-CG 4.16Å; V240-E244 WeakPolarHBondContact O-CB 3.29Å; V240-E244 WeakPolarHBondContact O-CG 3.34Å; V240-E244 PolarHBondContact O-N 2.83Å; E244-W248 VanDerWaalsContact O-CB 3.31Å; E244-W248 WeakPolarHBondContact O-CB 3.35Å; E244-W248 PolarHBondContact O-N 3.25Å; E244-W248 VanDerWaalsContact O-N 3.11Å
245F98.2Very high94Very high0 Ų060.9 Ų60.90%032%0.32CS..Hα-helixtrans-66.2-45.7175.9166.9-111.4000112.2F192 H194 L197 W198 F201 F221 M229 L241 I242 D243 W248 A249F192-F245 AromaticContact CZ-CE1 3.97Å; F192-F245 HydrophobicContact CZ-CE1 3.97Å; F192-F245 HydrophobicContact CZ-CZ 4.16Å; H194-F245 HydrophobicContact CB-CZ 4.11Å; L197-F245 HydrophobicContact CB-CE2 4.2Å; L197-F245 HydrophobicContact CB-CZ 4.44Å; W198-F245 HydrophobicContact CB-CE2 4.1Å; W198-F245 HydrophobicContact CB-CZ 4.16Å; W198-F245 HydrophobicContact CE3-CB 3.89Å; W198-F245 AromaticContact CE3-CD1 3.72Å; W198-F245 HydrophobicContact CE3-CD1 3.72Å; W198-F245 AromaticContact CE3-CD2 3.59Å; W198-F245 HydrophobicContact CE3-CD2 3.59Å; W198-F245 HydrophobicContact CE3-CE1 4.12Å; W198-F245 AromaticContact CE3-CE2 4Å; W198-F245 HydrophobicContact CE3-CE2 4Å; W198-F245 AromaticContact CE3-CG 3.43Å; W198-F245 HydrophobicContact CE3-CG 3.43Å; W198-F245 VanDerWaalsContact CE3-CG 3.43Å; W198-F245 HydrophobicContact CE3-CZ 4.24Å; W198-F245 HydrophobicContact CZ3-CB 3.54Å; W198-F245 AromaticContact CZ3-CD1 3.98Å; W198-F245 HydrophobicContact CZ3-CD1 3.98Å; W198-F245 HydrophobicContact CZ3-CD2 4.17Å; W198-F245 AromaticContact CZ3-CG 3.62Å; W198-F245 HydrophobicContact CZ3-CG 3.62Å; F201-F245 HydrophobicContact CB-CD2 3.82Å; F201-F245 HydrophobicContact CB-CE2 4.34Å; F201-F245 HydrophobicContact CD1-CB 3.78Å; F201-F245 AromaticContact CD1-CD2 3.86Å; F201-F245 HydrophobicContact CD1-CD2 3.86Å; F201-F245 HydrophobicContact CD1-CG 4.26Å; F201-F245 HydrophobicContact CE1-CB 3.68Å; F201-F245 HydrophobicContact CG-CB 4.33Å; F201-F245 AromaticContact CG-CD2 3.84Å; F201-F245 HydrophobicContact CG-CD2 3.84Å; F201-F245 HydrophobicContact CZ-CB 4.17Å; F221-F245 HydrophobicContact CE1-CD1 4.32Å; F221-F245 HydrophobicContact CE1-CE1 4.03Å; F221-F245 HydrophobicContact CZ-CD1 4.26Å; F221-F245 HydrophobicContact CZ-CE1 4.14Å; M229-F245 HydrophobicContact CE-CE1 3.74Å; M229-F245 HydrophobicContact CE-CZ 3.82Å; L241-F245 WeakPolarHBondContact O-CB 3.47Å; L241-F245 PolarHBondContact O-N 3.01Å; I242-F245 WeakPolarHBondContact O-CB 3.17Å; I242-F245 PolarHBondContact O-N 3.3Å; D243-F245 PolarHBondContact O-N 3.06Å; F245-W248 HydrophobicContact CD2-CE3 4.28Å; F245-W248 HydrophobicContact CE2-CE3 4.44Å; F245-W248 HydrophobicContact CE2-CZ3 4.42Å; F245-W248 PolarHBondContact O-N 3.07Å; F245-A249 HydrophobicContact CD2-CB 4.07Å; F245-A249 HydrophobicContact CE1-CB 4.42Å; F245-A249 HydrophobicContact CE2-CB 3.67Å; F245-A249 HydrophobicContact CZ-CB 3.88Å; F245-A249 WeakPolarHBondContact O-CB 3.28Å; F245-A249 PolarHBondContact O-N 2.95Å
246V97.5Very high92.9Very high3 Ų358.7 Ų58.72%0.01831%0.314CS..Hα-helixtrans-65.1-43.9-179.8173.50000110.5F221 M229 Y232 I242 D243 W248 A249 K250F221-V246 HydrophobicContact CE2-CG2 3.75Å; F221-V246 HydrophobicContact CZ-CG2 3.78Å; M229-V246 HydrophobicContact CB-CG1 4.46Å; M229-V246 HydrophobicContact SD-CG1 4.29Å; M229-V246 HydrophobicContact SD-CG2 4.42Å; Y232-V246 HydrophobicContact CD1-CB 4.06Å; Y232-V246 HydrophobicContact CD1-CG1 3.65Å; Y232-V246 HydrophobicContact CD1-CG2 4.18Å; Y232-V246 HydrophobicContact CD2-CG1 4.47Å; Y232-V246 HydrophobicContact CD2-CG2 3.83Å; Y232-V246 HydrophobicContact CE1-CB 4.08Å; Y232-V246 HydrophobicContact CE1-CG1 4.18Å; Y232-V246 HydrophobicContact CE1-CG2 4.16Å; Y232-V246 HydrophobicContact CE2-CG2 3.8Å; Y232-V246 HydrophobicContact CG-CB 4.3Å; Y232-V246 HydrophobicContact CG-CG1 3.8Å; Y232-V246 HydrophobicContact CG-CG2 4Å; I242-V246 WeakPolarHBondContact O-CG2 3.03Å; I242-V246 PolarHBondContact O-N 3.15Å; D243-V246 PolarHBondContact O-N 2.88Å; D243-V246 VanDerWaalsContact O-N 3.13Å; V246-W248 VanDerWaalsContact C-N 3.25Å; V246-W248 PolarHBondContact O-N 3.46Å; V246-A249 PolarHBondContact O-N 3.34Å; V246-K250 HydrophobicContact CG1-CD 4.47Å; V246-K250 WeakPolarHBondContact O-CB 3.48Å; V246-K250 PolarHBondContact O-N 3.29Å
247E96.3Very high91.3Very high155 Ų15562.5 Ų62.572%0.72433%0.329SS*.Hα-helixtrans-55.6-42.5175.1-172.7-178.3-179.300111.4D243 P251D243-E247 PolarHBondContact O-N 3.23Å; E247-P251 VanDerWaalsContact O-CD 3.24Å; E247-P251 WeakPolarHBondContact O-CD 3.48Å
248W96.9Very high89.1Confident50 Ų5062.2 Ų62.219%0.18932%0.319CS..Hα-helixtrans-76.4-38.1179.6176.986000114.2L197 K200 F201 H205 E244 F245 V246 Q252L197-W248 HydrophobicContact CB-CZ3 4.33Å; L197-W248 HydrophobicContact CD2-CH2 4.4Å; L197-W248 HydrophobicContact CD2-CZ3 4.3Å; L197-W248 WeakPolarHBondContact O-CZ3 3.44Å; K200-W248 HydrophobicContact CB-CH2 4.07Å; K200-W248 HydrophobicContact CD-CH2 3.91Å; K200-W248 HydrophobicContact CD-CZ2 4.28Å; K200-W248 HydrophobicContact CG-CH2 3.88Å; K200-W248 HydrophobicContact CG-CZ2 4.27Å; F201-W248 HydrophobicContact CB-CD2 4.28Å; F201-W248 HydrophobicContact CB-CE3 3.67Å; F201-W248 HydrophobicContact CB-CH2 4.07Å; F201-W248 HydrophobicContact CB-CZ3 3.57Å; F201-W248 HydrophobicContact CD2-CB 4.02Å; F201-W248 AromaticContact CD2-CD2 3.74Å; F201-W248 HydrophobicContact CD2-CD2 3.74Å; F201-W248 AromaticContact CD2-CE3 3.84Å; F201-W248 HydrophobicContact CD2-CE3 3.84Å; F201-W248 AromaticContact CD2-CG 3.84Å; F201-W248 HydrophobicContact CD2-CG 3.84Å; F201-W248 HydrophobicContact CE2-CB 4.11Å; F201-W248 HydrophobicContact CE2-CG 4.32Å; F201-W248 HydrophobicContact CG-CD2 4.44Å; F201-W248 HydrophobicContact CG-CE3 4.1Å; F201-W248 HydrophobicContact CG-CZ3 4.48Å; H205-W248 AromaticContact CD2-CD1 3.98Å; H205-W248 AromaticContact CD2-CE2 3.64Å; H205-W248 AromaticContact CD2-CZ2 3.93Å; H205-W248 AromaticContact CD2-NE1 3.33Å; H205-W248 PolarHBondContact CD2-NE1 2.72Å; H205-W248 VanDerWaalsContact CD2-NE1 3.33Å; H205-W248 AromaticContact CE1-CD1 3.8Å; H205-W248 AromaticContact CE1-NE1 3.39Å; H205-W248 PolarHBondContact CE1-NE1 3Å; H205-W248 AromaticContact NE2-CD1 3.68Å; H205-W248 AromaticContact NE2-CE2 3.54Å; H205-W248 AromaticContact NE2-CZ2 3.89Å; H205-W248 AromaticContact NE2-NE1 2.86Å; H205-W248 PolarHBondContact NE2-NE1 3.46Å; E244-W248 VanDerWaalsContact O-CB 3.31Å; E244-W248 WeakPolarHBondContact O-CB 3.35Å; E244-W248 PolarHBondContact O-N 3.25Å; E244-W248 VanDerWaalsContact O-N 3.11Å; F245-W248 HydrophobicContact CD2-CE3 4.28Å; F245-W248 HydrophobicContact CE2-CE3 4.44Å; F245-W248 HydrophobicContact CE2-CZ3 4.42Å; F245-W248 PolarHBondContact O-N 3.07Å; V246-W248 VanDerWaalsContact C-N 3.25Å; V246-W248 PolarHBondContact O-N 3.46Å; W248-Q252 VanDerWaalsContact CE3-NE2 3.26Å; W248-Q252 VanDerWaalsContact CH2-NE2 3.31Å; W248-Q252 VanDerWaalsContact CZ2-NE2 3.26Å; W248-Q252 VanDerWaalsContact CZ3-NE2 3.28Å; W248-Q252 PolarHBondContact O-NE2 3.23Å
249A96.6Very high86.9Confident0 Ų067.1 Ų67.10%035%0.348CS..Hα-helixtrans-85.8-36.3-171.700000113M229 F245 V246 Q252 V253M229-A249 HydrophobicContact CE-CB 3.66Å; M229-A249 HydrophobicContact SD-CB 3.96Å; F245-A249 HydrophobicContact CD2-CB 4.07Å; F245-A249 HydrophobicContact CE1-CB 4.42Å; F245-A249 HydrophobicContact CE2-CB 3.67Å; F245-A249 HydrophobicContact CZ-CB 3.88Å; F245-A249 WeakPolarHBondContact O-CB 3.28Å; F245-A249 PolarHBondContact O-N 2.95Å; V246-A249 PolarHBondContact O-N 3.34Å; A249-Q252 WeakPolarHBondContact O-CB 3.31Å; A249-Q252 PolarHBondContact O-N 2.51Å; A249-V253 WeakPolarHBondContact O-CG2 3.49Å; A249-V253 PolarHBondContact O-N 2.97Å
250K94.6Very high84.5Confident54 Ų5472.5 Ų72.524%0.23538%0.381CS..Hα-helixtrans-56.3-42.8-174.7-172.6174.8-172.6171.50113.4M229 V246 Q252 V253 Q254M229-K250 HydrophobicContact CB-CG 4.42Å; M229-K250 HydrophobicContact SD-CB 4.32Å; V246-K250 HydrophobicContact CG1-CD 4.47Å; V246-K250 WeakPolarHBondContact O-CB 3.48Å; V246-K250 PolarHBondContact O-N 3.29Å; K250-Q252 VanDerWaalsContact C-N 3.32Å; K250-Q252 PolarHBondContact O-N 3.22Å; K250-V253 PolarHBondContact O-N 3.07Å; K250-Q254 WeakPolarHBondContact O-CG 3.31Å; K250-Q254 PolarHBondContact O-N 3.15Å; K250-Q254 VanDerWaalsContact O-N 3.13Å
251P93.2Very high81.8Confident65 Ų6575.1 Ų75.142%0.42239%0.392SS..Hα-helixtrans-62.4-35.3174.1-23.134.8000113.6E247 M255E247-P251 VanDerWaalsContact O-CD 3.24Å; E247-P251 WeakPolarHBondContact O-CD 3.48Å; P251-M255 WeakPolarHBondContact O-CG 3.32Å; P251-M255 PolarHBondContact O-N 3Å
252Q93.1Very high79.1Confident51 Ų5182.9 Ų82.924%0.23843%0.428CS..Hα-helixtrans-70-41.9179-65.8173.385.300111W248 A249 K250 Q254 M255 D256W248-Q252 VanDerWaalsContact CE3-NE2 3.26Å; W248-Q252 VanDerWaalsContact CH2-NE2 3.31Å; W248-Q252 VanDerWaalsContact CZ2-NE2 3.26Å; W248-Q252 VanDerWaalsContact CZ3-NE2 3.28Å; W248-Q252 PolarHBondContact O-NE2 3.23Å; A249-Q252 WeakPolarHBondContact O-CB 3.31Å; A249-Q252 PolarHBondContact O-N 2.51Å; K250-Q252 VanDerWaalsContact C-N 3.32Å; K250-Q252 PolarHBondContact O-N 3.22Å; Q252-Q254 VanDerWaalsContact C-N 3.34Å; Q252-Q254 PolarHBondContact O-N 2.95Å; Q252-M255 PolarHBondContact O-N 2.8Å; Q252-D256 PolarHBondContact O-N 2.91Å
253V90Very high76.6Confident20 Ų2092.1 Ų92.112%0.12149%0.487CS..Hα-helixtrans-63.9-39.1177.9174.20000111.7L197 P227 M229 A249 K250 D256L197-V253 HydrophobicContact CD1-CG2 3.75Å; P227-V253 VanDerWaalsContact O-CG1 3.31Å; P227-V253 WeakPolarHBondContact O-CG1 3.21Å; M229-V253 HydrophobicContact CE-CG2 4.29Å; A249-V253 WeakPolarHBondContact O-CG2 3.49Å; A249-V253 PolarHBondContact O-N 2.97Å; K250-V253 PolarHBondContact O-N 3.07Å; V253-D256 PolarHBondContact O-N 3.47Å
254Q81.4Confident75.6Confident111 Ų11194.4 Ų94.452%0.51950%0.499SS..Hα-helixtrans-71.3-28.7179.8-71.5177.9-6.200113.5K250 Q252 D256K250-Q254 WeakPolarHBondContact O-CG 3.31Å; K250-Q254 PolarHBondContact O-N 3.15Å; K250-Q254 VanDerWaalsContact O-N 3.13Å; Q252-Q254 VanDerWaalsContact C-N 3.34Å; Q252-Q254 PolarHBondContact O-N 2.95Å; Q254-D256 VanDerWaalsContact C-N 3.32Å
255M74.4Confident74.4Confident162 Ų16295.4 Ų95.480%0.79851%0.507SS*.Hα-helixtrans-72.2-25.6176.6-73.7-174.8178.200113.2P251 Q252 I257P251-M255 WeakPolarHBondContact O-CG 3.32Å; P251-M255 PolarHBondContact O-N 3Å; Q252-M255 PolarHBondContact O-N 2.8Å; M255-I257 VanDerWaalsContact C-N 3.32Å
256D68.1Low73.1Confident139 Ų139100.7 Ų100.774%0.74354%0.535SS*.THydrogen-bonded Turntrans-83-6-179.8-77.2-20.6000113.6Q252 V253 Q254 P258Q252-D256 PolarHBondContact O-N 2.91Å; V253-D256 PolarHBondContact O-N 3.47Å; Q254-D256 VanDerWaalsContact C-N 3.32Å; D256-P258 VanDerWaalsContact O-CD 3.27Å; D256-P258 WeakPolarHBondContact O-CD 3.25Å
257I58.9Low71.7Confident101 Ų101106.5 Ų106.552%0.51857%0.566SS.*SBendtrans-76.7113.6171.9-56.2173.8000107.5M255 L259M255-I257 VanDerWaalsContact C-N 3.32Å; I257-L259 PolarHBondContact O-N 3.16Å; I257-L259 VanDerWaalsContact O-N 3.16Å
258P49.8Very low70.2Confident97 Ų97103.4 Ų103.463%0.6356%0.556SS**  trans-58128.4176.1-16.829.3000107.9D256 T260D256-P258 VanDerWaalsContact O-CD 3.27Å; D256-P258 WeakPolarHBondContact O-CD 3.25Å; P258-T260 PolarHBondContact O-N 3.35Å
259L50.2Low68.4Low162 Ų162107 Ų10785%0.84858%0.58SS**  trans-57.187.7163-72.3165.2000107.3I257 N261I257-L259 PolarHBondContact O-N 3.16Å; I257-L259 VanDerWaalsContact O-N 3.16Å; L259-N261 PolarHBondContact O-N 3.1Å
260T46.8Very low66.4Low124 Ų124114.6 Ų114.676%0.76162%0.622SS**  trans-68.992.316448.50000105.4P258 H262P258-T260 PolarHBondContact O-N 3.35Å; T260-H262 PolarHBondContact O-N 2.62Å
261N40.2Very low64.2Low151 Ų151119.3 Ų119.381%0.80765%0.651SS**  trans-44.6111165.3-73-39.9000108.7L259L259-N261 PolarHBondContact O-N 3.1Å
262H41.2Very low61.8Low175 Ų175123.8 Ų123.881%0.8167%0.671SS**  trans-75.6145.2148.8-99.6-69.9000107.7T260T260-H262 PolarHBondContact O-N 2.62Å
263P47.2Very low58.9Low193 Ų193130.5 Ų130.5100%1.25371%0.71SS**  trans-61.60-170.427.5-35.2000113.9

Retrieved 263 of 263 residues in 56.6 ms (Link to these results)

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