A0A087XYT5_POEFO Loading...

Protein regulator of cytokinesis 1b

AlphaFold DB , UniProt , Accession A0A087XYT5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 584 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
1M54.1Low80.9Confident201 Ų201110.9 Ų110.999%0.9959%0.593SS**  0138.70-73.1-170.4-170.300108.5E5 V6M1-E5 WeakPolarHBondContact CA-OE2 3.32Å; M1-V6 HydrophobicContact CB-CG2 3.89Å; M1-V6 HydrophobicContact SD-CG2 4.22Å
2R72.7Confident81.6Confident181 Ų181108.8 Ų108.868%0.68359%0.587SS**  trans-69.8146.8173.2-60.1177.3-169.1156.41.9108.6S4 E5 V6R2-S4 PolarHBondContact O-N 2.85Å; R2-S4 VanDerWaalsContact O-N 3.16Å; R2-E5 HydrophobicContact CB-CG 4.1Å; R2-E5 WeakPolarHBondContact CD-OE1 3.31Å; R2-E5 PolarHBondContact N-OE2 3.34Å; R2-E5 IonicContact NE-OE1 3.96Å; R2-E5 WeakPolarHBondContact O-CB 3.39Å; R2-E5 PolarHBondContact O-N 3.37Å; R2-V6 PolarHBondContact O-N 3.08Å
3K78.3Confident82.2Confident188 Ų188104.3 Ų104.382%0.81757%0.569SS**Hα-helixtrans-55.7-33.8179.9-67.5-179178.7178.50112.4V6 L7K3-V6 PolarHBondContact O-N 3.31Å; K3-L7 WeakPolarHBondContact O-CG 3.17Å; K3-L7 PolarHBondContact O-N 3.16Å; K3-L7 VanDerWaalsContact O-N 3.09Å
4S82.8Confident82.6Confident77 Ų77102.9 Ų102.954%0.53857%0.569SS.*Hα-helixtrans-65.1-36.7174.9510000113.7R2 L7 A8R2-S4 PolarHBondContact O-N 2.85Å; R2-S4 VanDerWaalsContact O-N 3.16Å; S4-L7 PolarHBondContact O-N 3.34Å; S4-A8 WeakPolarHBondContact O-CB 3.49Å; S4-A8 PolarHBondContact O-N 3.35Å
5E83Confident83.1Confident85 Ų85100.3 Ų100.340%0.39755%0.554SS.*Hα-helixtrans-69.4-36.8177.9-65.4161.8-177.300111M1 R2 A8 A9M1-E5 WeakPolarHBondContact CA-OE2 3.32Å; R2-E5 HydrophobicContact CB-CG 4.1Å; R2-E5 WeakPolarHBondContact CD-OE1 3.31Å; R2-E5 PolarHBondContact N-OE2 3.34Å; R2-E5 IonicContact NE-OE1 3.96Å; R2-E5 WeakPolarHBondContact O-CB 3.39Å; R2-E5 PolarHBondContact O-N 3.37Å; E5-A8 PolarHBondContact O-N 2.93Å; E5-A9 PolarHBondContact O-N 3.5Å; E5-A9 VanDerWaalsContact O-N 3.07Å
6V85.6Confident83.4Confident73 Ų7399.6 Ų99.644%0.44255%0.548SS..Hα-helixtrans-66.3-44.7175.2-179.90000110.8M1 R2 K3 A8 A9 E10M1-V6 HydrophobicContact CB-CG2 3.89Å; M1-V6 HydrophobicContact SD-CG2 4.22Å; R2-V6 PolarHBondContact O-N 3.08Å; K3-V6 PolarHBondContact O-N 3.31Å; V6-A8 VanDerWaalsContact C-N 3.35Å; V6-A8 PolarHBondContact O-N 3.27Å; V6-A9 PolarHBondContact O-N 3.32Å; V6-E10 PolarHBondContact O-N 3.46Å
7L85.7Confident83.7Confident109 Ų109102.5 Ų102.557%0.57155%0.554SS**Hα-helixtrans-63.9-38176.3-72.5171.1000112.5K3 S4 E10 A11K3-L7 WeakPolarHBondContact O-CG 3.17Å; K3-L7 PolarHBondContact O-N 3.16Å; K3-L7 VanDerWaalsContact O-N 3.09Å; S4-L7 PolarHBondContact O-N 3.34Å; L7-E10 PolarHBondContact O-N 2.84Å; L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.2Å
8A85.9Confident83.9Confident57 Ų5799.6 Ų99.647%0.47155%0.546SS..Hα-helixtrans-62.8-43.1174.500000111.5S4 E5 V6 A11 V12S4-A8 WeakPolarHBondContact O-CB 3.49Å; S4-A8 PolarHBondContact O-N 3.35Å; E5-A8 PolarHBondContact O-N 2.93Å; V6-A8 VanDerWaalsContact C-N 3.35Å; V6-A8 PolarHBondContact O-N 3.27Å; A8-A11 PolarHBondContact O-N 3.49Å; A8-V12 WeakPolarHBondContact O-CG2 3.45Å; A8-V12 PolarHBondContact O-N 3.2Å; A8-V12 VanDerWaalsContact O-N 3.16Å
9A86.6Confident84.1Confident62 Ų6297.3 Ų97.351%0.51253%0.533SS..Hα-helixtrans-65-38.7176.200000112.5E5 V6 V12 S13E5-A9 PolarHBondContact O-N 3.5Å; E5-A9 VanDerWaalsContact O-N 3.07Å; V6-A9 PolarHBondContact O-N 3.32Å; A9-V12 PolarHBondContact O-N 3.21Å; A9-S13 PolarHBondContact O-N 3.11Å
10E88.4Confident84.2Confident124 Ų12496.3 Ų96.358%0.57953%0.532SS*.Hα-helixtrans-63.8-43.2175.1-173.5173.5-168.500112.1V6 L7 V12 S13 C14V6-E10 PolarHBondContact O-N 3.46Å; L7-E10 PolarHBondContact O-N 2.84Å; E10-V12 VanDerWaalsContact C-N 3.34Å; E10-V12 PolarHBondContact O-N 3.4Å; E10-S13 WeakPolarHBondContact O-CB 3.34Å; E10-S13 PolarHBondContact O-N 3.16Å; E10-S13 VanDerWaalsContact O-N 3.16Å; E10-C14 PolarHBondContact O-N 3.23Å
11A86.9Confident84.4Confident63 Ų6397.2 Ų97.252%0.52153%0.532SS..Hα-helixtrans-59.8-42.1175.800000112.2L7 A8 C14 L15L7-A11 WeakPolarHBondContact O-CB 3.48Å; L7-A11 PolarHBondContact O-N 3.2Å; A8-A11 PolarHBondContact O-N 3.49Å; A11-C14 PolarHBondContact O-N 3.49Å; A11-L15 PolarHBondContact O-N 2.83Å
12V89.6Confident85.9Confident85 Ų8590.5 Ų90.552%0.51550%0.5SS..Hα-helixtrans-64-41.8174.7173.80000111.3A8 A9 E10 L15 N16A8-V12 WeakPolarHBondContact O-CG2 3.45Å; A8-V12 PolarHBondContact O-N 3.2Å; A8-V12 VanDerWaalsContact O-N 3.16Å; A9-V12 PolarHBondContact O-N 3.21Å; E10-V12 VanDerWaalsContact C-N 3.34Å; E10-V12 PolarHBondContact O-N 3.4Å; V12-L15 PolarHBondContact O-N 3.31Å; V12-N16 PolarHBondContact O-N 2.84Å; V12-N16 PolarHBondContact O-ND2 3.39Å
13S88.6Confident86.6Confident51 Ų5187.2 Ų87.236%0.35749%0.491SS..Hα-helixtrans-63.3-42.1176-175.40000112.2A9 E10 N16 K17A9-S13 PolarHBondContact O-N 3.11Å; E10-S13 WeakPolarHBondContact O-CB 3.34Å; E10-S13 PolarHBondContact O-N 3.16Å; E10-S13 VanDerWaalsContact O-N 3.16Å; S13-N16 PolarHBondContact O-N 3.3Å; S13-K17 WeakPolarHBondContact O-CG 3.49Å; S13-K17 PolarHBondContact O-N 2.91Å
14C88.8Confident87Confident84 Ų8481.9 Ų81.957%0.56847%0.472SS*.Hα-helixtrans-61.3-44.4176.5-171.10000111.7E10 A11 K17 A18E10-C14 PolarHBondContact O-N 3.23Å; A11-C14 PolarHBondContact O-N 3.49Å; C14-K17 PolarHBondContact O-N 2.87Å; C14-A18 WeakPolarHBondContact O-CB 3.4Å; C14-A18 PolarHBondContact O-N 2.81Å
15L88.9Confident87.3Confident65 Ų6581 Ų8134%0.3446%0.46SS..Hα-helixtrans-60.4-46.1175.8177.961.7000111.6A11 V12 K17 A18 L19 I47A11-L15 PolarHBondContact O-N 2.83Å; V12-L15 PolarHBondContact O-N 3.31Å; L15-K17 PolarHBondContact O-N 3.43Å; L15-A18 PolarHBondContact O-N 2.86Å; L15-L19 HydrophobicContact CD1-CD1 4.12Å; L15-L19 HydrophobicContact CD1-CG 4.19Å; L15-L19 HydrophobicContact CG-CD1 4.06Å; L15-L19 WeakPolarHBondContact O-CG 3.33Å; L15-L19 PolarHBondContact O-N 3.18Å; L15-I47 HydrophobicContact CD1-CD1 3.48Å; L15-I47 VanDerWaalsContact CD1-CD1 3.48Å; L15-I47 HydrophobicContact CD2-CD1 3.87Å; L15-I47 HydrophobicContact CG-CD1 4.33Å
16N88Confident87.6Confident88 Ų8878.3 Ų78.347%0.47145%0.446SS..Hα-helixtrans-62.5-43.3178.8-75.7-27.6000112.1V12 S13 A18 L19 C20V12-N16 PolarHBondContact O-N 2.84Å; V12-N16 PolarHBondContact O-ND2 3.39Å; S13-N16 PolarHBondContact O-N 3.3Å; N16-A18 VanDerWaalsContact C-N 3.35Å; N16-A18 PolarHBondContact O-N 3.05Å; N16-L19 PolarHBondContact O-N 3.38Å; N16-C20 WeakPolarHBondContact O-CB 3.47Å; N16-C20 PolarHBondContact O-N 3.08Å; N16-C20 PolarHBondContact O-SG 3.05Å; N16-C20 VanDerWaalsContact O-SG 3.34Å
17K89.1Confident87.6Confident150 Ų15079.5 Ų79.565%0.65245%0.447SS*.Hα-helixtrans-59.8-44.3174.8-72.8174.3-177.6175.60111.7S13 C14 L15 C20 H21S13-K17 WeakPolarHBondContact O-CG 3.49Å; S13-K17 PolarHBondContact O-N 2.91Å; C14-K17 PolarHBondContact O-N 2.87Å; L15-K17 PolarHBondContact O-N 3.43Å; K17-C20 PolarHBondContact O-N 3.29Å; K17-H21 WeakPolarHBondContact O-CB 3.27Å; K17-H21 PolarHBondContact O-N 2.99Å
18A87.7Confident87.7Confident49 Ų4982.3 Ų82.341%0.40546%0.457SS..Hα-helixtrans-65.1-40.1178.600000112.6C14 L15 N16 H21 L22C14-A18 WeakPolarHBondContact O-CB 3.4Å; C14-A18 PolarHBondContact O-N 2.81Å; L15-A18 PolarHBondContact O-N 2.86Å; N16-A18 VanDerWaalsContact C-N 3.35Å; N16-A18 PolarHBondContact O-N 3.05Å; A18-H21 PolarHBondContact O-N 3.43Å; A18-L22 WeakPolarHBondContact O-CG 3.15Å; A18-L22 PolarHBondContact O-N 3.01Å
19L86.8Confident87.8Confident57 Ų5785.1 Ų85.130%0.29846%0.463SS..Hα-helixtrans-68.7-40.3176.5-70.9174.5000112.5L15 N16 H21 L22 K23 V43L15-L19 HydrophobicContact CD1-CD1 4.12Å; L15-L19 HydrophobicContact CD1-CG 4.19Å; L15-L19 HydrophobicContact CG-CD1 4.06Å; L15-L19 WeakPolarHBondContact O-CG 3.33Å; L15-L19 PolarHBondContact O-N 3.18Å; N16-L19 PolarHBondContact O-N 3.38Å; L19-H21 VanDerWaalsContact C-N 3.34Å; L19-L22 HydrophobicContact CD2-CD1 4.44Å; L19-L22 PolarHBondContact O-N 3.09Å; L19-K23 PolarHBondContact O-N 3.39Å; L19-V43 HydrophobicContact CD2-CG1 4.27Å
20C86.8Confident87.7Confident76 Ų7684.8 Ų84.851%0.51447%0.466SS..Hα-helixtrans-59.8-45.9172.1-72.60000111N16 K17 L22 K23 D24N16-C20 WeakPolarHBondContact O-CB 3.47Å; N16-C20 PolarHBondContact O-N 3.08Å; N16-C20 PolarHBondContact O-SG 3.05Å; N16-C20 VanDerWaalsContact O-SG 3.34Å; K17-C20 PolarHBondContact O-N 3.29Å; C20-L22 PolarHBondContact O-N 3.32Å; C20-K23 WeakPolarHBondContact O-CB 3.35Å; C20-K23 PolarHBondContact O-N 3.26Å; C20-K23 VanDerWaalsContact O-N 3.15Å; C20-D24 VanDerWaalsContact O-CG 3.27Å; C20-D24 PolarHBondContact O-N 3.45Å
21H88.6Confident87.5Confident116 Ų11680 Ų8054%0.53744%0.444SS..Hα-helixtrans-64.4-39.6178.7-169.450.4000113K17 A18 L19 K23 D24 I25K17-H21 WeakPolarHBondContact O-CB 3.27Å; K17-H21 PolarHBondContact O-N 2.99Å; A18-H21 PolarHBondContact O-N 3.43Å; L19-H21 VanDerWaalsContact C-N 3.34Å; H21-K23 VanDerWaalsContact C-N 3.29Å; H21-K23 PolarHBondContact O-N 3.39Å; H21-D24 PolarHBondContact O-N 3.46Å; H21-I25 WeakPolarHBondContact O-CG1 3.3Å; H21-I25 PolarHBondContact O-N 3.16Å
22L85.9Confident87.6Confident60 Ų6080.3 Ų80.331%0.31444%0.441SS..Hα-helixtrans-61.3-38.4173.2-77.9171.2000112.2A18 L19 C20 I25 W26A18-L22 WeakPolarHBondContact O-CG 3.15Å; A18-L22 PolarHBondContact O-N 3.01Å; L19-L22 HydrophobicContact CD2-CD1 4.44Å; L19-L22 PolarHBondContact O-N 3.09Å; C20-L22 PolarHBondContact O-N 3.32Å; L22-I25 PolarHBondContact O-N 3.18Å; L22-W26 HydrophobicContact CB-CH2 4.37Å; L22-W26 HydrophobicContact CB-CZ2 4.21Å; L22-W26 VanDerWaalsContact O-CD2 3.27Å; L22-W26 PolarHBondContact O-N 3.2Å
23K85.9Confident87.3Confident112 Ų11282.2 Ų82.249%0.48744%0.444SS..Hα-helixtrans-63-47.8175.4-177.4-171.3169.3-168.80111L19 C20 H21 I25 W26 E27L19-K23 PolarHBondContact O-N 3.39Å; C20-K23 WeakPolarHBondContact O-CB 3.35Å; C20-K23 PolarHBondContact O-N 3.26Å; C20-K23 VanDerWaalsContact O-N 3.15Å; H21-K23 VanDerWaalsContact C-N 3.29Å; H21-K23 PolarHBondContact O-N 3.39Å; K23-I25 VanDerWaalsContact C-N 3.33Å; K23-I25 PolarHBondContact O-N 3.39Å; K23-W26 PolarHBondContact O-N 2.8Å; K23-W26 VanDerWaalsContact O-N 3.15Å; K23-E27 WeakPolarHBondContact CE-OE1 3.38Å; K23-E27 IonicContact NZ-OE1 3.84Å; K23-E27 WeakPolarHBondContact O-CG 3.32Å; K23-E27 PolarHBondContact O-N 3.05Å
24D88Confident87.1Confident77 Ų7785.6 Ų85.641%0.41246%0.458SS..Hα-helixtrans-57.9-46178.1-59-24.4000110.7C20 H21 W26 E27 E28C20-D24 VanDerWaalsContact O-CG 3.27Å; C20-D24 PolarHBondContact O-N 3.45Å; H21-D24 PolarHBondContact O-N 3.46Å; D24-W26 PolarHBondContact O-N 3.19Å; D24-E27 WeakPolarHBondContact O-CB 3.37Å; D24-E27 PolarHBondContact O-N 3.14Å; D24-E28 WeakPolarHBondContact O-CG 3.4Å; D24-E28 PolarHBondContact O-N 3.02Å
25I87.8Confident86.9Confident57 Ų5785.7 Ų85.729%0.29245%0.45SS..Hα-helixtrans-60.7-42.3175.9-66.7166000111.8H21 L22 K23 E27 E28 I29H21-I25 WeakPolarHBondContact O-CG1 3.3Å; H21-I25 PolarHBondContact O-N 3.16Å; L22-I25 PolarHBondContact O-N 3.18Å; K23-I25 VanDerWaalsContact C-N 3.33Å; K23-I25 PolarHBondContact O-N 3.39Å; I25-E27 VanDerWaalsContact C-N 3.31Å; I25-E27 PolarHBondContact O-N 3.38Å; I25-E28 PolarHBondContact O-N 3.46Å; I25-I29 HydrophobicContact CG2-CD1 3.65Å; I25-I29 HydrophobicContact CG2-CG1 4.45Å; I25-I29 VanDerWaalsContact O-CG1 3.27Å; I25-I29 WeakPolarHBondContact O-CG1 3.28Å; I25-I29 PolarHBondContact O-N 2.85Å
26W89.4Confident86.7Confident30 Ų3084.5 Ų84.511%0.11444%0.441CS..Hα-helixtrans-69.2-29.3178.9-64.7-20.3000113.2L22 K23 D24 G30 I31 R36 R39 T40L22-W26 HydrophobicContact CB-CH2 4.37Å; L22-W26 HydrophobicContact CB-CZ2 4.21Å; L22-W26 VanDerWaalsContact O-CD2 3.27Å; L22-W26 PolarHBondContact O-N 3.2Å; K23-W26 PolarHBondContact O-N 2.8Å; K23-W26 VanDerWaalsContact O-N 3.15Å; D24-W26 PolarHBondContact O-N 3.19Å; W26-G30 PolarHBondContact O-N 3.05Å; W26-G30 VanDerWaalsContact O-N 3.13Å; W26-I31 HydrophobicContact CB-CB 4.44Å; W26-I31 HydrophobicContact CB-CD1 4.21Å; W26-I31 VanDerWaalsContact CD1-CD1 3.49Å; W26-I31 HydrophobicContact CG-CD1 4Å; W26-I31 PolarHBondContact O-N 2.9Å; W26-I31 VanDerWaalsContact O-N 3.16Å; W26-R36 HydrophobicContact CB-CG 4.12Å; W26-R36 HydrophobicContact CD2-CB 4.45Å; W26-R36 HydrophobicContact CD2-CG 4.07Å; W26-R36 HydrophobicContact CE3-CB 3.78Å; W26-R36 HydrophobicContact CE3-CG 3.75Å; W26-R36 HydrophobicContact CG-CG 4.27Å; W26-R36 HydrophobicContact CZ3-CB 4.05Å; W26-R36 PolarHBondContact O-NH2 2.94Å; W26-R39 HydrophobicContact CH2-CB 4.03Å; W26-R39 HydrophobicContact CZ2-CB 3.76Å; W26-T40 VanDerWaalsContact CH2-OG1 3.27Å; W26-T40 WeakPolarHBondContact CH2-OG1 3.12Å; W26-T40 VanDerWaalsContact CZ3-OG1 3.24Å; W26-T40 WeakPolarHBondContact CZ3-OG1 3.43Å
27E87.2Confident86.7Confident98 Ų9885.7 Ų85.746%0.45845%0.447SS..Hα-helixtrans-68.5-44171.9-73.7179.6-177.600111.6K23 D24 I25 I29 G30K23-E27 WeakPolarHBondContact CE-OE1 3.38Å; K23-E27 IonicContact NZ-OE1 3.84Å; K23-E27 WeakPolarHBondContact O-CG 3.32Å; K23-E27 PolarHBondContact O-N 3.05Å; D24-E27 WeakPolarHBondContact O-CB 3.37Å; D24-E27 PolarHBondContact O-N 3.14Å; I25-E27 VanDerWaalsContact C-N 3.31Å; I25-E27 PolarHBondContact O-N 3.38Å; E27-I29 PolarHBondContact O-N 3.07Å; E27-G30 PolarHBondContact O-N 2.84Å
28E87.1Confident86.5Confident168 Ų16884.8 Ų84.879%0.78545%0.445SS*.Hα-helixtrans-62.7-39.1175.3-71.3178.8-172.900113.1D24 I25D24-E28 WeakPolarHBondContact O-CG 3.4Å; D24-E28 PolarHBondContact O-N 3.02Å; I25-E28 PolarHBondContact O-N 3.46Å
29I87.6Confident86.5Confident115 Ų11587.7 Ų87.759%0.5945%0.445SS*.Hα-helixtrans-78.5-23-179.8-62.4168.7000112.2I25 E27 I31I25-I29 HydrophobicContact CG2-CD1 3.65Å; I25-I29 HydrophobicContact CG2-CG1 4.45Å; I25-I29 VanDerWaalsContact O-CG1 3.27Å; I25-I29 WeakPolarHBondContact O-CG1 3.28Å; I25-I29 PolarHBondContact O-N 2.85Å; E27-I29 PolarHBondContact O-N 3.07Å; I29-I31 HydrophobicContact CB-CD1 4.27Å; I29-I31 HydrophobicContact CB-CG1 4.28Å; I29-I31 HydrophobicContact CD1-CD1 4.49Å; I29-I31 HydrophobicContact CG2-CD1 4.07Å; I29-I31 HydrophobicContact CG2-CG1 3.89Å
30G84.6Confident86.5Confident56 Ų5687.5 Ų87.558%0.57745%0.447SS*.THydrogen-bonded Turntrans80.231.5-177.800000114.9W26 E27W26-G30 PolarHBondContact O-N 3.05Å; W26-G30 VanDerWaalsContact O-N 3.13Å; E27-G30 PolarHBondContact O-N 2.84Å
31I85.2Confident86.6Confident23 Ų2387.5 Ų87.512%0.11844%0.442CS..  trans-69.7133.4179.6-68.9162.6000110.6W26 I29 Q35 R36W26-I31 HydrophobicContact CB-CB 4.44Å; W26-I31 HydrophobicContact CB-CD1 4.21Å; W26-I31 VanDerWaalsContact CD1-CD1 3.49Å; W26-I31 HydrophobicContact CG-CD1 4Å; W26-I31 PolarHBondContact O-N 2.9Å; W26-I31 VanDerWaalsContact O-N 3.16Å; I29-I31 HydrophobicContact CB-CD1 4.27Å; I29-I31 HydrophobicContact CB-CG1 4.28Å; I29-I31 HydrophobicContact CD1-CD1 4.49Å; I29-I31 HydrophobicContact CG2-CD1 4.07Å; I29-I31 HydrophobicContact CG2-CG1 3.89Å; I31-Q35 HydrophobicContact CG2-CB 3.72Å; I31-R36 HydrophobicContact CB-CG 4.29Å; I31-R36 HydrophobicContact CG2-CG 3.75Å; I31-R36 VanDerWaalsContact O-CZ 3.29Å; I31-R36 PolarHBondContact O-NE 2.94Å; I31-R36 PolarHBondContact O-NH2 3.49Å
32P87.8Confident86.6Confident69 Ų6985.8 Ų85.845%0.44844%0.439SS..  trans-67.2150.6177.827.7-34.7000112.7D34 Q35 R36P32-D34 VanDerWaalsContact C-N 3.27Å; P32-D34 PolarHBondContact O-N 3.2Å; P32-Q35 HydrophobicContact CG-CB 4.38Å; P32-Q35 HydrophobicContact CG-CG 4.08Å; P32-Q35 PolarHBondContact O-N 3.02Å; P32-R36 PolarHBondContact O-N 2.9Å
33E83.7Confident86.7Confident125 Ų12585.2 Ų85.258%0.58444%0.438SS*.Hα-helixtrans-56-38.8-172.6-171.960-164.400113.1Q35 R36 L37E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 2.81Å; E33-R36 PolarHBondContact O-N 2.98Å; E33-R36 VanDerWaalsContact O-N 3.1Å; E33-L37 WeakPolarHBondContact O-CB 3.48Å; E33-L37 PolarHBondContact O-N 3.43Å
34D84.5Confident86.9Confident123 Ų12386 Ų8666%0.65844%0.442SS*.Hα-helixtrans-58.8-38.1179.2-54.1-28.8000112.2P32 Q38P32-D34 VanDerWaalsContact C-N 3.27Å; P32-D34 PolarHBondContact O-N 3.2Å; D34-Q38 VanDerWaalsContact O-CG 3.32Å; D34-Q38 WeakPolarHBondContact O-CG 3.37Å; D34-Q38 PolarHBondContact O-N 3.15Å; D34-Q38 VanDerWaalsContact O-N 3.09Å
35Q84.6Confident87.1Confident85 Ų8584.4 Ų84.440%0.39743%0.433SS..Hα-helixtrans-77.8-33.2177.1-69-175.718.300112.5I31 P32 E33 L37 Q38 R39I31-Q35 HydrophobicContact CG2-CB 3.72Å; P32-Q35 HydrophobicContact CG-CB 4.38Å; P32-Q35 HydrophobicContact CG-CG 4.08Å; P32-Q35 PolarHBondContact O-N 3.02Å; E33-Q35 VanDerWaalsContact C-N 3.27Å; E33-Q35 PolarHBondContact O-N 2.81Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; Q35-Q38 PolarHBondContact O-N 3.38Å; Q35-R39 WeakPolarHBondContact O-CG 3.39Å; Q35-R39 PolarHBondContact O-N 2.98Å
36R84.3Confident87.2Confident40 Ų4087.8 Ų87.815%0.15145%0.447CS..Hα-helixtrans-64.9-42.1173.1-62.1-177.7-171.3-176.6-3110.6W26 I31 P32 E33 R39 T40W26-R36 HydrophobicContact CB-CG 4.12Å; W26-R36 HydrophobicContact CD2-CB 4.45Å; W26-R36 HydrophobicContact CD2-CG 4.07Å; W26-R36 HydrophobicContact CE3-CB 3.78Å; W26-R36 HydrophobicContact CE3-CG 3.75Å; W26-R36 HydrophobicContact CG-CG 4.27Å; W26-R36 HydrophobicContact CZ3-CB 4.05Å; W26-R36 PolarHBondContact O-NH2 2.94Å; I31-R36 HydrophobicContact CB-CG 4.29Å; I31-R36 HydrophobicContact CG2-CG 3.75Å; I31-R36 VanDerWaalsContact O-CZ 3.29Å; I31-R36 PolarHBondContact O-NE 2.94Å; I31-R36 PolarHBondContact O-NH2 3.49Å; P32-R36 PolarHBondContact O-N 2.9Å; E33-R36 PolarHBondContact O-N 2.98Å; E33-R36 VanDerWaalsContact O-N 3.1Å; R36-R39 PolarHBondContact O-N 2.69Å; R36-T40 WeakPolarHBondContact O-CB 3.49Å; R36-T40 PolarHBondContact O-N 2.92Å; R36-T40 PolarHBondContact O-OG1 3.46Å
37L87.3Confident87.2Confident113 Ų11389 Ų8959%0.59246%0.455SS*.Hα-helixtrans-62.3-45.2175.1-174.565.3000111E33 Q35 T40 N41E33-L37 WeakPolarHBondContact O-CB 3.48Å; E33-L37 PolarHBondContact O-N 3.43Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; L37-T40 PolarHBondContact O-N 3.32Å; L37-N41 WeakPolarHBondContact O-CB 3.39Å; L37-N41 PolarHBondContact O-N 2.72Å
38Q86.4Confident87.4Confident132 Ų13289.7 Ų89.762%0.61745%0.454SS*.Hα-helixtrans-58.2-49.6174.6-76.5175.25.900112D34 Q35 N41 V42D34-Q38 VanDerWaalsContact O-CG 3.32Å; D34-Q38 WeakPolarHBondContact O-CG 3.37Å; D34-Q38 PolarHBondContact O-N 3.15Å; D34-Q38 VanDerWaalsContact O-N 3.09Å; Q35-Q38 PolarHBondContact O-N 3.38Å; Q38-N41 PolarHBondContact O-N 2.7Å; Q38-V42 WeakPolarHBondContact O-CG2 3.48Å; Q38-V42 PolarHBondContact O-N 3.45Å
39R87.8Confident87.7Confident109 Ų10985.9 Ų85.941%0.41144%0.439SS..Hα-helixtrans-63.2-43.6179.2-71.5178.8177.9114.70.2112.2W26 Q35 R36 N41 V42 V43W26-R39 HydrophobicContact CH2-CB 4.03Å; W26-R39 HydrophobicContact CZ2-CB 3.76Å; Q35-R39 WeakPolarHBondContact O-CG 3.39Å; Q35-R39 PolarHBondContact O-N 2.98Å; R36-R39 PolarHBondContact O-N 2.69Å; R39-N41 VanDerWaalsContact C-N 3.33Å; R39-N41 PolarHBondContact O-N 3.32Å; R39-V42 WeakPolarHBondContact O-CB 3.36Å; R39-V42 PolarHBondContact O-N 3.49Å; R39-V43 PolarHBondContact O-N 3.35Å; R39-V43 VanDerWaalsContact O-N 3.15Å
40T85.8Confident88Confident54 Ų5484.8 Ų84.833%0.33143%0.434SS..Hα-helixtrans-65.8-36.8176.9-51.20000111.6W26 R36 L37 V42 V43 K44W26-T40 VanDerWaalsContact CH2-OG1 3.27Å; W26-T40 WeakPolarHBondContact CH2-OG1 3.12Å; W26-T40 VanDerWaalsContact CZ3-OG1 3.24Å; W26-T40 WeakPolarHBondContact CZ3-OG1 3.43Å; R36-T40 WeakPolarHBondContact O-CB 3.49Å; R36-T40 PolarHBondContact O-N 2.92Å; R36-T40 PolarHBondContact O-OG1 3.46Å; L37-T40 PolarHBondContact O-N 3.32Å; T40-V42 VanDerWaalsContact C-N 3.35Å; T40-V43 PolarHBondContact O-N 3.08Å; T40-K44 WeakPolarHBondContact O-CB 3.46Å; T40-K44 PolarHBondContact O-N 3.23Å
41N87.9Confident88.3Confident76 Ų7686.9 Ų86.941%0.40643%0.431SS..Hα-helixtrans-66.8-36.4176.2-165.943.2000111.8L37 Q38 R39 K44 N45L37-N41 WeakPolarHBondContact O-CB 3.39Å; L37-N41 PolarHBondContact O-N 2.72Å; Q38-N41 PolarHBondContact O-N 2.7Å; R39-N41 VanDerWaalsContact C-N 3.33Å; R39-N41 PolarHBondContact O-N 3.32Å; N41-K44 PolarHBondContact O-N 3.27Å; N41-N45 WeakPolarHBondContact O-CB 3.49Å; N41-N45 PolarHBondContact O-N 3.07Å; N41-N45 PolarHBondContact O-ND2 2.91Å; N41-N45 VanDerWaalsContact O-ND2 3.17Å
42V89.4Confident88.7Confident79 Ų7991 Ų9148%0.47945%0.45SS..Hα-helixtrans-61.1-46.8171.61740000110.8Q38 R39 T40 N45 H46Q38-V42 WeakPolarHBondContact O-CG2 3.48Å; Q38-V42 PolarHBondContact O-N 3.45Å; R39-V42 WeakPolarHBondContact O-CB 3.36Å; R39-V42 PolarHBondContact O-N 3.49Å; T40-V42 VanDerWaalsContact C-N 3.35Å; V42-N45 PolarHBondContact O-N 3.4Å; V42-H46 PolarHBondContact O-N 2.89Å; V42-H46 PolarHBondContact O-ND1 3.03Å
43V88.7Confident89Confident49 Ų4992.1 Ų92.130%0.29745%0.45SS..Hα-helixtrans-60.7-48.2176.5174.80000111.4L19 R39 T40 N45 H46 I47L19-V43 HydrophobicContact CD2-CG1 4.27Å; R39-V43 PolarHBondContact O-N 3.35Å; R39-V43 VanDerWaalsContact O-N 3.15Å; T40-V43 PolarHBondContact O-N 3.08Å; V43-N45 VanDerWaalsContact C-N 3.3Å; V43-N45 PolarHBondContact O-N 2.73Å; V43-H46 PolarHBondContact O-N 3.35Å; V43-I47 HydrophobicContact CG1-CD1 3.76Å; V43-I47 HydrophobicContact CG1-CG1 4.47Å; V43-I47 WeakPolarHBondContact O-CG1 3.4Å; V43-I47 PolarHBondContact O-N 3.05Å
44K90.1Very high89.5Confident128 Ų12891 Ų9156%0.55745%0.446SS*.Hα-helixtrans-54.9-45175.1176.2-173.2168.4-175.80111.6T40 N41 I47 R48T40-K44 WeakPolarHBondContact O-CB 3.46Å; T40-K44 PolarHBondContact O-N 3.23Å; N41-K44 PolarHBondContact O-N 3.27Å; K44-I47 PolarHBondContact O-N 2.84Å; K44-R48 VanDerWaalsContact O-CB 3.25Å; K44-R48 WeakPolarHBondContact O-CB 3.18Å; K44-R48 PolarHBondContact O-N 3.32Å
45N91.3Very high89.9Confident44 Ų4488.9 Ų88.924%0.23544%0.438CS..Hα-helixtrans-65.2-40.8179.5-73.3-27.1000112.1N41 V42 V43 R48 N49N41-N45 WeakPolarHBondContact O-CB 3.49Å; N41-N45 PolarHBondContact O-N 3.07Å; N41-N45 PolarHBondContact O-ND2 2.91Å; N41-N45 VanDerWaalsContact O-ND2 3.17Å; V42-N45 PolarHBondContact O-N 3.4Å; V43-N45 VanDerWaalsContact C-N 3.3Å; V43-N45 PolarHBondContact O-N 2.73Å; N45-R48 PolarHBondContact O-N 2.81Å; N45-R48 PolarHBondContact OD1-NH2 2.86Å; N45-N49 WeakPolarHBondContact O-CB 3.31Å; N45-N49 PolarHBondContact O-N 2.86Å; N45-N49 PolarHBondContact O-ND2 2.78Å; N45-N49 PolarHBondContact O-OD1 3.3Å
46H90.2Very high90.3Very high127 Ų12792 Ų9259%0.58845%0.45SS*.Hα-helixtrans-64.9-45177.5-7663.3000111.8V42 V43 N49 L50V42-H46 PolarHBondContact O-N 2.89Å; V42-H46 PolarHBondContact O-ND1 3.03Å; V43-H46 PolarHBondContact O-N 3.35Å; H46-N49 PolarHBondContact O-N 3.15Å; H46-L50 PolarHBondContact O-N 2.9Å
47I90.8Very high90.8Very high55 Ų5595.2 Ų95.228%0.28247%0.467SS..Hα-helixtrans-63.9-45.9177.5-65.4169.5000110.6L15 V43 K44 N49 L50 L51L15-I47 HydrophobicContact CD1-CD1 3.48Å; L15-I47 VanDerWaalsContact CD1-CD1 3.48Å; L15-I47 HydrophobicContact CD2-CD1 3.87Å; L15-I47 HydrophobicContact CG-CD1 4.33Å; V43-I47 HydrophobicContact CG1-CD1 3.76Å; V43-I47 HydrophobicContact CG1-CG1 4.47Å; V43-I47 WeakPolarHBondContact O-CG1 3.4Å; V43-I47 PolarHBondContact O-N 3.05Å; K44-I47 PolarHBondContact O-N 2.84Å; I47-N49 PolarHBondContact O-N 3Å; I47-L50 PolarHBondContact O-N 3.48Å; I47-L51 HydrophobicContact CG2-CD1 3.93Å; I47-L51 HydrophobicContact CG2-CG 4.4Å; I47-L51 WeakPolarHBondContact O-CG 3.21Å; I47-L51 PolarHBondContact O-N 3.48Å
48R91.3Very high91Very high113 Ų11395.8 Ų95.843%0.42647%0.466SS..Hα-helixtrans-58.7-48.8177.2-180-178.562174.4-2.9111.4K44 N45 L50 L51 E52K44-R48 VanDerWaalsContact O-CB 3.25Å; K44-R48 WeakPolarHBondContact O-CB 3.18Å; K44-R48 PolarHBondContact O-N 3.32Å; N45-R48 PolarHBondContact O-N 2.81Å; N45-R48 PolarHBondContact OD1-NH2 2.86Å; R48-L50 VanDerWaalsContact C-N 3.32Å; R48-L50 PolarHBondContact O-N 2.78Å; R48-L51 PolarHBondContact O-N 2.87Å; R48-E52 VanDerWaalsContact CD-OE1 3.31Å; R48-E52 WeakPolarHBondContact CD-OE1 3.49Å; R48-E52 HydrophobicContact CG-CG 4.22Å; R48-E52 WeakPolarHBondContact CG-OE1 3.33Å; R48-E52 IonicContact NE-OE1 3.99Å; R48-E52 WeakPolarHBondContact O-CB 3.33Å; R48-E52 WeakPolarHBondContact O-CG 3.41Å; R48-E52 PolarHBondContact O-N 3.48Å
49N92.9Very high91.2Very high89 Ų8994.6 Ų94.648%0.47646%0.461SS..Hα-helixtrans-62.6-38.7-178.9-68-3.5000112N45 H46 I47 M53N45-N49 WeakPolarHBondContact O-CB 3.31Å; N45-N49 PolarHBondContact O-N 2.86Å; N45-N49 PolarHBondContact O-ND2 2.78Å; N45-N49 PolarHBondContact O-OD1 3.3Å; H46-N49 PolarHBondContact O-N 3.15Å; I47-N49 PolarHBondContact O-N 3Å; N49-M53 WeakPolarHBondContact O-CB 3.34Å; N49-M53 PolarHBondContact O-N 3.37Å
50L92.8Very high91.5Very high91 Ų9191.8 Ų91.848%0.47646%0.458SS..Hα-helixtrans-65.1-46.5175.6178.562.3000111.7H46 I47 R48 M53 M54H46-L50 PolarHBondContact O-N 2.9Å; I47-L50 PolarHBondContact O-N 3.48Å; R48-L50 VanDerWaalsContact C-N 3.32Å; R48-L50 PolarHBondContact O-N 2.78Å; L50-M53 HydrophobicContact CD1-CE 3.84Å; L50-M53 HydrophobicContact CD1-SD 4.44Å; L50-M53 WeakPolarHBondContact O-CB 3.49Å; L50-M53 PolarHBondContact O-N 3.39Å; L50-M54 HydrophobicContact CD1-CG 4.48Å; L50-M54 HydrophobicContact CG-SD 4.43Å; L50-M54 WeakPolarHBondContact O-CG 3.34Å; L50-M54 PolarHBondContact O-N 3.07Å
51L90.8Very high91.7Very high101 Ų10192.4 Ų92.453%0.52946%0.459SS..Hα-helixtrans-65.5-41.4178.2-68.2175.5000111.9I47 R48 M53 M54 V55I47-L51 HydrophobicContact CG2-CD1 3.93Å; I47-L51 HydrophobicContact CG2-CG 4.4Å; I47-L51 WeakPolarHBondContact O-CG 3.21Å; I47-L51 PolarHBondContact O-N 3.48Å; R48-L51 PolarHBondContact O-N 2.87Å; L51-M53 VanDerWaalsContact C-N 3.32Å; L51-M53 PolarHBondContact O-N 3.31Å; L51-M54 PolarHBondContact O-N 3.38Å; L51-V55 WeakPolarHBondContact O-CB 3.38Å; L51-V55 VanDerWaalsContact O-CG2 3.27Å; L51-V55 WeakPolarHBondContact O-CG2 3.34Å; L51-V55 PolarHBondContact O-N 3.37Å
52E93.6Very high91.8Very high109 Ų10994.2 Ų94.251%0.50946%0.463SS..Hα-helixtrans-62.1-39.4174.6-76.7175-171.900111.6R48 K56R48-E52 VanDerWaalsContact CD-OE1 3.31Å; R48-E52 WeakPolarHBondContact CD-OE1 3.49Å; R48-E52 HydrophobicContact CG-CG 4.22Å; R48-E52 WeakPolarHBondContact CG-OE1 3.33Å; R48-E52 IonicContact NE-OE1 3.99Å; R48-E52 WeakPolarHBondContact O-CB 3.33Å; R48-E52 WeakPolarHBondContact O-CG 3.41Å; R48-E52 PolarHBondContact O-N 3.48Å; E52-K56 WeakPolarHBondContact O-CB 3.4Å; E52-K56 PolarHBondContact O-N 2.88Å
53M94.4Very high91.9Very high92 Ų9296.9 Ų96.945%0.45347%0.468SS..Hα-helixtrans-62-52173.5178.8-131.7-62.100111.2N49 L50 L51 V55 K56 E57N49-M53 WeakPolarHBondContact O-CB 3.34Å; N49-M53 PolarHBondContact O-N 3.37Å; L50-M53 HydrophobicContact CD1-CE 3.84Å; L50-M53 HydrophobicContact CD1-SD 4.44Å; L50-M53 WeakPolarHBondContact O-CB 3.49Å; L50-M53 PolarHBondContact O-N 3.39Å; L51-M53 VanDerWaalsContact C-N 3.32Å; L51-M53 PolarHBondContact O-N 3.31Å; M53-V55 PolarHBondContact O-N 2.77Å; M53-K56 PolarHBondContact O-N 3.28Å; M53-E57 WeakPolarHBondContact O-CG 3.07Å; M53-E57 PolarHBondContact O-N 2.87Å
54M94.3Very high92Very high101 Ų101102.1 Ų102.150%0.49848%0.483SS..Hα-helixtrans-61-44179.8-68.5-17973.400112.1L50 L51 K56 E57 E58L50-M54 HydrophobicContact CD1-CG 4.48Å; L50-M54 HydrophobicContact CG-SD 4.43Å; L50-M54 WeakPolarHBondContact O-CG 3.34Å; L50-M54 PolarHBondContact O-N 3.07Å; L51-M54 PolarHBondContact O-N 3.38Å; M54-K56 VanDerWaalsContact C-N 3.34Å; M54-K56 PolarHBondContact O-N 3.29Å; M54-E57 PolarHBondContact O-N 3.22Å; M54-E58 WeakPolarHBondContact O-CG 3.31Å; M54-E58 PolarHBondContact O-N 2.9Å
55V93.5Very high92Very high79 Ų7997.1 Ų97.148%0.47946%0.462SS..Hα-helixtrans-62.2-43.7175.8170.70000110.5L51 M53 E57 E58 E59L51-V55 WeakPolarHBondContact O-CB 3.38Å; L51-V55 VanDerWaalsContact O-CG2 3.27Å; L51-V55 WeakPolarHBondContact O-CG2 3.34Å; L51-V55 PolarHBondContact O-N 3.37Å; M53-V55 PolarHBondContact O-N 2.77Å; V55-E57 VanDerWaalsContact C-N 3.33Å; V55-E57 PolarHBondContact O-N 2.78Å; V55-E58 PolarHBondContact O-N 2.93Å; V55-E59 HydrophobicContact CG1-CG 4.28Å; V55-E59 WeakPolarHBondContact O-CB 3.5Å; V55-E59 WeakPolarHBondContact O-CG 3.43Å; V55-E59 PolarHBondContact O-N 2.95Å
56K93.3Very high91.9Very high152 Ų15299 Ų9966%0.66147%0.471SS*.Hα-helixtrans-64.3-37.6177.7-174.6179.4180-176.90112.1E52 M53 M54 S60E52-K56 WeakPolarHBondContact O-CB 3.4Å; E52-K56 PolarHBondContact O-N 2.88Å; M53-K56 PolarHBondContact O-N 3.28Å; M54-K56 VanDerWaalsContact C-N 3.34Å; M54-K56 PolarHBondContact O-N 3.29Å; K56-S60 VanDerWaalsContact O-CB 3.24Å; K56-S60 WeakPolarHBondContact O-CB 3.38Å; K56-S60 PolarHBondContact O-N 3.4Å
57E93.3Very high92Very high106 Ų10696.4 Ų96.450%0.49547%0.468SS..Hα-helixtrans-62.4-48.7174.5-75.9176.4176.200111.1M53 M54 V55 S60 L61M53-E57 WeakPolarHBondContact O-CG 3.07Å; M53-E57 PolarHBondContact O-N 2.87Å; M54-E57 PolarHBondContact O-N 3.22Å; V55-E57 VanDerWaalsContact C-N 3.33Å; V55-E57 PolarHBondContact O-N 2.78Å; E57-S60 WeakPolarHBondContact O-CB 3.19Å; E57-S60 PolarHBondContact O-N 3.41Å; E57-S60 PolarHBondContact O-OG 3.28Å; E57-L61 PolarHBondContact O-N 2.93Å
58E92.6Very high92Very high125 Ų12595.1 Ų95.158%0.58446%0.464SS*.Hα-helixtrans-66.9-39.3177.8-66.3-57.5144.300112.9M54 V55 S60 L61 K62M54-E58 WeakPolarHBondContact O-CG 3.31Å; M54-E58 PolarHBondContact O-N 2.9Å; V55-E58 PolarHBondContact O-N 2.93Å; E58-S60 VanDerWaalsContact C-N 3.3Å; E58-S60 PolarHBondContact O-N 3.17Å; E58-L61 PolarHBondContact O-N 3.11Å; E58-K62 PolarHBondContact O-N 2.89Å
59E91.6Very high91.9Very high108 Ų10889.9 Ų89.951%0.50544%0.444SS..Hα-helixtrans-63-38.3171.7-77.1-177179.600111.6V55 K63V55-E59 HydrophobicContact CG1-CG 4.28Å; V55-E59 WeakPolarHBondContact O-CB 3.5Å; V55-E59 WeakPolarHBondContact O-CG 3.43Å; V55-E59 PolarHBondContact O-N 2.95Å; E59-K63 WeakPolarHBondContact O-CG 3.49Å; E59-K63 PolarHBondContact O-N 3.35Å
60S92.4Very high91.8Very high50 Ų5092 Ų9235%0.3545%0.451SS..Hα-helixtrans-66.7-39.217584.70000111.5K56 E57 E58 K63 R64K56-S60 VanDerWaalsContact O-CB 3.24Å; K56-S60 WeakPolarHBondContact O-CB 3.38Å; K56-S60 PolarHBondContact O-N 3.4Å; E57-S60 WeakPolarHBondContact O-CB 3.19Å; E57-S60 PolarHBondContact O-N 3.41Å; E57-S60 PolarHBondContact O-OG 3.28Å; E58-S60 VanDerWaalsContact C-N 3.3Å; E58-S60 PolarHBondContact O-N 3.17Å; S60-K63 PolarHBondContact O-N 3.45Å; S60-R64 WeakPolarHBondContact O-CB 3.49Å; S60-R64 PolarHBondContact O-N 2.85Å
61L90.8Very high91.7Very high66 Ų6691.7 Ų91.735%0.34645%0.453SS..Hα-helixtrans-62.8-49.2175.2178.561.6000110.2E57 E58 K63 R64 L65E57-L61 PolarHBondContact O-N 2.93Å; E58-L61 PolarHBondContact O-N 3.11Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 2.82Å; L61-R64 WeakPolarHBondContact O-CB 3.38Å; L61-R64 PolarHBondContact O-N 2.9Å; L61-R64 VanDerWaalsContact O-N 3.1Å; L61-L65 HydrophobicContact CD1-CG 4.42Å; L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 3.35Å
62K89.6Confident91.6Very high114 Ų11487.6 Ų87.650%0.49643%0.432SS..Hα-helixtrans-56.7-45175.8-178.9179176-178.90112.3E58 R64 L65 L66 M96E58-K62 PolarHBondContact O-N 2.89Å; K62-R64 VanDerWaalsContact C-N 3.34Å; K62-L65 PolarHBondContact O-N 2.8Å; K62-L66 HydrophobicContact CG-CD1 4.38Å; K62-L66 WeakPolarHBondContact O-CG 3.41Å; K62-L66 PolarHBondContact O-N 3.28Å; K62-M96 HydrophobicContact CD-CE 4.29Å; K62-M96 HydrophobicContact CG-CE 4.12Å
63K91.4Very high91.4Very high135 Ų13586.2 Ų86.259%0.58742%0.423SS*.Hα-helixtrans-61.4-43175.9-75.2173.7-176.7172.50111.5E59 S60 L61 L66 S67E59-K63 WeakPolarHBondContact O-CG 3.49Å; E59-K63 PolarHBondContact O-N 3.35Å; S60-K63 PolarHBondContact O-N 3.45Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 2.82Å; K63-L66 PolarHBondContact O-N 2.92Å; K63-S67 PolarHBondContact O-N 2.7Å; K63-S67 PolarHBondContact O-OG 3.39Å
64R90.9Very high91.2Very high160 Ų16085.5 Ų85.560%0.60442%0.424SS*.Hα-helixtrans-62-44.1178.1-149.4-173.1-50.4154.36.7111.8S60 L61 K62 S67 S68S60-R64 WeakPolarHBondContact O-CB 3.49Å; S60-R64 PolarHBondContact O-N 2.85Å; L61-R64 WeakPolarHBondContact O-CB 3.38Å; L61-R64 PolarHBondContact O-N 2.9Å; L61-R64 VanDerWaalsContact O-N 3.1Å; K62-R64 VanDerWaalsContact C-N 3.34Å; R64-S67 PolarHBondContact O-N 3.31Å; R64-S68 VanDerWaalsContact O-CB 3.31Å; R64-S68 WeakPolarHBondContact O-CB 3.33Å; R64-S68 PolarHBondContact O-N 3.45Å
65L90.2Very high91Very high22 Ų2284.3 Ų84.312%0.11542%0.417CS..Hα-helixtrans-60.7-46.1175.3-68.2174000111.6L61 K62 S67 S68 I69 L97 E100L61-L65 HydrophobicContact CD1-CG 4.42Å; L61-L65 HydrophobicContact CG-CD1 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 3.35Å; K62-L65 PolarHBondContact O-N 2.8Å; L65-S67 PolarHBondContact O-N 3.46Å; L65-S68 WeakPolarHBondContact O-CB 3.36Å; L65-S68 PolarHBondContact O-N 2.94Å; L65-I69 WeakPolarHBondContact O-CB 3.39Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.35Å; L65-I69 PolarHBondContact O-N 3.12Å; L65-L97 HydrophobicContact CD1-CD1 4.44Å; L65-L97 HydrophobicContact CD2-CD1 3.94Å; L65-E100 WeakPolarHBondContact CD2-OE2 3.4Å
66L89.8Confident90.7Very high84 Ų8480.8 Ų80.844%0.4440%0.395SS..Hα-helixtrans-62.4-43.1177.6-72.8171.6000112.3K62 K63 Q70 M96K62-L66 HydrophobicContact CG-CD1 4.38Å; K62-L66 WeakPolarHBondContact O-CG 3.41Å; K62-L66 PolarHBondContact O-N 3.28Å; K63-L66 PolarHBondContact O-N 2.92Å; L66-Q70 WeakPolarHBondContact O-CB 3.23Å; L66-Q70 PolarHBondContact O-N 3.42Å; L66-M96 HydrophobicContact CD2-SD 4.1Å; L66-M96 HydrophobicContact CG-SD 4.5Å
67S91.7Very high90.5Very high73 Ų7378.4 Ų78.451%0.5139%0.387SS..Hα-helixtrans-65.1-40.2175.7-63.30000112.4K63 R64 L65 Q70 T71K63-S67 PolarHBondContact O-N 2.7Å; K63-S67 PolarHBondContact O-OG 3.39Å; R64-S67 PolarHBondContact O-N 3.31Å; L65-S67 PolarHBondContact O-N 3.46Å; S67-Q70 PolarHBondContact O-N 2.8Å; S67-T71 WeakPolarHBondContact O-CB 3.14Å; S67-T71 PolarHBondContact O-N 3.37Å; S67-T71 PolarHBondContact O-OG1 3.27Å
68S91.6Very high90.3Very high28 Ų2879.5 Ų79.520%0.19639%0.39CS..Hα-helixtrans-61.1-53.5175.1-177.90000111.3R64 L65 Q70 T71 C72 E100R64-S68 VanDerWaalsContact O-CB 3.31Å; R64-S68 WeakPolarHBondContact O-CB 3.33Å; R64-S68 PolarHBondContact O-N 3.45Å; L65-S68 WeakPolarHBondContact O-CB 3.36Å; L65-S68 PolarHBondContact O-N 2.94Å; S68-Q70 VanDerWaalsContact C-N 3.29Å; S68-Q70 PolarHBondContact O-N 2.91Å; S68-T71 PolarHBondContact O-N 2.98Å; S68-T71 VanDerWaalsContact O-N 3.08Å; S68-C72 PolarHBondContact O-N 2.81Å; S68-C72 PolarHBondContact O-SG 2.63Å; S68-E100 WeakPolarHBondContact CB-OE1 3Å; S68-E100 PolarHBondContact OG-OE1 3.08Å
69I89.4Confident90.2Very high3 Ų374.1 Ų74.12%0.01537%0.365CS..Hα-helixtrans-53.6-46.9175.6-70165.7000110.9L65 T71 C72 R73 E100 I103L65-I69 WeakPolarHBondContact O-CB 3.39Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.35Å; L65-I69 PolarHBondContact O-N 3.12Å; I69-T71 VanDerWaalsContact C-N 3.35Å; I69-T71 PolarHBondContact O-N 3.06Å; I69-C72 PolarHBondContact O-N 3.45Å; I69-R73 HydrophobicContact CG2-CG 4.39Å; I69-R73 WeakPolarHBondContact O-CB 3.37Å; I69-R73 VanDerWaalsContact O-CG 3.26Å; I69-R73 WeakPolarHBondContact O-CG 3.28Å; I69-R73 PolarHBondContact O-N 3.31Å; I69-E100 HydrophobicContact CD1-CB 4.19Å; I69-E100 HydrophobicContact CG1-CB 3.72Å; I69-E100 HydrophobicContact CG1-CG 4.18Å; I69-I103 HydrophobicContact CG2-CD1 3.92Å
70Q90.3Very high90Very high133 Ų13369.2 Ų69.262%0.62134%0.342SS*.Hα-helixtrans-65.2-38.9-179.5-174.1146.412.900112.5L66 S67 S68 R73 T74L66-Q70 WeakPolarHBondContact O-CB 3.23Å; L66-Q70 PolarHBondContact O-N 3.42Å; S67-Q70 PolarHBondContact O-N 2.8Å; S68-Q70 VanDerWaalsContact C-N 3.29Å; S68-Q70 PolarHBondContact O-N 2.91Å; Q70-R73 PolarHBondContact O-N 3.16Å; Q70-T74 WeakPolarHBondContact O-CG2 3.37Å; Q70-T74 PolarHBondContact O-N 3.09Å; Q70-T74 VanDerWaalsContact O-N 3.1Å; Q70-T74 PolarHBondContact O-OG1 2.85Å
71T91.1Very high89.8Confident84 Ų8473.6 Ų73.652%0.51536%0.361SS..Hα-helixtrans-66.1-49.3177.2-52.90000110.3S67 S68 I69 R73 T74 E75S67-T71 WeakPolarHBondContact O-CB 3.14Å; S67-T71 PolarHBondContact O-N 3.37Å; S67-T71 PolarHBondContact O-OG1 3.27Å; S68-T71 PolarHBondContact O-N 2.98Å; S68-T71 VanDerWaalsContact O-N 3.08Å; I69-T71 VanDerWaalsContact C-N 3.35Å; I69-T71 PolarHBondContact O-N 3.06Å; T71-R73 VanDerWaalsContact C-N 3.32Å; T71-R73 PolarHBondContact O-N 3.23Å; T71-T74 PolarHBondContact O-N 2.94Å; T71-T74 PolarHBondContact O-OG1 2.88Å; T71-E75 PolarHBondContact O-N 3.19Å
72C88.8Confident89.6Confident15 Ų1573.1 Ų73.110%0.10136%0.357CS..Hα-helixtrans-61.7-37.3177.5-61.90000112.1S68 I69 E75 M76 I103 V107S68-C72 PolarHBondContact O-N 2.81Å; S68-C72 PolarHBondContact O-SG 2.63Å; I69-C72 PolarHBondContact O-N 3.45Å; C72-E75 PolarHBondContact O-N 3.45Å; C72-M76 VanDerWaalsContact O-CB 3.26Å; C72-M76 WeakPolarHBondContact O-CB 3.45Å; C72-M76 PolarHBondContact O-N 2.94Å; C72-I103 HydrophobicContact CB-CB 4.5Å; C72-I103 HydrophobicContact CB-CG2 3.55Å; C72-V107 HydrophobicContact CB-CG2 4.46Å; C72-V107 WeakPolarHBondContact O-CG2 3.2Å
73R88.3Confident89.6Confident80 Ų8067.9 Ų67.930%0.30233%0.334SS..Hα-helixtrans-61.4-47.6173.1-78.2175.4174.3161.1-4.9112.5I69 Q70 T71 E75 M76 E77 E90 I103I69-R73 HydrophobicContact CG2-CG 4.39Å; I69-R73 WeakPolarHBondContact O-CB 3.37Å; I69-R73 VanDerWaalsContact O-CG 3.26Å; I69-R73 WeakPolarHBondContact O-CG 3.28Å; I69-R73 PolarHBondContact O-N 3.31Å; Q70-R73 PolarHBondContact O-N 3.16Å; T71-R73 VanDerWaalsContact C-N 3.32Å; T71-R73 PolarHBondContact O-N 3.23Å; R73-E75 VanDerWaalsContact C-N 3.28Å; R73-E75 PolarHBondContact O-N 3.08Å; R73-M76 WeakPolarHBondContact O-CB 3.46Å; R73-M76 PolarHBondContact O-N 2.85Å; R73-E77 WeakPolarHBondContact O-CG 3.5Å; R73-E77 PolarHBondContact O-N 2.91Å; R73-E90 IonicContact CZ-OE1 2.86Å; R73-E90 IonicContact CZ-OE2 2.71Å; R73-E90 IonicContact NE-OE1 3.84Å; R73-E90 PolarHBondContact NE-OE1 3.13Å; R73-E90 IonicContact NH2-OE1 2.71Å; R73-E90 PolarHBondContact NH2-OE1 3.1Å; R73-E90 IonicContact NH2-OE2 3.19Å; R73-E90 PolarHBondContact NH2-OE2 2.97Å; R73-I103 HydrophobicContact CG-CD1 3.98Å; R73-I103 HydrophobicContact CG-CG2 4.5Å
74T89.7Confident89.3Confident78 Ų7868 Ų6848%0.47934%0.337SS..Hα-helixtrans-64.4-35.9178.955.40000112.3Q70 T71 K78Q70-T74 WeakPolarHBondContact O-CG2 3.37Å; Q70-T74 PolarHBondContact O-N 3.09Å; Q70-T74 VanDerWaalsContact O-N 3.1Å; Q70-T74 PolarHBondContact O-OG1 2.85Å; T71-T74 PolarHBondContact O-N 2.94Å; T71-T74 PolarHBondContact O-OG1 2.88Å; T74-K78 WeakPolarHBondContact O-CB 3.38Å; T74-K78 PolarHBondContact O-N 3.45Å; T74-K78 VanDerWaalsContact O-N 3.15Å
75E90.3Very high89Confident75 Ų7563 Ų6335%0.3532%0.322SS..Hα-helixtrans-68.2-43.1174.6-176169-156.800111.5T71 C72 R73 K78 L79 V107 M111T71-E75 PolarHBondContact O-N 3.19Å; C72-E75 PolarHBondContact O-N 3.45Å; R73-E75 VanDerWaalsContact C-N 3.28Å; R73-E75 PolarHBondContact O-N 3.08Å; E75-K78 WeakPolarHBondContact O-CB 3.38Å; E75-K78 PolarHBondContact O-N 2.95Å; E75-L79 HydrophobicContact CG-CD1 4.09Å; E75-L79 VanDerWaalsContact O-CG 3.32Å; E75-L79 WeakPolarHBondContact O-CG 3.5Å; E75-L79 PolarHBondContact O-N 2.88Å; E75-V107 HydrophobicContact CG-CG1 4.05Å; E75-M111 WeakPolarHBondContact OE1-CE 3.28Å
76M88.3Confident88.6Confident6 Ų667.4 Ų67.43%0.0335%0.351CS..Hα-helixtrans-60-48.5175.6-168.1173.167.700111.8C72 R73 K78 L79 C80 F88 I103 E106 V107 L110C72-M76 VanDerWaalsContact O-CB 3.26Å; C72-M76 WeakPolarHBondContact O-CB 3.45Å; C72-M76 PolarHBondContact O-N 2.94Å; R73-M76 WeakPolarHBondContact O-CB 3.46Å; R73-M76 PolarHBondContact O-N 2.85Å; M76-K78 VanDerWaalsContact C-N 3.31Å; M76-K78 PolarHBondContact O-N 3.45Å; M76-L79 PolarHBondContact O-N 3.33Å; M76-L79 VanDerWaalsContact O-N 3.17Å; M76-C80 WeakPolarHBondContact O-CB 3.3Å; M76-C80 PolarHBondContact O-N 2.92Å; M76-C80 PolarHBondContact O-SG 2.9Å; M76-C80 VanDerWaalsContact O-SG 3.34Å; M76-F88 HydrophobicContact CE-CB 3.9Å; M76-F88 HydrophobicContact CE-CD1 4.38Å; M76-F88 HydrophobicContact SD-CB 3.77Å; M76-F88 HydrophobicContact SD-CD1 4.45Å; M76-F88 HydrophobicContact SD-CG 4.34Å; M76-I103 HydrophobicContact CE-CG2 4.49Å; M76-I103 HydrophobicContact SD-CG2 4.19Å; M76-E106 HydrophobicContact SD-CB 4.31Å; M76-E106 HydrophobicContact SD-CG 4.1Å; M76-V107 HydrophobicContact CB-CG2 3.63Å; M76-V107 HydrophobicContact CG-CG2 4.14Å; M76-L110 HydrophobicContact CG-CD1 3.89Å
77E87.9Confident88Confident102 Ų10267.4 Ų67.448%0.47736%0.355SS..Hα-helixtrans-58.3-43.5176.8-74.7172.7-170.800111.5R73 C80 L81R73-E77 WeakPolarHBondContact O-CG 3.5Å; R73-E77 PolarHBondContact O-N 2.91Å; E77-C80 PolarHBondContact O-N 3.4Å; E77-L81 VanDerWaalsContact O-CG 3.31Å; E77-L81 WeakPolarHBondContact O-CG 3.42Å; E77-L81 PolarHBondContact O-N 3.24Å
78K89.9Confident87.2Confident129 Ų12967.4 Ų67.456%0.56135%0.346SS*.Hα-helixtrans-61.4-46.3175.3-178.5-177.1170.4-172.90111.5T74 E75 M76 L81 E82T74-K78 WeakPolarHBondContact O-CB 3.38Å; T74-K78 PolarHBondContact O-N 3.45Å; T74-K78 VanDerWaalsContact O-N 3.15Å; E75-K78 WeakPolarHBondContact O-CB 3.38Å; E75-K78 PolarHBondContact O-N 2.95Å; M76-K78 VanDerWaalsContact C-N 3.31Å; M76-K78 PolarHBondContact O-N 3.45Å; K78-L81 PolarHBondContact O-N 2.9Å; K78-E82 WeakPolarHBondContact CE-OE1 3.48Å; K78-E82 IonicContact NZ-OE1 3.76Å; K78-E82 WeakPolarHBondContact O-CG 3.31Å; K78-E82 PolarHBondContact O-N 3.32Å
79L89.8Confident86.3Confident11 Ų1174.4 Ų74.46%0.05838%0.376CS..Hα-helixtrans-65.4-40.2178.8-71.6170000112.1E75 M76 E82 L83 V107 L110 M111E75-L79 HydrophobicContact CG-CD1 4.09Å; E75-L79 VanDerWaalsContact O-CG 3.32Å; E75-L79 WeakPolarHBondContact O-CG 3.5Å; E75-L79 PolarHBondContact O-N 2.88Å; M76-L79 PolarHBondContact O-N 3.33Å; M76-L79 VanDerWaalsContact O-N 3.17Å; L79-E82 PolarHBondContact O-N 3.34Å; L79-L83 VanDerWaalsContact O-CB 3.29Å; L79-L83 WeakPolarHBondContact O-CB 3.46Å; L79-L83 WeakPolarHBondContact O-CG 3.41Å; L79-L83 PolarHBondContact O-N 2.73Å; L79-V107 HydrophobicContact CD1-CG1 4.14Å; L79-L110 HydrophobicContact CB-CB 4.09Å; L79-L110 HydrophobicContact CB-CD1 4.21Å; L79-L110 HydrophobicContact CD1-CB 4.03Å; L79-M111 HydrophobicContact CD1-CG 3.67Å; L79-M111 HydrophobicContact CD2-CG 4.36Å
80C88Confident85.5Confident5 Ų577.4 Ų77.43%0.03439%0.389CS..Hα-helixtrans-60.6-43.4173.9-75.50000111.7M76 E77 Q84 I85 V87M76-C80 WeakPolarHBondContact O-CB 3.3Å; M76-C80 PolarHBondContact O-N 2.92Å; M76-C80 PolarHBondContact O-SG 2.9Å; M76-C80 VanDerWaalsContact O-SG 3.34Å; E77-C80 PolarHBondContact O-N 3.4Å; C80-Q84 WeakPolarHBondContact O-CA 3.46Å; C80-Q84 PolarHBondContact O-N 2.9Å; C80-I85 WeakPolarHBondContact CB-O 3.35Å; C80-I85 PolarHBondContact O-N 3.26Å; C80-V87 HydrophobicContact CB-CG2 4.46Å
81L87.9Confident84.8Confident142 Ų14277.7 Ų77.774%0.74339%0.391SS*.Hα-helixtrans-65.1-44.2175.6-72.1171.9000112.1E77 K78 Q84E77-L81 VanDerWaalsContact O-CG 3.31Å; E77-L81 WeakPolarHBondContact O-CG 3.42Å; E77-L81 PolarHBondContact O-N 3.24Å; K78-L81 PolarHBondContact O-N 2.9Å; L81-Q84 PolarHBondContact O-N 3.42Å
82E87.8Confident83.7Confident56 Ų5681.8 Ų81.826%0.26241%0.41SS..Hα-helixtrans-62.9-42.1176.7-75.5-178.3-163.900112.1K78 L79 R114 V147K78-E82 WeakPolarHBondContact CE-OE1 3.48Å; K78-E82 IonicContact NZ-OE1 3.76Å; K78-E82 WeakPolarHBondContact O-CG 3.31Å; K78-E82 PolarHBondContact O-N 3.32Å; L79-E82 PolarHBondContact O-N 3.34Å; E82-R114 IonicContact OE2-CZ 2.88Å; E82-R114 IonicContact OE2-NE 3.95Å; E82-R114 PolarHBondContact OE2-NE 3.18Å; E82-R114 IonicContact OE2-NH2 3.75Å; E82-V147 HydrophobicContact CB-CG2 4.45Å
83L87.9Confident82.8Confident4 Ų485.2 Ų85.22%0.02145%0.448CS..Hα-helixtrans-84.7-10.2-177.8-70.2167.3000114.1L79 I85 L110 E113 R114 R117 V147L79-L83 VanDerWaalsContact O-CB 3.29Å; L79-L83 WeakPolarHBondContact O-CB 3.46Å; L79-L83 WeakPolarHBondContact O-CG 3.41Å; L79-L83 PolarHBondContact O-N 2.73Å; L83-I85 VanDerWaalsContact C-N 3.31Å; L83-I85 HydrophobicContact CB-CB 4.47Å; L83-I85 HydrophobicContact CB-CD1 3.67Å; L83-I85 HydrophobicContact CB-CG1 3.79Å; L83-I85 HydrophobicContact CD1-CD1 4.05Å; L83-I85 HydrophobicContact CG-CD1 4.41Å; L83-L110 HydrophobicContact CD1-CB 4.09Å; L83-L110 HydrophobicContact CD1-CD2 3.84Å; L83-E113 HydrophobicContact CD1-CG 4.41Å; L83-E113 HydrophobicContact CD2-CG 4.2Å; L83-R114 HydrophobicContact CD1-CB 4.47Å; L83-R114 HydrophobicContact CD2-CB 4.21Å; L83-R117 PolarHBondContact O-NH1 3.29Å; L83-V147 HydrophobicContact CD2-CG1 3.77Å
84Q85.8Confident82.5Confident138 Ų13883.8 Ų83.865%0.64545%0.445SS*.THydrogen-bonded Turntrans58.439.7-173.1-54.8169.822.700112.5C80 L81C80-Q84 WeakPolarHBondContact O-CA 3.46Å; C80-Q84 PolarHBondContact O-N 2.9Å; L81-Q84 PolarHBondContact O-N 3.42Å
85I85.4Confident82.4Confident56 Ų5683.7 Ų83.729%0.28745%0.448SS..  trans-105.1142-179.9-62.1174.7000108.9C80 L83 L110C80-I85 WeakPolarHBondContact CB-O 3.35Å; C80-I85 PolarHBondContact O-N 3.26Å; L83-I85 VanDerWaalsContact C-N 3.31Å; L83-I85 HydrophobicContact CB-CB 4.47Å; L83-I85 HydrophobicContact CB-CD1 3.67Å; L83-I85 HydrophobicContact CB-CG1 3.79Å; L83-I85 HydrophobicContact CD1-CD1 4.05Å; L83-I85 HydrophobicContact CG-CD1 4.41Å; I85-L110 HydrophobicContact CD1-CD2 4Å
86P81.8Confident82.1Confident113 Ų11383.7 Ų83.773%0.73445%0.449SS*.PPolyproline II helixtrans-55.9146173.822.4-33.8000112.1
87V75.6Confident82.1Confident85 Ų8588.7 Ų88.752%0.51548%0.475SS..PPolyproline II helixtrans-66.4136.6179.1-177.70000109.6C80 E89C80-V87 HydrophobicContact CB-CG2 4.46Å; V87-E89 PolarHBondContact O-N 2.99Å
88F75.8Confident82Confident72 Ų7287.6 Ų87.632%0.31647%0.47SS..PPolyproline II helixtrans-59.5128.2176.9177.9-95.5000111.6M76 E90 E106M76-F88 HydrophobicContact CE-CB 3.9Å; M76-F88 HydrophobicContact CE-CD1 4.38Å; M76-F88 HydrophobicContact SD-CB 3.77Å; M76-F88 HydrophobicContact SD-CD1 4.45Å; M76-F88 HydrophobicContact SD-CG 4.34Å; F88-E90 HydrophobicContact CD1-CG 4.33Å; F88-E90 HydrophobicContact CE1-CG 4.35Å; F88-E106 HydrophobicContact CB-CG 4.31Å; F88-E106 HydrophobicContact CD2-CG 3.97Å; F88-E106 HydrophobicContact CG-CG 4.22Å
89E73.6Confident81.9Confident176 Ų17683.2 Ų83.282%0.82245%0.451SS*.PPolyproline II helixtrans-86.1122.9174.5-66.8-173.8170.300110.1V87V87-E89 PolarHBondContact O-N 2.99Å
90E72.1Confident81.7Confident65 Ų6584 Ų8430%0.30446%0.455SS..PPolyproline II helixtrans-77.6138.2178.6-61.9-176.9-175.200111.6R73 F88 D92 Q99R73-E90 IonicContact CZ-OE1 2.86Å; R73-E90 IonicContact CZ-OE2 2.71Å; R73-E90 IonicContact NE-OE1 3.84Å; R73-E90 PolarHBondContact NE-OE1 3.13Å; R73-E90 IonicContact NH2-OE1 2.71Å; R73-E90 PolarHBondContact NH2-OE1 3.1Å; R73-E90 IonicContact NH2-OE2 3.19Å; R73-E90 PolarHBondContact NH2-OE2 2.97Å; F88-E90 HydrophobicContact CD1-CG 4.33Å; F88-E90 HydrophobicContact CE1-CG 4.35Å; E90-D92 PolarHBondContact O-N 3.33Å; E90-Q99 PolarHBondContact OE2-NE2 3.41Å
91E75.3Confident81.8Confident139 Ų13989.7 Ų89.765%0.6548%0.479SS*.PPolyproline II helixtrans-71.4123.5171.7-73.8-176.4166.100111.4I94E91-I94 HydrophobicContact CB-CG2 4.18Å; E91-I94 WeakPolarHBondContact O-CG1 3.37Å
92D67.2Low81.8Confident171 Ų17185.2 Ų85.291%0.91446%0.456SS*.THydrogen-bonded Turntrans-65.9133176.2-77.9-37.5000111.9E90E90-D92 PolarHBondContact O-N 3.33Å
93G70.7Confident81.7Confident87 Ų8782.6 Ų82.690%0.89744%0.443SS*.THydrogen-bonded Turntrans94.96.7170.700000116.5
94I82.3Confident81.8Confident50 Ų5085.6 Ų85.626%0.25646%0.457SS..  trans-79.3156174.463.5178.1000113E91 Q99E91-I94 HydrophobicContact CB-CG2 4.18Å; E91-I94 WeakPolarHBondContact O-CG1 3.37Å; I94-Q99 HydrophobicContact CD1-CB 3.87Å; I94-Q99 HydrophobicContact CD1-CG 4.3Å; I94-Q99 HydrophobicContact CG1-CB 4.12Å
95S87.2Confident81.9Confident75 Ų7582.7 Ų82.752%0.52445%0.449SS..  trans-69.6149.417775.70000112L97 Q98 Q99S95-L97 PolarHBondContact O-N 3.47Å; S95-L97 VanDerWaalsContact O-N 3.16Å; S95-Q98 PolarHBondContact O-N 3.06Å; S95-Q98 WeakPolarHBondContact OG-CB 3.4Å; S95-Q98 PolarHBondContact OG-N 3.15Å; S95-Q99 PolarHBondContact O-N 3.37Å
96M84.8Confident82.1Confident75 Ų7583.2 Ų83.237%0.36945%0.45SS..Hα-helixtrans-53.4-37.7178.9-72.8-175.7-72.500113.2K62 L66 Q99 E100K62-M96 HydrophobicContact CD-CE 4.29Å; K62-M96 HydrophobicContact CG-CE 4.12Å; L66-M96 HydrophobicContact CD2-SD 4.1Å; L66-M96 HydrophobicContact CG-SD 4.5Å; M96-Q99 PolarHBondContact O-N 3.32Å; M96-E100 PolarHBondContact O-N 2.98Å
97L86.9Confident82.5Confident112 Ų11278 Ų7859%0.58642%0.417SS*.Hα-helixtrans-68.7-37.4178.3-168.271.9000112L65 S95 K101L65-L97 HydrophobicContact CD1-CD1 4.44Å; L65-L97 HydrophobicContact CD2-CD1 3.94Å; S95-L97 PolarHBondContact O-N 3.47Å; S95-L97 VanDerWaalsContact O-N 3.16Å; L97-K101 PolarHBondContact O-N 3.39Å
98Q86.9Confident83.3Confident79 Ų7979.8 Ų79.837%0.36942%0.419SS..Hα-helixtrans-72-37.9176.4-171.860.650.900111.4S95 K101 N102S95-Q98 PolarHBondContact O-N 3.06Å; S95-Q98 WeakPolarHBondContact OG-CB 3.4Å; S95-Q98 PolarHBondContact OG-N 3.15Å; Q98-K101 PolarHBondContact O-N 3.08Å; Q98-N102 PolarHBondContact NE2-OD1 3.49Å; Q98-N102 VanDerWaalsContact O-CG 3.24Å; Q98-N102 PolarHBondContact O-N 2.96Å; Q98-N102 PolarHBondContact O-OD1 3.41Å
99Q86.3Confident84Confident36 Ų3678.5 Ų78.517%0.16842%0.422CS..Hα-helixtrans-61-47.5175.3-173.9174.830.100111.7E90 I94 S95 M96 K101 N102 I103E90-Q99 PolarHBondContact OE2-NE2 3.41Å; I94-Q99 HydrophobicContact CD1-CB 3.87Å; I94-Q99 HydrophobicContact CD1-CG 4.3Å; I94-Q99 HydrophobicContact CG1-CB 4.12Å; S95-Q99 PolarHBondContact O-N 3.37Å; M96-Q99 PolarHBondContact O-N 3.32Å; Q99-K101 VanDerWaalsContact C-N 3.34Å; Q99-K101 PolarHBondContact O-N 2.89Å; Q99-N102 PolarHBondContact O-N 2.86Å; Q99-I103 HydrophobicContact CG-CD1 3.91Å; Q99-I103 VanDerWaalsContact O-CG1 3.29Å; Q99-I103 WeakPolarHBondContact O-CG1 3.3Å; Q99-I103 PolarHBondContact O-N 3.25Å
100E87.1Confident84.9Confident29 Ų2970.5 Ų70.514%0.13639%0.385CS..Hα-helixtrans-56.4-49174-175.3-170.6-14900111.3L65 S68 I69 M96 N102 I103 Q104L65-E100 WeakPolarHBondContact CD2-OE2 3.4Å; S68-E100 WeakPolarHBondContact CB-OE1 3Å; S68-E100 PolarHBondContact OG-OE1 3.08Å; I69-E100 HydrophobicContact CD1-CB 4.19Å; I69-E100 HydrophobicContact CG1-CB 3.72Å; I69-E100 HydrophobicContact CG1-CG 4.18Å; M96-E100 PolarHBondContact O-N 2.98Å; E100-N102 VanDerWaalsContact C-N 3.35Å; E100-N102 PolarHBondContact O-N 2.99Å; E100-I103 PolarHBondContact O-N 2.92Å; E100-Q104 HydrophobicContact CG-CG 4.39Å; E100-Q104 WeakPolarHBondContact O-CB 3.26Å; E100-Q104 WeakPolarHBondContact O-CG 3.43Å; E100-Q104 PolarHBondContact O-N 3.24Å; E100-Q104 PolarHBondContact OE1-NE2 2.66Å
101K88.9Confident85.8Confident123 Ų12370.6 Ų70.654%0.53539%0.386SS..Hα-helixtrans-60.3-42.7179.9-173.7179.3178.5-177.50112.6L97 Q98 Q99 T105L97-K101 PolarHBondContact O-N 3.39Å; Q98-K101 PolarHBondContact O-N 3.08Å; Q99-K101 VanDerWaalsContact C-N 3.34Å; Q99-K101 PolarHBondContact O-N 2.89Å; K101-T105 WeakPolarHBondContact O-CB 3.44Å; K101-T105 PolarHBondContact O-N 3.44Å; K101-T105 PolarHBondContact O-OG1 3.41Å
102N87.8Confident86.7Confident48 Ų4868.4 Ų68.426%0.25738%0.382SS..Hα-helixtrans-63.4-49178.7-71.42.7000110.9Q98 Q99 E100 Q104 T105 E106Q98-N102 PolarHBondContact NE2-OD1 3.49Å; Q98-N102 VanDerWaalsContact O-CG 3.24Å; Q98-N102 PolarHBondContact O-N 2.96Å; Q98-N102 PolarHBondContact O-OD1 3.41Å; Q99-N102 PolarHBondContact O-N 2.86Å; E100-N102 VanDerWaalsContact C-N 3.35Å; E100-N102 PolarHBondContact O-N 2.99Å; N102-Q104 PolarHBondContact O-N 3.16Å; N102-T105 PolarHBondContact O-N 2.9Å; N102-E106 PolarHBondContact O-N 2.92Å
103I87.2Confident87.8Confident1 Ų162.3 Ų62.31%0.00535%0.348CS..Hα-helixtrans-64.6-40.6-179.8-61.3165.3000110.5I69 C72 R73 M76 Q99 E100 E106 V107I69-I103 HydrophobicContact CG2-CD1 3.92Å; C72-I103 HydrophobicContact CB-CB 4.5Å; C72-I103 HydrophobicContact CB-CG2 3.55Å; R73-I103 HydrophobicContact CG-CD1 3.98Å; R73-I103 HydrophobicContact CG-CG2 4.5Å; M76-I103 HydrophobicContact CE-CG2 4.49Å; M76-I103 HydrophobicContact SD-CG2 4.19Å; Q99-I103 HydrophobicContact CG-CD1 3.91Å; Q99-I103 VanDerWaalsContact O-CG1 3.29Å; Q99-I103 WeakPolarHBondContact O-CG1 3.3Å; Q99-I103 PolarHBondContact O-N 3.25Å; E100-I103 PolarHBondContact O-N 2.92Å; I103-E106 PolarHBondContact O-N 3.21Å; I103-V107 HydrophobicContact CG2-CG2 4.29Å; I103-V107 WeakPolarHBondContact O-CB 3.27Å; I103-V107 VanDerWaalsContact O-CG2 3.26Å; I103-V107 WeakPolarHBondContact O-CG2 3.42Å; I103-V107 PolarHBondContact O-N 2.83Å
104Q88.4Confident88.9Confident67 Ų6762.2 Ų62.231%0.31332%0.321SS..Hα-helixtrans-60.7-45.3174.9-77.8174.5-5.900112E100 N102 E106 V107 E108E100-Q104 HydrophobicContact CG-CG 4.39Å; E100-Q104 WeakPolarHBondContact O-CB 3.26Å; E100-Q104 WeakPolarHBondContact O-CG 3.43Å; E100-Q104 PolarHBondContact O-N 3.24Å; E100-Q104 PolarHBondContact OE1-NE2 2.66Å; N102-Q104 PolarHBondContact O-N 3.16Å; Q104-E106 VanDerWaalsContact C-N 3.32Å; Q104-E106 PolarHBondContact O-N 2.91Å; Q104-V107 PolarHBondContact O-N 3.35Å; Q104-E108 WeakPolarHBondContact O-CB 3.48Å; Q104-E108 VanDerWaalsContact O-CG 3.32Å; Q104-E108 WeakPolarHBondContact O-CG 3.42Å; Q104-E108 PolarHBondContact O-N 3.22Å
105T89.6Confident89.4Confident78 Ų7863.6 Ų63.648%0.47933%0.329SS..Hα-helixtrans-62.2-40.9178.7-52.50000111.3K101 N102 E108 A109K101-T105 WeakPolarHBondContact O-CB 3.44Å; K101-T105 PolarHBondContact O-N 3.44Å; K101-T105 PolarHBondContact O-OG1 3.41Å; N102-T105 PolarHBondContact O-N 2.9Å; T105-E108 PolarHBondContact O-N 2.87Å; T105-A109 PolarHBondContact O-N 3.46Å
106E88.9Confident89.7Confident66 Ų6664 Ų6431%0.30832%0.319SS..Hα-helixtrans-69.6-42.6178.5-168.361.8-156.600112M76 F88 N102 I103 Q104 E108 A109 L110M76-E106 HydrophobicContact SD-CB 4.31Å; M76-E106 HydrophobicContact SD-CG 4.1Å; F88-E106 HydrophobicContact CB-CG 4.31Å; F88-E106 HydrophobicContact CD2-CG 3.97Å; F88-E106 HydrophobicContact CG-CG 4.22Å; N102-E106 PolarHBondContact O-N 2.92Å; I103-E106 PolarHBondContact O-N 3.21Å; Q104-E106 VanDerWaalsContact C-N 3.32Å; Q104-E106 PolarHBondContact O-N 2.91Å; E106-E108 VanDerWaalsContact C-N 3.32Å; E106-E108 PolarHBondContact O-N 3.45Å; E106-A109 WeakPolarHBondContact O-CB 3.46Å; E106-A109 PolarHBondContact O-N 3.25Å; E106-A109 VanDerWaalsContact O-N 3.16Å; E106-L110 HydrophobicContact CG-CD1 4.39Å; E106-L110 WeakPolarHBondContact O-CG 3.31Å; E106-L110 PolarHBondContact O-N 3.22Å
107V90Very high90.1Very high5 Ų561 Ų613%0.0330%0.303CS..Hα-helixtrans-59.6-43.6174.1166.70000110.9C72 E75 M76 L79 I103 Q104 L110 M111C72-V107 HydrophobicContact CB-CG2 4.46Å; C72-V107 WeakPolarHBondContact O-CG2 3.2Å; E75-V107 HydrophobicContact CG-CG1 4.05Å; M76-V107 HydrophobicContact CB-CG2 3.63Å; M76-V107 HydrophobicContact CG-CG2 4.14Å; L79-V107 HydrophobicContact CD1-CG1 4.14Å; I103-V107 HydrophobicContact CG2-CG2 4.29Å; I103-V107 WeakPolarHBondContact O-CB 3.27Å; I103-V107 VanDerWaalsContact O-CG2 3.26Å; I103-V107 WeakPolarHBondContact O-CG2 3.42Å; I103-V107 PolarHBondContact O-N 2.83Å; Q104-V107 PolarHBondContact O-N 3.35Å; V107-L110 PolarHBondContact O-N 3.36Å; V107-M111 HydrophobicContact CG1-CE 3.38Å; V107-M111 WeakPolarHBondContact O-CB 3.34Å; V107-M111 WeakPolarHBondContact O-CG 3.49Å; V107-M111 PolarHBondContact O-N 2.93Å
108E92.4Very high90.4Very high122 Ų12258 Ų5857%0.5729%0.287SS*.Hα-helixtrans-59.3-45.9173.6-75.3174.4-170.600111.3Q104 T105 E106 M111 T112Q104-E108 WeakPolarHBondContact O-CB 3.48Å; Q104-E108 VanDerWaalsContact O-CG 3.32Å; Q104-E108 WeakPolarHBondContact O-CG 3.42Å; Q104-E108 PolarHBondContact O-N 3.22Å; T105-E108 PolarHBondContact O-N 2.87Å; E106-E108 VanDerWaalsContact C-N 3.32Å; E106-E108 PolarHBondContact O-N 3.45Å; E108-M111 PolarHBondContact O-N 2.9Å; E108-T112 WeakPolarHBondContact O-CG2 3.26Å; E108-T112 PolarHBondContact O-N 2.93Å
109A91.1Very high90.8Very high45 Ų4560.9 Ų60.937%0.37230%0.301SS..Hα-helixtrans-60.5-47.9176.900000112.2T105 E106 M111 T112 E113T105-A109 PolarHBondContact O-N 3.46Å; E106-A109 WeakPolarHBondContact O-CB 3.46Å; E106-A109 PolarHBondContact O-N 3.25Å; E106-A109 VanDerWaalsContact O-N 3.16Å; A109-M111 PolarHBondContact O-N 3.44Å; A109-T112 PolarHBondContact O-N 2.83Å; A109-T112 VanDerWaalsContact O-N 3.17Å; A109-T112 PolarHBondContact O-OG1 3.24Å; A109-E113 PolarHBondContact O-N 2.84Å
110L91.5Very high91.1Very high8 Ų862.3 Ų62.34%0.04231%0.307CS..Hα-helixtrans-63.4-39177.4-68.2172.8000112.2M76 L79 L83 I85 E106 V107 E113 R114M76-L110 HydrophobicContact CG-CD1 3.89Å; L79-L110 HydrophobicContact CB-CB 4.09Å; L79-L110 HydrophobicContact CB-CD1 4.21Å; L79-L110 HydrophobicContact CD1-CB 4.03Å; L83-L110 HydrophobicContact CD1-CB 4.09Å; L83-L110 HydrophobicContact CD1-CD2 3.84Å; I85-L110 HydrophobicContact CD1-CD2 4Å; E106-L110 HydrophobicContact CG-CD1 4.39Å; E106-L110 WeakPolarHBondContact O-CG 3.31Å; E106-L110 PolarHBondContact O-N 3.22Å; V107-L110 PolarHBondContact O-N 3.36Å; L110-E113 PolarHBondContact O-N 3.4Å; L110-R114 WeakPolarHBondContact O-CB 3.43Å; L110-R114 PolarHBondContact O-N 3.3Å
111M91.6Very high91.5Very high66 Ų6661.1 Ų61.133%0.32530%0.302SS..Hα-helixtrans-62.5-41.7173.3-78.2-157.7-119.700112E75 L79 V107 E108 A109 E113 R114 N115E75-M111 WeakPolarHBondContact OE1-CE 3.28Å; L79-M111 HydrophobicContact CD1-CG 3.67Å; L79-M111 HydrophobicContact CD2-CG 4.36Å; V107-M111 HydrophobicContact CG1-CE 3.38Å; V107-M111 WeakPolarHBondContact O-CB 3.34Å; V107-M111 WeakPolarHBondContact O-CG 3.49Å; V107-M111 PolarHBondContact O-N 2.93Å; E108-M111 PolarHBondContact O-N 2.9Å; A109-M111 PolarHBondContact O-N 3.44Å; M111-E113 VanDerWaalsContact C-N 3.33Å; M111-E113 PolarHBondContact O-N 3.49Å; M111-R114 PolarHBondContact O-N 2.98Å; M111-N115 WeakPolarHBondContact O-CB 3.46Å; M111-N115 PolarHBondContact O-N 2.88Å; M111-N115 PolarHBondContact O-ND2 3.35Å
112T93Very high91.7Very high93 Ų9361.7 Ų61.757%0.57130%0.304SS*.Hα-helixtrans-63.2-40.617661.20000111.9E108 A109 N115 R116E108-T112 WeakPolarHBondContact O-CG2 3.26Å; E108-T112 PolarHBondContact O-N 2.93Å; A109-T112 PolarHBondContact O-N 2.83Å; A109-T112 VanDerWaalsContact O-N 3.17Å; A109-T112 PolarHBondContact O-OG1 3.24Å; T112-N115 PolarHBondContact O-N 2.95Å; T112-R116 WeakPolarHBondContact O-CB 3.36Å; T112-R116 PolarHBondContact O-N 2.82Å
113E91.9Very high92Very high43 Ų4361.6 Ų61.620%0.20131%0.31CS..Hα-helixtrans-66.2-44176.9176.159-166.400112.2L83 A109 L110 M111 N115 R116 R117L83-E113 HydrophobicContact CD1-CG 4.41Å; L83-E113 HydrophobicContact CD2-CG 4.2Å; A109-E113 PolarHBondContact O-N 2.84Å; L110-E113 PolarHBondContact O-N 3.4Å; M111-E113 VanDerWaalsContact C-N 3.33Å; M111-E113 PolarHBondContact O-N 3.49Å; E113-N115 VanDerWaalsContact C-N 3.35Å; E113-N115 PolarHBondContact O-N 3.46Å; E113-R116 VanDerWaalsContact CD-NH2 3.29Å; E113-R116 WeakPolarHBondContact O-CB 3.39Å; E113-R116 PolarHBondContact O-N 3.08Å; E113-R116 IonicContact OE1-CZ 2.8Å; E113-R116 IonicContact OE1-NE 3.34Å; E113-R116 IonicContact OE1-NH2 2.69Å; E113-R116 PolarHBondContact OE1-NH2 3.49Å; E113-R116 IonicContact OE2-CZ 3.56Å; E113-R116 IonicContact OE2-NE 2.73Å; E113-R116 PolarHBondContact OE2-NE 2.93Å; E113-R116 IonicContact OE2-NH2 3.8Å; E113-R116 PolarHBondContact OE2-NH2 3.43Å; E113-R116 VanDerWaalsContact OE2-NH2 3.15Å; E113-R117 WeakPolarHBondContact O-CG 3.47Å; E113-R117 PolarHBondContact O-N 3.26Å; E113-R117 IonicContact OE1-CZ 2.73Å; E113-R117 IonicContact OE1-NE 3.77Å; E113-R117 PolarHBondContact OE1-NE 2.76Å; E113-R117 IonicContact OE1-NH2 3.5Å; E113-R117 PolarHBondContact OE1-NH2 3.24Å
114R92.9Very high92.3Very high86 Ų8662.1 Ų62.133%0.32531%0.313SS..Hα-helixtrans-55.5-50172.5178.3-174.9-175.9-90.8-2.2111.4E82 L83 L110 M111 R116 R117 M118 V147E82-R114 IonicContact OE2-CZ 2.88Å; E82-R114 IonicContact OE2-NE 3.95Å; E82-R114 PolarHBondContact OE2-NE 3.18Å; E82-R114 IonicContact OE2-NH2 3.75Å; L83-R114 HydrophobicContact CD1-CB 4.47Å; L83-R114 HydrophobicContact CD2-CB 4.21Å; L110-R114 WeakPolarHBondContact O-CB 3.43Å; L110-R114 PolarHBondContact O-N 3.3Å; M111-R114 PolarHBondContact O-N 2.98Å; R114-R116 VanDerWaalsContact C-N 3.3Å; R114-R116 PolarHBondContact O-N 2.83Å; R114-R117 PolarHBondContact O-N 3.29Å; R114-M118 WeakPolarHBondContact O-CG 3.32Å; R114-M118 PolarHBondContact O-N 3.37Å; R114-V147 HydrophobicContact CG-CG2 3.9Å
115N93Very high92.6Very high78 Ų7861 Ų6142%0.41731%0.309SS..Hα-helixtrans-62.9-39.3179.3-69-23000111.3M111 T112 E113 M118 Q119M111-N115 WeakPolarHBondContact O-CB 3.46Å; M111-N115 PolarHBondContact O-N 2.88Å; M111-N115 PolarHBondContact O-ND2 3.35Å; T112-N115 PolarHBondContact O-N 2.95Å; E113-N115 VanDerWaalsContact C-N 3.35Å; E113-N115 PolarHBondContact O-N 3.46Å; N115-M118 PolarHBondContact O-N 3.03Å; N115-Q119 WeakPolarHBondContact O-CB 3.48Å; N115-Q119 VanDerWaalsContact O-CG 3.24Å; N115-Q119 WeakPolarHBondContact O-CG 3.38Å; N115-Q119 PolarHBondContact O-N 3.3Å
116R93.9Very high92.8Very high85 Ų8561.4 Ų61.432%0.32131%0.308SS..Hα-helixtrans-61-49.2175.1-170.5-169.669.272.62.6111.8T112 E113 R114 M118 Q119 Q120T112-R116 WeakPolarHBondContact O-CB 3.36Å; T112-R116 PolarHBondContact O-N 2.82Å; E113-R116 VanDerWaalsContact CD-NH2 3.29Å; E113-R116 WeakPolarHBondContact O-CB 3.39Å; E113-R116 PolarHBondContact O-N 3.08Å; E113-R116 IonicContact OE1-CZ 2.8Å; E113-R116 IonicContact OE1-NE 3.34Å; E113-R116 IonicContact OE1-NH2 2.69Å; E113-R116 PolarHBondContact OE1-NH2 3.49Å; E113-R116 IonicContact OE2-CZ 3.56Å; E113-R116 IonicContact OE2-NE 2.73Å; E113-R116 PolarHBondContact OE2-NE 2.93Å; E113-R116 IonicContact OE2-NH2 3.8Å; E113-R116 PolarHBondContact OE2-NH2 3.43Å; E113-R116 VanDerWaalsContact OE2-NH2 3.15Å; R114-R116 VanDerWaalsContact C-N 3.3Å; R114-R116 PolarHBondContact O-N 2.83Å; R116-M118 PolarHBondContact O-N 2.73Å; R116-Q119 PolarHBondContact O-N 3.19Å; R116-Q120 WeakPolarHBondContact O-CG 3.38Å; R116-Q120 PolarHBondContact O-N 2.85Å
117R93.1Very high93.1Very high11 Ų1162.6 Ų62.64%0.04231%0.313CS..Hα-helixtrans-63-41.3178.6-68.5-170.5-167.1177.76112.3L83 E113 R114 Q120 L121 V147 P148 L153L83-R117 PolarHBondContact O-NH1 3.29Å; E113-R117 WeakPolarHBondContact O-CG 3.47Å; E113-R117 PolarHBondContact O-N 3.26Å; E113-R117 IonicContact OE1-CZ 2.73Å; E113-R117 IonicContact OE1-NE 3.77Å; E113-R117 PolarHBondContact OE1-NE 2.76Å; E113-R117 IonicContact OE1-NH2 3.5Å; E113-R117 PolarHBondContact OE1-NH2 3.24Å; R114-R117 PolarHBondContact O-N 3.29Å; R117-Q120 PolarHBondContact O-N 3.1Å; R117-L121 WeakPolarHBondContact O-CB 3.36Å; R117-L121 PolarHBondContact O-N 3.41Å; R117-V147 HydrophobicContact CB-CG1 4.37Å; R117-P148 HydrophobicContact CB-CG 4.36Å; R117-P148 WeakPolarHBondContact CD-O 3.33Å; R117-P148 PolarHBondContact NH1-O 3.15Å; R117-L153 HydrophobicContact CB-CD1 4.14Å; R117-L153 HydrophobicContact CG-CD1 4.02Å
118M93.4Very high93.3Very high50 Ų5062.5 Ų62.525%0.24631%0.313CS..Hα-helixtrans-66.3-39.9176.8-70.7-60.5-65.100112.4R114 N115 R116 L121 K122 V147R114-M118 WeakPolarHBondContact O-CG 3.32Å; R114-M118 PolarHBondContact O-N 3.37Å; N115-M118 PolarHBondContact O-N 3.03Å; R116-M118 PolarHBondContact O-N 2.73Å; M118-L121 PolarHBondContact O-N 2.89Å; M118-K122 WeakPolarHBondContact O-CB 3.24Å; M118-K122 PolarHBondContact O-N 3.31Å; M118-V147 HydrophobicContact CG-CG2 4.34Å; M118-V147 HydrophobicContact SD-CB 4.4Å; M118-V147 HydrophobicContact SD-CG2 4.03Å
119Q93.9Very high93.3Very high139 Ų13961 Ų6165%0.6531%0.305SS*.Hα-helixtrans-64.4-41.4174.1-75.8173.4-0.200111.8N115 R116 K122 A123N115-Q119 WeakPolarHBondContact O-CB 3.48Å; N115-Q119 VanDerWaalsContact O-CG 3.24Å; N115-Q119 WeakPolarHBondContact O-CG 3.38Å; N115-Q119 PolarHBondContact O-N 3.3Å; R116-Q119 PolarHBondContact O-N 3.19Å; Q119-K122 PolarHBondContact O-N 3.49Å; Q119-A123 PolarHBondContact O-N 2.97Å
120Q94Very high93.4Very high66 Ų6663.9 Ų63.931%0.30832%0.315SS..Hα-helixtrans-62.7-45.2174.4-75.2-176.7-2600111.8R116 R117 K122 A123 L124 L153R116-Q120 WeakPolarHBondContact O-CG 3.38Å; R116-Q120 PolarHBondContact O-N 2.85Å; R117-Q120 PolarHBondContact O-N 3.1Å; Q120-K122 VanDerWaalsContact C-N 3.33Å; Q120-K122 PolarHBondContact O-N 3.22Å; Q120-A123 PolarHBondContact O-N 2.92Å; Q120-L124 WeakPolarHBondContact O-CG 3.4Å; Q120-L124 PolarHBondContact O-N 3.38Å; Q120-L153 HydrophobicContact CB-CD2 4.36Å
121L93.9Very high93.5Very high4 Ų463.9 Ų63.92%0.02132%0.315CS..Hα-helixtrans-57.9-47.2175.7178.958.7000111.4R117 M118 A123 L124 L125 V142 P148 L153 F156R117-L121 WeakPolarHBondContact O-CB 3.36Å; R117-L121 PolarHBondContact O-N 3.41Å; M118-L121 PolarHBondContact O-N 2.89Å; L121-A123 PolarHBondContact O-N 2.99Å; L121-L124 PolarHBondContact O-N 3.31Å; L121-L125 HydrophobicContact CD1-CD1 4.21Å; L121-L125 HydrophobicContact CD1-CG 4.16Å; L121-L125 HydrophobicContact CG-CD1 4Å; L121-L125 HydrophobicContact CG-CG 4.4Å; L121-L125 WeakPolarHBondContact O-CG 3.37Å; L121-L125 PolarHBondContact O-N 2.78Å; L121-V142 HydrophobicContact CD1-CG1 3.81Å; L121-V142 HydrophobicContact CD2-CG1 4.48Å; L121-P148 HydrophobicContact CB-CG 4.13Å; L121-P148 HydrophobicContact CD2-CG 4.18Å; L121-L153 HydrophobicContact CB-CD2 4.33Å; L121-F156 HydrophobicContact CD1-CD1 4.18Å; L121-F156 HydrophobicContact CD1-CE1 4.16Å
122K93.4Very high93.5Very high135 Ų13561 Ų6159%0.58730%0.301SS*.Hα-helixtrans-58-48177.7-174.8-178.8176.8-176.30111.6M118 Q119 Q120 L124 L125 D126M118-K122 WeakPolarHBondContact O-CB 3.24Å; M118-K122 PolarHBondContact O-N 3.31Å; Q119-K122 PolarHBondContact O-N 3.49Å; Q120-K122 VanDerWaalsContact C-N 3.33Å; Q120-K122 PolarHBondContact O-N 3.22Å; K122-L124 VanDerWaalsContact C-N 3.29Å; K122-L124 PolarHBondContact O-N 3.25Å; K122-L125 PolarHBondContact O-N 2.9Å; K122-D126 VanDerWaalsContact O-CG 3.26Å; K122-D126 PolarHBondContact O-N 2.9Å
123A94.3Very high93.4Very high45 Ų4561.1 Ų61.137%0.37230%0.298SS..Hα-helixtrans-61.7-36.8178.500000112.6Q119 Q120 L121 Q127Q119-A123 PolarHBondContact O-N 2.97Å; Q120-A123 PolarHBondContact O-N 2.92Å; L121-A123 PolarHBondContact O-N 2.99Å; A123-Q127 VanDerWaalsContact O-CG 3.28Å; A123-Q127 WeakPolarHBondContact O-CG 3.43Å; A123-Q127 PolarHBondContact O-N 2.76Å; A123-Q127 VanDerWaalsContact O-N 3.12Å
124L95.1Very high93.4Very high13 Ų1360.7 Ų60.77%0.06830%0.299CS..Hα-helixtrans-70.7-38.7175.8-67.8169.7000112.2Q120 L121 K122 Q127 D128 L153 F156 Q157 I160Q120-L124 WeakPolarHBondContact O-CG 3.4Å; Q120-L124 PolarHBondContact O-N 3.38Å; L121-L124 PolarHBondContact O-N 3.31Å; K122-L124 VanDerWaalsContact C-N 3.29Å; K122-L124 PolarHBondContact O-N 3.25Å; L124-Q127 PolarHBondContact O-N 3Å; L124-D128 WeakPolarHBondContact O-CB 3.34Å; L124-D128 PolarHBondContact O-N 3.34Å; L124-L153 HydrophobicContact CD1-CD2 3.97Å; L124-F156 HydrophobicContact CB-CD1 3.61Å; L124-F156 HydrophobicContact CB-CE1 3.46Å; L124-F156 VanDerWaalsContact CB-CE1 3.46Å; L124-F156 HydrophobicContact CB-CG 4.29Å; L124-F156 HydrophobicContact CB-CZ 4.02Å; L124-F156 HydrophobicContact CD1-CB 4.34Å; L124-F156 HydrophobicContact CD1-CD1 3.92Å; L124-F156 HydrophobicContact CD1-CG 4.29Å; L124-F156 HydrophobicContact CG-CD1 4.38Å; L124-Q157 HydrophobicContact CD1-CG 3.9Å; L124-Q157 HydrophobicContact CD2-CG 3.76Å; L124-Q157 HydrophobicContact CG-CG 4.47Å; L124-I160 HydrophobicContact CD2-CG1 4.2Å
125L94.1Very high93.4Very high44 Ų4456.9 Ų56.923%0.2329%0.285CS..Hα-helixtrans-64.2-43.1174.7-72.7171000111.9L121 K122 Q127 D128 Q129 A144 F156L121-L125 HydrophobicContact CD1-CD1 4.21Å; L121-L125 HydrophobicContact CD1-CG 4.16Å; L121-L125 HydrophobicContact CG-CD1 4Å; L121-L125 HydrophobicContact CG-CG 4.4Å; L121-L125 WeakPolarHBondContact O-CG 3.37Å; L121-L125 PolarHBondContact O-N 2.78Å; K122-L125 PolarHBondContact O-N 2.9Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.48Å; L125-D128 PolarHBondContact O-N 3.14Å; L125-Q129 WeakPolarHBondContact O-CB 3.43Å; L125-Q129 PolarHBondContact O-N 2.8Å; L125-A144 HydrophobicContact CD1-CB 4.08Å; L125-F156 HydrophobicContact CD2-CE1 3.93Å; L125-F156 HydrophobicContact CD2-CZ 4.07Å; L125-F156 HydrophobicContact CG-CE1 4.12Å
126D93.3Very high93.3Very high86 Ų8656.9 Ų56.946%0.4629%0.29SS..Hα-helixtrans-61.3-44.2176.4-65.7-21.5000110.1K122 Q129 D130K122-D126 VanDerWaalsContact O-CG 3.26Å; K122-D126 PolarHBondContact O-N 2.9Å; D126-Q129 PolarHBondContact O-N 3.01Å; D126-D130 PolarHBondContact O-N 3.4Å; D126-D130 VanDerWaalsContact O-N 3.11Å
127Q94.9Very high93.1Very high90 Ų9054.6 Ų54.642%0.42129%0.287SS..Hα-helixtrans-64.7-39.9175.1-73.4174.921.600113.4A123 L124 L125 Q129 D130 L131 I160A123-Q127 VanDerWaalsContact O-CG 3.28Å; A123-Q127 WeakPolarHBondContact O-CG 3.43Å; A123-Q127 PolarHBondContact O-N 2.76Å; A123-Q127 VanDerWaalsContact O-N 3.12Å; L124-Q127 PolarHBondContact O-N 3Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.48Å; Q127-Q129 VanDerWaalsContact C-N 3.33Å; Q127-D130 PolarHBondContact O-N 2.88Å; Q127-L131 WeakPolarHBondContact O-CB 3.31Å; Q127-L131 VanDerWaalsContact O-CG 3.27Å; Q127-L131 WeakPolarHBondContact O-CG 3.39Å; Q127-L131 PolarHBondContact O-N 3.08Å; Q127-I160 HydrophobicContact CB-CD1 4.37Å
128D94.4Very high92.9Very high3 Ų362 Ų622%0.01632%0.324CS..Hα-helixtrans-63-41.8177.2-167.464.4000111.3L124 L125 L131 C132 P139 Y140 F156 H159 I160L124-D128 WeakPolarHBondContact O-CB 3.34Å; L124-D128 PolarHBondContact O-N 3.34Å; L125-D128 PolarHBondContact O-N 3.14Å; D128-L131 PolarHBondContact O-N 2.91Å; D128-C132 VanDerWaalsContact O-CB 3.32Å; D128-C132 WeakPolarHBondContact O-CB 3.28Å; D128-C132 PolarHBondContact O-N 2.92Å; D128-C132 PolarHBondContact O-SG 3.06Å; D128-P139 VanDerWaalsContact OD2-CA 3.3Å; D128-P139 WeakPolarHBondContact OD2-CA 3.44Å; D128-Y140 PolarHBondContact OD2-N 2.78Å; D128-F156 HydrophobicContact CB-CE2 3.89Å; D128-F156 HydrophobicContact CB-CZ 3.73Å; D128-H159 IonicContact OD1-CD2 3.73Å; D128-H159 IonicContact OD1-NE2 2.68Å; D128-I160 HydrophobicContact CB-CD1 3.74Å
129Q93.2Very high92.7Very high90 Ų9062.9 Ų62.942%0.42133%0.334SS..Hα-helixtrans-62.8-48.3177.5-173.261.254.600111L125 D126 Q127 L131 C132 D133L125-Q129 WeakPolarHBondContact O-CB 3.43Å; L125-Q129 PolarHBondContact O-N 2.8Å; D126-Q129 PolarHBondContact O-N 3.01Å; Q127-Q129 VanDerWaalsContact C-N 3.33Å; Q129-L131 VanDerWaalsContact C-N 3.27Å; Q129-L131 PolarHBondContact O-N 3.13Å; Q129-C132 PolarHBondContact O-N 2.95Å; Q129-C132 VanDerWaalsContact O-N 3.15Å; Q129-D133 PolarHBondContact NE2-OD1 3.15Å; Q129-D133 VanDerWaalsContact O-CG 3.27Å; Q129-D133 PolarHBondContact O-N 2.88Å
130D92.1Very high92.4Very high107 Ų10760.2 Ų60.257%0.57232%0.318SS*.Hα-helixtrans-58.2-40.3176.7-69.8-18.9000111.7D126 Q127 V134D126-D130 PolarHBondContact O-N 3.4Å; D126-D130 VanDerWaalsContact O-N 3.11Å; Q127-D130 PolarHBondContact O-N 2.88Å; D130-V134 WeakPolarHBondContact O-CG2 3.24Å; D130-V134 PolarHBondContact O-N 2.79Å
131L93.6Very high91.7Very high7 Ų761 Ų614%0.03735%0.345CS..Hα-helixtrans-69.3-40.9176.8-73168000112.1Q127 D128 Q129 V134 L135 I160 Q163 K167Q127-L131 WeakPolarHBondContact O-CB 3.31Å; Q127-L131 VanDerWaalsContact O-CG 3.27Å; Q127-L131 WeakPolarHBondContact O-CG 3.39Å; Q127-L131 PolarHBondContact O-N 3.08Å; D128-L131 PolarHBondContact O-N 2.91Å; Q129-L131 VanDerWaalsContact C-N 3.27Å; Q129-L131 PolarHBondContact O-N 3.13Å; L131-V134 PolarHBondContact O-N 3.07Å; L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.44Å; L131-L135 WeakPolarHBondContact O-CG 3.34Å; L131-L135 PolarHBondContact O-N 2.95Å; L131-I160 HydrophobicContact CD1-CD1 3.98Å; L131-I160 HydrophobicContact CD1-CG2 4.08Å; L131-Q163 HydrophobicContact CD1-CB 3.9Å; L131-K167 HydrophobicContact CD2-CB 4.41Å; L131-K167 HydrophobicContact CD2-CD 3.79Å
132C92.6Very high91.1Very high6 Ų663 Ų634%0.04136%0.357CS..Hα-helixtrans-66.4-37.6178.2-73.20000112.4D128 Q129 V134 C136 S137D128-C132 VanDerWaalsContact O-CB 3.32Å; D128-C132 WeakPolarHBondContact O-CB 3.28Å; D128-C132 PolarHBondContact O-N 2.92Å; D128-C132 PolarHBondContact O-SG 3.06Å; Q129-C132 PolarHBondContact O-N 2.95Å; Q129-C132 VanDerWaalsContact O-N 3.15Å; C132-V134 VanDerWaalsContact C-N 3.34Å; C132-V134 PolarHBondContact O-N 3.42Å; C132-C136 WeakPolarHBondContact O-CA 3.46Å; C132-C136 PolarHBondContact O-N 3.27Å; C132-S137 WeakPolarHBondContact CB-O 3.46Å; C132-S137 PolarHBondContact O-N 3.24Å; C132-S137 PolarHBondContact SG-OG 3.47Å; C132-S137 VanDerWaalsContact SG-OG 3.37Å
133D90.7Very high90.6Very high95 Ų9559.5 Ų59.551%0.50835%0.353SS..Hα-helixtrans-62.6-42.8176.5-70.4-16.5000110.9Q129Q129-D133 PolarHBondContact NE2-OD1 3.15Å; Q129-D133 VanDerWaalsContact O-CG 3.27Å; Q129-D133 PolarHBondContact O-N 2.88Å
134V91.7Very high89.9Confident35 Ų3560 Ų6021%0.21236%0.357CS..Hα-helixtrans-75.2-45.8179.71760000112.6D130 L131 C132 C136 K167 L210D130-V134 WeakPolarHBondContact O-CG2 3.24Å; D130-V134 PolarHBondContact O-N 2.79Å; L131-V134 PolarHBondContact O-N 3.07Å; C132-V134 VanDerWaalsContact C-N 3.34Å; C132-V134 PolarHBondContact O-N 3.42Å; V134-C136 VanDerWaalsContact C-N 3.32Å; V134-K167 HydrophobicContact CG1-CD 4.39Å; V134-L210 HydrophobicContact CG1-CB 4.26Å; V134-L210 HydrophobicContact CG1-CD1 3.94Å; V134-L210 HydrophobicContact CG1-CG 4.14Å; V134-L210 PolarHBondContact O-N 3.28Å
135L92.9Very high89.2Confident5 Ų566.8 Ų66.83%0.02639%0.393CS..Hα-helixtrans-83.7-10-176.3-66.9175.1000113.4L131 S137 Q163 E166 K167 R170 L210L131-L135 VanDerWaalsContact O-CB 3.28Å; L131-L135 WeakPolarHBondContact O-CB 3.44Å; L131-L135 WeakPolarHBondContact O-CG 3.34Å; L131-L135 PolarHBondContact O-N 2.95Å; L135-S137 PolarHBondContact O-N 2.9Å; L135-Q163 HydrophobicContact CD1-CB 4.34Å; L135-E166 HydrophobicContact CD2-CG 4.48Å; L135-K167 HydrophobicContact CD1-CB 4.36Å; L135-K167 HydrophobicContact CD2-CB 4.15Å; L135-K167 HydrophobicContact CG-CB 4.47Å; L135-R170 PolarHBondContact O-NH1 3.13Å; L135-L210 HydrophobicContact CD2-CB 4.27Å
136C91.3Very high88.8Confident78 Ų7868.5 Ų68.553%0.52741%0.408SS..THydrogen-bonded Turntrans51.842.8-169.4-53.70000112.1C132 V134C132-C136 WeakPolarHBondContact O-CA 3.46Å; C132-C136 PolarHBondContact O-N 3.27Å; V134-C136 VanDerWaalsContact C-N 3.32Å
137S90.3Very high88.5Confident37 Ų3765.3 Ų65.326%0.25939%0.391SS..PPolyproline II helixtrans-97164.5177.753.20000112.1C132 L135C132-S137 WeakPolarHBondContact CB-O 3.46Å; C132-S137 PolarHBondContact O-N 3.24Å; C132-S137 PolarHBondContact SG-OG 3.47Å; C132-S137 VanDerWaalsContact SG-OG 3.37Å; L135-S137 PolarHBondContact O-N 2.9Å
138M88.2Confident88.2Confident166 Ų16661.2 Ų61.282%0.81837%0.373SS*.PPolyproline II helixtrans-78.4135.3174.3-69.3-63.6-61.600110.3
139P89.4Confident88Confident70 Ų7061.9 Ų61.946%0.45538%0.378SS..PPolyproline II helixtrans-58.4152.5176.4-25.433.9000113.5D128 G141D128-P139 VanDerWaalsContact OD2-CA 3.3Å; D128-P139 WeakPolarHBondContact OD2-CA 3.44Å; P139-G141 PolarHBondContact O-N 3.32Å
140Y86.5Confident87.8Confident82 Ų8262.2 Ų62.232%0.32238%0.382SS..PPolyproline II helixtrans-68.7124.6176.8-164.9-104.7000110.6D128 V142 F156 H159D128-Y140 PolarHBondContact OD2-N 2.78Å; Y140-V142 VanDerWaalsContact C-N 3.3Å; Y140-V142 HydrophobicContact CD1-CB 4.42Å; Y140-V142 HydrophobicContact CD1-CG2 3.31Å; Y140-V142 HydrophobicContact CE1-CG2 3.37Å; Y140-V142 PolarHBondContact O-N 3.07Å; Y140-F156 HydrophobicContact CD1-CB 4.29Å; Y140-F156 HydrophobicContact CD1-CD1 4.26Å; Y140-F156 AromaticContact CD1-CD2 3.43Å; Y140-F156 HydrophobicContact CD1-CD2 3.43Å; Y140-F156 VanDerWaalsContact CD1-CD2 3.43Å; Y140-F156 HydrophobicContact CD1-CE1 4.47Å; Y140-F156 AromaticContact CD1-CE2 3.71Å; Y140-F156 HydrophobicContact CD1-CE2 3.71Å; Y140-F156 AromaticContact CD1-CG 3.75Å; Y140-F156 HydrophobicContact CD1-CG 3.75Å; Y140-F156 HydrophobicContact CD1-CZ 4.22Å; Y140-F156 HydrophobicContact CD2-CD2 4.47Å; Y140-F156 HydrophobicContact CE1-CB 4.03Å; Y140-F156 AromaticContact CE1-CD2 3.99Å; Y140-F156 HydrophobicContact CE1-CD2 3.99Å; Y140-F156 HydrophobicContact CE1-CG 4.02Å; Y140-F156 AromaticContact CG-CD2 3.75Å; Y140-F156 HydrophobicContact CG-CD2 3.75Å; Y140-F156 AromaticContact CG-CE2 3.75Å; Y140-F156 HydrophobicContact CG-CE2 3.75Å; Y140-F156 HydrophobicContact CG-CZ 4.49Å; Y140-H159 HydrophobicContact CD2-CB 4.23Å; Y140-H159 AromaticContact CD2-CD2 3.63Å; Y140-H159 AromaticContact CD2-CG 3.71Å; Y140-H159 AromaticContact CD2-NE2 3.91Å; Y140-H159 HydrophobicContact CE2-CB 4.16Å
141G80.4Confident87.7Confident84 Ų8463.4 Ų63.487%0.86638%0.384SS*.  trans-75.764.1-168.600000115.5P139P139-G141 PolarHBondContact O-N 3.32Å
142V82.1Confident87.6Confident46 Ų4667.8 Ų67.828%0.27940%0.404SS..  trans-109.1138.1178177.50000111.3L121 Y140 A144L121-V142 HydrophobicContact CD1-CG1 3.81Å; L121-V142 HydrophobicContact CD2-CG1 4.48Å; Y140-V142 VanDerWaalsContact C-N 3.3Å; Y140-V142 HydrophobicContact CD1-CB 4.42Å; Y140-V142 HydrophobicContact CD1-CG2 3.31Å; Y140-V142 HydrophobicContact CE1-CG2 3.37Å; Y140-V142 PolarHBondContact O-N 3.07Å; V142-A144 PolarHBondContact O-N 3Å
143A81.4Confident87.6Confident60 Ų6067.8 Ų67.850%0.49640%0.404SS..  trans-72.8114.4175.600000110.7D145 C146A143-D145 PolarHBondContact O-N 3.35Å; A143-C146 HydrophobicContact CB-CB 4.38Å; A143-C146 PolarHBondContact O-N 3.36Å
144A79.4Confident87.7Confident56 Ų5668.4 Ų68.446%0.46340%0.404SS..THydrogen-bonded Turntrans-62.8-23.3-176.500000114.3L125 V142L125-A144 HydrophobicContact CD1-CB 4.08Å; V142-A144 PolarHBondContact O-N 3Å
145D81.7Confident87.8Confident156 Ų15669.8 Ų69.883%0.83441%0.41SS*.THydrogen-bonded Turntrans-93.4-7.3-173.3-61.2-34000113.9A143A143-D145 PolarHBondContact O-N 3.35Å
146C84Confident87.9Confident79 Ų7969.6 Ų69.653%0.53441%0.409SS..SBendtrans-102.4140.4-176.4-65.10000111.6A143 P148A143-C146 HydrophobicContact CB-CB 4.38Å; A143-C146 PolarHBondContact O-N 3.36Å; C146-P148 WeakPolarHBondContact O-CD 3.36Å
147V88.3Confident88Confident19 Ų1970 Ų7012%0.11540%0.403CS..PPolyproline II helixtrans-68.6119.3174.2-175.10000108.5E82 L83 R114 R117 M118E82-V147 HydrophobicContact CB-CG2 4.45Å; L83-V147 HydrophobicContact CD2-CG1 3.77Å; R114-V147 HydrophobicContact CG-CG2 3.9Å; R117-V147 HydrophobicContact CB-CG1 4.37Å; M118-V147 HydrophobicContact CG-CG2 4.34Å; M118-V147 HydrophobicContact SD-CB 4.4Å; M118-V147 HydrophobicContact SD-CG2 4.03Å
148P89.1Confident88.3Confident5 Ų573.2 Ų73.23%0.03241%0.414CS..PPolyproline II helixtrans-77.1151.7-176.732-35.8000111.4R117 L121 C146 Q152 L153R117-P148 HydrophobicContact CB-CG 4.36Å; R117-P148 WeakPolarHBondContact CD-O 3.33Å; R117-P148 PolarHBondContact NH1-O 3.15Å; L121-P148 HydrophobicContact CB-CG 4.13Å; L121-P148 HydrophobicContact CD2-CG 4.18Å; C146-P148 WeakPolarHBondContact O-CD 3.36Å; P148-Q152 HydrophobicContact CB-CB 4.26Å; P148-L153 HydrophobicContact CB-CD2 4.16Å; P148-L153 HydrophobicContact CB-CG 3.98Å; P148-L153 HydrophobicContact CG-CD1 3.99Å; P148-L153 HydrophobicContact CG-CD2 3.62Å; P148-L153 HydrophobicContact CG-CG 3.68Å
149S89.4Confident88.6Confident17 Ų1767.1 Ų67.112%0.11938%0.383CS..PPolyproline II helixtrans-70.816216678.70000110.6E151 Q152 L153S149-E151 VanDerWaalsContact C-N 3.28Å; S149-E151 PolarHBondContact O-N 3.41Å; S149-Q152 PolarHBondContact O-N 3.48Å; S149-Q152 WeakPolarHBondContact OG-CG 3.38Å; S149-Q152 PolarHBondContact OG-N 2.93Å; S149-Q152 VanDerWaalsContact OG-N 3.13Å; S149-L153 PolarHBondContact O-N 2.81Å; S149-L153 VanDerWaalsContact O-N 3.08Å
150L89.3Confident88.8Confident96 Ų9664 Ų6450%0.50336%0.363SS..Hα-helixtrans-62.4-37.8176.5-66.4176.4000111.9L153 E154L150-L153 PolarHBondContact O-N 3.23Å; L150-E154 WeakPolarHBondContact O-CB 3.29Å; L150-E154 PolarHBondContact O-N 3.06Å
151E90.3Very high89.3Confident132 Ų13264 Ų6462%0.61737%0.371SS*.Hα-helixtrans-66.2-39.3176.6-173.6-177177.800111.8S149 E154 N155S149-E151 VanDerWaalsContact C-N 3.28Å; S149-E151 PolarHBondContact O-N 3.41Å; E151-E154 PolarHBondContact O-N 3.39Å; E151-N155 WeakPolarHBondContact O-CB 3.42Å; E151-N155 VanDerWaalsContact O-CG 3.24Å; E151-N155 PolarHBondContact O-N 3.14Å; E151-N155 PolarHBondContact O-ND2 3.33Å
152Q90.7Very high90Very high100 Ų10065.9 Ų65.947%0.46736%0.357SS..Hα-helixtrans-63.1-42174.6-75.2172.8-31.500111.8P148 S149 F156P148-Q152 HydrophobicContact CB-CB 4.26Å; S149-Q152 PolarHBondContact O-N 3.48Å; S149-Q152 WeakPolarHBondContact OG-CG 3.38Å; S149-Q152 PolarHBondContact OG-N 2.93Å; S149-Q152 VanDerWaalsContact OG-N 3.13Å; Q152-F156 WeakPolarHBondContact O-CB 3.23Å; Q152-F156 PolarHBondContact O-N 2.93Å
153L91.9Very high90.6Very high6 Ų665.3 Ų65.33%0.03135%0.352CS..Hα-helixtrans-64-42.4174.8-74.2174000111.8R117 Q120 L121 L124 P148 S149 L150 F156 Q157R117-L153 HydrophobicContact CB-CD1 4.14Å; R117-L153 HydrophobicContact CG-CD1 4.02Å; Q120-L153 HydrophobicContact CB-CD2 4.36Å; L121-L153 HydrophobicContact CB-CD2 4.33Å; L124-L153 HydrophobicContact CD1-CD2 3.97Å; P148-L153 HydrophobicContact CB-CD2 4.16Å; P148-L153 HydrophobicContact CB-CG 3.98Å; P148-L153 HydrophobicContact CG-CD1 3.99Å; P148-L153 HydrophobicContact CG-CD2 3.62Å; P148-L153 HydrophobicContact CG-CG 3.68Å; S149-L153 PolarHBondContact O-N 2.81Å; S149-L153 VanDerWaalsContact O-N 3.08Å; L150-L153 PolarHBondContact O-N 3.23Å; L153-F156 PolarHBondContact O-N 3.26Å; L153-Q157 WeakPolarHBondContact O-CB 3.41Å; L153-Q157 VanDerWaalsContact O-CG 3.31Å; L153-Q157 WeakPolarHBondContact O-CG 3.16Å; L153-Q157 PolarHBondContact O-N 3.14Å
154E93.8Very high91.3Very high107 Ų10766 Ų6650%0.535%0.347SS..Hα-helixtrans-64.7-46.2178.3-175.5173.7-159.700111.7L150 E151 F156 Q157 Q158L150-E154 WeakPolarHBondContact O-CB 3.29Å; L150-E154 PolarHBondContact O-N 3.06Å; E151-E154 PolarHBondContact O-N 3.39Å; E154-F156 VanDerWaalsContact C-N 3.31Å; E154-F156 PolarHBondContact O-N 2.82Å; E154-Q157 WeakPolarHBondContact O-CB 3.35Å; E154-Q157 PolarHBondContact O-N 3.18Å; E154-Q158 WeakPolarHBondContact O-CG 3.28Å; E154-Q158 PolarHBondContact O-N 3.29Å
155N93.8Very high92.1Very high65 Ų6569.8 Ų69.835%0.34836%0.355SS..Hα-helixtrans-61.5-39.5176.2-72.2-24.9000111.9E151 Q158 H159E151-N155 WeakPolarHBondContact O-CB 3.42Å; E151-N155 VanDerWaalsContact O-CG 3.24Å; E151-N155 PolarHBondContact O-N 3.14Å; E151-N155 PolarHBondContact O-ND2 3.33Å; N155-Q158 PolarHBondContact O-N 2.89Å; N155-H159 PolarHBondContact O-N 2.77Å
156F94.3Very high92.7Very high1 Ų163.9 Ų63.90%0.00432%0.323CS..Hα-helixtrans-68.9-40.4176.7-167.7-169.6000111.4L121 L124 L125 D128 Y140 Q152 L153 E154 Q158 H159 I160L121-F156 HydrophobicContact CD1-CD1 4.18Å; L121-F156 HydrophobicContact CD1-CE1 4.16Å; L124-F156 HydrophobicContact CB-CD1 3.61Å; L124-F156 HydrophobicContact CB-CE1 3.46Å; L124-F156 VanDerWaalsContact CB-CE1 3.46Å; L124-F156 HydrophobicContact CB-CG 4.29Å; L124-F156 HydrophobicContact CB-CZ 4.02Å; L124-F156 HydrophobicContact CD1-CB 4.34Å; L124-F156 HydrophobicContact CD1-CD1 3.92Å; L124-F156 HydrophobicContact CD1-CG 4.29Å; L124-F156 HydrophobicContact CG-CD1 4.38Å; L125-F156 HydrophobicContact CD2-CE1 3.93Å; L125-F156 HydrophobicContact CD2-CZ 4.07Å; L125-F156 HydrophobicContact CG-CE1 4.12Å; D128-F156 HydrophobicContact CB-CE2 3.89Å; D128-F156 HydrophobicContact CB-CZ 3.73Å; Y140-F156 HydrophobicContact CD1-CB 4.29Å; Y140-F156 HydrophobicContact CD1-CD1 4.26Å; Y140-F156 AromaticContact CD1-CD2 3.43Å; Y140-F156 HydrophobicContact CD1-CD2 3.43Å; Y140-F156 VanDerWaalsContact CD1-CD2 3.43Å; Y140-F156 HydrophobicContact CD1-CE1 4.47Å; Y140-F156 AromaticContact CD1-CE2 3.71Å; Y140-F156 HydrophobicContact CD1-CE2 3.71Å; Y140-F156 AromaticContact CD1-CG 3.75Å; Y140-F156 HydrophobicContact CD1-CG 3.75Å; Y140-F156 HydrophobicContact CD1-CZ 4.22Å; Y140-F156 HydrophobicContact CD2-CD2 4.47Å; Y140-F156 HydrophobicContact CE1-CB 4.03Å; Y140-F156 AromaticContact CE1-CD2 3.99Å; Y140-F156 HydrophobicContact CE1-CD2 3.99Å; Y140-F156 HydrophobicContact CE1-CG 4.02Å; Y140-F156 AromaticContact CG-CD2 3.75Å; Y140-F156 HydrophobicContact CG-CD2 3.75Å; Y140-F156 AromaticContact CG-CE2 3.75Å; Y140-F156 HydrophobicContact CG-CE2 3.75Å; Y140-F156 HydrophobicContact CG-CZ 4.49Å; Q152-F156 WeakPolarHBondContact O-CB 3.23Å; Q152-F156 PolarHBondContact O-N 2.93Å; L153-F156 PolarHBondContact O-N 3.26Å; E154-F156 VanDerWaalsContact C-N 3.31Å; E154-F156 PolarHBondContact O-N 2.82Å; F156-Q158 VanDerWaalsContact C-N 3.33Å; F156-Q158 PolarHBondContact O-N 3.19Å; F156-H159 HydrophobicContact CD2-CB 4.46Å; F156-H159 WeakPolarHBondContact O-CB 3.25Å; F156-H159 PolarHBondContact O-N 3.17Å; F156-I160 HydrophobicContact CD2-CD1 4.41Å; F156-I160 HydrophobicContact CD2-CG1 4.03Å; F156-I160 HydrophobicContact CE2-CD1 3.85Å; F156-I160 HydrophobicContact CE2-CG1 3.95Å; F156-I160 WeakPolarHBondContact O-CG1 3.26Å; F156-I160 PolarHBondContact O-N 2.79Å
157Q94.9Very high93.2Very high87 Ų8763.7 Ų63.741%0.40731%0.313SS..Hα-helixtrans-58.4-44.5171.9-77.1174.3-2.900111.9L124 L153 E154 H159 I160 T161L124-Q157 HydrophobicContact CD1-CG 3.9Å; L124-Q157 HydrophobicContact CD2-CG 3.76Å; L124-Q157 HydrophobicContact CG-CG 4.47Å; L153-Q157 WeakPolarHBondContact O-CB 3.41Å; L153-Q157 VanDerWaalsContact O-CG 3.31Å; L153-Q157 WeakPolarHBondContact O-CG 3.16Å; L153-Q157 PolarHBondContact O-N 3.14Å; E154-Q157 WeakPolarHBondContact O-CB 3.35Å; E154-Q157 PolarHBondContact O-N 3.18Å; Q157-H159 VanDerWaalsContact C-N 3.33Å; Q157-H159 PolarHBondContact O-N 2.66Å; Q157-I160 PolarHBondContact O-N 3.18Å; Q157-T161 WeakPolarHBondContact O-CG2 3.44Å; Q157-T161 PolarHBondContact O-N 3.45Å; Q157-T161 PolarHBondContact O-OG1 2.91Å
158Q94.9Very high93.6Very high104 Ų10465.8 Ų65.849%0.48633%0.332SS..Hα-helixtrans-60.8-42.1175.7-71.1177.215.600111.7E154 N155 F156 T161 Q162E154-Q158 WeakPolarHBondContact O-CG 3.28Å; E154-Q158 PolarHBondContact O-N 3.29Å; N155-Q158 PolarHBondContact O-N 2.89Å; F156-Q158 VanDerWaalsContact C-N 3.33Å; F156-Q158 PolarHBondContact O-N 3.19Å; Q158-T161 WeakPolarHBondContact CA-OG1 3.37Å; Q158-T161 PolarHBondContact O-N 3Å; Q158-T161 PolarHBondContact O-OG1 2.79Å; Q158-Q162 PolarHBondContact O-N 3.5Å
159H94.3Very high93.9Very high37 Ų3773.5 Ų73.517%0.17136%0.361CS..Hα-helixtrans-58.5-48.8174.1-179.972.4000112.1D128 Y140 N155 F156 Q157 T161 Q162 Q163D128-H159 IonicContact OD1-CD2 3.73Å; D128-H159 IonicContact OD1-NE2 2.68Å; Y140-H159 HydrophobicContact CD2-CB 4.23Å; Y140-H159 AromaticContact CD2-CD2 3.63Å; Y140-H159 AromaticContact CD2-CG 3.71Å; Y140-H159 AromaticContact CD2-NE2 3.91Å; Y140-H159 HydrophobicContact CE2-CB 4.16Å; N155-H159 PolarHBondContact O-N 2.77Å; F156-H159 HydrophobicContact CD2-CB 4.46Å; F156-H159 WeakPolarHBondContact O-CB 3.25Å; F156-H159 PolarHBondContact O-N 3.17Å; Q157-H159 VanDerWaalsContact C-N 3.33Å; Q157-H159 PolarHBondContact O-N 2.66Å; H159-T161 VanDerWaalsContact C-N 3.3Å; H159-T161 PolarHBondContact O-N 3.3Å; H159-Q162 WeakPolarHBondContact O-CB 3.22Å; H159-Q162 PolarHBondContact O-N 3.29Å; H159-Q162 VanDerWaalsContact O-N 3.14Å; H159-Q163 PolarHBondContact CE1-NE2 3.45Å; H159-Q163 VanDerWaalsContact CE1-NE2 3.34Å; H159-Q163 WeakPolarHBondContact O-CG 3.46Å; H159-Q163 PolarHBondContact O-N 3.32Å
160I95.5Very high94.1Very high6 Ų674.7 Ų74.73%0.03136%0.363CS..Hα-helixtrans-59.8-40.7177.2-65.8-64.9000111.3L124 Q127 D128 L131 F156 Q157 Q162 Q163 N164L124-I160 HydrophobicContact CD2-CG1 4.2Å; Q127-I160 HydrophobicContact CB-CD1 4.37Å; D128-I160 HydrophobicContact CB-CD1 3.74Å; L131-I160 HydrophobicContact CD1-CD1 3.98Å; L131-I160 HydrophobicContact CD1-CG2 4.08Å; F156-I160 HydrophobicContact CD2-CD1 4.41Å; F156-I160 HydrophobicContact CD2-CG1 4.03Å; F156-I160 HydrophobicContact CE2-CD1 3.85Å; F156-I160 HydrophobicContact CE2-CG1 3.95Å; F156-I160 WeakPolarHBondContact O-CG1 3.26Å; F156-I160 PolarHBondContact O-N 2.79Å; Q157-I160 PolarHBondContact O-N 3.18Å; I160-Q162 PolarHBondContact O-N 2.9Å; I160-Q163 PolarHBondContact O-N 3.37Å; I160-N164 WeakPolarHBondContact CG2-ND2 3.09Å; I160-N164 WeakPolarHBondContact O-CB 3.45Å; I160-N164 PolarHBondContact O-N 3.32Å; I160-N164 PolarHBondContact O-ND2 3.48Å
161T96.4Very high94.4Very high80 Ų8074 Ų7449%0.49135%0.354SS..Hα-helixtrans-62.1-43.8175.656.30000111.7Q157 Q158 H159 Q163 N164 E165Q157-T161 WeakPolarHBondContact O-CG2 3.44Å; Q157-T161 PolarHBondContact O-N 3.45Å; Q157-T161 PolarHBondContact O-OG1 2.91Å; Q158-T161 WeakPolarHBondContact CA-OG1 3.37Å; Q158-T161 PolarHBondContact O-N 3Å; Q158-T161 PolarHBondContact O-OG1 2.79Å; H159-T161 VanDerWaalsContact C-N 3.3Å; H159-T161 PolarHBondContact O-N 3.3Å; T161-Q163 PolarHBondContact O-N 2.78Å; T161-N164 PolarHBondContact O-N 2.82Å; T161-E165 WeakPolarHBondContact O-CG 3.46Å; T161-E165 PolarHBondContact O-N 3.38Å
162Q95.2Very high94.6Very high124 Ų12471.5 Ų71.558%0.57935%0.351SS*.Hα-helixtrans-64.5-40.7177.7-172.5-17820.400112.4Q158 H159 I160 E165 E166Q158-Q162 PolarHBondContact O-N 3.5Å; H159-Q162 WeakPolarHBondContact O-CB 3.22Å; H159-Q162 PolarHBondContact O-N 3.29Å; H159-Q162 VanDerWaalsContact O-N 3.14Å; I160-Q162 PolarHBondContact O-N 2.9Å; Q162-E165 PolarHBondContact O-N 2.99Å; Q162-E166 PolarHBondContact O-N 2.98Å
163Q95.1Very high94.9Very high35 Ų3570 Ų7016%0.16434%0.344CS..Hα-helixtrans-67.1-37.8176.7-69.7-58.9-2700112L131 L135 H159 I160 T161 E166 K167L131-Q163 HydrophobicContact CD1-CB 3.9Å; L135-Q163 HydrophobicContact CD1-CB 4.34Å; H159-Q163 PolarHBondContact CE1-NE2 3.45Å; H159-Q163 VanDerWaalsContact CE1-NE2 3.34Å; H159-Q163 WeakPolarHBondContact O-CG 3.46Å; H159-Q163 PolarHBondContact O-N 3.32Å; I160-Q163 PolarHBondContact O-N 3.37Å; T161-Q163 PolarHBondContact O-N 2.78Å; Q163-E166 PolarHBondContact O-N 3.41Å; Q163-K167 WeakPolarHBondContact O-CB 3.37Å; Q163-K167 PolarHBondContact O-N 2.69Å
164N95Very high95Very high74 Ų7469.8 Ų69.840%0.39634%0.343SS..Hα-helixtrans-64.4-41.9173.4-83.5-62.9000112.3I160 T161 E166 K167 A168I160-N164 WeakPolarHBondContact CG2-ND2 3.09Å; I160-N164 WeakPolarHBondContact O-CB 3.45Å; I160-N164 PolarHBondContact O-N 3.32Å; I160-N164 PolarHBondContact O-ND2 3.48Å; T161-N164 PolarHBondContact O-N 2.82Å; N164-E166 VanDerWaalsContact C-N 3.31Å; N164-E166 PolarHBondContact O-N 2.68Å; N164-K167 PolarHBondContact O-N 2.98Å; N164-A168 WeakPolarHBondContact O-CB 3.43Å; N164-A168 PolarHBondContact O-N 3.44Å
165E96.3Very high95.1Very high136 Ų13667 Ų6764%0.63633%0.333SS*.Hα-helixtrans-60.9-41.3173.3-72.5175.4179.300111.5T161 Q162 A168 R169T161-E165 WeakPolarHBondContact O-CG 3.46Å; T161-E165 PolarHBondContact O-N 3.38Å; Q162-E165 PolarHBondContact O-N 2.99Å; E165-A168 PolarHBondContact O-N 3.32Å; E165-R169 WeakPolarHBondContact O-CB 3.15Å; E165-R169 PolarHBondContact O-N 3.03Å
166E94.7Very high95.2Very high32 Ų3268.2 Ų68.215%0.1534%0.336CS..Hα-helixtrans-65.9-42.717617362.815700112.5L135 Q162 Q163 N164 A168 R169 R170L135-E166 HydrophobicContact CD2-CG 4.48Å; Q162-E166 PolarHBondContact O-N 2.98Å; Q163-E166 PolarHBondContact O-N 3.41Å; N164-E166 VanDerWaalsContact C-N 3.31Å; N164-E166 PolarHBondContact O-N 2.68Å; E166-A168 VanDerWaalsContact C-N 3.35Å; E166-A168 PolarHBondContact O-N 2.94Å; E166-R169 PolarHBondContact O-N 2.89Å; E166-R169 IonicContact OE1-NH2 3.32Å; E166-R169 IonicContact OE2-CZ 3.91Å; E166-R169 IonicContact OE2-NE 2.95Å; E166-R169 PolarHBondContact OE2-NE 3.06Å; E166-R169 IonicContact OE2-NH2 2.66Å; E166-R169 PolarHBondContact OE2-NH2 2.95Å; E166-R170 PolarHBondContact O-N 3.3Å; E166-R170 IonicContact OE1-CZ 3.6Å; E166-R170 IonicContact OE1-NE 3.78Å; E166-R170 PolarHBondContact OE1-NE 3.21Å; E166-R170 IonicContact OE1-NH2 3.31Å; E166-R170 PolarHBondContact OE1-NH2 3.5Å
167K94.6Very high95.2Very high75 Ų7569 Ų6933%0.32634%0.341SS..Hα-helixtrans-57.4-48173178.5177.6173.2175.60111.1L131 V134 L135 Q163 N164 R169 R170 Y171 L210L131-K167 HydrophobicContact CD2-CB 4.41Å; L131-K167 HydrophobicContact CD2-CD 3.79Å; V134-K167 HydrophobicContact CG1-CD 4.39Å; L135-K167 HydrophobicContact CD1-CB 4.36Å; L135-K167 HydrophobicContact CD2-CB 4.15Å; L135-K167 HydrophobicContact CG-CB 4.47Å; Q163-K167 WeakPolarHBondContact O-CB 3.37Å; Q163-K167 PolarHBondContact O-N 2.69Å; N164-K167 PolarHBondContact O-N 2.98Å; K167-R169 VanDerWaalsContact C-N 3.33Å; K167-R169 PolarHBondContact O-N 2.77Å; K167-R170 PolarHBondContact O-N 3.21Å; K167-Y171 WeakPolarHBondContact O-CB 3.44Å; K167-Y171 PolarHBondContact O-N 3.22Å; K167-L210 HydrophobicContact CG-CD1 4.26Å
168A95.3Very high95.2Very high63 Ų6365.4 Ų65.452%0.52132%0.324SS..Hα-helixtrans-61-42.1177.900000112N164 E165 E166 S172N164-A168 WeakPolarHBondContact O-CB 3.43Å; N164-A168 PolarHBondContact O-N 3.44Å; E165-A168 PolarHBondContact O-N 3.32Å; E166-A168 VanDerWaalsContact C-N 3.35Å; E166-A168 PolarHBondContact O-N 2.94Å; A168-S172 PolarHBondContact O-N 3.46Å
169R95.9Very high95.2Very high166 Ų16666.3 Ų66.363%0.62633%0.326SS*.Hα-helixtrans-61.8-51.5176.1175.1171.655.7-169.4-6.6112.2E165 E166 K167 Y171 S172 E173E165-R169 WeakPolarHBondContact O-CB 3.15Å; E165-R169 PolarHBondContact O-N 3.03Å; E166-R169 PolarHBondContact O-N 2.89Å; E166-R169 IonicContact OE1-NH2 3.32Å; E166-R169 IonicContact OE2-CZ 3.91Å; E166-R169 IonicContact OE2-NE 2.95Å; E166-R169 PolarHBondContact OE2-NE 3.06Å; E166-R169 IonicContact OE2-NH2 2.66Å; E166-R169 PolarHBondContact OE2-NH2 2.95Å; K167-R169 VanDerWaalsContact C-N 3.33Å; K167-R169 PolarHBondContact O-N 2.77Å; R169-Y171 VanDerWaalsContact C-N 3.35Å; R169-S172 PolarHBondContact O-N 3.11Å; R169-E173 PolarHBondContact O-N 2.78Å
170R95Very high95.3Very high43 Ų4367.8 Ų67.816%0.16233%0.333CS..Hα-helixtrans-66.2-36.9-179.6-71.4-170.3-170.1167.110.4112.5L135 E166 K167 E173 F174 L210L135-R170 PolarHBondContact O-NH1 3.13Å; E166-R170 PolarHBondContact O-N 3.3Å; E166-R170 IonicContact OE1-CZ 3.6Å; E166-R170 IonicContact OE1-NE 3.78Å; E166-R170 PolarHBondContact OE1-NE 3.21Å; E166-R170 IonicContact OE1-NH2 3.31Å; E166-R170 PolarHBondContact OE1-NH2 3.5Å; K167-R170 PolarHBondContact O-N 3.21Å; R170-E173 PolarHBondContact O-N 3.42Å; R170-F174 WeakPolarHBondContact O-CB 3.36Å; R170-F174 PolarHBondContact O-N 3.28Å; R170-L210 HydrophobicContact CB-CB 4.29Å; R170-L210 HydrophobicContact CB-CD1 4.49Å; R170-L210 VanDerWaalsContact CD-O 3.23Å; R170-L210 WeakPolarHBondContact CD-O 3.35Å; R170-L210 PolarHBondContact NH1-O 2.94Å
171Y94.4Very high95.4Very high81 Ų8167.5 Ų67.532%0.31833%0.331SS..Hα-helixtrans-62.6-46.6175.4-176.4-95.5000110.9K167 R169 E173 F174 T175 E205 L210K167-Y171 WeakPolarHBondContact O-CB 3.44Å; K167-Y171 PolarHBondContact O-N 3.22Å; R169-Y171 VanDerWaalsContact C-N 3.35Å; Y171-E173 VanDerWaalsContact C-N 3.3Å; Y171-E173 PolarHBondContact O-N 2.83Å; Y171-F174 WeakPolarHBondContact O-CB 3.39Å; Y171-F174 PolarHBondContact O-N 2.99Å; Y171-T175 PolarHBondContact O-N 3.49Å; Y171-T175 PolarHBondContact O-OG1 3.33Å; Y171-T175 VanDerWaalsContact O-OG1 3.08Å; Y171-E205 HydrophobicContact CE2-CB 4.22Å; Y171-E205 PolarHBondContact OH-OE2 3.08Å; Y171-E205 VanDerWaalsContact OH-OE2 3.08Å; Y171-L210 HydrophobicContact CD2-CD1 4.3Å
172S95.2Very high95.3Very high79 Ų7965.9 Ų65.955%0.55232%0.319SS*.Hα-helixtrans-59.9-39.8175-176.70000112.7A168 R169 E176A168-S172 PolarHBondContact O-N 3.46Å; R169-S172 PolarHBondContact O-N 3.11Å; S172-E176 PolarHBondContact O-N 3.4Å
173E95.8Very high95.2Very high68 Ų6864.5 Ų64.532%0.31832%0.315SS..Hα-helixtrans-66.4-43.1175.8-178.5170.6-148.300111.6R169 R170 Y171 E176 L177 I215 K219R169-E173 PolarHBondContact O-N 2.78Å; R170-E173 PolarHBondContact O-N 3.42Å; Y171-E173 VanDerWaalsContact C-N 3.3Å; Y171-E173 PolarHBondContact O-N 2.83Å; E173-E176 PolarHBondContact O-N 2.9Å; E173-L177 HydrophobicContact CG-CD1 3.91Å; E173-L177 HydrophobicContact CG-CG 4.42Å; E173-L177 WeakPolarHBondContact O-CB 3.34Å; E173-L177 VanDerWaalsContact O-CG 3.25Å; E173-L177 WeakPolarHBondContact O-CG 3.48Å; E173-L177 PolarHBondContact O-N 3.29Å; E173-I215 HydrophobicContact CG-CG2 4.45Å; E173-K219 WeakPolarHBondContact OE1-CE 3.31Å; E173-K219 IonicContact OE1-NZ 3.18Å; E173-K219 PolarHBondContact OE1-NZ 3.45Å
174F95.4Very high95.2Very high2 Ų263.7 Ų63.71%0.00931%0.312CS..Hα-helixtrans-59.1-51.8175.6165.5-114.3000112.1R170 Y171 E176 L177 K178 E205 F208 L210 I215 L218R170-F174 WeakPolarHBondContact O-CB 3.36Å; R170-F174 PolarHBondContact O-N 3.28Å; Y171-F174 WeakPolarHBondContact O-CB 3.39Å; Y171-F174 PolarHBondContact O-N 2.99Å; F174-E176 VanDerWaalsContact C-N 3.29Å; F174-E176 PolarHBondContact O-N 3.4Å; F174-L177 PolarHBondContact O-N 3.47Å; F174-K178 HydrophobicContact CE1-CD 4.34Å; F174-K178 HydrophobicContact CE2-CB 4.36Å; F174-K178 HydrophobicContact CE2-CD 4.47Å; F174-K178 HydrophobicContact CZ-CD 3.96Å; F174-K178 VanDerWaalsContact O-CB 3.23Å; F174-K178 WeakPolarHBondContact O-CB 3.36Å; F174-K178 PolarHBondContact O-N 3.19Å; F174-E205 HydrophobicContact CE1-CB 4.14Å; F174-E205 HydrophobicContact CE1-CG 4.17Å; F174-F208 AromaticContact CD2-CD1 3.87Å; F174-F208 HydrophobicContact CD2-CD1 3.87Å; F174-F208 AromaticContact CD2-CE1 3.9Å; F174-F208 HydrophobicContact CD2-CE1 3.9Å; F174-F208 HydrophobicContact CE1-CB 4.29Å; F174-F208 HydrophobicContact CE1-CD1 4.46Å; F174-F208 HydrophobicContact CE2-CB 4.39Å; F174-F208 AromaticContact CE2-CD1 3.64Å; F174-F208 HydrophobicContact CE2-CD1 3.64Å; F174-F208 HydrophobicContact CE2-CD2 4.22Å; F174-F208 AromaticContact CE2-CE1 3.87Å; F174-F208 HydrophobicContact CE2-CE1 3.87Å; F174-F208 HydrophobicContact CE2-CE2 4.42Å; F174-F208 AromaticContact CE2-CG 3.82Å; F174-F208 HydrophobicContact CE2-CG 3.82Å; F174-F208 HydrophobicContact CE2-CZ 4.25Å; F174-F208 HydrophobicContact CG-CD1 4.35Å; F174-F208 HydrophobicContact CZ-CB 3.89Å; F174-F208 AromaticContact CZ-CD1 3.96Å; F174-F208 HydrophobicContact CZ-CD1 3.96Å; F174-F208 HydrophobicContact CZ-CD2 4.41Å; F174-F208 AromaticContact CZ-CG 3.83Å; F174-F208 HydrophobicContact CZ-CG 3.83Å; F174-L210 HydrophobicContact CB-CD2 3.86Å; F174-L210 HydrophobicContact CD1-CD2 4.27Å; F174-L210 HydrophobicContact CG-CD2 4.1Å; F174-I215 HydrophobicContact CB-CD1 4.12Å; F174-L218 HydrophobicContact CD2-CD1 3.53Å; F174-L218 HydrophobicContact CD2-CD2 4.5Å; F174-L218 HydrophobicContact CE2-CD1 4.13Å
175T94.3Very high95.1Very high48 Ų4860.6 Ų60.629%0.29430%0.295SS..Hα-helixtrans-60.9-39.6-178.4-53.50000111.6Y171 K179Y171-T175 PolarHBondContact O-N 3.49Å; Y171-T175 PolarHBondContact O-OG1 3.33Å; Y171-T175 VanDerWaalsContact O-OG1 3.08Å; T175-K179 WeakPolarHBondContact O-CB 3.32Å; T175-K179 PolarHBondContact O-N 2.71Å
176E95.8Very high94.9Very high91 Ų9159.9 Ų59.943%0.42529%0.292SS..Hα-helixtrans-68.2-46.1177.1-176.155.9-145.700111.7S172 E173 F174 K179 Q180S172-E176 PolarHBondContact O-N 3.4Å; E173-E176 PolarHBondContact O-N 2.9Å; F174-E176 VanDerWaalsContact C-N 3.29Å; F174-E176 PolarHBondContact O-N 3.4Å; E176-K179 PolarHBondContact O-N 3Å; E176-Q180 WeakPolarHBondContact O-CG 3.39Å; E176-Q180 PolarHBondContact O-N 3.44Å; E176-Q180 VanDerWaalsContact O-N 3.1Å; E176-Q180 PolarHBondContact OE1-NE2 3.1Å
177L95.8Very high94.6Very high18 Ų1862 Ų629%0.09430%0.302CS..Hα-helixtrans-61.8-44.5175.9-71.4173.3000111.7E173 F174 K179 Q180 I181 L218 K219 L222E173-L177 HydrophobicContact CG-CD1 3.91Å; E173-L177 HydrophobicContact CG-CG 4.42Å; E173-L177 WeakPolarHBondContact O-CB 3.34Å; E173-L177 VanDerWaalsContact O-CG 3.25Å; E173-L177 WeakPolarHBondContact O-CG 3.48Å; E173-L177 PolarHBondContact O-N 3.29Å; F174-L177 PolarHBondContact O-N 3.47Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 2.81Å; L177-Q180 PolarHBondContact O-N 3.49Å; L177-I181 WeakPolarHBondContact O-CB 3.48Å; L177-I181 VanDerWaalsContact O-CG1 3.27Å; L177-I181 WeakPolarHBondContact O-CG1 3.49Å; L177-I181 PolarHBondContact O-N 3.29Å; L177-L218 HydrophobicContact CD1-CB 4.12Å; L177-K219 HydrophobicContact CD1-CG 3.84Å; L177-K219 HydrophobicContact CD2-CG 4.37Å; L177-L222 HydrophobicContact CD2-CD2 3.56Å
178K94.9Very high94.4Very high12 Ų1259.2 Ų59.25%0.05229%0.291CS..Hα-helixtrans-56.2-47.8176.6176.2-179.3178-175.60110.8F174 Q180 I181 I182 V200 S202 E205F174-K178 HydrophobicContact CE1-CD 4.34Å; F174-K178 HydrophobicContact CE2-CB 4.36Å; F174-K178 HydrophobicContact CE2-CD 4.47Å; F174-K178 HydrophobicContact CZ-CD 3.96Å; F174-K178 VanDerWaalsContact O-CB 3.23Å; F174-K178 WeakPolarHBondContact O-CB 3.36Å; F174-K178 PolarHBondContact O-N 3.19Å; K178-Q180 PolarHBondContact O-N 3.09Å; K178-I181 PolarHBondContact O-N 3.4Å; K178-I182 HydrophobicContact CD-CD1 4.49Å; K178-I182 HydrophobicContact CG-CD1 3.78Å; K178-I182 HydrophobicContact CG-CG1 4.47Å; K178-I182 VanDerWaalsContact O-CG1 3.28Å; K178-I182 WeakPolarHBondContact O-CG1 3.33Å; K178-I182 PolarHBondContact O-N 2.73Å; K178-V200 WeakPolarHBondContact CD-O 3.48Å; K178-V200 WeakPolarHBondContact CE-O 3.46Å; K178-V200 HydrophobicContact CG-CG1 4.49Å; K178-V200 WeakPolarHBondContact CG-O 3.44Å; K178-S202 WeakPolarHBondContact CE-O 3.48Å; K178-S202 PolarHBondContact NZ-O 3.49Å; K178-E205 HydrophobicContact CD-CG 4.41Å; K178-E205 IonicContact NZ-OE1 3.64Å; K178-E205 PolarHBondContact NZ-OE1 3.03Å
179K95.2Very high94Very high122 Ų12259.1 Ų59.153%0.5328%0.282SS..Hα-helixtrans-59.4-44.8177.6-178.3-175.3172.2-1680111.9T175 E176 L177 L183T175-K179 WeakPolarHBondContact O-CB 3.32Å; T175-K179 PolarHBondContact O-N 2.71Å; E176-K179 PolarHBondContact O-N 3Å; L177-K179 VanDerWaalsContact C-N 3.33Å; L177-K179 PolarHBondContact O-N 2.81Å; K179-L183 HydrophobicContact CG-CD1 4.38Å; K179-L183 VanDerWaalsContact O-CG 3.32Å; K179-L183 WeakPolarHBondContact O-CG 3.44Å; K179-L183 PolarHBondContact O-N 2.93Å; K179-L183 VanDerWaalsContact O-N 3.12Å
180Q96.6Very high93.7Very high68 Ų6853.8 Ų53.832%0.31826%0.264SS..Hα-helixtrans-65.3-43.1178.2-68.3175.526.600112E176 L177 K178 L183 L184 L222E176-Q180 WeakPolarHBondContact O-CG 3.39Å; E176-Q180 PolarHBondContact O-N 3.44Å; E176-Q180 VanDerWaalsContact O-N 3.1Å; E176-Q180 PolarHBondContact OE1-NE2 3.1Å; L177-Q180 PolarHBondContact O-N 3.49Å; K178-Q180 PolarHBondContact O-N 3.09Å; Q180-L183 PolarHBondContact O-N 3.42Å; Q180-L184 WeakPolarHBondContact O-CG 3.28Å; Q180-L184 PolarHBondContact O-N 3.24Å; Q180-L222 HydrophobicContact CB-CD1 3.99Å
181I96Very high93.4Very high0 Ų059.4 Ų59.40%029%0.29CS..Hα-helixtrans-60.1-48.4176.6-72.5165.8000110.5L177 K178 L183 L184 M185 V200 L218 L221 L222 L225L177-I181 WeakPolarHBondContact O-CB 3.48Å; L177-I181 VanDerWaalsContact O-CG1 3.27Å; L177-I181 WeakPolarHBondContact O-CG1 3.49Å; L177-I181 PolarHBondContact O-N 3.29Å; K178-I181 PolarHBondContact O-N 3.4Å; I181-L183 VanDerWaalsContact C-N 3.34Å; I181-L183 PolarHBondContact O-N 3.42Å; I181-L184 PolarHBondContact O-N 3.38Å; I181-M185 HydrophobicContact CG2-CG 4.2Å; I181-M185 HydrophobicContact CG2-SD 3.65Å; I181-M185 WeakPolarHBondContact O-CB 3.37Å; I181-M185 VanDerWaalsContact O-CG 3.24Å; I181-M185 WeakPolarHBondContact O-CG 3.36Å; I181-M185 PolarHBondContact O-N 3.01Å; I181-V200 HydrophobicContact CD1-CG1 4.33Å; I181-V200 HydrophobicContact CG2-CG1 4.44Å; I181-L218 HydrophobicContact CD1-CD2 3.67Å; I181-L221 HydrophobicContact CD1-CD2 4.18Å; I181-L221 HydrophobicContact CD1-CG 4.38Å; I181-L221 HydrophobicContact CG2-CD2 4.21Å; I181-L222 HydrophobicContact CD1-CB 4.43Å; I181-L222 HydrophobicContact CG1-CB 4.1Å; I181-L222 HydrophobicContact CG1-CD1 4.09Å; I181-L225 HydrophobicContact CB-CD1 4.42Å; I181-L225 HydrophobicContact CG1-CD1 4.43Å; I181-L225 HydrophobicContact CG2-CD1 3.86Å
182I94.6Very high93.3Very high46 Ų4657.5 Ų57.524%0.23629%0.287CS..Hα-helixtrans-59.1-46.5179-69.2167.6000110.6K178 L184 M185 E186 V201K178-I182 HydrophobicContact CD-CD1 4.49Å; K178-I182 HydrophobicContact CG-CD1 3.78Å; K178-I182 HydrophobicContact CG-CG1 4.47Å; K178-I182 VanDerWaalsContact O-CG1 3.28Å; K178-I182 WeakPolarHBondContact O-CG1 3.33Å; K178-I182 PolarHBondContact O-N 2.73Å; I182-L184 VanDerWaalsContact C-N 3.34Å; I182-L184 PolarHBondContact O-N 3.2Å; I182-M185 PolarHBondContact O-N 2.86Å; I182-E186 HydrophobicContact CG2-CG 4.48Å; I182-E186 WeakPolarHBondContact O-CG 3.5Å; I182-E186 PolarHBondContact O-N 3.34Å; I182-V201 HydrophobicContact CG1-CG2 4.35Å
183L93.9Very high93Very high95 Ų9560.7 Ų60.750%0.49729%0.293SS..Hα-helixtrans-60.6-42.1178.1-71.9172000112.5K179 Q180 I181 E187K179-L183 HydrophobicContact CG-CD1 4.38Å; K179-L183 VanDerWaalsContact O-CG 3.32Å; K179-L183 WeakPolarHBondContact O-CG 3.44Å; K179-L183 PolarHBondContact O-N 2.93Å; K179-L183 VanDerWaalsContact O-N 3.12Å; Q180-L183 PolarHBondContact O-N 3.42Å; I181-L183 VanDerWaalsContact C-N 3.34Å; I181-L183 PolarHBondContact O-N 3.42Å; L183-E187 WeakPolarHBondContact O-CB 3.34Å; L183-E187 PolarHBondContact O-N 3.41Å
184L93.8Very high92.8Very high18 Ų1860.5 Ų60.59%0.09430%0.297CS..Hα-helixtrans-69.5-38.8177-73.2169.9000112.2Q180 I181 I182 E186 E187 L188 L222 L225 E226 K229Q180-L184 WeakPolarHBondContact O-CG 3.28Å; Q180-L184 PolarHBondContact O-N 3.24Å; I181-L184 PolarHBondContact O-N 3.38Å; I182-L184 VanDerWaalsContact C-N 3.34Å; I182-L184 PolarHBondContact O-N 3.2Å; L184-E186 VanDerWaalsContact C-N 3.34Å; L184-E187 PolarHBondContact O-N 3.37Å; L184-L188 VanDerWaalsContact O-CB 3.32Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 VanDerWaalsContact O-CG 3.24Å; L184-L188 WeakPolarHBondContact O-CG 3.11Å; L184-L188 PolarHBondContact O-N 2.92Å; L184-L222 HydrophobicContact CD1-CD1 3.44Å; L184-L222 VanDerWaalsContact CD1-CD1 3.44Å; L184-L225 HydrophobicContact CB-CB 4.23Å; L184-L225 HydrophobicContact CB-CD1 4.48Å; L184-L225 HydrophobicContact CD1-CB 4.18Å; L184-E226 HydrophobicContact CD1-CG 3.7Å; L184-K229 HydrophobicContact CD2-CD 3.73Å
185M93.6Very high92.5Very high9 Ų964.8 Ų64.84%0.04433%0.327CS..Hα-helixtrans-62.6-42.6175.3-71.3178.480.800111I181 I182 L188 D189 H190 P192 V201 L225I181-M185 HydrophobicContact CG2-CG 4.2Å; I181-M185 HydrophobicContact CG2-SD 3.65Å; I181-M185 WeakPolarHBondContact O-CB 3.37Å; I181-M185 VanDerWaalsContact O-CG 3.24Å; I181-M185 WeakPolarHBondContact O-CG 3.36Å; I181-M185 PolarHBondContact O-N 3.01Å; I182-M185 PolarHBondContact O-N 2.86Å; M185-L188 PolarHBondContact O-N 3.33Å; M185-D189 PolarHBondContact O-N 3.11Å; M185-D189 VanDerWaalsContact O-N 3.09Å; M185-H190 PolarHBondContact O-N 3.23Å; M185-P192 HydrophobicContact CE-CB 3.99Å; M185-P192 HydrophobicContact CE-CG 3.64Å; M185-V201 HydrophobicContact CE-CG2 4.26Å; M185-V201 HydrophobicContact SD-CG2 3.82Å; M185-L225 HydrophobicContact CG-CD1 3.8Å; M185-L225 HydrophobicContact CG-CD2 4.32Å
186E91.5Very high92.4Very high121 Ų12164.8 Ų64.857%0.56532%0.323SS*.Hα-helixtrans-63.2-41.9173.5-73.3177.2-177.800112.5I182 L184 L188 D189I182-E186 HydrophobicContact CG2-CG 4.48Å; I182-E186 WeakPolarHBondContact O-CG 3.5Å; I182-E186 PolarHBondContact O-N 3.34Å; L184-E186 VanDerWaalsContact C-N 3.34Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 3.46Å; E186-D189 PolarHBondContact O-N 2.8Å
187E89.4Confident92.3Very high76 Ų7661.5 Ų61.536%0.35531%0.307SS..Hα-helixtrans-68.1-34.5179.6-171.2175.6-176.100112.8L183 L184 D189 K229L183-E187 WeakPolarHBondContact O-CB 3.34Å; L183-E187 PolarHBondContact O-N 3.41Å; L184-E187 PolarHBondContact O-N 3.37Å; E187-D189 VanDerWaalsContact C-N 3.32Å; E187-K229 VanDerWaalsContact CD-CE 3.5Å; E187-K229 WeakPolarHBondContact OE1-CE 3.41Å; E187-K229 IonicContact OE1-NZ 2.76Å; E187-K229 PolarHBondContact OE1-NZ 3.18Å; E187-K229 WeakPolarHBondContact OE2-CE 3.38Å; E187-K229 IonicContact OE2-NZ 3.54Å; E187-K229 PolarHBondContact OE2-NZ 3.1Å
188L89.4Confident92.1Very high18 Ų1866 Ų669%0.09433%0.326CS..THydrogen-bonded Turntrans-84.2-4.2177.5-67.1173000113.5L184 M185 E186 H190 L225 R228 K229L184-L188 VanDerWaalsContact O-CB 3.32Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 VanDerWaalsContact O-CG 3.24Å; L184-L188 WeakPolarHBondContact O-CG 3.11Å; L184-L188 PolarHBondContact O-N 2.92Å; M185-L188 PolarHBondContact O-N 3.33Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 3.46Å; L188-H190 HydrophobicContact CB-CB 4.16Å; L188-H190 PolarHBondContact O-N 3.24Å; L188-L225 HydrophobicContact CD1-CB 4.36Å; L188-L225 HydrophobicContact CD1-CD2 4.08Å; L188-R228 HydrophobicContact CD1-CB 4.42Å; L188-K229 HydrophobicContact CD2-CB 3.99Å; L188-K229 HydrophobicContact CD2-CG 4.45Å
189D88.5Confident91.8Very high61 Ų6169.8 Ų69.833%0.32635%0.347SS..THydrogen-bonded Turntrans50.336.7-168.4-59.3-55.2000111.6M185 E186 E187 R269M185-D189 PolarHBondContact O-N 3.11Å; M185-D189 VanDerWaalsContact O-N 3.09Å; E186-D189 PolarHBondContact O-N 2.8Å; E187-D189 VanDerWaalsContact C-N 3.32Å; D189-R269 HydrophobicContact CB-CB 4.36Å
190H88.3Confident91.6Very high54 Ų5464 Ų6425%0.2532%0.322CS..  trans-92.5131.3-179-178.860.2000110.8M185 L188 E197M185-H190 PolarHBondContact O-N 3.23Å; L188-H190 HydrophobicContact CB-CB 4.16Å; L188-H190 PolarHBondContact O-N 3.24Å; H190-E197 IonicContact CD2-OE2 3.61Å; H190-E197 IonicContact CE1-OE2 3.15Å; H190-E197 IonicContact NE2-OE2 2.67Å; H190-E197 PolarHBondContact NE2-OE2 2.91Å
191F89Confident91.2Very high161 Ų16163.2 Ų63.271%0.70632%0.322SS*.  trans-100144.1178.5-63.9-81.6000110.6E193F191-E193 PolarHBondContact O-N 2.88Å
192P91.4Very high90.7Very high40 Ų4065.2 Ų65.226%0.2634%0.336SS..  trans-59.5110.5177.4-16.325.1000111.5M185 E197 K198 V201M185-P192 HydrophobicContact CE-CB 3.99Å; M185-P192 HydrophobicContact CE-CG 3.64Å; P192-E197 WeakPolarHBondContact CA-OE2 3.29Å; P192-E197 HydrophobicContact CB-CB 3.86Å; P192-K198 HydrophobicContact CB-CG 3.8Å; P192-K198 WeakPolarHBondContact O-CE 3.3Å; P192-V201 HydrophobicContact CG-CB 4.14Å; P192-V201 HydrophobicContact CG-CG1 4.18Å; P192-V201 HydrophobicContact CG-CG2 4.05Å
193E89.4Confident90Very high146 Ų14672.4 Ų72.468%0.68237%0.369SS*.  trans-96.7-47.1-178-71.2-174177.400111.5F191 E197 K198F191-E193 PolarHBondContact O-N 2.88Å; E193-E197 PolarHBondContact N-OE2 2.97Å; E193-E197 VanDerWaalsContact N-OE2 3.08Å; E193-K198 WeakPolarHBondContact O-CE 3.32Å; E193-K198 PolarHBondContact O-NZ 2.87Å; E193-K198 VanDerWaalsContact O-NZ 3.11Å
194T91.6Very high89.5Confident65 Ų6572.3 Ų72.340%0.39937%0.368SS..SBendtrans-75.6155.7-177.865.50000111.6F196 E197 K198T194-F196 PolarHBondContact O-N 3.47Å; T194-E197 VanDerWaalsContact CG2-OE1 3.31Å; T194-E197 WeakPolarHBondContact CG2-OE1 3.35Å; T194-E197 PolarHBondContact O-N 3.08Å; T194-E197 WeakPolarHBondContact OG1-CB 3.23Å; T194-E197 WeakPolarHBondContact OG1-CG 3.37Å; T194-E197 PolarHBondContact OG1-N 3.27Å; T194-E197 VanDerWaalsContact OG1-N 3.13Å; T194-E197 PolarHBondContact OG1-OE1 3.31Å; T194-K198 WeakPolarHBondContact O-CG 3.35Å; T194-K198 PolarHBondContact O-N 2.75Å; T194-K198 VanDerWaalsContact O-N 3.14Å
195S90.5Very high88.9Confident92 Ų9274 Ų7464%0.64338%0.376SS*.Hα-helixtrans-58.5-40.1173.654.30000111K198 D199S195-K198 WeakPolarHBondContact O-CB 3.42Å; S195-K198 PolarHBondContact O-N 3.17Å; S195-D199 PolarHBondContact O-N 3.19Å
196F91.4Very high88.2Confident48 Ų4879.9 Ų79.921%0.21141%0.407CS..Hα-helixtrans-62.6-47.4178.1-174.7-102.5000112.5T194 K198 D199 V200 F208 S217 L218 L221T194-F196 PolarHBondContact O-N 3.47Å; F196-K198 VanDerWaalsContact C-N 3.27Å; F196-K198 PolarHBondContact O-N 3.3Å; F196-D199 PolarHBondContact O-N 3.2Å; F196-V200 HydrophobicContact CD1-CG2 4.18Å; F196-V200 HydrophobicContact CE1-CG2 3.88Å; F196-V200 HydrophobicContact CE2-CG2 4.45Å; F196-V200 HydrophobicContact CZ-CG2 4.03Å; F196-V200 VanDerWaalsContact O-CG2 3.29Å; F196-V200 WeakPolarHBondContact O-CG2 3.41Å; F196-V200 PolarHBondContact O-N 3.27Å; F196-F208 HydrophobicContact CE2-CE2 4.16Å; F196-F208 HydrophobicContact CE2-CZ 4.11Å; F196-F208 HydrophobicContact CZ-CZ 4.36Å; F196-S217 VanDerWaalsContact CZ-CB 3.48Å; F196-L218 HydrophobicContact CE1-CG 4.43Å; F196-L218 HydrophobicContact CZ-CG 3.99Å; F196-L221 HydrophobicContact CD1-CD2 4.35Å; F196-L221 HydrophobicContact CE1-CD2 4.3Å
197E92.9Very high87.8Confident21 Ų2177.3 Ų77.310%0.09841%0.407CS..Hα-helixtrans-59.8-39.1176-75.7159-124.900112.1H190 P192 E193 T194 V200 V201 L221H190-E197 IonicContact CD2-OE2 3.61Å; H190-E197 IonicContact CE1-OE2 3.15Å; H190-E197 IonicContact NE2-OE2 2.67Å; H190-E197 PolarHBondContact NE2-OE2 2.91Å; P192-E197 WeakPolarHBondContact CA-OE2 3.29Å; P192-E197 HydrophobicContact CB-CB 3.86Å; E193-E197 PolarHBondContact N-OE2 2.97Å; E193-E197 VanDerWaalsContact N-OE2 3.08Å; T194-E197 VanDerWaalsContact CG2-OE1 3.31Å; T194-E197 WeakPolarHBondContact CG2-OE1 3.35Å; T194-E197 PolarHBondContact O-N 3.08Å; T194-E197 WeakPolarHBondContact OG1-CB 3.23Å; T194-E197 WeakPolarHBondContact OG1-CG 3.37Å; T194-E197 PolarHBondContact OG1-N 3.27Å; T194-E197 VanDerWaalsContact OG1-N 3.13Å; T194-E197 PolarHBondContact OG1-OE1 3.31Å; E197-V200 PolarHBondContact O-N 3.36Å; E197-V201 WeakPolarHBondContact O-CB 3.33Å; E197-V201 VanDerWaalsContact O-CG2 3.31Å; E197-V201 WeakPolarHBondContact O-CG2 3.49Å; E197-V201 PolarHBondContact O-N 3.19Å; E197-L221 HydrophobicContact CG-CD1 4.04Å; E197-L221 HydrophobicContact CG-CD2 3.81Å
198K91.5Very high87.8Confident113 Ų11374.4 Ų74.449%0.49139%0.393SS..Hα-helixtrans-64-42177-70.6168-176.1163.50111.7P192 E193 T194 S195 F196 V201 S202P192-K198 HydrophobicContact CB-CG 3.8Å; P192-K198 WeakPolarHBondContact O-CE 3.3Å; E193-K198 WeakPolarHBondContact O-CE 3.32Å; E193-K198 PolarHBondContact O-NZ 2.87Å; E193-K198 VanDerWaalsContact O-NZ 3.11Å; T194-K198 WeakPolarHBondContact O-CG 3.35Å; T194-K198 PolarHBondContact O-N 2.75Å; T194-K198 VanDerWaalsContact O-N 3.14Å; S195-K198 WeakPolarHBondContact O-CB 3.42Å; S195-K198 PolarHBondContact O-N 3.17Å; F196-K198 VanDerWaalsContact C-N 3.27Å; F196-K198 PolarHBondContact O-N 3.3Å; K198-V201 PolarHBondContact O-N 2.93Å; K198-S202 PolarHBondContact O-N 3.22Å; K198-S202 VanDerWaalsContact O-N 3.09Å
199D89.9Confident87.8Confident92 Ų9276.2 Ų76.249%0.49241%0.407SS..Hα-helixtrans-65.3-40.1176.9-65.1-14.7000110.9S195 F196 S202S195-D199 PolarHBondContact O-N 3.19Å; F196-D199 PolarHBondContact O-N 3.2Å; D199-S202 WeakPolarHBondContact O-CB 3.23Å; D199-S202 PolarHBondContact O-N 3.05Å; D199-S202 PolarHBondContact O-OG 3.08Å
200V90.3Very high88Confident0 Ų073.5 Ų73.50%039%0.392CS..Hα-helixtrans-66.4-39.9177.6171.90000112.6K178 I181 F196 E197 S202 F208 L218K178-V200 WeakPolarHBondContact CD-O 3.48Å; K178-V200 WeakPolarHBondContact CE-O 3.46Å; K178-V200 HydrophobicContact CG-CG1 4.49Å; K178-V200 WeakPolarHBondContact CG-O 3.44Å; I181-V200 HydrophobicContact CD1-CG1 4.33Å; I181-V200 HydrophobicContact CG2-CG1 4.44Å; F196-V200 HydrophobicContact CD1-CG2 4.18Å; F196-V200 HydrophobicContact CE1-CG2 3.88Å; F196-V200 HydrophobicContact CE2-CG2 4.45Å; F196-V200 HydrophobicContact CZ-CG2 4.03Å; F196-V200 VanDerWaalsContact O-CG2 3.29Å; F196-V200 WeakPolarHBondContact O-CG2 3.41Å; F196-V200 PolarHBondContact O-N 3.27Å; E197-V200 PolarHBondContact O-N 3.36Å; V200-S202 VanDerWaalsContact C-N 3.28Å; V200-F208 HydrophobicContact CG2-CE2 3.9Å; V200-F208 HydrophobicContact CG2-CZ 4.39Å; V200-L218 HydrophobicContact CB-CD2 4.19Å; V200-L218 HydrophobicContact CG1-CD2 3.56Å; V200-L218 HydrophobicContact CG2-CD2 3.47Å; V200-L218 VanDerWaalsContact CG2-CD2 3.47Å; V200-L218 HydrophobicContact CG2-CG 4.29Å
201V88.8Confident88.2Confident52 Ų5271.6 Ų71.632%0.31538%0.384SS..Hα-helixtrans-82.7-7.2-178.7178.40000112.4I182 M185 P192 E197 K198I182-V201 HydrophobicContact CG1-CG2 4.35Å; M185-V201 HydrophobicContact CE-CG2 4.26Å; M185-V201 HydrophobicContact SD-CG2 3.82Å; P192-V201 HydrophobicContact CG-CB 4.14Å; P192-V201 HydrophobicContact CG-CG1 4.18Å; P192-V201 HydrophobicContact CG-CG2 4.05Å; E197-V201 WeakPolarHBondContact O-CB 3.33Å; E197-V201 VanDerWaalsContact O-CG2 3.31Å; E197-V201 WeakPolarHBondContact O-CG2 3.49Å; E197-V201 PolarHBondContact O-N 3.19Å; K198-V201 PolarHBondContact O-N 2.93Å
202S85.7Confident88.4Confident42 Ų4273 Ų7329%0.29439%0.385SS..SBendtrans-59.5151.417973.60000113K178 K198 D199 V200 D204K178-S202 WeakPolarHBondContact CE-O 3.48Å; K178-S202 PolarHBondContact NZ-O 3.49Å; K198-S202 PolarHBondContact O-N 3.22Å; K198-S202 VanDerWaalsContact O-N 3.09Å; D199-S202 WeakPolarHBondContact O-CB 3.23Å; D199-S202 PolarHBondContact O-N 3.05Å; D199-S202 PolarHBondContact O-OG 3.08Å; V200-S202 VanDerWaalsContact C-N 3.28Å; S202-D204 VanDerWaalsContact C-N 3.31Å
203E79.3Confident88.5Confident197 Ų19776.7 Ų76.792%0.92140%0.403SS*.SBendtrans-73.5-24.6179.5-66.1-177.918000112.5E205E203-E205 PolarHBondContact O-N 3.14Å
204D84.5Confident88.8Confident92 Ų9271.8 Ų71.849%0.49238%0.381SS..  trans-88.392.5-177.7-168.9-5.9000111.1S202 D206 A207S202-D204 VanDerWaalsContact C-N 3.31Å; D204-D206 PolarHBondContact O-N 3.5Å; D204-D206 PolarHBondContact OD1-N 3.38Å; D204-A207 HydrophobicContact CB-CB 4.16Å; D204-A207 PolarHBondContact O-N 2.84Å; D204-A207 PolarHBondContact OD1-N 2.83Å
205E80.7Confident88.9Confident55 Ų5569.1 Ų69.126%0.25736%0.364SS..G310 helixtrans-69.5-22.3179.7-68.7-174.8-177.200113.5Y171 F174 K178 E203Y171-E205 HydrophobicContact CE2-CB 4.22Å; Y171-E205 PolarHBondContact OH-OE2 3.08Å; Y171-E205 VanDerWaalsContact OH-OE2 3.08Å; F174-E205 HydrophobicContact CE1-CB 4.14Å; F174-E205 HydrophobicContact CE1-CG 4.17Å; K178-E205 HydrophobicContact CD-CG 4.41Å; K178-E205 IonicContact NZ-OE1 3.64Å; K178-E205 PolarHBondContact NZ-OE1 3.03Å; E203-E205 PolarHBondContact O-N 3.14Å
206D78.9Confident89.2Confident132 Ų13268.4 Ų68.471%0.70636%0.356SS*.G310 helixtrans-82-19.2-177.7-66.9-35.4000112D204 F208D204-D206 PolarHBondContact O-N 3.5Å; D204-D206 PolarHBondContact OD1-N 3.38Å; D206-F208 VanDerWaalsContact C-N 3.32Å
207A83.2Confident89.4Confident66 Ų6668.4 Ų68.455%0.54536%0.362SS..G310 helixtrans-76.6-15.9175.700000113.6D204D204-A207 HydrophobicContact CB-CB 4.16Å; D204-A207 PolarHBondContact O-N 2.84Å; D204-A207 PolarHBondContact OD1-N 2.83Å
208F88.4Confident89.5Confident16 Ų1667.4 Ų67.47%0.0736%0.358CS..SBendtrans-82.4122.4-176.4-172.4-93.7000112F174 F196 V200 D206 L210 N214 L218F174-F208 AromaticContact CD2-CD1 3.87Å; F174-F208 HydrophobicContact CD2-CD1 3.87Å; F174-F208 AromaticContact CD2-CE1 3.9Å; F174-F208 HydrophobicContact CD2-CE1 3.9Å; F174-F208 HydrophobicContact CE1-CB 4.29Å; F174-F208 HydrophobicContact CE1-CD1 4.46Å; F174-F208 HydrophobicContact CE2-CB 4.39Å; F174-F208 AromaticContact CE2-CD1 3.64Å; F174-F208 HydrophobicContact CE2-CD1 3.64Å; F174-F208 HydrophobicContact CE2-CD2 4.22Å; F174-F208 AromaticContact CE2-CE1 3.87Å; F174-F208 HydrophobicContact CE2-CE1 3.87Å; F174-F208 HydrophobicContact CE2-CE2 4.42Å; F174-F208 AromaticContact CE2-CG 3.82Å; F174-F208 HydrophobicContact CE2-CG 3.82Å; F174-F208 HydrophobicContact CE2-CZ 4.25Å; F174-F208 HydrophobicContact CG-CD1 4.35Å; F174-F208 HydrophobicContact CZ-CB 3.89Å; F174-F208 AromaticContact CZ-CD1 3.96Å; F174-F208 HydrophobicContact CZ-CD1 3.96Å; F174-F208 HydrophobicContact CZ-CD2 4.41Å; F174-F208 AromaticContact CZ-CG 3.83Å; F174-F208 HydrophobicContact CZ-CG 3.83Å; F196-F208 HydrophobicContact CE2-CE2 4.16Å; F196-F208 HydrophobicContact CE2-CZ 4.11Å; F196-F208 HydrophobicContact CZ-CZ 4.36Å; V200-F208 HydrophobicContact CG2-CE2 3.9Å; V200-F208 HydrophobicContact CG2-CZ 4.39Å; D206-F208 VanDerWaalsContact C-N 3.32Å; F208-L210 HydrophobicContact CD1-CD2 4.18Å; F208-L210 PolarHBondContact O-N 3.48Å; F208-N214 HydrophobicContact CE1-CB 3.95Å; F208-N214 HydrophobicContact CZ-CB 3.81Å; F208-L218 HydrophobicContact CE1-CD1 3.76Å; F208-L218 HydrophobicContact CZ-CD1 3.73Å; F208-L218 HydrophobicContact CZ-CG 4.26Å
209C88.8Confident89.7Confident56 Ų5666.3 Ų66.338%0.37835%0.353SS..  trans-70.1120.9177.2-55.10000111.3S211 N214C209-S211 PolarHBondContact O-N 3.25Å; C209-N214 WeakPolarHBondContact O-CB 3.36Å; C209-N214 PolarHBondContact O-ND2 3.25Å
210L92.6Very high90Very high4 Ų466.7 Ų66.72%0.02135%0.354CS..  trans-83.342.5-179.3-60.7174.4000112.3V134 L135 K167 R170 Y171 F174 F208 I215V134-L210 HydrophobicContact CG1-CB 4.26Å; V134-L210 HydrophobicContact CG1-CD1 3.94Å; V134-L210 HydrophobicContact CG1-CG 4.14Å; V134-L210 PolarHBondContact O-N 3.28Å; L135-L210 HydrophobicContact CD2-CB 4.27Å; K167-L210 HydrophobicContact CG-CD1 4.26Å; R170-L210 HydrophobicContact CB-CB 4.29Å; R170-L210 HydrophobicContact CB-CD1 4.49Å; R170-L210 VanDerWaalsContact CD-O 3.23Å; R170-L210 WeakPolarHBondContact CD-O 3.35Å; R170-L210 PolarHBondContact NH1-O 2.94Å; Y171-L210 HydrophobicContact CD2-CD1 4.3Å; F174-L210 HydrophobicContact CB-CD2 3.86Å; F174-L210 HydrophobicContact CD1-CD2 4.27Å; F174-L210 HydrophobicContact CG-CD2 4.1Å; F208-L210 HydrophobicContact CD1-CD2 4.18Å; F208-L210 PolarHBondContact O-N 3.48Å; L210-I215 HydrophobicContact CD2-CD1 4.47Å
211S93.8Very high90.3Very high13 Ų1367.2 Ų67.29%0.09136%0.357CS..  trans-68.4153.2175.886.10000110.9C209 D213 N214 I215C209-S211 PolarHBondContact O-N 3.25Å; S211-D213 PolarHBondContact O-N 2.94Å; S211-N214 PolarHBondContact O-N 2.89Å; S211-N214 VanDerWaalsContact OG-CB 3.31Å; S211-N214 WeakPolarHBondContact OG-CB 3.5Å; S211-N214 PolarHBondContact OG-N 3.33Å; S211-N214 PolarHBondContact OG-ND2 3.44Å; S211-N214 PolarHBondContact OG-OD1 2.91Å; S211-I215 WeakPolarHBondContact O-CG1 3.33Å; S211-I215 PolarHBondContact O-N 3.42Å
212R92.8Very high90.7Very high190 Ų19065.4 Ų65.472%0.71735%0.346SS*.Hα-helixtrans-60-35.6176.7-178.2177.5170.3-176.5-3.3112T216R212-T216 WeakPolarHBondContact O-CB 3.29Å; R212-T216 PolarHBondContact O-N 3.36Å; R212-T216 PolarHBondContact O-OG1 3.5Å
213D94.3Very high91.2Very high119 Ų11966.3 Ų66.364%0.63635%0.351SS*.Hα-helixtrans-71.7-37.4-179.8-63.7-19.2000111.1S211 T216 S217S211-D213 PolarHBondContact O-N 2.94Å; D213-T216 PolarHBondContact O-N 3.16Å; D213-S217 WeakPolarHBondContact O-CB 3.24Å; D213-S217 PolarHBondContact O-N 2.7Å; D213-S217 PolarHBondContact O-OG 3.44Å
214N94.1Very high91.9Very high42 Ų4260.3 Ų60.323%0.22532%0.323CS..Hα-helixtrans-67.1-43.6175.6-74-1.7000111.8F208 C209 S211 T216 S217 L218F208-N214 HydrophobicContact CE1-CB 3.95Å; F208-N214 HydrophobicContact CZ-CB 3.81Å; C209-N214 WeakPolarHBondContact O-CB 3.36Å; C209-N214 PolarHBondContact O-ND2 3.25Å; S211-N214 PolarHBondContact O-N 2.89Å; S211-N214 VanDerWaalsContact OG-CB 3.31Å; S211-N214 WeakPolarHBondContact OG-CB 3.5Å; S211-N214 PolarHBondContact OG-N 3.33Å; S211-N214 PolarHBondContact OG-ND2 3.44Å; S211-N214 PolarHBondContact OG-OD1 2.91Å; N214-T216 VanDerWaalsContact C-N 3.29Å; N214-T216 PolarHBondContact O-N 3.05Å; N214-S217 PolarHBondContact O-N 3.03Å; N214-L218 PolarHBondContact O-N 3.29Å
215I94.9Very high92.4Very high9 Ų956 Ų565%0.04630%0.3CS..Hα-helixtrans-61.4-39.3173.5-62.4-63.3000111.2E173 F174 L210 S211 L218 K219E173-I215 HydrophobicContact CG-CG2 4.45Å; F174-I215 HydrophobicContact CB-CD1 4.12Å; L210-I215 HydrophobicContact CD2-CD1 4.47Å; S211-I215 WeakPolarHBondContact O-CG1 3.33Å; S211-I215 PolarHBondContact O-N 3.42Å; I215-L218 HydrophobicContact CD1-CD1 4.14Å; I215-L218 WeakPolarHBondContact O-CB 3.42Å; I215-L218 PolarHBondContact O-N 3.08Å; I215-K219 WeakPolarHBondContact O-CG 3.3Å; I215-K219 PolarHBondContact O-N 3.09Å; I215-K219 VanDerWaalsContact O-N 3.14Å
216T96Very high93.1Very high78 Ų7857.5 Ų57.548%0.47931%0.307SS..Hα-helixtrans-66.4-40.1176.1-55.10000111.2R212 D213 N214 K219 L220R212-T216 WeakPolarHBondContact O-CB 3.29Å; R212-T216 PolarHBondContact O-N 3.36Å; R212-T216 PolarHBondContact O-OG1 3.5Å; D213-T216 PolarHBondContact O-N 3.16Å; N214-T216 VanDerWaalsContact C-N 3.29Å; N214-T216 PolarHBondContact O-N 3.05Å; T216-K219 PolarHBondContact O-N 2.78Å; T216-L220 PolarHBondContact O-N 2.9Å
217S95.3Very high93.9Very high48 Ų4857.6 Ų57.634%0.33630%0.303SS..Hα-helixtrans-66.8-36.3177.3-580000112.3F196 D213 N214 L220 L221F196-S217 VanDerWaalsContact CZ-CB 3.48Å; D213-S217 WeakPolarHBondContact O-CB 3.24Å; D213-S217 PolarHBondContact O-N 2.7Å; D213-S217 PolarHBondContact O-OG 3.44Å; N214-S217 PolarHBondContact O-N 3.03Å; S217-L220 PolarHBondContact O-N 3.36Å; S217-L221 WeakPolarHBondContact O-CB 3.44Å; S217-L221 PolarHBondContact O-N 3.28Å
218L95.6Very high94.3Very high0 Ų059.8 Ų59.80%030%0.297CS..Hα-helixtrans-60.6-47.2171.4-83.8159.1000112.2F174 L177 I181 F196 V200 F208 N214 I215 L220 L221 L222F174-L218 HydrophobicContact CD2-CD1 3.53Å; F174-L218 HydrophobicContact CD2-CD2 4.5Å; F174-L218 HydrophobicContact CE2-CD1 4.13Å; L177-L218 HydrophobicContact CD1-CB 4.12Å; I181-L218 HydrophobicContact CD1-CD2 3.67Å; F196-L218 HydrophobicContact CE1-CG 4.43Å; F196-L218 HydrophobicContact CZ-CG 3.99Å; V200-L218 HydrophobicContact CB-CD2 4.19Å; V200-L218 HydrophobicContact CG1-CD2 3.56Å; V200-L218 HydrophobicContact CG2-CD2 3.47Å; V200-L218 VanDerWaalsContact CG2-CD2 3.47Å; V200-L218 HydrophobicContact CG2-CG 4.29Å; F208-L218 HydrophobicContact CE1-CD1 3.76Å; F208-L218 HydrophobicContact CZ-CD1 3.73Å; F208-L218 HydrophobicContact CZ-CG 4.26Å; N214-L218 PolarHBondContact O-N 3.29Å; I215-L218 HydrophobicContact CD1-CD1 4.14Å; I215-L218 WeakPolarHBondContact O-CB 3.42Å; I215-L218 PolarHBondContact O-N 3.08Å; L218-L220 VanDerWaalsContact C-N 3.3Å; L218-L220 PolarHBondContact O-N 3.43Å; L218-L221 PolarHBondContact O-N 2.91Å; L218-L222 PolarHBondContact O-N 2.96Å
219K96.1Very high94.5Very high90 Ų9062.4 Ų62.439%0.39131%0.309SS..Hα-helixtrans-61.8-40.9176.2-70.1175.8-178.7177.80111.7E173 L177 I215 T216 L222 C223E173-K219 WeakPolarHBondContact OE1-CE 3.31Å; E173-K219 IonicContact OE1-NZ 3.18Å; E173-K219 PolarHBondContact OE1-NZ 3.45Å; L177-K219 HydrophobicContact CD1-CG 3.84Å; L177-K219 HydrophobicContact CD2-CG 4.37Å; I215-K219 WeakPolarHBondContact O-CG 3.3Å; I215-K219 PolarHBondContact O-N 3.09Å; I215-K219 VanDerWaalsContact O-N 3.14Å; T216-K219 PolarHBondContact O-N 2.78Å; K219-L222 PolarHBondContact O-N 2.95Å; K219-C223 PolarHBondContact O-N 2.84Å; K219-C223 PolarHBondContact O-SG 2.85Å
220L96.8Very high94.7Very high100 Ų10064.7 Ų64.752%0.52432%0.321SS..Hα-helixtrans-62.9-45176.1-179.963.2000111.4T216 S217 L218 L222 C223 Q224T216-L220 PolarHBondContact O-N 2.9Å; S217-L220 PolarHBondContact O-N 3.36Å; L218-L220 VanDerWaalsContact C-N 3.3Å; L218-L220 PolarHBondContact O-N 3.43Å; L220-L222 VanDerWaalsContact C-N 3.32Å; L220-L222 PolarHBondContact O-N 2.89Å; L220-C223 PolarHBondContact O-N 3.42Å; L220-Q224 HydrophobicContact CD1-CG 4.46Å; L220-Q224 VanDerWaalsContact O-CG 3.28Å; L220-Q224 WeakPolarHBondContact O-CG 3.49Å; L220-Q224 PolarHBondContact O-N 2.67Å
221L95.8Very high94.7Very high11 Ų1170.2 Ų70.26%0.05835%0.346CS..Hα-helixtrans-59.5-44.4176176.460.3000111.2I181 F196 E197 S217 L218 Q224 L225I181-L221 HydrophobicContact CD1-CD2 4.18Å; I181-L221 HydrophobicContact CD1-CG 4.38Å; I181-L221 HydrophobicContact CG2-CD2 4.21Å; F196-L221 HydrophobicContact CD1-CD2 4.35Å; F196-L221 HydrophobicContact CE1-CD2 4.3Å; E197-L221 HydrophobicContact CG-CD1 4.04Å; E197-L221 HydrophobicContact CG-CD2 3.81Å; S217-L221 WeakPolarHBondContact O-CB 3.44Å; S217-L221 PolarHBondContact O-N 3.28Å; L218-L221 PolarHBondContact O-N 2.91Å; L221-Q224 PolarHBondContact O-N 2.89Å; L221-L225 HydrophobicContact CD1-CD1 4.26Å; L221-L225 HydrophobicContact CD1-CG 4.29Å; L221-L225 HydrophobicContact CG-CD1 4.22Å; L221-L225 WeakPolarHBondContact O-CG 3.47Å; L221-L225 PolarHBondContact O-N 3.38Å
222L96.4Very high94.6Very high14 Ų1471.5 Ų71.57%0.07335%0.352CS..Hα-helixtrans-57.5-51.5175.4179.463.4000111.5L177 Q180 I181 L184 L218 K219 L220 Q224 L225 E226L177-L222 HydrophobicContact CD2-CD2 3.56Å; Q180-L222 HydrophobicContact CB-CD1 3.99Å; I181-L222 HydrophobicContact CD1-CB 4.43Å; I181-L222 HydrophobicContact CG1-CB 4.1Å; I181-L222 HydrophobicContact CG1-CD1 4.09Å; L184-L222 HydrophobicContact CD1-CD1 3.44Å; L184-L222 VanDerWaalsContact CD1-CD1 3.44Å; L218-L222 PolarHBondContact O-N 2.96Å; K219-L222 PolarHBondContact O-N 2.95Å; L220-L222 VanDerWaalsContact C-N 3.32Å; L220-L222 PolarHBondContact O-N 2.89Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 2.72Å; L222-L225 PolarHBondContact O-N 3.2Å; L222-L225 VanDerWaalsContact O-N 3.11Å; L222-E226 HydrophobicContact CD1-CG 4.45Å; L222-E226 WeakPolarHBondContact O-CG 3.43Å; L222-E226 PolarHBondContact O-N 2.85Å
223C96.8Very high94.6Very high60 Ų6066.2 Ų66.241%0.40534%0.336SS..Hα-helixtrans-56.7-43.7177.1-67.50000111.9K219 L220 L225 E226 E227K219-C223 PolarHBondContact O-N 2.84Å; K219-C223 PolarHBondContact O-SG 2.85Å; L220-C223 PolarHBondContact O-N 3.42Å; C223-L225 VanDerWaalsContact C-N 3.31Å; C223-L225 PolarHBondContact O-N 3.28Å; C223-E226 PolarHBondContact O-N 3.35Å; C223-E227 WeakPolarHBondContact O-CB 3.4Å; C223-E227 WeakPolarHBondContact O-CG 3.49Å; C223-E227 PolarHBondContact O-N 3.01Å
224Q95.1Very high94.6Very high71 Ų7163.4 Ų63.433%0.33233%0.329SS..Hα-helixtrans-65.1-33179-71.81751.200112.9L220 L221 L222 R228L220-Q224 HydrophobicContact CD1-CG 4.46Å; L220-Q224 VanDerWaalsContact O-CG 3.28Å; L220-Q224 WeakPolarHBondContact O-CG 3.49Å; L220-Q224 PolarHBondContact O-N 2.67Å; L221-Q224 PolarHBondContact O-N 2.89Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 2.72Å; Q224-R228 WeakPolarHBondContact O-CG 3.41Å; Q224-R228 PolarHBondContact O-N 3.1Å; Q224-R228 PolarHBondContact O-NH1 3.45Å; Q224-R228 VanDerWaalsContact O-NH1 3.15Å
225L95Very high94.6Very high1 Ų164.3 Ų64.31%0.00533%0.333CS..Hα-helixtrans-73.3-41.1175.3-69.3171.4000111.1I181 L184 M185 L188 L221 L222 C223 R228 K229I181-L225 HydrophobicContact CB-CD1 4.42Å; I181-L225 HydrophobicContact CG1-CD1 4.43Å; I181-L225 HydrophobicContact CG2-CD1 3.86Å; L184-L225 HydrophobicContact CB-CB 4.23Å; L184-L225 HydrophobicContact CB-CD1 4.48Å; L184-L225 HydrophobicContact CD1-CB 4.18Å; M185-L225 HydrophobicContact CG-CD1 3.8Å; M185-L225 HydrophobicContact CG-CD2 4.32Å; L188-L225 HydrophobicContact CD1-CB 4.36Å; L188-L225 HydrophobicContact CD1-CD2 4.08Å; L221-L225 HydrophobicContact CD1-CD1 4.26Å; L221-L225 HydrophobicContact CD1-CG 4.29Å; L221-L225 HydrophobicContact CG-CD1 4.22Å; L221-L225 WeakPolarHBondContact O-CG 3.47Å; L221-L225 PolarHBondContact O-N 3.38Å; L222-L225 PolarHBondContact O-N 3.2Å; L222-L225 VanDerWaalsContact O-N 3.11Å; C223-L225 VanDerWaalsContact C-N 3.31Å; C223-L225 PolarHBondContact O-N 3.28Å; L225-R228 PolarHBondContact O-N 3.35Å; L225-K229 PolarHBondContact O-N 3.44Å
226E95.4Very high94.6Very high88 Ų8863.9 Ų63.941%0.41133%0.331SS..Hα-helixtrans-62.2-44.1174.5-71177.9165.900112.1L184 L222 C223 R228 K229 V230L184-E226 HydrophobicContact CD1-CG 3.7Å; L222-E226 HydrophobicContact CD1-CG 4.45Å; L222-E226 WeakPolarHBondContact O-CG 3.43Å; L222-E226 PolarHBondContact O-N 2.85Å; C223-E226 PolarHBondContact O-N 3.35Å; E226-R228 PolarHBondContact O-N 3.44Å; E226-K229 WeakPolarHBondContact O-CB 3.46Å; E226-K229 PolarHBondContact O-N 3.29Å; E226-V230 WeakPolarHBondContact O-CG2 3.49Å; E226-V230 PolarHBondContact O-N 2.62Å
227E95.3Very high94.6Very high134 Ų13464.1 Ų64.163%0.62633%0.327SS*.Hα-helixtrans-59.2-47.1175.6-76.6174.3-178.700111.6C223 K229 V230 E231C223-E227 WeakPolarHBondContact O-CB 3.4Å; C223-E227 WeakPolarHBondContact O-CG 3.49Å; C223-E227 PolarHBondContact O-N 3.01Å; E227-K229 VanDerWaalsContact C-N 3.29Å; E227-K229 PolarHBondContact O-N 3.01Å; E227-V230 PolarHBondContact O-N 3.28Å; E227-E231 WeakPolarHBondContact O-CB 3.5Å; E227-E231 PolarHBondContact O-N 3.49Å
228R91.8Very high94.6Very high111 Ų11165.3 Ų65.342%0.41934%0.335SS..Hα-helixtrans-61.5-36.9175.6-75.4-174.7-166.297.5-8.6112.5L188 Q224 L225 E226 E231 N232L188-R228 HydrophobicContact CD1-CB 4.42Å; Q224-R228 WeakPolarHBondContact O-CG 3.41Å; Q224-R228 PolarHBondContact O-N 3.1Å; Q224-R228 PolarHBondContact O-NH1 3.45Å; Q224-R228 VanDerWaalsContact O-NH1 3.15Å; L225-R228 PolarHBondContact O-N 3.35Å; E226-R228 PolarHBondContact O-N 3.44Å; R228-E231 PolarHBondContact O-N 3.18Å; R228-N232 WeakPolarHBondContact O-CB 3.41Å; R228-N232 VanDerWaalsContact O-CG 3.24Å; R228-N232 PolarHBondContact O-N 3.4Å
229K92.1Very high94.6Very high72 Ų7267 Ų6731%0.31334%0.343SS..Hα-helixtrans-62.8-46175.2-179.1179.2173172.40111.6L184 E187 L188 L225 E226 E227 N232 E233L184-K229 HydrophobicContact CD2-CD 3.73Å; E187-K229 VanDerWaalsContact CD-CE 3.5Å; E187-K229 WeakPolarHBondContact OE1-CE 3.41Å; E187-K229 IonicContact OE1-NZ 2.76Å; E187-K229 PolarHBondContact OE1-NZ 3.18Å; E187-K229 WeakPolarHBondContact OE2-CE 3.38Å; E187-K229 IonicContact OE2-NZ 3.54Å; E187-K229 PolarHBondContact OE2-NZ 3.1Å; L188-K229 HydrophobicContact CD2-CB 3.99Å; L188-K229 HydrophobicContact CD2-CG 4.45Å; L225-K229 PolarHBondContact O-N 3.44Å; E226-K229 WeakPolarHBondContact O-CB 3.46Å; E226-K229 PolarHBondContact O-N 3.29Å; E227-K229 VanDerWaalsContact C-N 3.29Å; E227-K229 PolarHBondContact O-N 3.01Å; K229-N232 PolarHBondContact O-N 3.19Å; K229-E233 WeakPolarHBondContact O-CB 3.44Å; K229-E233 PolarHBondContact O-N 2.58Å
230V93.5Very high94.6Very high103 Ų10363 Ų6362%0.62433%0.325SS*.Hα-helixtrans-64.5-41.8177.5173.90000111.2E226 E227 E233 A234E226-V230 WeakPolarHBondContact O-CG2 3.49Å; E226-V230 PolarHBondContact O-N 2.62Å; E227-V230 PolarHBondContact O-N 3.28Å; V230-E233 PolarHBondContact O-N 3.29Å; V230-A234 WeakPolarHBondContact O-CB 3.47Å; V230-A234 PolarHBondContact O-N 3.45Å
231E92.6Very high94.6Very high120 Ų12063 Ų6356%0.56132%0.322SS*.Hα-helixtrans-62-47.2176.4-175.1174.8-162.300111.7E227 R228 E233 A234 I235E227-E231 WeakPolarHBondContact O-CB 3.5Å; E227-E231 PolarHBondContact O-N 3.49Å; R228-E231 PolarHBondContact O-N 3.18Å; E231-E233 VanDerWaalsContact C-N 3.34Å; E231-E233 PolarHBondContact O-N 3.1Å; E231-A234 PolarHBondContact O-N 3.18Å; E231-I235 HydrophobicContact CG-CD1 4.01Å; E231-I235 WeakPolarHBondContact O-CG1 3.18Å; E231-I235 PolarHBondContact O-N 3.43Å
232N91.7Very high94.6Very high41 Ų4166 Ų6622%0.21934%0.335CS..Hα-helixtrans-60.2-42.1176.6-76.2-13.4000112.3R228 K229 I235 C236R228-N232 WeakPolarHBondContact O-CB 3.41Å; R228-N232 VanDerWaalsContact O-CG 3.24Å; R228-N232 PolarHBondContact O-N 3.4Å; K229-N232 PolarHBondContact O-N 3.19Å; N232-I235 PolarHBondContact O-N 3.44Å; N232-C236 WeakPolarHBondContact O-CB 3.47Å; N232-C236 PolarHBondContact O-N 3.5Å; N232-C236 PolarHBondContact O-SG 3.47Å
233E93.1Very high94.6Very high79 Ų7965.3 Ų65.337%0.36933%0.332SS..Hα-helixtrans-60.5-46.3175-174.465.3-13200111.2K229 V230 E231 I235 C236 E237 R240 S267K229-E233 WeakPolarHBondContact O-CB 3.44Å; K229-E233 PolarHBondContact O-N 2.58Å; V230-E233 PolarHBondContact O-N 3.29Å; E231-E233 VanDerWaalsContact C-N 3.34Å; E231-E233 PolarHBondContact O-N 3.1Å; E233-I235 PolarHBondContact O-N 2.76Å; E233-C236 PolarHBondContact O-N 2.84Å; E233-E237 WeakPolarHBondContact O-CB 3.33Å; E233-E237 PolarHBondContact O-N 3.18Å; E233-R240 IonicContact OE1-CZ 3.19Å; E233-R240 IonicContact OE1-NH2 2.8Å; E233-R240 PolarHBondContact OE1-NH2 2.83Å; E233-S267 PolarHBondContact OE1-OG 3.33Å; E233-S267 WeakPolarHBondContact OE2-CB 3.25Å; E233-S267 PolarHBondContact OE2-OG 3.22Å
234A94.1Very high94.5Very high60 Ų6067.2 Ų67.250%0.49634%0.335SS..Hα-helixtrans-62.7-41.3179.600000112.4V230 E231 E237 S238V230-A234 WeakPolarHBondContact O-CB 3.47Å; V230-A234 PolarHBondContact O-N 3.45Å; E231-A234 PolarHBondContact O-N 3.18Å; A234-E237 PolarHBondContact O-N 3.49Å; A234-S238 PolarHBondContact O-N 3.41Å
235I93.9Very high94.6Very high61 Ų6169.7 Ų69.731%0.31335%0.346SS..Hα-helixtrans-66.1-44.6176-63.6166.7000110.4E231 N232 E233 E237 S238 H239 L272E231-I235 HydrophobicContact CG-CD1 4.01Å; E231-I235 WeakPolarHBondContact O-CG1 3.18Å; E231-I235 PolarHBondContact O-N 3.43Å; N232-I235 PolarHBondContact O-N 3.44Å; E233-I235 PolarHBondContact O-N 2.76Å; I235-E237 VanDerWaalsContact C-N 3.32Å; I235-E237 PolarHBondContact O-N 3.33Å; I235-S238 PolarHBondContact O-N 3.02Å; I235-H239 PolarHBondContact O-CD2 2.96Å; I235-H239 VanDerWaalsContact O-CD2 3.29Å; I235-H239 PolarHBondContact O-N 3.3Å; I235-L272 HydrophobicContact CB-CD1 4.39Å; I235-L272 HydrophobicContact CG2-CD1 3.58Å
236C94.6Very high94.5Very high0 Ų070.1 Ų70.10%035%0.348CS..Hα-helixtrans-59.2-44.9176.1-70.10000111.1N232 E233 S238 H239 R240 L275N232-C236 WeakPolarHBondContact O-CB 3.47Å; N232-C236 PolarHBondContact O-N 3.5Å; N232-C236 PolarHBondContact O-SG 3.47Å; E233-C236 PolarHBondContact O-N 2.84Å; C236-S238 PolarHBondContact O-N 3.39Å; C236-H239 PolarHBondContact O-N 3.44Å; C236-R240 WeakPolarHBondContact O-CG 3.12Å; C236-R240 PolarHBondContact O-N 3Å; C236-L275 HydrophobicContact CB-CD1 3.83Å
237E95.2Very high94.6Very high82 Ų8266.5 Ų66.538%0.38333%0.331SS..Hα-helixtrans-62.8-43.7179.2-16357.5-146.900112E233 A234 I235 H239 R240 E241E233-E237 WeakPolarHBondContact O-CB 3.33Å; E233-E237 PolarHBondContact O-N 3.18Å; A234-E237 PolarHBondContact O-N 3.49Å; I235-E237 VanDerWaalsContact C-N 3.32Å; I235-E237 PolarHBondContact O-N 3.33Å; E237-H239 VanDerWaalsContact C-N 3.3Å; E237-H239 PolarHBondContact O-N 3.03Å; E237-R240 WeakPolarHBondContact O-CB 3.5Å; E237-R240 PolarHBondContact O-N 2.92Å; E237-R240 VanDerWaalsContact O-N 3.1Å; E237-R240 IonicContact OE2-CZ 3.34Å; E237-R240 VanDerWaalsContact OE2-CZ 3.3Å; E237-R240 IonicContact OE2-NE 3.19Å; E237-R240 PolarHBondContact OE2-NE 2.89Å; E237-R240 IonicContact OE2-NH2 3.6Å; E237-R240 PolarHBondContact OE2-NH2 2.97Å; E237-E241 WeakPolarHBondContact O-CG 3.33Å; E237-E241 PolarHBondContact O-N 3.39Å
238S96.3Very high94.5Very high73 Ų7364.4 Ų64.451%0.5132%0.324SS..Hα-helixtrans-59.2-40.7174.3-176.70000112.4A234 I235 C236 K242A234-S238 PolarHBondContact O-N 3.41Å; I235-S238 PolarHBondContact O-N 3.02Å; C236-S238 PolarHBondContact O-N 3.39Å; S238-K242 WeakPolarHBondContact O-CB 3.47Å; S238-K242 PolarHBondContact O-N 3.45Å; S238-K242 VanDerWaalsContact O-N 3.08Å
239H95.9Very high94.6Very high37 Ų3766.2 Ų66.217%0.17133%0.331CS..Hα-helixtrans-66.8-40.6173.8-71.8-46.4000112.2I235 C236 E237 K242 I243 L275 Q276 V279I235-H239 PolarHBondContact O-CD2 2.96Å; I235-H239 VanDerWaalsContact O-CD2 3.29Å; I235-H239 PolarHBondContact O-N 3.3Å; C236-H239 PolarHBondContact O-N 3.44Å; E237-H239 VanDerWaalsContact C-N 3.3Å; E237-H239 PolarHBondContact O-N 3.03Å; H239-K242 PolarHBondContact O-N 2.67Å; H239-I243 WeakPolarHBondContact O-CB 3.5Å; H239-I243 WeakPolarHBondContact O-CD1 3.14Å; H239-I243 VanDerWaalsContact O-CG1 3.22Å; H239-I243 WeakPolarHBondContact O-CG1 3.42Å; H239-I243 PolarHBondContact O-N 2.93Å; H239-L275 HydrophobicContact CB-CB 3.99Å; H239-Q276 WeakPolarHBondContact NE2-CG 3.47Å; H239-V279 HydrophobicContact CB-CG2 4.2Å
240R96Very high94.6Very high5 Ų564.4 Ų64.42%0.01933%0.325CS..Hα-helixtrans-61.8-45.2176.9-73.9-173.2-76.3-109.74.5112.1E233 C236 E237 K242 I243 Q244 M264 A266 S267 L275E233-R240 IonicContact OE1-CZ 3.19Å; E233-R240 IonicContact OE1-NH2 2.8Å; E233-R240 PolarHBondContact OE1-NH2 2.83Å; C236-R240 WeakPolarHBondContact O-CG 3.12Å; C236-R240 PolarHBondContact O-N 3Å; E237-R240 WeakPolarHBondContact O-CB 3.5Å; E237-R240 PolarHBondContact O-N 2.92Å; E237-R240 VanDerWaalsContact O-N 3.1Å; E237-R240 IonicContact OE2-CZ 3.34Å; E237-R240 VanDerWaalsContact OE2-CZ 3.3Å; E237-R240 IonicContact OE2-NE 3.19Å; E237-R240 PolarHBondContact OE2-NE 2.89Å; E237-R240 IonicContact OE2-NH2 3.6Å; E237-R240 PolarHBondContact OE2-NH2 2.97Å; R240-K242 VanDerWaalsContact C-N 3.33Å; R240-K242 PolarHBondContact O-N 2.9Å; R240-I243 PolarHBondContact O-N 3.21Å; R240-Q244 PolarHBondContact O-N 2.97Å; R240-M264 HydrophobicContact CB-CE 3.86Å; R240-M264 HydrophobicContact CB-SD 4.34Å; R240-M264 WeakPolarHBondContact CD-O 3.1Å; R240-M264 HydrophobicContact CG-CE 3.92Å; R240-M264 HydrophobicContact CG-SD 3.81Å; R240-A266 PolarHBondContact NH1-O 3.42Å; R240-S267 PolarHBondContact NH1-OG 3.33Å; R240-S267 PolarHBondContact NH2-OG 3.27Å; R240-L275 HydrophobicContact CG-CD1 3.96Å; R240-L275 HydrophobicContact CG-CD2 3.79Å
241E96.1Very high94.6Very high99 Ų9966.7 Ų66.746%0.46333%0.328SS..Hα-helixtrans-59-45.6174.2-72.2-179.7174.700111.2E237 Q244 Q245E237-E241 WeakPolarHBondContact O-CG 3.33Å; E237-E241 PolarHBondContact O-N 3.39Å; E241-Q244 PolarHBondContact O-N 2.97Å; E241-Q245 VanDerWaalsContact O-CG 3.29Å; E241-Q245 WeakPolarHBondContact O-CG 3.3Å; E241-Q245 PolarHBondContact O-N 3.1Å
242K96Very high94.6Very high74 Ų7461.3 Ų61.332%0.32230%0.304SS..Hα-helixtrans-63.5-42.3177.7-173.6175.4-179.7-177.50112.2S238 H239 R240 Q245 L246 V279 E283S238-K242 WeakPolarHBondContact O-CB 3.47Å; S238-K242 PolarHBondContact O-N 3.45Å; S238-K242 VanDerWaalsContact O-N 3.08Å; H239-K242 PolarHBondContact O-N 2.67Å; R240-K242 VanDerWaalsContact C-N 3.33Å; R240-K242 PolarHBondContact O-N 2.9Å; K242-Q245 PolarHBondContact O-N 3.15Å; K242-L246 HydrophobicContact CG-CD1 4.2Å; K242-L246 WeakPolarHBondContact O-CB 3.22Å; K242-L246 WeakPolarHBondContact O-CG 3.44Å; K242-L246 PolarHBondContact O-N 2.85Å; K242-V279 HydrophobicContact CD-CG1 3.79Å; K242-V279 HydrophobicContact CD-CG2 4.37Å; K242-E283 WeakPolarHBondContact CE-OE1 3.49Å; K242-E283 IonicContact NZ-OE1 3.44Å; K242-E283 PolarHBondContact NZ-OE1 3.15Å
243I96.1Very high94.6Very high0 Ų062.2 Ų62.20%031%0.312CS..Hα-helixtrans-62-46.3176-72.6162.9000110.3H239 R240 Q245 L246 W247 L260 L275 E278 V279 L282H239-I243 WeakPolarHBondContact O-CB 3.5Å; H239-I243 WeakPolarHBondContact O-CD1 3.14Å; H239-I243 VanDerWaalsContact O-CG1 3.22Å; H239-I243 WeakPolarHBondContact O-CG1 3.42Å; H239-I243 PolarHBondContact O-N 2.93Å; R240-I243 PolarHBondContact O-N 3.21Å; I243-Q245 PolarHBondContact O-N 2.79Å; I243-L246 PolarHBondContact O-N 2.96Å; I243-W247 HydrophobicContact CG2-CD2 3.55Å; I243-W247 HydrophobicContact CG2-CE3 3.89Å; I243-W247 HydrophobicContact CG2-CG 4.16Å; I243-W247 HydrophobicContact CG2-CH2 3.83Å; I243-W247 HydrophobicContact CG2-CZ2 3.47Å; I243-W247 VanDerWaalsContact CG2-CZ2 3.47Å; I243-W247 HydrophobicContact CG2-CZ3 4.02Å; I243-W247 WeakPolarHBondContact O-CB 3.42Å; I243-W247 VanDerWaalsContact O-CG 3.32Å; I243-W247 PolarHBondContact O-N 2.88Å; I243-L260 HydrophobicContact CD1-CD2 4.01Å; I243-L260 HydrophobicContact CG2-CD2 4.22Å; I243-L275 HydrophobicContact CD1-CB 4.18Å; I243-L275 HydrophobicContact CD1-CD2 3.53Å; I243-L275 HydrophobicContact CD1-CG 4.47Å; I243-E278 HydrophobicContact CD1-CB 4.18Å; I243-E278 HydrophobicContact CD1-CG 4.18Å; I243-E278 HydrophobicContact CG1-CG 4.25Å; I243-E278 HydrophobicContact CG2-CG 4.37Å; I243-V279 HydrophobicContact CD1-CG2 3.93Å; I243-V279 HydrophobicContact CG1-CG2 3.56Å; I243-L282 HydrophobicContact CB-CD1 4.4Å; I243-L282 HydrophobicContact CG1-CD1 4.29Å; I243-L282 HydrophobicContact CG2-CD1 4.03Å
244Q95Very high94.5Very high101 Ų10163.3 Ų63.347%0.47232%0.317SS..Hα-helixtrans-58.8-46.5176.2-82.2176.9-10.600111.8R240 E241 L246 W247 D248 M264R240-Q244 PolarHBondContact O-N 2.97Å; E241-Q244 PolarHBondContact O-N 2.97Å; Q244-L246 VanDerWaalsContact C-N 3.33Å; Q244-L246 PolarHBondContact O-N 3.18Å; Q244-W247 HydrophobicContact CG-CE3 4.45Å; Q244-W247 PolarHBondContact O-N 3.23Å; Q244-D248 PolarHBondContact O-N 3.13Å; Q244-M264 HydrophobicContact CG-CE 4.13Å
245Q95.8Very high94.4Very high122 Ų12266.8 Ų66.857%0.5732%0.323SS*.Hα-helixtrans-58.8-44.1176-70171.826.700111.9E241 K242 I243 D248 R249E241-Q245 VanDerWaalsContact O-CG 3.29Å; E241-Q245 WeakPolarHBondContact O-CG 3.3Å; E241-Q245 PolarHBondContact O-N 3.1Å; K242-Q245 PolarHBondContact O-N 3.15Å; I243-Q245 PolarHBondContact O-N 2.79Å; Q245-D248 PolarHBondContact O-N 3.34Å; Q245-R249 WeakPolarHBondContact O-CB 3.43Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.49Å; Q245-R249 PolarHBondContact O-N 2.96Å
246L94.8Very high94.3Very high10 Ų1067.9 Ų67.95%0.05233%0.327CS..Hα-helixtrans-68.9-40.9178.4-73.4172.5000112.2K242 I243 Q244 D248 R249 L250 L282 E283K242-L246 HydrophobicContact CG-CD1 4.2Å; K242-L246 WeakPolarHBondContact O-CB 3.22Å; K242-L246 WeakPolarHBondContact O-CG 3.44Å; K242-L246 PolarHBondContact O-N 2.85Å; I243-L246 PolarHBondContact O-N 2.96Å; Q244-L246 VanDerWaalsContact C-N 3.33Å; Q244-L246 PolarHBondContact O-N 3.18Å; L246-D248 VanDerWaalsContact C-N 3.31Å; L246-D248 PolarHBondContact O-N 3.38Å; L246-R249 PolarHBondContact O-N 3.49Å; L246-L250 VanDerWaalsContact O-CB 3.24Å; L246-L250 WeakPolarHBondContact O-CB 3.44Å; L246-L250 WeakPolarHBondContact O-CG 3.44Å; L246-L250 PolarHBondContact O-N 3.31Å; L246-L282 HydrophobicContact CB-CB 4.07Å; L246-L282 HydrophobicContact CB-CD1 3.93Å; L246-L282 HydrophobicContact CD1-CB 3.7Å; L246-L282 HydrophobicContact CD1-CD1 4.37Å; L246-L282 HydrophobicContact CG-CB 4.44Å; L246-E283 HydrophobicContact CD1-CG 4.18Å
247W95.8Very high94.1Very high12 Ų1269.9 Ų69.95%0.04533%0.334CS..Hα-helixtrans-58.8-42.4174.8-78.7-12.7000112.1I243 Q244 Q251 V252 R257 L260 M264 E278I243-W247 HydrophobicContact CG2-CD2 3.55Å; I243-W247 HydrophobicContact CG2-CE3 3.89Å; I243-W247 HydrophobicContact CG2-CG 4.16Å; I243-W247 HydrophobicContact CG2-CH2 3.83Å; I243-W247 HydrophobicContact CG2-CZ2 3.47Å; I243-W247 VanDerWaalsContact CG2-CZ2 3.47Å; I243-W247 HydrophobicContact CG2-CZ3 4.02Å; I243-W247 WeakPolarHBondContact O-CB 3.42Å; I243-W247 VanDerWaalsContact O-CG 3.32Å; I243-W247 PolarHBondContact O-N 2.88Å; Q244-W247 HydrophobicContact CG-CE3 4.45Å; Q244-W247 PolarHBondContact O-N 3.23Å; W247-Q251 WeakPolarHBondContact O-CA 3.47Å; W247-Q251 PolarHBondContact O-N 2.9Å; W247-V252 HydrophobicContact CB-CB 4.44Å; W247-V252 HydrophobicContact CG-CB 4.29Å; W247-V252 PolarHBondContact O-N 3.22Å; W247-R257 HydrophobicContact CD2-CB 4.38Å; W247-R257 HydrophobicContact CD2-CG 3.7Å; W247-R257 HydrophobicContact CE3-CB 4.23Å; W247-R257 HydrophobicContact CE3-CG 3.84Å; W247-R257 HydrophobicContact CG-CG 4.15Å; W247-R257 HydrophobicContact CH2-CB 3.94Å; W247-R257 HydrophobicContact CH2-CG 4.33Å; W247-R257 HydrophobicContact CZ2-CB 4.09Å; W247-R257 HydrophobicContact CZ2-CG 4.21Å; W247-R257 HydrophobicContact CZ3-CB 4.02Å; W247-R257 HydrophobicContact CZ3-CG 4.16Å; W247-R257 PolarHBondContact O-NH2 3.3Å; W247-R257 VanDerWaalsContact O-NH2 3.07Å; W247-L260 HydrophobicContact CH2-CB 4.14Å; W247-L260 HydrophobicContact CH2-CD2 4Å; W247-L260 HydrophobicContact CZ2-CB 4.08Å; W247-L260 HydrophobicContact CZ2-CD2 3.76Å; W247-M264 HydrophobicContact CH2-CE 4.44Å; W247-M264 HydrophobicContact CH2-CG 4.18Å; W247-M264 HydrophobicContact CH2-SD 4.06Å; W247-M264 HydrophobicContact CZ3-CE 4.13Å; W247-M264 HydrophobicContact CZ3-SD 4.35Å; W247-E278 PolarHBondContact NE1-OE1 2.98Å
248D94.8Very high93.9Very high90 Ų9070.9 Ų70.948%0.48134%0.339SS..Hα-helixtrans-72.6-38.3179.1-67.8-16.2000112.1Q244 Q245 L246 Q251 R257Q244-D248 PolarHBondContact O-N 3.13Å; Q245-D248 PolarHBondContact O-N 3.34Å; L246-D248 VanDerWaalsContact C-N 3.31Å; L246-D248 PolarHBondContact O-N 3.38Å; D248-Q251 PolarHBondContact O-NE2 3.19Å; D248-R257 IonicContact OD1-CZ 3.09Å; D248-R257 IonicContact OD1-NH1 3.86Å; D248-R257 PolarHBondContact OD1-NH1 3.42Å; D248-R257 IonicContact OD1-NH2 2.63Å
249R93.1Very high93.6Very high150 Ų15074.4 Ų74.457%0.56635%0.351SS*.Hα-helixtrans-69.7-41.4176.4-72.6178.870.6-172.62112.9Q245 L246 Q251 E328Q245-R249 WeakPolarHBondContact O-CB 3.43Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.49Å; Q245-R249 PolarHBondContact O-N 2.96Å; L246-R249 PolarHBondContact O-N 3.49Å; R249-Q251 VanDerWaalsContact C-N 3.35Å; R249-E328 IonicContact CZ-OE1 3.28Å; R249-E328 IonicContact NH1-OE1 2.86Å; R249-E328 IonicContact NH2-OE1 3.08Å; R249-E328 PolarHBondContact NH2-OE1 3.39Å; R249-E328 IonicContact NH2-OE2 2.9Å
250L92.9Very high93.4Very high34 Ų3473.5 Ų73.518%0.17835%0.348CS..Hα-helixtrans-87.4-6-178.3-62.3172.1000113L246 V252 L282 L285 Q286L246-L250 VanDerWaalsContact O-CB 3.24Å; L246-L250 WeakPolarHBondContact O-CB 3.44Å; L246-L250 WeakPolarHBondContact O-CG 3.44Å; L246-L250 PolarHBondContact O-N 3.31Å; L250-V252 VanDerWaalsContact C-N 3.31Å; L250-V252 HydrophobicContact CB-CG2 3.99Å; L250-V252 PolarHBondContact O-N 3.21Å; L250-L282 HydrophobicContact CD1-CB 4.37Å; L250-L282 HydrophobicContact CD1-CD2 4.14Å; L250-L282 WeakPolarHBondContact CD1-O 3.36Å; L250-L285 HydrophobicContact CD1-CB 4.38Å; L250-L285 HydrophobicContact CD1-CD2 4.2Å; L250-L285 HydrophobicContact CD1-CG 4.31Å; L250-Q286 HydrophobicContact CD1-CB 4.31Å; L250-Q286 HydrophobicContact CD2-CB 3.98Å; L250-Q286 HydrophobicContact CD2-CG 4.29Å
251Q93.4Very high93.1Very high150 Ų15077.3 Ų77.370%0.70137%0.368SS*.THydrogen-bonded Turntrans55.545.2-178.4-61.2-71-44.100112.1W247 D248 R249W247-Q251 WeakPolarHBondContact O-CA 3.47Å; W247-Q251 PolarHBondContact O-N 2.9Å; D248-Q251 PolarHBondContact O-NE2 3.19Å; R249-Q251 VanDerWaalsContact C-N 3.35Å
252V91.9Very high92.7Very high8 Ų877.8 Ų77.85%0.04837%0.37CS..  trans-64.1131-179.4178.20000110W247 L250 E256 R257 L282W247-V252 HydrophobicContact CB-CB 4.44Å; W247-V252 HydrophobicContact CG-CB 4.29Å; W247-V252 PolarHBondContact O-N 3.22Å; L250-V252 VanDerWaalsContact C-N 3.31Å; L250-V252 HydrophobicContact CB-CG2 3.99Å; L250-V252 PolarHBondContact O-N 3.21Å; V252-E256 HydrophobicContact CG1-CB 3.75Å; V252-R257 HydrophobicContact CG1-CG 4.4Å; V252-R257 PolarHBondContact O-NE 3.12Å; V252-R257 PolarHBondContact O-NH2 2.98Å; V252-R257 VanDerWaalsContact O-NH2 3.13Å; V252-L282 HydrophobicContact CG2-CD2 3.92Å
253P92.7Very high92.4Very high59 Ų5975.9 Ų75.938%0.38336%0.363SS..  trans-58.6150.7-179.5-23.333000113.2E255 E256 R257P253-E255 VanDerWaalsContact CB-OE2 3.24Å; P253-E255 WeakPolarHBondContact CB-OE2 3.48Å; P253-E255 PolarHBondContact O-N 2.88Å; P253-E256 PolarHBondContact O-N 2.91Å; P253-R257 WeakPolarHBondContact O-CG 2.92Å; P253-R257 PolarHBondContact O-N 3.45Å
254Q90.8Very high92Very high102 Ų10277.4 Ų77.448%0.47737%0.37SS..Hα-helixtrans-62.7-34.2-176.6-174.661.426.800112E256 R257 E258Q254-E256 VanDerWaalsContact C-N 3.27Å; Q254-E256 PolarHBondContact O-N 3.36Å; Q254-R257 WeakPolarHBondContact O-CB 3.15Å; Q254-R257 PolarHBondContact O-N 2.99Å; Q254-R257 VanDerWaalsContact O-N 3.14Å; Q254-E258 HydrophobicContact CG-CG 4.39Å; Q254-E258 WeakPolarHBondContact O-CG 3.45Å; Q254-E258 PolarHBondContact O-N 3.2Å
255E92Very high91.6Very high134 Ų13478.4 Ų78.463%0.62638%0.383SS*.Hα-helixtrans-61.3-36179-58.381.8-179.600112P253P253-E255 VanDerWaalsContact CB-OE2 3.24Å; P253-E255 WeakPolarHBondContact CB-OE2 3.48Å; P253-E255 PolarHBondContact O-N 2.88Å
256E90.2Very high91.2Very high83 Ų8374.2 Ų74.239%0.38837%0.369SS..Hα-helixtrans-74.4-38.3175.6-71.1-178.1-138.500111.5V252 P253 Q254 E258 L259 R281V252-E256 HydrophobicContact CG1-CB 3.75Å; P253-E256 PolarHBondContact O-N 2.91Å; Q254-E256 VanDerWaalsContact C-N 3.27Å; Q254-E256 PolarHBondContact O-N 3.36Å; E256-E258 VanDerWaalsContact C-N 3.27Å; E256-E258 PolarHBondContact O-N 2.91Å; E256-L259 WeakPolarHBondContact O-CB 3.42Å; E256-L259 PolarHBondContact O-N 3.26Å; E256-R281 IonicContact OE2-NH1 3.98Å; E256-R281 IonicContact OE2-NH2 2.66Å
257R91.4Very high90.9Very high42 Ų4274.8 Ų74.816%0.15837%0.374CS..Hα-helixtrans-61.5-38.8175.7-57.9-175-165.9-149.9-1.1111.3W247 D248 V252 P253 Q254 L259 L260W247-R257 HydrophobicContact CD2-CB 4.38Å; W247-R257 HydrophobicContact CD2-CG 3.7Å; W247-R257 HydrophobicContact CE3-CB 4.23Å; W247-R257 HydrophobicContact CE3-CG 3.84Å; W247-R257 HydrophobicContact CG-CG 4.15Å; W247-R257 HydrophobicContact CH2-CB 3.94Å; W247-R257 HydrophobicContact CH2-CG 4.33Å; W247-R257 HydrophobicContact CZ2-CB 4.09Å; W247-R257 HydrophobicContact CZ2-CG 4.21Å; W247-R257 HydrophobicContact CZ3-CB 4.02Å; W247-R257 HydrophobicContact CZ3-CG 4.16Å; W247-R257 PolarHBondContact O-NH2 3.3Å; W247-R257 VanDerWaalsContact O-NH2 3.07Å; D248-R257 IonicContact OD1-CZ 3.09Å; D248-R257 IonicContact OD1-NH1 3.86Å; D248-R257 PolarHBondContact OD1-NH1 3.42Å; D248-R257 IonicContact OD1-NH2 2.63Å; V252-R257 HydrophobicContact CG1-CG 4.4Å; V252-R257 PolarHBondContact O-NE 3.12Å; V252-R257 PolarHBondContact O-NH2 2.98Å; V252-R257 VanDerWaalsContact O-NH2 3.13Å; P253-R257 WeakPolarHBondContact O-CG 2.92Å; P253-R257 PolarHBondContact O-N 3.45Å; Q254-R257 WeakPolarHBondContact O-CB 3.15Å; Q254-R257 PolarHBondContact O-N 2.99Å; Q254-R257 VanDerWaalsContact O-N 3.14Å; R257-L259 PolarHBondContact O-N 3.44Å; R257-L260 PolarHBondContact O-N 3.1Å; R257-L260 VanDerWaalsContact O-N 3.1Å
258E90.7Very high90.4Very high104 Ų10479.6 Ų79.649%0.48639%0.392SS..Hα-helixtrans-63.1-28.7-178.2-77.3174.4-169.300113.5Q254 E256 L260 N261Q254-E258 HydrophobicContact CG-CG 4.39Å; Q254-E258 WeakPolarHBondContact O-CG 3.45Å; Q254-E258 PolarHBondContact O-N 3.2Å; E256-E258 VanDerWaalsContact C-N 3.27Å; E256-E258 PolarHBondContact O-N 2.91Å; E258-L260 PolarHBondContact O-N 2.83Å; E258-N261 WeakPolarHBondContact CA-ND2 3.35Å; E258-N261 WeakPolarHBondContact O-CB 3.35Å; E258-N261 PolarHBondContact O-N 2.93Å; E258-N261 PolarHBondContact O-ND2 3.41Å
259L90.1Very high90Very high147 Ų14782.2 Ų82.277%0.7740%0.395SS*.THydrogen-bonded Turntrans-62.9-24176.2-62.3175000112.6E256 R257E256-L259 WeakPolarHBondContact O-CB 3.42Å; E256-L259 PolarHBondContact O-N 3.26Å; R257-L259 PolarHBondContact O-N 3.44Å
260L91.8Very high89.7Confident18 Ų1880.6 Ų80.69%0.09439%0.389CS..THydrogen-bonded Turntrans-98.7-2.2-178.1-153.276.2000113.4I243 W247 R257 E258 E262 H263 M264 L275 E278I243-L260 HydrophobicContact CD1-CD2 4.01Å; I243-L260 HydrophobicContact CG2-CD2 4.22Å; W247-L260 HydrophobicContact CH2-CB 4.14Å; W247-L260 HydrophobicContact CH2-CD2 4Å; W247-L260 HydrophobicContact CZ2-CB 4.08Å; W247-L260 HydrophobicContact CZ2-CD2 3.76Å; R257-L260 PolarHBondContact O-N 3.1Å; R257-L260 VanDerWaalsContact O-N 3.1Å; E258-L260 PolarHBondContact O-N 2.83Å; L260-E262 PolarHBondContact O-N 3.23Å; L260-E262 VanDerWaalsContact O-N 3.09Å; L260-H263 HydrophobicContact CD1-CB 4.39Å; L260-H263 HydrophobicContact CG-CB 4.23Å; L260-H263 PolarHBondContact O-N 3.25Å; L260-M264 HydrophobicContact CD2-CG 4.38Å; L260-M264 HydrophobicContact CD2-SD 3.93Å; L260-M264 HydrophobicContact CG-CG 4.49Å; L260-M264 WeakPolarHBondContact O-CG 3.4Å; L260-M264 PolarHBondContact O-N 3.45Å; L260-M264 VanDerWaalsContact O-N 3.08Å; L260-L275 HydrophobicContact CD2-CD2 4.13Å; L260-E278 HydrophobicContact CD1-CB 4.23Å; L260-E278 HydrophobicContact CD2-CB 4.12Å; L260-E278 HydrophobicContact CD2-CG 3.83Å
261N89.3Confident89.6Confident85 Ų8579 Ų7946%0.45538%0.381SS..THydrogen-bonded Turntrans-53-37.7-172.6-82-18.3000114E258 H263 M264E258-N261 WeakPolarHBondContact CA-ND2 3.35Å; E258-N261 WeakPolarHBondContact O-CB 3.35Å; E258-N261 PolarHBondContact O-N 2.93Å; E258-N261 PolarHBondContact O-ND2 3.41Å; N261-H263 VanDerWaalsContact C-N 3.31Å; N261-H263 PolarHBondContact O-N 3.5Å; N261-M264 PolarHBondContact O-N 2.87Å
262E88.3Confident89.5Confident108 Ų10873 Ų7351%0.50535%0.353SS..THydrogen-bonded Turntrans-61-40.7177.4-174.8179.3166.100111.9L260 A266 R270L260-E262 PolarHBondContact O-N 3.23Å; L260-E262 VanDerWaalsContact O-N 3.09Å; E262-A266 PolarHBondContact O-N 3.39Å; E262-R270 IonicContact OE1-CZ 2.58Å; E262-R270 IonicContact OE1-NH1 3.83Å; E262-R270 PolarHBondContact OE1-NH1 3.32Å; E262-R270 IonicContact OE1-NH2 2.78Å; E262-R270 PolarHBondContact OE1-NH2 3.09Å
263H89.2Confident89.5Confident35 Ų3577.1 Ų77.116%0.16237%0.372CS..THydrogen-bonded Turntrans-81.4-16.8-179-54-61.1000112.8L260 N261 V265 N271 A274 L275L260-H263 HydrophobicContact CD1-CB 4.39Å; L260-H263 HydrophobicContact CG-CB 4.23Å; L260-H263 PolarHBondContact O-N 3.25Å; N261-H263 VanDerWaalsContact C-N 3.31Å; N261-H263 PolarHBondContact O-N 3.5Å; H263-V265 PolarHBondContact O-N 3.19Å; H263-N271 HydrophobicContact CB-CB 4.24Å; H263-N271 PolarHBondContact ND1-OD1 2.99Å; H263-A274 HydrophobicContact CB-CB 4.38Å; H263-L275 HydrophobicContact CB-CD2 4.34Å; H263-L275 HydrophobicContact CB-CG 4.41Å
264M87.2Confident89.5Confident32 Ų3275.4 Ų75.416%0.15836%0.363CS..THydrogen-bonded Turntrans-75.5-8.4175.8-67.1-59.3-68.800113.8R240 Q244 W247 L260 N261 L275R240-M264 HydrophobicContact CB-CE 3.86Å; R240-M264 HydrophobicContact CB-SD 4.34Å; R240-M264 WeakPolarHBondContact CD-O 3.1Å; R240-M264 HydrophobicContact CG-CE 3.92Å; R240-M264 HydrophobicContact CG-SD 3.81Å; Q244-M264 HydrophobicContact CG-CE 4.13Å; W247-M264 HydrophobicContact CH2-CE 4.44Å; W247-M264 HydrophobicContact CH2-CG 4.18Å; W247-M264 HydrophobicContact CH2-SD 4.06Å; W247-M264 HydrophobicContact CZ3-CE 4.13Å; W247-M264 HydrophobicContact CZ3-SD 4.35Å; L260-M264 HydrophobicContact CD2-CG 4.38Å; L260-M264 HydrophobicContact CD2-SD 3.93Å; L260-M264 HydrophobicContact CG-CG 4.49Å; L260-M264 WeakPolarHBondContact O-CG 3.4Å; L260-M264 PolarHBondContact O-N 3.45Å; L260-M264 VanDerWaalsContact O-N 3.08Å; N261-M264 PolarHBondContact O-N 2.87Å; M264-L275 HydrophobicContact SD-CD2 4.03Å
265V87.6Confident89.8Confident121 Ų12170.5 Ų70.573%0.73334%0.34SS*.THydrogen-bonded Turntrans-119.8-41.9-178.1-178.90000112.2H263H263-V265 PolarHBondContact O-N 3.19Å
266A86.9Confident89.9Confident35 Ų3568.4 Ų68.429%0.28933%0.33SS..  trans-94.6151.3-175.800000111.6R240 E262 N271R240-A266 PolarHBondContact NH1-O 3.42Å; E262-A266 PolarHBondContact O-N 3.39Å; A266-N271 WeakPolarHBondContact CB-ND2 3.08Å; A266-N271 WeakPolarHBondContact O-CB 3.34Å; A266-N271 PolarHBondContact O-ND2 3.36Å
267S88.4Confident90.2Very high21 Ų2169 Ų6915%0.14734%0.34CS..  trans-124.332.7-175.2-52.60000114E233 R240 N271E233-S267 PolarHBondContact OE1-OG 3.33Å; E233-S267 WeakPolarHBondContact OE2-CB 3.25Å; E233-S267 PolarHBondContact OE2-OG 3.22Å; R240-S267 PolarHBondContact NH1-OG 3.33Å; R240-S267 PolarHBondContact NH2-OG 3.27Å; S267-N271 PolarHBondContact N-ND2 3.29Å
268R86.4Confident90.4Very high113 Ų11368.2 Ų68.243%0.42634%0.338SS..SBendtrans-69.5164.8170.4-58.8-167.1-176.4-178.3-2.6110.9R270 N271 L272R268-R270 VanDerWaalsContact C-N 3.31Å; R268-R270 HydrophobicContact CB-CG 4.32Å; R268-R270 PolarHBondContact O-N 2.95Å; R268-N271 PolarHBondContact N-ND2 2.92Å; R268-N271 VanDerWaalsContact N-ND2 3.18Å; R268-N271 WeakPolarHBondContact O-CA 3.22Å; R268-N271 WeakPolarHBondContact O-CB 3.22Å; R268-N271 PolarHBondContact O-N 2.98Å; R268-L272 PolarHBondContact O-N 3.31Å; R268-L272 VanDerWaalsContact O-N 3.13Å
269R85.2Confident90.6Very high146 Ų14663.6 Ų63.655%0.55132%0.317SS*.Hα-helixtrans-50.4-47.8178.5-177.4178-178.9139.34.2113.2D189 N271 L272 E273D189-R269 HydrophobicContact CB-CB 4.36Å; R269-N271 PolarHBondContact O-N 3.11Å; R269-L272 WeakPolarHBondContact O-CB 3.43Å; R269-L272 PolarHBondContact O-N 3.4Å; R269-L272 VanDerWaalsContact O-N 3.15Å; R269-E273 IonicContact NE-OE1 3.69Å; R269-E273 PolarHBondContact NE-OE1 2.78Å; R269-E273 PolarHBondContact O-N 3.15Å; R269-E273 VanDerWaalsContact O-N 3.1Å
270R87.7Confident90.9Very high115 Ų11561.6 Ų61.643%0.43430%0.303SS..Hα-helixtrans-57.3-31.4177.369.2-179.4-177.71316.6113.5E262 R268 A274E262-R270 IonicContact OE1-CZ 2.58Å; E262-R270 IonicContact OE1-NH1 3.83Å; E262-R270 PolarHBondContact OE1-NH1 3.32Å; E262-R270 IonicContact OE1-NH2 2.78Å; E262-R270 PolarHBondContact OE1-NH2 3.09Å; R268-R270 VanDerWaalsContact C-N 3.31Å; R268-R270 HydrophobicContact CB-CG 4.32Å; R268-R270 PolarHBondContact O-N 2.95Å; R270-A274 WeakPolarHBondContact O-CB 3.45Å; R270-A274 PolarHBondContact O-N 2.96Å
271N90.8Very high91.1Very high0 Ų064.7 Ų64.70%031%0.314CS..Hα-helixtrans-78.3-40.1-180-54.5-33.6000110.6H263 A266 S267 R268 R269 E273 A274 L275H263-N271 HydrophobicContact CB-CB 4.24Å; H263-N271 PolarHBondContact ND1-OD1 2.99Å; A266-N271 WeakPolarHBondContact CB-ND2 3.08Å; A266-N271 WeakPolarHBondContact O-CB 3.34Å; A266-N271 PolarHBondContact O-ND2 3.36Å; S267-N271 PolarHBondContact N-ND2 3.29Å; R268-N271 PolarHBondContact N-ND2 2.92Å; R268-N271 VanDerWaalsContact N-ND2 3.18Å; R268-N271 WeakPolarHBondContact O-CA 3.22Å; R268-N271 WeakPolarHBondContact O-CB 3.22Å; R268-N271 PolarHBondContact O-N 2.98Å; R269-N271 PolarHBondContact O-N 3.11Å; N271-E273 VanDerWaalsContact C-N 3.31Å; N271-E273 PolarHBondContact O-N 3.47Å; N271-A274 PolarHBondContact O-N 3.27Å; N271-L275 WeakPolarHBondContact O-CB 3.48Å; N271-L275 WeakPolarHBondContact O-CG 3.42Å; N271-L275 PolarHBondContact O-N 3.47Å
272L90.9Very high91.4Very high25 Ų2560.7 Ų60.713%0.13129%0.292CS..Hα-helixtrans-57-47.2173.9178.360.5000111.2I235 R268 R269 A274 L275 Q276I235-L272 HydrophobicContact CB-CD1 4.39Å; I235-L272 HydrophobicContact CG2-CD1 3.58Å; R268-L272 PolarHBondContact O-N 3.31Å; R268-L272 VanDerWaalsContact O-N 3.13Å; R269-L272 WeakPolarHBondContact O-CB 3.43Å; R269-L272 PolarHBondContact O-N 3.4Å; R269-L272 VanDerWaalsContact O-N 3.15Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 3.35Å; L272-L275 PolarHBondContact O-N 3.35Å; L272-Q276 HydrophobicContact CD1-CG 4.35Å; L272-Q276 WeakPolarHBondContact O-CB 3.46Å; L272-Q276 WeakPolarHBondContact O-CG 3.33Å; L272-Q276 PolarHBondContact O-N 2.87Å
273E91.7Very high91.7Very high95 Ų9559.1 Ų59.144%0.44429%0.285SS..Hα-helixtrans-61.6-41.3177.5-68.2172.8-173.100111.8R269 N271 T277R269-E273 IonicContact NE-OE1 3.69Å; R269-E273 PolarHBondContact NE-OE1 2.78Å; R269-E273 PolarHBondContact O-N 3.15Å; R269-E273 VanDerWaalsContact O-N 3.1Å; N271-E273 VanDerWaalsContact C-N 3.31Å; N271-E273 PolarHBondContact O-N 3.47Å; E273-T277 WeakPolarHBondContact O-CB 3.44Å; E273-T277 PolarHBondContact O-N 3.32Å; E273-T277 PolarHBondContact O-OG1 3.25Å
274A93.8Very high91.9Very high22 Ų2262.1 Ų62.118%0.18230%0.299CS..Hα-helixtrans-65.9-43.9175.900000112.6H263 R270 N271 L272 T277 E278H263-A274 HydrophobicContact CB-CB 4.38Å; R270-A274 WeakPolarHBondContact O-CB 3.45Å; R270-A274 PolarHBondContact O-N 2.96Å; N271-A274 PolarHBondContact O-N 3.27Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 3.35Å; A274-T277 PolarHBondContact O-N 3.42Å; A274-E278 PolarHBondContact O-N 2.69Å
275L95.3Very high92.3Very high0 Ų063.3 Ų63.30%031%0.306CS..Hα-helixtrans-63.2-43177.1-69.2170.2000111.2C236 H239 R240 I243 L260 H263 M264 N271 L272 T277 E278 V279C236-L275 HydrophobicContact CB-CD1 3.83Å; H239-L275 HydrophobicContact CB-CB 3.99Å; R240-L275 HydrophobicContact CG-CD1 3.96Å; R240-L275 HydrophobicContact CG-CD2 3.79Å; I243-L275 HydrophobicContact CD1-CB 4.18Å; I243-L275 HydrophobicContact CD1-CD2 3.53Å; I243-L275 HydrophobicContact CD1-CG 4.47Å; L260-L275 HydrophobicContact CD2-CD2 4.13Å; H263-L275 HydrophobicContact CB-CD2 4.34Å; H263-L275 HydrophobicContact CB-CG 4.41Å; M264-L275 HydrophobicContact SD-CD2 4.03Å; N271-L275 WeakPolarHBondContact O-CB 3.48Å; N271-L275 WeakPolarHBondContact O-CG 3.42Å; N271-L275 PolarHBondContact O-N 3.47Å; L272-L275 PolarHBondContact O-N 3.35Å; L275-T277 VanDerWaalsContact C-N 3.35Å; L275-T277 PolarHBondContact O-N 2.91Å; L275-E278 PolarHBondContact O-N 2.63Å; L275-V279 WeakPolarHBondContact O-CG2 3.45Å; L275-V279 PolarHBondContact O-N 3.05Å
276Q95.4Very high92.6Very high89 Ų8959.3 Ų59.342%0.41628%0.279SS..Hα-helixtrans-61.5-43.6175.6-76.2177.2-12.800112.1H239 L272 E278 V279 H280H239-Q276 WeakPolarHBondContact NE2-CG 3.47Å; L272-Q276 HydrophobicContact CD1-CG 4.35Å; L272-Q276 WeakPolarHBondContact O-CB 3.46Å; L272-Q276 WeakPolarHBondContact O-CG 3.33Å; L272-Q276 PolarHBondContact O-N 2.87Å; Q276-E278 VanDerWaalsContact C-N 3.32Å; Q276-E278 PolarHBondContact O-N 3.27Å; Q276-V279 PolarHBondContact O-N 3.32Å; Q276-H280 PolarHBondContact O-N 3.36Å
277T95.6Very high92.9Very high97 Ų9761.8 Ų61.860%0.59529%0.287SS*.Hα-helixtrans-61.4-43.1177.1-57.80000111E273 A274 L275 H280 R281E273-T277 WeakPolarHBondContact O-CB 3.44Å; E273-T277 PolarHBondContact O-N 3.32Å; E273-T277 PolarHBondContact O-OG1 3.25Å; A274-T277 PolarHBondContact O-N 3.42Å; L275-T277 VanDerWaalsContact C-N 3.35Å; L275-T277 PolarHBondContact O-N 2.91Å; T277-H280 PolarHBondContact O-N 3.14Å; T277-R281 WeakPolarHBondContact O-CB 3.33Å; T277-R281 PolarHBondContact O-N 3.28Å
278E95.1Very high93.1Very high24 Ų2464.5 Ų64.511%0.11230%0.3CS..Hα-helixtrans-68.4-41.8178.2-179.364.5-175.500112.4I243 W247 L260 A274 L275 Q276 H280 R281 L282I243-E278 HydrophobicContact CD1-CB 4.18Å; I243-E278 HydrophobicContact CD1-CG 4.18Å; I243-E278 HydrophobicContact CG1-CG 4.25Å; I243-E278 HydrophobicContact CG2-CG 4.37Å; W247-E278 PolarHBondContact NE1-OE1 2.98Å; L260-E278 HydrophobicContact CD1-CB 4.23Å; L260-E278 HydrophobicContact CD2-CB 4.12Å; L260-E278 HydrophobicContact CD2-CG 3.83Å; A274-E278 PolarHBondContact O-N 2.69Å; L275-E278 PolarHBondContact O-N 2.63Å; Q276-E278 VanDerWaalsContact C-N 3.32Å; Q276-E278 PolarHBondContact O-N 3.27Å; E278-H280 VanDerWaalsContact C-N 3.28Å; E278-H280 PolarHBondContact O-N 2.96Å; E278-R281 PolarHBondContact O-N 3.43Å; E278-R281 IonicContact OE1-CZ 2.63Å; E278-R281 IonicContact OE1-NE 3.02Å; E278-R281 PolarHBondContact OE1-NE 3.05Å; E278-R281 IonicContact OE1-NH2 3.98Å; E278-R281 PolarHBondContact OE1-NH2 3.45Å; E278-R281 IonicContact OE2-CZ 3.95Å; E278-R281 IonicContact OE2-NE 2.69Å; E278-R281 PolarHBondContact OE2-NE 3.35Å; E278-R281 IonicContact OE2-NH2 2.96Å; E278-L282 HydrophobicContact CG-CD1 3.87Å; E278-L282 HydrophobicContact CG-CG 4.24Å; E278-L282 WeakPolarHBondContact O-CB 3.41Å; E278-L282 VanDerWaalsContact O-CG 3.3Å; E278-L282 WeakPolarHBondContact O-CG 3.47Å; E278-L282 PolarHBondContact O-N 3.44Å; E278-L282 WeakPolarHBondContact OE1-CG 3.4Å
279V96.3Very high93.5Very high8 Ų862.3 Ų62.35%0.04830%0.296CS..Hα-helixtrans-54.7-49.2173.4167.80000110.1H239 K242 I243 L275 Q276 R281 L282 E283H239-V279 HydrophobicContact CB-CG2 4.2Å; K242-V279 HydrophobicContact CD-CG1 3.79Å; K242-V279 HydrophobicContact CD-CG2 4.37Å; I243-V279 HydrophobicContact CD1-CG2 3.93Å; I243-V279 HydrophobicContact CG1-CG2 3.56Å; L275-V279 WeakPolarHBondContact O-CG2 3.45Å; L275-V279 PolarHBondContact O-N 3.05Å; Q276-V279 PolarHBondContact O-N 3.32Å; V279-R281 PolarHBondContact O-N 2.9Å; V279-L282 PolarHBondContact O-N 3.4Å; V279-E283 HydrophobicContact CG1-CG 4.43Å; V279-E283 WeakPolarHBondContact O-CG 3.15Å; V279-E283 PolarHBondContact O-N 2.99Å
280H96.2Very high93.9Very high104 Ų10456.2 Ų56.248%0.48128%0.275SS..Hα-helixtrans-61.2-47.2-179.9-176.351.1000111.8Q276 T277 E278 L282 E283 E284Q276-H280 PolarHBondContact O-N 3.36Å; T277-H280 PolarHBondContact O-N 3.14Å; E278-H280 VanDerWaalsContact C-N 3.28Å; E278-H280 PolarHBondContact O-N 2.96Å; H280-L282 VanDerWaalsContact C-N 3.31Å; H280-L282 PolarHBondContact O-N 2.87Å; H280-E283 PolarHBondContact O-N 3.04Å; H280-E284 IonicContact CE1-OE1 3.75Å; H280-E284 IonicContact NE2-OE1 3.58Å; H280-E284 PolarHBondContact NE2-OE1 3.33Å; H280-E284 WeakPolarHBondContact O-CG 3.44Å; H280-E284 PolarHBondContact O-N 3.08Å
281R95.9Very high94.3Very high84 Ų8456 Ų5632%0.31727%0.274SS..Hα-helixtrans-57.8-42.5177-170-163.672.689.9-6.4112.2E256 T277 E278 V279 L285E256-R281 IonicContact OE2-NH1 3.98Å; E256-R281 IonicContact OE2-NH2 2.66Å; T277-R281 WeakPolarHBondContact O-CB 3.33Å; T277-R281 PolarHBondContact O-N 3.28Å; E278-R281 PolarHBondContact O-N 3.43Å; E278-R281 IonicContact OE1-CZ 2.63Å; E278-R281 IonicContact OE1-NE 3.02Å; E278-R281 PolarHBondContact OE1-NE 3.05Å; E278-R281 IonicContact OE1-NH2 3.98Å; E278-R281 PolarHBondContact OE1-NH2 3.45Å; E278-R281 IonicContact OE2-CZ 3.95Å; E278-R281 IonicContact OE2-NE 2.69Å; E278-R281 PolarHBondContact OE2-NE 3.35Å; E278-R281 IonicContact OE2-NH2 2.96Å; V279-R281 PolarHBondContact O-N 2.9Å; R281-L285 WeakPolarHBondContact O-CB 3.48Å; R281-L285 PolarHBondContact O-N 2.78Å
282L95.5Very high94.4Very high0 Ų060.4 Ų60.40%030%0.297CS..Hα-helixtrans-70.4-37.5179.4-70.4172000112.3I243 L246 L250 V252 E278 V279 H280 L285 Q286I243-L282 HydrophobicContact CB-CD1 4.4Å; I243-L282 HydrophobicContact CG1-CD1 4.29Å; I243-L282 HydrophobicContact CG2-CD1 4.03Å; L246-L282 HydrophobicContact CB-CB 4.07Å; L246-L282 HydrophobicContact CB-CD1 3.93Å; L246-L282 HydrophobicContact CD1-CB 3.7Å; L246-L282 HydrophobicContact CD1-CD1 4.37Å; L246-L282 HydrophobicContact CG-CB 4.44Å; L250-L282 HydrophobicContact CD1-CB 4.37Å; L250-L282 HydrophobicContact CD1-CD2 4.14Å; L250-L282 WeakPolarHBondContact CD1-O 3.36Å; V252-L282 HydrophobicContact CG2-CD2 3.92Å; E278-L282 HydrophobicContact CG-CD1 3.87Å; E278-L282 HydrophobicContact CG-CG 4.24Å; E278-L282 WeakPolarHBondContact O-CB 3.41Å; E278-L282 VanDerWaalsContact O-CG 3.3Å; E278-L282 WeakPolarHBondContact O-CG 3.47Å; E278-L282 PolarHBondContact O-N 3.44Å; E278-L282 WeakPolarHBondContact OE1-CG 3.4Å; V279-L282 PolarHBondContact O-N 3.4Å; H280-L282 VanDerWaalsContact C-N 3.31Å; H280-L282 PolarHBondContact O-N 2.87Å; L282-L285 PolarHBondContact O-N 2.9Å; L282-Q286 PolarHBondContact O-N 3.35Å
283E94.3Very high94.6Very high76 Ų7662.7 Ų62.736%0.35531%0.312SS..Hα-helixtrans-64.1-42.6173.2-73.4179.5146.300111.8K242 L246 V279 H280 L285 Q286 L287K242-E283 WeakPolarHBondContact CE-OE1 3.49Å; K242-E283 IonicContact NZ-OE1 3.44Å; K242-E283 PolarHBondContact NZ-OE1 3.15Å; L246-E283 HydrophobicContact CD1-CG 4.18Å; V279-E283 HydrophobicContact CG1-CG 4.43Å; V279-E283 WeakPolarHBondContact O-CG 3.15Å; V279-E283 PolarHBondContact O-N 2.99Å; H280-E283 PolarHBondContact O-N 3.04Å; E283-L285 VanDerWaalsContact C-N 3.33Å; E283-L285 PolarHBondContact O-N 2.9Å; E283-Q286 WeakPolarHBondContact O-CB 3.5Å; E283-Q286 PolarHBondContact O-N 3.19Å; E283-L287 WeakPolarHBondContact O-CB 3.47Å; E283-L287 PolarHBondContact O-N 2.82Å
284E94.3Very high94.9Very high98 Ų9858.1 Ų58.146%0.45829%0.291SS..Hα-helixtrans-62.2-41.1173.4-72.5-170.8149.500111.8H280 L287 N288H280-E284 IonicContact CE1-OE1 3.75Å; H280-E284 IonicContact NE2-OE1 3.58Å; H280-E284 PolarHBondContact NE2-OE1 3.33Å; H280-E284 WeakPolarHBondContact O-CG 3.44Å; H280-E284 PolarHBondContact O-N 3.08Å; E284-L287 PolarHBondContact O-N 3.34Å; E284-N288 WeakPolarHBondContact O-CB 3.42Å; E284-N288 VanDerWaalsContact O-CG 3.32Å; E284-N288 PolarHBondContact O-N 3.04Å; E284-N288 PolarHBondContact O-ND2 2.88Å
285L94.5Very high94.9Very high57 Ų5760.7 Ų60.730%0.29830%0.299SS..Hα-helixtrans-62.9-42.3175.5-178.360.2000111.6L250 R281 L282 E283 N288 N289L250-L285 HydrophobicContact CD1-CB 4.38Å; L250-L285 HydrophobicContact CD1-CD2 4.2Å; L250-L285 HydrophobicContact CD1-CG 4.31Å; R281-L285 WeakPolarHBondContact O-CB 3.48Å; R281-L285 PolarHBondContact O-N 2.78Å; L282-L285 PolarHBondContact O-N 2.9Å; E283-L285 VanDerWaalsContact C-N 3.33Å; E283-L285 PolarHBondContact O-N 2.9Å; L285-N288 PolarHBondContact O-N 3.08Å; L285-N289 WeakPolarHBondContact O-CB 3.45Å; L285-N289 PolarHBondContact O-N 3.29Å
286Q93.6Very high95Very high37 Ų3763.1 Ų63.117%0.17332%0.319CS..Hα-helixtrans-60.2-47.4174.7-175.3-176.89.600111.3L250 L282 E283 N288 N289 I290 E328L250-Q286 HydrophobicContact CD1-CB 4.31Å; L250-Q286 HydrophobicContact CD2-CB 3.98Å; L250-Q286 HydrophobicContact CD2-CG 4.29Å; L282-Q286 PolarHBondContact O-N 3.35Å; E283-Q286 WeakPolarHBondContact O-CB 3.5Å; E283-Q286 PolarHBondContact O-N 3.19Å; Q286-N288 PolarHBondContact O-N 3.02Å; Q286-N289 PolarHBondContact O-N 3.46Å; Q286-I290 HydrophobicContact CG-CD1 4.24Å; Q286-I290 WeakPolarHBondContact O-CG1 3.32Å; Q286-I290 PolarHBondContact O-N 2.78Å; Q286-E328 PolarHBondContact NE2-OE1 2.97Å
287L93.6Very high95Very high87 Ų8759.4 Ų59.446%0.45530%0.302SS..Hα-helixtrans-61.7-44.6178.6-17763.1000111.6E283 E284 N289 I290 R291 F326E283-L287 WeakPolarHBondContact O-CB 3.47Å; E283-L287 PolarHBondContact O-N 2.82Å; E284-L287 PolarHBondContact O-N 3.34Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 3.08Å; L287-I290 PolarHBondContact O-N 2.8Å; L287-R291 WeakPolarHBondContact O-CB 3.41Å; L287-R291 PolarHBondContact O-N 3.03Å; L287-F326 HydrophobicContact CD1-CB 3.88Å; L287-F326 WeakPolarHBondContact CD1-O 3.35Å
288N93.6Very high95Very high78 Ų7856.2 Ų56.242%0.41728%0.279SS..Hα-helixtrans-62.6-38.6176.5-77.7-33.8000112.1E284 L285 Q286 R291 N292E284-N288 WeakPolarHBondContact O-CB 3.42Å; E284-N288 VanDerWaalsContact O-CG 3.32Å; E284-N288 PolarHBondContact O-N 3.04Å; E284-N288 PolarHBondContact O-ND2 2.88Å; L285-N288 PolarHBondContact O-N 3.08Å; Q286-N288 PolarHBondContact O-N 3.02Å; N288-R291 PolarHBondContact O-N 2.99Å; N288-N292 WeakPolarHBondContact O-CB 3.37Å; N288-N292 PolarHBondContact O-N 2.93Å; N288-N292 PolarHBondContact O-ND2 3.35Å
289N94.1Very high95.1Very high66 Ų6658.8 Ų58.835%0.35330%0.3SS..Hα-helixtrans-63.4-47.3174.2-77.1-16.5000111.7L285 Q286 L287 R291 N292 V293L285-N289 WeakPolarHBondContact O-CB 3.45Å; L285-N289 PolarHBondContact O-N 3.29Å; Q286-N289 PolarHBondContact O-N 3.46Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 3.08Å; N289-R291 VanDerWaalsContact C-N 3.29Å; N289-R291 PolarHBondContact O-N 2.76Å; N289-N292 PolarHBondContact O-N 3.09Å; N289-V293 VanDerWaalsContact O-CG2 3.32Å; N289-V293 WeakPolarHBondContact O-CG2 3.25Å; N289-V293 PolarHBondContact O-N 2.58Å
290I94.7Very high95.1Very high19 Ų1962.4 Ų62.410%0.09732%0.316CS..Hα-helixtrans-57.9-45.1176.3-69.6168.4000110.5Q286 L287 V293 T294 F326 E328 L331Q286-I290 HydrophobicContact CG-CD1 4.24Å; Q286-I290 WeakPolarHBondContact O-CG1 3.32Å; Q286-I290 PolarHBondContact O-N 2.78Å; L287-I290 PolarHBondContact O-N 2.8Å; I290-V293 PolarHBondContact O-N 3.03Å; I290-T294 VanDerWaalsContact O-CB 3.3Å; I290-T294 WeakPolarHBondContact O-CB 3.24Å; I290-T294 PolarHBondContact O-N 2.76Å; I290-T294 PolarHBondContact O-OG1 3.4Å; I290-F326 HydrophobicContact CG2-CB 4.38Å; I290-E328 HydrophobicContact CD1-CG 3.65Å; I290-L331 HydrophobicContact CG2-CB 4.22Å; I290-L331 HydrophobicContact CG2-CD2 4.49Å
291R94.6Very high95Very high111 Ų11157.4 Ų57.442%0.41929%0.293SS..Hα-helixtrans-58.1-53.1176.3173.2172.3-178.6-178.84.7112.1L287 N288 N289 V293 T294 E295 F326L287-R291 WeakPolarHBondContact O-CB 3.41Å; L287-R291 PolarHBondContact O-N 3.03Å; N288-R291 PolarHBondContact O-N 2.99Å; N289-R291 VanDerWaalsContact C-N 3.29Å; N289-R291 PolarHBondContact O-N 2.76Å; R291-V293 VanDerWaalsContact C-N 3.33Å; R291-V293 PolarHBondContact O-N 3.48Å; R291-T294 PolarHBondContact O-N 3.48Å; R291-E295 HydrophobicContact CG-CG 4.4Å; R291-E295 WeakPolarHBondContact CG-OE1 3.32Å; R291-E295 IonicContact CZ-OE1 3.99Å; R291-E295 IonicContact NE-OE1 3.03Å; R291-E295 PolarHBondContact NE-OE1 3.4Å; R291-E295 IonicContact NH2-OE1 3Å; R291-E295 PolarHBondContact NH2-OE1 3.05Å; R291-E295 WeakPolarHBondContact O-CB 3.33Å; R291-E295 WeakPolarHBondContact O-CG 3.4Å; R291-E295 PolarHBondContact O-N 3.3Å; R291-F326 HydrophobicContact CB-CB 4.38Å; R291-F326 HydrophobicContact CB-CD1 3.86Å; R291-F326 HydrophobicContact CB-CD2 4.05Å; R291-F326 HydrophobicContact CB-CE1 4.11Å; R291-F326 HydrophobicContact CB-CE2 4.31Å; R291-F326 HydrophobicContact CB-CG 3.82Å; R291-F326 HydrophobicContact CB-CZ 4.33Å; R291-F326 HydrophobicContact CG-CD1 4.05Å; R291-F326 HydrophobicContact CG-CD2 3.99Å; R291-F326 HydrophobicContact CG-CE1 3.78Å; R291-F326 HydrophobicContact CG-CE2 3.74Å; R291-F326 HydrophobicContact CG-CG 4.14Å; R291-F326 HydrophobicContact CG-CZ 3.62Å
292N94.3Very high95Very high92 Ų9254.6 Ų54.649%0.49229%0.287SS..Hα-helixtrans-59.9-43.1-178.2-69.8-23.1000112N288 N289 A296N288-N292 WeakPolarHBondContact O-CB 3.37Å; N288-N292 PolarHBondContact O-N 2.93Å; N288-N292 PolarHBondContact O-ND2 3.35Å; N289-N292 PolarHBondContact O-N 3.09Å; N292-A296 WeakPolarHBondContact O-CB 3.41Å; N292-A296 PolarHBondContact O-N 3.3Å
293V95.4Very high95Very high72 Ų7257.7 Ų57.744%0.43631%0.306SS..Hα-helixtrans-66.2-43.8177.2178.20000110.7N289 I290 R291 E295 A296 I297 L331N289-V293 VanDerWaalsContact O-CG2 3.32Å; N289-V293 WeakPolarHBondContact O-CG2 3.25Å; N289-V293 PolarHBondContact O-N 2.58Å; I290-V293 PolarHBondContact O-N 3.03Å; R291-V293 VanDerWaalsContact C-N 3.33Å; R291-V293 PolarHBondContact O-N 3.48Å; V293-E295 PolarHBondContact O-N 2.98Å; V293-A296 WeakPolarHBondContact O-CB 3.33Å; V293-A296 PolarHBondContact O-N 3.31Å; V293-I297 HydrophobicContact CG1-CD1 3.86Å; V293-I297 HydrophobicContact CG1-CG1 4.45Å; V293-I297 WeakPolarHBondContact O-CG1 3.27Å; V293-I297 PolarHBondContact O-N 3.24Å; V293-L331 HydrophobicContact CB-CD1 4.21Å; V293-L331 HydrophobicContact CG1-CD1 3.64Å
294T95.9Very high94.9Very high0 Ų055.4 Ų55.40%030%0.295CS..Hα-helixtrans-61.5-44.3177.7-56.30000111.3I290 R291 A296 I297 R298 F326 L330I290-T294 VanDerWaalsContact O-CB 3.3Å; I290-T294 WeakPolarHBondContact O-CB 3.24Å; I290-T294 PolarHBondContact O-N 2.76Å; I290-T294 PolarHBondContact O-OG1 3.4Å; R291-T294 PolarHBondContact O-N 3.48Å; T294-A296 VanDerWaalsContact C-N 3.34Å; T294-A296 PolarHBondContact O-N 2.84Å; T294-I297 PolarHBondContact O-N 2.77Å; T294-R298 WeakPolarHBondContact O-CB 3.37Å; T294-R298 VanDerWaalsContact O-CG 3.31Å; T294-R298 WeakPolarHBondContact O-CG 3.45Å; T294-R298 PolarHBondContact O-N 3.48Å; T294-F326 HydrophobicContact CG2-CD1 4.36Å; T294-F326 HydrophobicContact CG2-CE1 4.24Å; T294-L330 HydrophobicContact CG2-CD2 4.4Å
295E95.4Very high94.9Very high75 Ų7551 Ų5135%0.3527%0.274SS..Hα-helixtrans-63.8-37.5176.7-72.8178.3-176.600112.2R291 V293 R298 S299R291-E295 HydrophobicContact CG-CG 4.4Å; R291-E295 WeakPolarHBondContact CG-OE1 3.32Å; R291-E295 IonicContact CZ-OE1 3.99Å; R291-E295 IonicContact NE-OE1 3.03Å; R291-E295 PolarHBondContact NE-OE1 3.4Å; R291-E295 IonicContact NH2-OE1 3Å; R291-E295 PolarHBondContact NH2-OE1 3.05Å; R291-E295 WeakPolarHBondContact O-CB 3.33Å; R291-E295 WeakPolarHBondContact O-CG 3.4Å; R291-E295 PolarHBondContact O-N 3.3Å; V293-E295 PolarHBondContact O-N 2.98Å; E295-R298 PolarHBondContact O-N 2.85Å; E295-S299 PolarHBondContact O-N 2.68Å; E295-S299 PolarHBondContact O-OG 3.2Å
296A96.1Very high94.8Very high52 Ų5254.2 Ų54.243%0.4329%0.288SS..Hα-helixtrans-64-45.6172.800000111.5N292 V293 T294 R298 S299 E300N292-A296 WeakPolarHBondContact O-CB 3.41Å; N292-A296 PolarHBondContact O-N 3.3Å; V293-A296 WeakPolarHBondContact O-CB 3.33Å; V293-A296 PolarHBondContact O-N 3.31Å; T294-A296 VanDerWaalsContact C-N 3.34Å; T294-A296 PolarHBondContact O-N 2.84Å; A296-R298 PolarHBondContact O-N 3.42Å; A296-S299 WeakPolarHBondContact O-CB 3.44Å; A296-S299 PolarHBondContact O-N 3.39Å; A296-E300 PolarHBondContact O-N 2.98Å
297I95.9Very high94.6Very high11 Ų1156.6 Ų56.66%0.05630%0.298CS..Hα-helixtrans-63.7-41.6175.9-64.4161.7000110.9V293 T294 S299 E300 I301 L331 H334 D335 I338V293-I297 HydrophobicContact CG1-CD1 3.86Å; V293-I297 HydrophobicContact CG1-CG1 4.45Å; V293-I297 WeakPolarHBondContact O-CG1 3.27Å; V293-I297 PolarHBondContact O-N 3.24Å; T294-I297 PolarHBondContact O-N 2.77Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 3.2Å; I297-E300 CarbonylContact O-C 3.58Å; I297-E300 WeakPolarHBondContact O-CA 3.5Å; I297-E300 WeakPolarHBondContact O-CB 3.28Å; I297-E300 PolarHBondContact O-N 3.35Å; I297-I301 HydrophobicContact CG2-CD1 3.88Å; I297-I301 HydrophobicContact CG2-CG1 4.14Å; I297-I301 WeakPolarHBondContact O-CG1 3.44Å; I297-I301 PolarHBondContact O-N 3.28Å; I297-L331 HydrophobicContact CD1-CD1 3.54Å; I297-H334 HydrophobicContact CB-CB 4.36Å; I297-H334 HydrophobicContact CD1-CB 4.47Å; I297-H334 HydrophobicContact CG2-CB 3.81Å; I297-D335 WeakPolarHBondContact CD1-OD1 3.49Å; I297-I338 HydrophobicContact CG2-CB 3.83Å; I297-I338 HydrophobicContact CG2-CG1 4.45Å; I297-I338 HydrophobicContact CG2-CG2 3.75Å
298R96.8Very high94.3Very high30 Ų3052.6 Ų52.611%0.11328%0.277CS..Hα-helixtrans-57.2-41.8174.2-76.3176.4177.2177.5-6.1111.6T294 E295 A296 E300 I301 A302 P320 Y321 S323 H334T294-R298 WeakPolarHBondContact O-CB 3.37Å; T294-R298 VanDerWaalsContact O-CG 3.31Å; T294-R298 WeakPolarHBondContact O-CG 3.45Å; T294-R298 PolarHBondContact O-N 3.48Å; E295-R298 PolarHBondContact O-N 2.85Å; A296-R298 PolarHBondContact O-N 3.42Å; R298-E300 VanDerWaalsContact C-N 3.35Å; R298-I301 PolarHBondContact O-N 3.14Å; R298-A302 PolarHBondContact O-N 3.13Å; R298-P320 PolarHBondContact NH2-O 3.33Å; R298-Y321 HydrophobicContact CB-CD2 4.28Å; R298-Y321 HydrophobicContact CB-CE2 3.68Å; R298-Y321 HydrophobicContact CG-CD2 3.89Å; R298-Y321 HydrophobicContact CG-CE2 3.81Å; R298-Y321 PolarHBondContact NE-O 3.01Å; R298-Y321 PolarHBondContact NH2-O 3.4Å; R298-Y321 VanDerWaalsContact NH2-O 3.16Å; R298-S323 VanDerWaalsContact CZ-O 3.32Å; R298-S323 PolarHBondContact NH1-O 3.32Å; R298-S323 PolarHBondContact NH2-O 2.95Å; R298-H334 VanDerWaalsContact CG-CD2 3.5Å; R298-H334 WeakPolarHBondContact CG-CD2 3.2Å; R298-H334 WeakPolarHBondContact CG-NE2 3.47Å; R298-H334 PolarHBondContact NE-NE2 3.49Å
299S95.8Very high94Very high78 Ų7849.7 Ų49.755%0.54526%0.261SS..Hα-helixtrans-63-40.9175-56.80000111.7E295 A296 I297 A302 V303E295-S299 PolarHBondContact O-N 2.68Å; E295-S299 PolarHBondContact O-OG 3.2Å; A296-S299 WeakPolarHBondContact O-CB 3.44Å; A296-S299 PolarHBondContact O-N 3.39Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 3.2Å; S299-A302 PolarHBondContact O-N 3.38Å; S299-V303 WeakPolarHBondContact O-CG2 3.47Å; S299-V303 PolarHBondContact O-N 3.4Å
300E96.1Very high93.7Very high83 Ų8347.6 Ų47.639%0.38825%0.249SC..Hα-helixtrans-65-44.1173.1-70.7-171.1-145.800112.5A296 I297 R298 A302 V303 F304 I338 K342A296-E300 PolarHBondContact O-N 2.98Å; I297-E300 CarbonylContact O-C 3.58Å; I297-E300 WeakPolarHBondContact O-CA 3.5Å; I297-E300 WeakPolarHBondContact O-CB 3.28Å; I297-E300 PolarHBondContact O-N 3.35Å; R298-E300 VanDerWaalsContact C-N 3.35Å; E300-A302 VanDerWaalsContact C-N 3.3Å; E300-A302 PolarHBondContact O-N 3.11Å; E300-V303 WeakPolarHBondContact O-CB 3.24Å; E300-V303 PolarHBondContact O-N 3.48Å; E300-V303 VanDerWaalsContact O-N 3.15Å; E300-F304 WeakPolarHBondContact O-CD2 3.46Å; E300-F304 PolarHBondContact O-N 2.67Å; E300-I338 HydrophobicContact CB-CD1 3.82Å; E300-I338 HydrophobicContact CB-CG1 4.23Å; E300-K342 WeakPolarHBondContact OE2-CE 3.35Å; E300-K342 IonicContact OE2-NZ 2.86Å; E300-K342 PolarHBondContact OE2-NZ 3.45Å
301I95.6Very high93.4Very high0 Ų047.4 Ų47.40%025%0.249CC..Hα-helixtrans-56.5-46.5176.5-73.1173.1000109.8I297 R298 V303 F304 W305 F318 Y321 E337 I338 L341I297-I301 HydrophobicContact CG2-CD1 3.88Å; I297-I301 HydrophobicContact CG2-CG1 4.14Å; I297-I301 WeakPolarHBondContact O-CG1 3.44Å; I297-I301 PolarHBondContact O-N 3.28Å; R298-I301 PolarHBondContact O-N 3.14Å; I301-V303 VanDerWaalsContact C-N 3.31Å; I301-V303 PolarHBondContact O-N 3.23Å; I301-F304 PolarHBondContact O-N 3.27Å; I301-F304 VanDerWaalsContact O-N 3.1Å; I301-W305 HydrophobicContact CG2-CD2 3.61Å; I301-W305 HydrophobicContact CG2-CE3 3.9Å; I301-W305 HydrophobicContact CG2-CG 4.29Å; I301-W305 HydrophobicContact CG2-CH2 3.82Å; I301-W305 HydrophobicContact CG2-CZ2 3.49Å; I301-W305 VanDerWaalsContact CG2-CZ2 3.49Å; I301-W305 HydrophobicContact CG2-CZ3 4Å; I301-W305 PolarHBondContact O-N 3.38Å; I301-F318 HydrophobicContact CD1-CE1 4.22Å; I301-Y321 HydrophobicContact CB-CE2 4.43Å; I301-Y321 HydrophobicContact CG2-CD2 4.18Å; I301-Y321 HydrophobicContact CG2-CE2 4.14Å; I301-E337 HydrophobicContact CD1-CB 4.29Å; I301-E337 HydrophobicContact CD1-CG 4.07Å; I301-I338 HydrophobicContact CD1-CB 4.44Å; I301-I338 HydrophobicContact CG1-CB 3.92Å; I301-I338 HydrophobicContact CG1-CD1 3.89Å; I301-I338 HydrophobicContact CG1-CG1 4.38Å; I301-L341 HydrophobicContact CB-CD1 4.32Å; I301-L341 HydrophobicContact CG1-CD1 4.2Å; I301-L341 HydrophobicContact CG2-CD1 3.79Å
302A94.7Very high93Very high24 Ų2448 Ų4820%0.19826%0.259CS..Hα-helixtrans-58-42.6177.500000112.3R298 S299 E300 W305 E306R298-A302 PolarHBondContact O-N 3.13Å; S299-A302 PolarHBondContact O-N 3.38Å; E300-A302 VanDerWaalsContact C-N 3.3Å; E300-A302 PolarHBondContact O-N 3.11Å; A302-W305 PolarHBondContact O-N 3.39Å; A302-E306 WeakPolarHBondContact O-CG 2.87Å; A302-E306 PolarHBondContact O-N 3.42Å
303V94.9Very high92.7Very high66 Ų6649.1 Ų49.140%0.427%0.265SS..Hα-helixtrans-63.1-41.9175.1172.30000111.5S299 E300 I301 E306 K307S299-V303 WeakPolarHBondContact O-CG2 3.47Å; S299-V303 PolarHBondContact O-N 3.4Å; E300-V303 WeakPolarHBondContact O-CB 3.24Å; E300-V303 PolarHBondContact O-N 3.48Å; E300-V303 VanDerWaalsContact O-N 3.15Å; I301-V303 VanDerWaalsContact C-N 3.31Å; I301-V303 PolarHBondContact O-N 3.23Å; V303-E306 PolarHBondContact O-N 3.41Å; V303-K307 HydrophobicContact CG1-CD 4.2Å; V303-K307 WeakPolarHBondContact O-CG 3.48Å; V303-K307 PolarHBondContact O-N 2.9Å
304F92.8Very high92.3Very high27 Ų2749 Ų4912%0.11826%0.26CS..Hα-helixtrans-71.6-34.3178.1-85.4-81.3000113E300 I301 E306 K307 C308 I338 L341 K342 Y345E300-F304 WeakPolarHBondContact O-CD2 3.46Å; E300-F304 PolarHBondContact O-N 2.67Å; I301-F304 PolarHBondContact O-N 3.27Å; I301-F304 VanDerWaalsContact O-N 3.1Å; F304-E306 VanDerWaalsContact C-N 3.31Å; F304-E306 PolarHBondContact O-N 2.99Å; F304-K307 PolarHBondContact O-N 3.34Å; F304-C308 WeakPolarHBondContact O-CB 3.28Å; F304-C308 PolarHBondContact O-N 3.43Å; F304-C308 PolarHBondContact O-SG 3.26Å; F304-I338 HydrophobicContact CD2-CD1 3.62Å; F304-I338 HydrophobicContact CE2-CD1 4.17Å; F304-I338 HydrophobicContact CG-CD1 4.36Å; F304-L341 HydrophobicContact CB-CB 4.15Å; F304-L341 HydrophobicContact CB-CD1 4.48Å; F304-K342 HydrophobicContact CD1-CG 4.49Å; F304-K342 HydrophobicContact CD2-CG 4.27Å; F304-K342 HydrophobicContact CE1-CG 3.93Å; F304-K342 HydrophobicContact CE2-CD 4.3Å; F304-K342 HydrophobicContact CE2-CG 3.68Å; F304-K342 HydrophobicContact CZ-CD 4.36Å; F304-K342 HydrophobicContact CZ-CG 3.49Å; F304-K342 VanDerWaalsContact CZ-CG 3.49Å; F304-Y345 HydrophobicContact CD1-CG 4.13Å; F304-Y345 AromaticContact CE1-CD1 3.89Å; F304-Y345 HydrophobicContact CE1-CD1 3.89Å; F304-Y345 AromaticContact CE1-CG 3.96Å; F304-Y345 HydrophobicContact CE1-CG 3.96Å
305W94.1Very high92.1Very high6 Ų651.8 Ų51.82%0.02327%0.27CS..Hα-helixtrans-60.6-40.1170.7-75.5-22.1000112I301 A302 F309 F310 R315 F318 Y321I301-W305 HydrophobicContact CG2-CD2 3.61Å; I301-W305 HydrophobicContact CG2-CE3 3.9Å; I301-W305 HydrophobicContact CG2-CG 4.29Å; I301-W305 HydrophobicContact CG2-CH2 3.82Å; I301-W305 HydrophobicContact CG2-CZ2 3.49Å; I301-W305 VanDerWaalsContact CG2-CZ2 3.49Å; I301-W305 HydrophobicContact CG2-CZ3 4Å; I301-W305 PolarHBondContact O-N 3.38Å; A302-W305 PolarHBondContact O-N 3.39Å; W305-F309 PolarHBondContact O-N 2.95Å; W305-F309 VanDerWaalsContact O-N 3.15Å; W305-F310 HydrophobicContact CB-CB 4.11Å; W305-F310 AromaticContact CD1-CD1 3.54Å; W305-F310 AromaticContact CD1-CG 3.79Å; W305-F310 HydrophobicContact CG-CB 4.28Å; W305-F310 HydrophobicContact CG-CD1 4.41Å; W305-F310 HydrophobicContact CG-CG 4.41Å; W305-F310 AromaticContact NE1-CD1 3.87Å; W305-F310 PolarHBondContact O-N 3.14Å; W305-R315 HydrophobicContact CB-CG 4.26Å; W305-R315 HydrophobicContact CD2-CB 4.19Å; W305-R315 HydrophobicContact CD2-CG 3.59Å; W305-R315 HydrophobicContact CE3-CB 4.03Å; W305-R315 HydrophobicContact CE3-CG 3.66Å; W305-R315 HydrophobicContact CG-CG 3.9Å; W305-R315 HydrophobicContact CH2-CB 4.04Å; W305-R315 HydrophobicContact CH2-CG 4.5Å; W305-R315 HydrophobicContact CZ2-CB 4.21Å; W305-R315 HydrophobicContact CZ2-CG 4.46Å; W305-R315 HydrophobicContact CZ3-CB 3.96Å; W305-R315 HydrophobicContact CZ3-CG 4.13Å; W305-F318 HydrophobicContact CZ2-CB 4.25Å; W305-F318 HydrophobicContact CZ2-CD1 4.33Å; W305-Y321 HydrophobicContact CH2-CD1 4.09Å; W305-Y321 AromaticContact CH2-CD2 3.46Å; W305-Y321 HydrophobicContact CH2-CD2 3.46Å; W305-Y321 VanDerWaalsContact CH2-CD2 3.46Å; W305-Y321 HydrophobicContact CH2-CE1 4.44Å; W305-Y321 AromaticContact CH2-CE2 3.84Å; W305-Y321 HydrophobicContact CH2-CE2 3.84Å; W305-Y321 AromaticContact CH2-CG 3.6Å; W305-Y321 HydrophobicContact CH2-CG 3.6Å; W305-Y321 HydrophobicContact CZ2-CD2 4.38Å; W305-Y321 HydrophobicContact CZ3-CD1 4.17Å; W305-Y321 AromaticContact CZ3-CD2 3.77Å; W305-Y321 HydrophobicContact CZ3-CD2 3.77Å; W305-Y321 HydrophobicContact CZ3-CE1 4.06Å; W305-Y321 AromaticContact CZ3-CE2 3.62Å; W305-Y321 HydrophobicContact CZ3-CE2 3.62Å; W305-Y321 HydrophobicContact CZ3-CG 4.04Å; W305-Y321 AromaticContact CZ3-CZ 3.79Å
306E92.1Very high91.8Very high124 Ų12453.8 Ų53.858%0.57928%0.28SS*.Hα-helixtrans-66.4-47.5173.2-71.8177.4-174.800112A302 V303 F304 C308 F309A302-E306 WeakPolarHBondContact O-CG 2.87Å; A302-E306 PolarHBondContact O-N 3.42Å; V303-E306 PolarHBondContact O-N 3.41Å; F304-E306 VanDerWaalsContact C-N 3.31Å; F304-E306 PolarHBondContact O-N 2.99Å; E306-C308 VanDerWaalsContact C-N 3.28Å; E306-C308 PolarHBondContact O-N 2.92Å; E306-F309 PolarHBondContact O-N 3.4Å
307K89.6Confident91.6Very high87 Ų8757.8 Ų57.838%0.37829%0.294SS..Hα-helixtrans-61.6-33.8179.2-75.1177.9178.5179.40113.8V303 F304 Y345V303-K307 HydrophobicContact CG1-CD 4.2Å; V303-K307 WeakPolarHBondContact O-CG 3.48Å; V303-K307 PolarHBondContact O-N 2.9Å; F304-K307 PolarHBondContact O-N 3.34Å; K307-Y345 HydrophobicContact CB-CD2 4.13Å; K307-Y345 HydrophobicContact CB-CE2 3.93Å; K307-Y345 HydrophobicContact CD-CE2 4.38Å
308C88.7Confident91.5Very high4 Ų458.6 Ų58.63%0.02730%0.297CS..THydrogen-bonded Turntrans-91.93.5177.9-57.60000112.8F304 E306 F310 F352F304-C308 WeakPolarHBondContact O-CB 3.28Å; F304-C308 PolarHBondContact O-N 3.43Å; F304-C308 PolarHBondContact O-SG 3.26Å; E306-C308 VanDerWaalsContact C-N 3.28Å; E306-C308 PolarHBondContact O-N 2.92Å; C308-F310 VanDerWaalsContact C-N 3.31Å; C308-F310 HydrophobicContact CB-CD2 3.48Å; C308-F310 VanDerWaalsContact CB-CD2 3.48Å; C308-F310 HydrophobicContact CB-CE2 3.48Å; C308-F310 VanDerWaalsContact CB-CE2 3.48Å; C308-F310 PolarHBondContact O-N 3.38Å; C308-F352 HydrophobicContact CB-CE1 4.13Å; C308-F352 HydrophobicContact CB-CE2 4.2Å; C308-F352 HydrophobicContact CB-CZ 3.9Å; C308-F352 WeakPolarHBondContact O-CE1 3.39Å
309F87.3Confident91.3Very high17 Ų1760.3 Ų60.38%0.07532%0.318CS..THydrogen-bonded Turntrans55.538.7-179.3-54-87.4000114.7W305 E306 S311 F352 V355 Q356 V423 N424W305-F309 PolarHBondContact O-N 2.95Å; W305-F309 VanDerWaalsContact O-N 3.15Å; E306-F309 PolarHBondContact O-N 3.4Å; F309-S311 PolarHBondContact O-N 2.91Å; F309-F352 AromaticContact CD2-CD1 3.96Å; F309-F352 HydrophobicContact CD2-CD1 3.96Å; F309-F352 HydrophobicContact CE2-CD1 4.35Å; F309-V355 HydrophobicContact CD2-CG1 4.18Å; F309-V355 HydrophobicContact CE1-CG1 4.21Å; F309-V355 HydrophobicContact CE2-CB 4.04Å; F309-V355 HydrophobicContact CE2-CG1 3.65Å; F309-V355 HydrophobicContact CZ-CB 4.35Å; F309-V355 HydrophobicContact CZ-CG1 3.67Å; F309-Q356 HydrophobicContact CZ-CB 4.25Å; F309-V423 HydrophobicContact CB-CB 4.31Å; F309-V423 HydrophobicContact CB-CG1 3.8Å; F309-V423 HydrophobicContact CB-CG2 4.5Å; F309-V423 HydrophobicContact CD1-CG1 3.82Å; F309-V423 HydrophobicContact CG-CG1 3.83Å; F309-N424 PolarHBondContact O-N 3.5Å
310F86.3Confident91.2Very high21 Ų2158.3 Ų58.39%0.09230%0.303CS..  trans-63.8133.6178.3-87.5-131.4000111W305 C308 Q314 R315 L341W305-F310 HydrophobicContact CB-CB 4.11Å; W305-F310 AromaticContact CD1-CD1 3.54Å; W305-F310 AromaticContact CD1-CG 3.79Å; W305-F310 HydrophobicContact CG-CB 4.28Å; W305-F310 HydrophobicContact CG-CD1 4.41Å; W305-F310 HydrophobicContact CG-CG 4.41Å; W305-F310 AromaticContact NE1-CD1 3.87Å; W305-F310 PolarHBondContact O-N 3.14Å; C308-F310 VanDerWaalsContact C-N 3.31Å; C308-F310 HydrophobicContact CB-CD2 3.48Å; C308-F310 VanDerWaalsContact CB-CD2 3.48Å; C308-F310 HydrophobicContact CB-CE2 3.48Å; C308-F310 VanDerWaalsContact CB-CE2 3.48Å; C308-F310 PolarHBondContact O-N 3.38Å; F310-Q314 HydrophobicContact CB-CB 4.46Å; F310-Q314 HydrophobicContact CD1-CB 3.85Å; F310-Q314 HydrophobicContact CG-CB 4.44Å; F310-R315 HydrophobicContact CB-CG 4.11Å; F310-R315 PolarHBondContact O-NE 2.98Å; F310-R315 VanDerWaalsContact O-NE 3.09Å; F310-R315 PolarHBondContact O-NH2 3.39Å; F310-R315 VanDerWaalsContact O-NH2 3.14Å; F310-L341 HydrophobicContact CE1-CD2 3.91Å; F310-L341 HydrophobicContact CE2-CD2 4.21Å; F310-L341 HydrophobicContact CZ-CD2 3.59Å
311S88.4Confident91.1Very high16 Ų1656.8 Ų56.811%0.11229%0.294CS..  trans-68.4164173.8780000111.8F309 D313 Q314 R315F309-S311 PolarHBondContact O-N 2.91Å; S311-D313 VanDerWaalsContact C-N 3.28Å; S311-D313 PolarHBondContact O-N 2.89Å; S311-Q314 PolarHBondContact O-N 2.84Å; S311-Q314 WeakPolarHBondContact OG-CG 3.22Å; S311-Q314 PolarHBondContact OG-N 3.49Å; S311-R315 VanDerWaalsContact O-CG 3.29Å; S311-R315 WeakPolarHBondContact O-CG 3.46Å; S311-R315 PolarHBondContact O-N 3.49Å; S311-R315 VanDerWaalsContact O-N 3.13Å
312I87.4Confident90.9Very high123 Ų12362.6 Ų62.663%0.63132%0.32SS*.Hα-helixtrans-59.9-42.2177.4-62.7171000110.5Q314 R315 Q316I312-Q314 PolarHBondContact O-N 3.42Å; I312-R315 WeakPolarHBondContact O-CB 3.45Å; I312-R315 PolarHBondContact O-N 3.43Å; I312-Q316 WeakPolarHBondContact O-CG 3.23Å; I312-Q316 PolarHBondContact O-N 2.86Å; I312-Q316 VanDerWaalsContact O-N 3.08Å
313D87.3Confident90.9Very high116 Ų11663 Ų6362%0.6232%0.321SS*.Hα-helixtrans-63.1-43.9179.7-57.6-25.7000111.4S311 R315 Q316 D317S311-D313 VanDerWaalsContact C-N 3.28Å; S311-D313 PolarHBondContact O-N 2.89Å; D313-R315 VanDerWaalsContact C-N 3.26Å; D313-R315 PolarHBondContact O-N 3.01Å; D313-Q316 WeakPolarHBondContact O-CB 3.32Å; D313-Q316 PolarHBondContact O-N 2.84Å; D313-D317 PolarHBondContact O-N 3.29Å; D313-D317 VanDerWaalsContact O-N 3.14Å
314Q87.1Confident90.7Very high68 Ų6867.9 Ų67.932%0.31834%0.339SS..Hα-helixtrans-63.5-30.9176.9-71.9173-34.500113F310 S311 I312F310-Q314 HydrophobicContact CB-CB 4.46Å; F310-Q314 HydrophobicContact CD1-CB 3.85Å; F310-Q314 HydrophobicContact CG-CB 4.44Å; S311-Q314 PolarHBondContact O-N 2.84Å; S311-Q314 WeakPolarHBondContact OG-CG 3.22Å; S311-Q314 PolarHBondContact OG-N 3.49Å; I312-Q314 PolarHBondContact O-N 3.42Å
315R90.9Very high90.7Very high59 Ų5972.4 Ų72.422%0.22337%0.365CS..Hα-helixtrans-72.3-33.7174.1-63.4174.9-163.2-151.30.4111.3W305 F310 S311 I312 D313 D317 F318W305-R315 HydrophobicContact CB-CG 4.26Å; W305-R315 HydrophobicContact CD2-CB 4.19Å; W305-R315 HydrophobicContact CD2-CG 3.59Å; W305-R315 HydrophobicContact CE3-CB 4.03Å; W305-R315 HydrophobicContact CE3-CG 3.66Å; W305-R315 HydrophobicContact CG-CG 3.9Å; W305-R315 HydrophobicContact CH2-CB 4.04Å; W305-R315 HydrophobicContact CH2-CG 4.5Å; W305-R315 HydrophobicContact CZ2-CB 4.21Å; W305-R315 HydrophobicContact CZ2-CG 4.46Å; W305-R315 HydrophobicContact CZ3-CB 3.96Å; W305-R315 HydrophobicContact CZ3-CG 4.13Å; F310-R315 HydrophobicContact CB-CG 4.11Å; F310-R315 PolarHBondContact O-NE 2.98Å; F310-R315 VanDerWaalsContact O-NE 3.09Å; F310-R315 PolarHBondContact O-NH2 3.39Å; F310-R315 VanDerWaalsContact O-NH2 3.14Å; S311-R315 VanDerWaalsContact O-CG 3.29Å; S311-R315 WeakPolarHBondContact O-CG 3.46Å; S311-R315 PolarHBondContact O-N 3.49Å; S311-R315 VanDerWaalsContact O-N 3.13Å; I312-R315 WeakPolarHBondContact O-CB 3.45Å; I312-R315 PolarHBondContact O-N 3.43Å; D313-R315 VanDerWaalsContact C-N 3.26Å; D313-R315 PolarHBondContact O-N 3.01Å; R315-D317 VanDerWaalsContact C-N 3.31Å; R315-F318 PolarHBondContact O-N 2.89Å
316Q90.7Very high90.5Very high118 Ų11873.9 Ų73.955%0.55137%0.371SS*.Hα-helixtrans-71.9-23.8177.6-71-172.913.200113.3I312 D313 F318I312-Q316 WeakPolarHBondContact O-CG 3.23Å; I312-Q316 PolarHBondContact O-N 2.86Å; I312-Q316 VanDerWaalsContact O-N 3.08Å; D313-Q316 WeakPolarHBondContact O-CB 3.32Å; D313-Q316 PolarHBondContact O-N 2.84Å; Q316-F318 PolarHBondContact O-N 3.24Å
317D91.2Very high90.5Very high136 Ų13671.3 Ų71.373%0.72736%0.361SS*.THydrogen-bonded Turntrans-58.3-31.1175.3-70.4-22.5000112.5D313 R315 A319D313-D317 PolarHBondContact O-N 3.29Å; D313-D317 VanDerWaalsContact O-N 3.14Å; R315-D317 VanDerWaalsContact C-N 3.31Å; D317-A319 VanDerWaalsContact C-N 3.3Å; D317-A319 PolarHBondContact O-N 2.84Å; D317-A319 VanDerWaalsContact O-N 3.11Å
318F93.3Very high90.6Very high27 Ų2772 Ų7212%0.11837%0.366CS..  trans-8671.5172-173.2-120.7000111.1I301 W305 R315 Q316 P320 Y321 H334 E337I301-F318 HydrophobicContact CD1-CE1 4.22Å; W305-F318 HydrophobicContact CZ2-CB 4.25Å; W305-F318 HydrophobicContact CZ2-CD1 4.33Å; R315-F318 PolarHBondContact O-N 2.89Å; Q316-F318 PolarHBondContact O-N 3.24Å; F318-P320 VanDerWaalsContact C-N 3.31Å; F318-P320 HydrophobicContact CD2-CB 4.48Å; F318-P320 HydrophobicContact CD2-CG 4.09Å; F318-P320 HydrophobicContact CE1-CB 4.27Å; F318-P320 HydrophobicContact CE2-CB 3.85Å; F318-P320 HydrophobicContact CE2-CG 3.69Å; F318-P320 HydrophobicContact CZ-CB 3.71Å; F318-P320 HydrophobicContact CZ-CG 4.11Å; F318-Y321 VanDerWaalsContact O-CB 3.25Å; F318-Y321 WeakPolarHBondContact O-CB 3.31Å; F318-Y321 PolarHBondContact O-N 3.19Å; F318-Y321 VanDerWaalsContact O-N 3.08Å; F318-H334 AromaticContact CE1-CD2 4Å; F318-H334 AromaticContact CE1-NE2 3.97Å; F318-E337 HydrophobicContact CD1-CG 3.89Å; F318-E337 HydrophobicContact CD2-CB 4.38Å; F318-E337 HydrophobicContact CD2-CG 4.08Å; F318-E337 HydrophobicContact CE1-CB 4.13Å; F318-E337 HydrophobicContact CE1-CG 3.92Å; F318-E337 HydrophobicContact CE2-CB 3.89Å; F318-E337 HydrophobicContact CE2-CG 4.07Å; F318-E337 HydrophobicContact CG-CG 4.02Å; F318-E337 HydrophobicContact CZ-CB 3.77Å; F318-E337 HydrophobicContact CZ-CG 4Å
319A93.2Very high90.8Very high66 Ų6678.6 Ų78.655%0.54540%0.396SS..G310 helixtrans-49.9-37.2178.300000115.4D317 Y321 F322D317-A319 VanDerWaalsContact C-N 3.3Å; D317-A319 PolarHBondContact O-N 2.84Å; D317-A319 VanDerWaalsContact O-N 3.11Å; A319-Y321 PolarHBondContact O-N 3.45Å; A319-F322 PolarHBondContact O-N 3.4Å; A319-F322 VanDerWaalsContact O-N 3.1Å
320P94.2Very high91.2Very high36 Ų3678.2 Ų78.223%0.23440%0.395CS..G310 helixtrans-57.9-21.3178.2-25.534.9000114.7R298 F318 F322 S323 L330 L333 H334R298-P320 PolarHBondContact NH2-O 3.33Å; F318-P320 VanDerWaalsContact C-N 3.31Å; F318-P320 HydrophobicContact CD2-CB 4.48Å; F318-P320 HydrophobicContact CD2-CG 4.09Å; F318-P320 HydrophobicContact CE1-CB 4.27Å; F318-P320 HydrophobicContact CE2-CB 3.85Å; F318-P320 HydrophobicContact CE2-CG 3.69Å; F318-P320 HydrophobicContact CZ-CB 3.71Å; F318-P320 HydrophobicContact CZ-CG 4.11Å; P320-F322 PolarHBondContact O-N 2.93Å; P320-S323 PolarHBondContact O-N 2.98Å; P320-L330 HydrophobicContact CB-CD1 3.86Å; P320-L333 HydrophobicContact CB-CD1 4.34Å; P320-L333 HydrophobicContact CG-CD1 4.12Å; P320-H334 PolarHBondContact O-CE1 2.89Å
321Y92.9Very high91.6Very high52 Ų5278.8 Ų78.820%0.20440%0.399CS..G310 helixtrans-57-30.7175-171.9-93.3000113.6R298 I301 W305 F318 A319R298-Y321 HydrophobicContact CB-CD2 4.28Å; R298-Y321 HydrophobicContact CB-CE2 3.68Å; R298-Y321 HydrophobicContact CG-CD2 3.89Å; R298-Y321 HydrophobicContact CG-CE2 3.81Å; R298-Y321 PolarHBondContact NE-O 3.01Å; R298-Y321 PolarHBondContact NH2-O 3.4Å; R298-Y321 VanDerWaalsContact NH2-O 3.16Å; I301-Y321 HydrophobicContact CB-CE2 4.43Å; I301-Y321 HydrophobicContact CG2-CD2 4.18Å; I301-Y321 HydrophobicContact CG2-CE2 4.14Å; W305-Y321 HydrophobicContact CH2-CD1 4.09Å; W305-Y321 AromaticContact CH2-CD2 3.46Å; W305-Y321 HydrophobicContact CH2-CD2 3.46Å; W305-Y321 VanDerWaalsContact CH2-CD2 3.46Å; W305-Y321 HydrophobicContact CH2-CE1 4.44Å; W305-Y321 AromaticContact CH2-CE2 3.84Å; W305-Y321 HydrophobicContact CH2-CE2 3.84Å; W305-Y321 AromaticContact CH2-CG 3.6Å; W305-Y321 HydrophobicContact CH2-CG 3.6Å; W305-Y321 HydrophobicContact CZ2-CD2 4.38Å; W305-Y321 HydrophobicContact CZ3-CD1 4.17Å; W305-Y321 AromaticContact CZ3-CD2 3.77Å; W305-Y321 HydrophobicContact CZ3-CD2 3.77Å; W305-Y321 HydrophobicContact CZ3-CE1 4.06Å; W305-Y321 AromaticContact CZ3-CE2 3.62Å; W305-Y321 HydrophobicContact CZ3-CE2 3.62Å; W305-Y321 HydrophobicContact CZ3-CG 4.04Å; W305-Y321 AromaticContact CZ3-CZ 3.79Å; F318-Y321 VanDerWaalsContact O-CB 3.25Å; F318-Y321 WeakPolarHBondContact O-CB 3.31Å; F318-Y321 PolarHBondContact O-N 3.19Å; F318-Y321 VanDerWaalsContact O-N 3.08Å; A319-Y321 PolarHBondContact O-N 3.45Å
322F92.2Very high91.9Very high122 Ų12280.7 Ų80.754%0.53542%0.416SS..G310 helixtrans-100.20.3-174.6-55.6-79.3000113.5A319 P320A319-F322 PolarHBondContact O-N 3.4Å; A319-F322 VanDerWaalsContact O-N 3.1Å; P320-F322 PolarHBondContact O-N 2.93Å
323S93.4Very high92.3Very high33 Ų3378.5 Ų78.523%0.23141%0.405CS..  trans-71.3140.4178.1176.80000111.3R298 P320 D325R298-S323 VanDerWaalsContact CZ-O 3.32Å; R298-S323 PolarHBondContact NH1-O 3.32Å; R298-S323 PolarHBondContact NH2-O 2.95Å; P320-S323 PolarHBondContact O-N 2.98Å; S323-D325 PolarHBondContact OG-N 2.89Å
324E91.4Very high92.8Very high168 Ų16873 Ų7379%0.78538%0.376SS*.  trans-100.2-0.2171.5-62.2-171.1169.600112.3F326E324-F326 WeakPolarHBondContact O-CD2 3.18Å; E324-F326 WeakPolarHBondContact O-CE2 3.45Å; E324-F326 PolarHBondContact O-N 2.95Å; E324-F326 VanDerWaalsContact O-N 3.1Å
325D92.2Very high93.1Very high122 Ų12272.8 Ų72.865%0.65238%0.377SS*.  trans-85.981.4-177.6-60.4-43000110.3S323 N327 L330S323-D325 PolarHBondContact OG-N 2.89Å; D325-N327 PolarHBondContact O-N 3.37Å; D325-L330 WeakPolarHBondContact O-CD2 3.29Å
326F91.1Very high93.4Very high36 Ų3672.7 Ų72.716%0.15839%0.388CS..  trans-68.5114.3-179-60.6-76.8000111.6L287 I290 R291 T294 E324 L330L287-F326 HydrophobicContact CD1-CB 3.88Å; L287-F326 WeakPolarHBondContact CD1-O 3.35Å; I290-F326 HydrophobicContact CG2-CB 4.38Å; R291-F326 HydrophobicContact CB-CB 4.38Å; R291-F326 HydrophobicContact CB-CD1 3.86Å; R291-F326 HydrophobicContact CB-CD2 4.05Å; R291-F326 HydrophobicContact CB-CE1 4.11Å; R291-F326 HydrophobicContact CB-CE2 4.31Å; R291-F326 HydrophobicContact CB-CG 3.82Å; R291-F326 HydrophobicContact CB-CZ 4.33Å; R291-F326 HydrophobicContact CG-CD1 4.05Å; R291-F326 HydrophobicContact CG-CD2 3.99Å; R291-F326 HydrophobicContact CG-CE1 3.78Å; R291-F326 HydrophobicContact CG-CE2 3.74Å; R291-F326 HydrophobicContact CG-CG 4.14Å; R291-F326 HydrophobicContact CG-CZ 3.62Å; T294-F326 HydrophobicContact CG2-CD1 4.36Å; T294-F326 HydrophobicContact CG2-CE1 4.24Å; E324-F326 WeakPolarHBondContact O-CD2 3.18Å; E324-F326 WeakPolarHBondContact O-CE2 3.45Å; E324-F326 PolarHBondContact O-N 2.95Å; E324-F326 VanDerWaalsContact O-N 3.1Å; F326-L330 HydrophobicContact CD1-CD2 4.28Å
327N92Very high93.6Very high70 Ų7067.9 Ų67.937%0.37437%0.366SS..  trans-145.7170.6172.862.523.6000110.1D325 E329 L330 L331D325-N327 PolarHBondContact O-N 3.37Å; N327-E329 PolarHBondContact O-N 3.12Å; N327-E329 PolarHBondContact OD1-N 3.3Å; N327-L330 PolarHBondContact O-N 3.16Å; N327-L330 WeakPolarHBondContact OD1-CB 3.41Å; N327-L330 PolarHBondContact OD1-N 2.82Å; N327-L331 PolarHBondContact O-N 3.26Å
328E90.7Very high93.8Very high102 Ų10261.7 Ų61.748%0.47733%0.333SS..Hα-helixtrans-63.5-30.7-178.3-67-177.1-176.100112.5R249 Q286 I290 L331 A332R249-E328 IonicContact CZ-OE1 3.28Å; R249-E328 IonicContact NH1-OE1 2.86Å; R249-E328 IonicContact NH2-OE1 3.08Å; R249-E328 PolarHBondContact NH2-OE1 3.39Å; R249-E328 IonicContact NH2-OE2 2.9Å; Q286-E328 PolarHBondContact NE2-OE1 2.97Å; I290-E328 HydrophobicContact CD1-CG 3.65Å; E328-L331 PolarHBondContact O-N 2.85Å; E328-A332 PolarHBondContact O-N 3.4Å
329E93.9Very high94Very high142 Ų14266.7 Ų66.766%0.66436%0.356SS*.Hα-helixtrans-67-43.6176.6-175.5175.7-170.700111.8N327 L331 A332 L333N327-E329 PolarHBondContact O-N 3.12Å; N327-E329 PolarHBondContact OD1-N 3.3Å; E329-L331 VanDerWaalsContact C-N 3.32Å; E329-L331 PolarHBondContact O-N 3.03Å; E329-A332 PolarHBondContact O-N 3.47Å; E329-L333 WeakPolarHBondContact O-CG 3.31Å; E329-L333 PolarHBondContact O-N 3.15Å
330L94.6Very high94.1Very high10 Ų1069.6 Ų69.65%0.05235%0.353CS..Hα-helixtrans-60.7-44.4176-174.768.1000110.4T294 P320 D325 F326 N327 L333 H334T294-L330 HydrophobicContact CG2-CD2 4.4Å; P320-L330 HydrophobicContact CB-CD1 3.86Å; D325-L330 WeakPolarHBondContact O-CD2 3.29Å; F326-L330 HydrophobicContact CD1-CD2 4.28Å; N327-L330 PolarHBondContact O-N 3.16Å; N327-L330 WeakPolarHBondContact OD1-CB 3.41Å; N327-L330 PolarHBondContact OD1-N 2.82Å; L330-L333 PolarHBondContact O-N 2.81Å; L330-H334 PolarHBondContact O-N 3.31Å; L330-H334 PolarHBondContact O-ND1 3.11Å
331L95Very high94.1Very high32 Ų3267.9 Ų67.917%0.16834%0.342CS..Hα-helixtrans-59.9-46.6176.3176.359.9000111.1I290 V293 I297 N327 E328 E329 L333 H334 D335I290-L331 HydrophobicContact CG2-CB 4.22Å; I290-L331 HydrophobicContact CG2-CD2 4.49Å; V293-L331 HydrophobicContact CB-CD1 4.21Å; V293-L331 HydrophobicContact CG1-CD1 3.64Å; I297-L331 HydrophobicContact CD1-CD1 3.54Å; N327-L331 PolarHBondContact O-N 3.26Å; E328-L331 PolarHBondContact O-N 2.85Å; E329-L331 VanDerWaalsContact C-N 3.32Å; E329-L331 PolarHBondContact O-N 3.03Å; L331-L333 VanDerWaalsContact C-N 3.32Å; L331-L333 PolarHBondContact O-N 3.32Å; L331-H334 PolarHBondContact O-N 3.35Å; L331-H334 VanDerWaalsContact O-N 3.11Å; L331-D335 PolarHBondContact O-N 3.29Å
332A94.8Very high94.1Very high57 Ų5769.1 Ų69.147%0.47135%0.349SS..Hα-helixtrans-61-38.217800000112.9E328 E329 D335 A336E328-A332 PolarHBondContact O-N 3.4Å; E329-A332 PolarHBondContact O-N 3.47Å; A332-D335 PolarHBondContact O-N 3.49Å; A332-A336 WeakPolarHBondContact O-CB 3.14Å; A332-A336 PolarHBondContact O-N 3.34Å
333L96.1Very high94.2Very high77 Ų7768.6 Ų68.640%0.40335%0.348SS..Hα-helixtrans-63.7-41.3173.8-70.5172.5000112P320 E329 L330 L331 E337P320-L333 HydrophobicContact CB-CD1 4.34Å; P320-L333 HydrophobicContact CG-CD1 4.12Å; E329-L333 WeakPolarHBondContact O-CG 3.31Å; E329-L333 PolarHBondContact O-N 3.15Å; L330-L333 PolarHBondContact O-N 2.81Å; L331-L333 VanDerWaalsContact C-N 3.32Å; L331-L333 PolarHBondContact O-N 3.32Å; L333-E337 WeakPolarHBondContact O-CB 3.41Å; L333-E337 PolarHBondContact O-N 3.08Å
334H96.9Very high94.1Very high0 Ų069.4 Ų69.40%035%0.348CS..Hα-helixtrans-67.2-41.2176.7-75.876.6000111.8I297 R298 F318 P320 L330 L331 E337 I338I297-H334 HydrophobicContact CB-CB 4.36Å; I297-H334 HydrophobicContact CD1-CB 4.47Å; I297-H334 HydrophobicContact CG2-CB 3.81Å; R298-H334 VanDerWaalsContact CG-CD2 3.5Å; R298-H334 WeakPolarHBondContact CG-CD2 3.2Å; R298-H334 WeakPolarHBondContact CG-NE2 3.47Å; R298-H334 PolarHBondContact NE-NE2 3.49Å; F318-H334 AromaticContact CE1-CD2 4Å; F318-H334 AromaticContact CE1-NE2 3.97Å; P320-H334 PolarHBondContact O-CE1 2.89Å; L330-H334 PolarHBondContact O-N 3.31Å; L330-H334 PolarHBondContact O-ND1 3.11Å; L331-H334 PolarHBondContact O-N 3.35Å; L331-H334 VanDerWaalsContact O-N 3.11Å; H334-E337 PolarHBondContact O-N 3.29Å; H334-I338 WeakPolarHBondContact O-CG2 3.41Å; H334-I338 PolarHBondContact O-N 3.42Å
335D95.3Very high94.1Very high64 Ų6462.5 Ų62.534%0.34232%0.315SS..Hα-helixtrans-61.2-44.2175.1-87.8-32.7000112I297 L331 A332 I338 Q339I297-D335 WeakPolarHBondContact CD1-OD1 3.49Å; L331-D335 PolarHBondContact O-N 3.29Å; A332-D335 PolarHBondContact O-N 3.49Å; D335-I338 VanDerWaalsContact O-CG2 3.22Å; D335-I338 WeakPolarHBondContact O-CG2 3.41Å; D335-Q339 WeakPolarHBondContact O-CB 3.37Å; D335-Q339 WeakPolarHBondContact O-CG 3.36Å; D335-Q339 PolarHBondContact O-N 3.43Å; D335-Q339 VanDerWaalsContact O-N 3.1Å
336A96Very high94.2Very high56 Ų5661.6 Ų61.646%0.46331%0.307SS..Hα-helixtrans-64.1-41.617600000111.6A332 Q339 R340A332-A336 WeakPolarHBondContact O-CB 3.14Å; A332-A336 PolarHBondContact O-N 3.34Å; A336-Q339 PolarHBondContact O-N 3.15Å; A336-R340 WeakPolarHBondContact O-CB 3.46Å; A336-R340 PolarHBondContact O-N 3.36Å
337E95.2Very high94Very high17 Ų1764.6 Ų64.68%0.07933%0.325CS..Hα-helixtrans-67.7-44.8-179.6179.760.8-171.900112.1I301 F318 L333 H334 Q339 R340 L341I301-E337 HydrophobicContact CD1-CB 4.29Å; I301-E337 HydrophobicContact CD1-CG 4.07Å; F318-E337 HydrophobicContact CD1-CG 3.89Å; F318-E337 HydrophobicContact CD2-CB 4.38Å; F318-E337 HydrophobicContact CD2-CG 4.08Å; F318-E337 HydrophobicContact CE1-CB 4.13Å; F318-E337 HydrophobicContact CE1-CG 3.92Å; F318-E337 HydrophobicContact CE2-CB 3.89Å; F318-E337 HydrophobicContact CE2-CG 4.07Å; F318-E337 HydrophobicContact CG-CG 4.02Å; F318-E337 HydrophobicContact CZ-CB 3.77Å; F318-E337 HydrophobicContact CZ-CG 4Å; L333-E337 WeakPolarHBondContact O-CB 3.41Å; L333-E337 PolarHBondContact O-N 3.08Å; H334-E337 PolarHBondContact O-N 3.29Å; E337-Q339 VanDerWaalsContact C-N 3.28Å; E337-Q339 PolarHBondContact O-N 3.31Å; E337-R340 WeakPolarHBondContact O-CB 3.48Å; E337-R340 PolarHBondContact O-N 3.5Å; E337-R340 IonicContact OE1-CZ 3.39Å; E337-R340 IonicContact OE1-NE 2.8Å; E337-R340 IonicContact OE1-NH2 3.1Å; E337-R340 PolarHBondContact OE1-NH2 3.41Å; E337-R340 IonicContact OE2-CZ 3.88Å; E337-R340 IonicContact OE2-NE 3.42Å; E337-R340 PolarHBondContact OE2-NE 2.95Å; E337-R340 IonicContact OE2-NH2 2.73Å; E337-R340 PolarHBondContact OE2-NH2 2.88Å; E337-L341 HydrophobicContact CG-CD1 4.16Å; E337-L341 WeakPolarHBondContact O-CG 3.23Å; E337-L341 PolarHBondContact O-N 3.13Å
338I96.1Very high93.8Very high6 Ų662.4 Ų62.43%0.03131%0.312CS..Hα-helixtrans-64.4-35.5176.9-171.756.5000111.5I297 E300 I301 F304 H334 D335 L341 K342I297-I338 HydrophobicContact CG2-CB 3.83Å; I297-I338 HydrophobicContact CG2-CG1 4.45Å; I297-I338 HydrophobicContact CG2-CG2 3.75Å; E300-I338 HydrophobicContact CB-CD1 3.82Å; E300-I338 HydrophobicContact CB-CG1 4.23Å; I301-I338 HydrophobicContact CD1-CB 4.44Å; I301-I338 HydrophobicContact CG1-CB 3.92Å; I301-I338 HydrophobicContact CG1-CD1 3.89Å; I301-I338 HydrophobicContact CG1-CG1 4.38Å; F304-I338 HydrophobicContact CD2-CD1 3.62Å; F304-I338 HydrophobicContact CE2-CD1 4.17Å; F304-I338 HydrophobicContact CG-CD1 4.36Å; H334-I338 WeakPolarHBondContact O-CG2 3.41Å; H334-I338 PolarHBondContact O-N 3.42Å; D335-I338 VanDerWaalsContact O-CG2 3.22Å; D335-I338 WeakPolarHBondContact O-CG2 3.41Å; I338-L341 PolarHBondContact O-N 3.29Å; I338-K342 HydrophobicContact CD1-CD 4.49Å; I338-K342 HydrophobicContact CD1-CG 4.41Å; I338-K342 HydrophobicContact CG1-CD 4.1Å; I338-K342 HydrophobicContact CG1-CG 4.48Å; I338-K342 VanDerWaalsContact O-CB 3.32Å; I338-K342 WeakPolarHBondContact O-CB 3.47Å; I338-K342 VanDerWaalsContact O-CG 3.26Å; I338-K342 WeakPolarHBondContact O-CG 3.38Å; I338-K342 PolarHBondContact O-N 2.67Å
339Q95.9Very high93.7Very high132 Ų13260.6 Ų60.662%0.61730%0.302SS*.Hα-helixtrans-65.3-44.8173.7-73.7175.423.600111.6D335 A336 E337 L341 K342 Q343D335-Q339 WeakPolarHBondContact O-CB 3.37Å; D335-Q339 WeakPolarHBondContact O-CG 3.36Å; D335-Q339 PolarHBondContact O-N 3.43Å; D335-Q339 VanDerWaalsContact O-N 3.1Å; A336-Q339 PolarHBondContact O-N 3.15Å; E337-Q339 VanDerWaalsContact C-N 3.28Å; E337-Q339 PolarHBondContact O-N 3.31Å; Q339-L341 VanDerWaalsContact C-N 3.34Å; Q339-L341 PolarHBondContact O-N 2.8Å; Q339-K342 PolarHBondContact O-N 2.8Å; Q339-Q343 WeakPolarHBondContact O-CB 3.48Å; Q339-Q343 PolarHBondContact O-N 2.73Å
340R95.4Very high93.5Very high127 Ų12760.2 Ų60.248%0.47930%0.301SS..Hα-helixtrans-58.1-46175.2-173-171.474.595.5-2.1111.5A336 E337 Q343 H344A336-R340 WeakPolarHBondContact O-CB 3.46Å; A336-R340 PolarHBondContact O-N 3.36Å; E337-R340 WeakPolarHBondContact O-CB 3.48Å; E337-R340 PolarHBondContact O-N 3.5Å; E337-R340 IonicContact OE1-CZ 3.39Å; E337-R340 IonicContact OE1-NE 2.8Å; E337-R340 IonicContact OE1-NH2 3.1Å; E337-R340 PolarHBondContact OE1-NH2 3.41Å; E337-R340 IonicContact OE2-CZ 3.88Å; E337-R340 IonicContact OE2-NE 3.42Å; E337-R340 PolarHBondContact OE2-NE 2.95Å; E337-R340 IonicContact OE2-NH2 2.73Å; E337-R340 PolarHBondContact OE2-NH2 2.88Å; R340-Q343 PolarHBondContact O-N 3.36Å; R340-H344 VanDerWaalsContact O-CB 3.31Å; R340-H344 WeakPolarHBondContact O-CB 3.49Å; R340-H344 PolarHBondContact O-N 3.2Å
341L94.1Very high93.1Very high0 Ų060.3 Ų60.30%030%0.301CS..Hα-helixtrans-66.7-41.6178.7-71.3172.6000112.3I301 F304 F310 E337 I338 Q339 H344 Y345I301-L341 HydrophobicContact CB-CD1 4.32Å; I301-L341 HydrophobicContact CG1-CD1 4.2Å; I301-L341 HydrophobicContact CG2-CD1 3.79Å; F304-L341 HydrophobicContact CB-CB 4.15Å; F304-L341 HydrophobicContact CB-CD1 4.48Å; F310-L341 HydrophobicContact CE1-CD2 3.91Å; F310-L341 HydrophobicContact CE2-CD2 4.21Å; F310-L341 HydrophobicContact CZ-CD2 3.59Å; E337-L341 HydrophobicContact CG-CD1 4.16Å; E337-L341 WeakPolarHBondContact O-CG 3.23Å; E337-L341 PolarHBondContact O-N 3.13Å; I338-L341 PolarHBondContact O-N 3.29Å; Q339-L341 VanDerWaalsContact C-N 3.34Å; Q339-L341 PolarHBondContact O-N 2.8Å; L341-H344 PolarHBondContact O-N 3.37Å; L341-Y345 WeakPolarHBondContact O-CB 3.36Å; L341-Y345 PolarHBondContact O-N 2.96Å
342K94.3Very high92.9Very high78 Ų7859.1 Ų59.134%0.33930%0.295SS..Hα-helixtrans-60.2-45.7174.7-80.7171.5178.6168.20111.3E300 F304 I338 Q339 Y345 E346E300-K342 WeakPolarHBondContact OE2-CE 3.35Å; E300-K342 IonicContact OE2-NZ 2.86Å; E300-K342 PolarHBondContact OE2-NZ 3.45Å; F304-K342 HydrophobicContact CD1-CG 4.49Å; F304-K342 HydrophobicContact CD2-CG 4.27Å; F304-K342 HydrophobicContact CE1-CG 3.93Å; F304-K342 HydrophobicContact CE2-CD 4.3Å; F304-K342 HydrophobicContact CE2-CG 3.68Å; F304-K342 HydrophobicContact CZ-CD 4.36Å; F304-K342 HydrophobicContact CZ-CG 3.49Å; F304-K342 VanDerWaalsContact CZ-CG 3.49Å; I338-K342 HydrophobicContact CD1-CD 4.49Å; I338-K342 HydrophobicContact CD1-CG 4.41Å; I338-K342 HydrophobicContact CG1-CD 4.1Å; I338-K342 HydrophobicContact CG1-CG 4.48Å; I338-K342 VanDerWaalsContact O-CB 3.32Å; I338-K342 WeakPolarHBondContact O-CB 3.47Å; I338-K342 VanDerWaalsContact O-CG 3.26Å; I338-K342 WeakPolarHBondContact O-CG 3.38Å; I338-K342 PolarHBondContact O-N 2.67Å; Q339-K342 PolarHBondContact O-N 2.8Å; K342-Y345 PolarHBondContact O-N 2.97Å; K342-E346 PolarHBondContact O-N 3.4Å
343Q93.8Very high92.7Very high111 Ų11160.8 Ų60.852%0.51929%0.293SS..Hα-helixtrans-63.4-48.3177.2-171.860.845.400111.2Q339 R340 Y345 E346 D347Q339-Q343 WeakPolarHBondContact O-CB 3.48Å; Q339-Q343 PolarHBondContact O-N 2.73Å; R340-Q343 PolarHBondContact O-N 3.36Å; Q343-Y345 VanDerWaalsContact C-N 3.27Å; Q343-Y345 PolarHBondContact O-N 2.88Å; Q343-E346 PolarHBondContact O-N 3.45Å; Q343-E346 VanDerWaalsContact O-N 3.15Å; Q343-D347 PolarHBondContact NE2-OD1 2.95Å; Q343-D347 PolarHBondContact NE2-OD2 3.39Å; Q343-D347 WeakPolarHBondContact O-CB 3.45Å; Q343-D347 VanDerWaalsContact O-CG 3.24Å; Q343-D347 PolarHBondContact O-N 3.22Å
344H90.4Very high92.4Very high51 Ų5157.6 Ų57.624%0.23628%0.278CS..Hα-helixtrans-58.5-38.6177.5178.5-97.1000112.8R340 L341 H348 F352R340-H344 VanDerWaalsContact O-CB 3.31Å; R340-H344 WeakPolarHBondContact O-CB 3.49Å; R340-H344 PolarHBondContact O-N 3.2Å; L341-H344 PolarHBondContact O-N 3.37Å; H344-H348 AromaticContact CD2-CE1 3.9Å; H344-H348 AromaticContact CD2-ND1 3.65Å; H344-H348 AromaticContact NE2-ND1 3.77Å; H344-H348 PolarHBondContact O-N 2.93Å; H344-H348 PolarHBondContact O-ND1 3.5Å; H344-F352 AromaticContact CE1-CZ 3.67Å
345Y92.1Very high92.1Very high22 Ų2257.7 Ų57.79%0.08628%0.279CS..Hα-helixtrans-66.6-46.2175177.7-101.5000112F304 K307 L341 K342 Q343 H348 K349 F352F304-Y345 HydrophobicContact CD1-CG 4.13Å; F304-Y345 AromaticContact CE1-CD1 3.89Å; F304-Y345 HydrophobicContact CE1-CD1 3.89Å; F304-Y345 AromaticContact CE1-CG 3.96Å; F304-Y345 HydrophobicContact CE1-CG 3.96Å; K307-Y345 HydrophobicContact CB-CD2 4.13Å; K307-Y345 HydrophobicContact CB-CE2 3.93Å; K307-Y345 HydrophobicContact CD-CE2 4.38Å; L341-Y345 WeakPolarHBondContact O-CB 3.36Å; L341-Y345 PolarHBondContact O-N 2.96Å; K342-Y345 PolarHBondContact O-N 2.97Å; Q343-Y345 VanDerWaalsContact C-N 3.27Å; Q343-Y345 PolarHBondContact O-N 2.88Å; Y345-H348 CarbonylContact O-C 3.25Å; Y345-H348 PolarHBondContact O-N 2.83Å; Y345-K349 HydrophobicContact CE1-CD 4.35Å; Y345-K349 HydrophobicContact CE1-CG 4.15Å; Y345-K349 WeakPolarHBondContact O-CA 3.48Å; Y345-K349 WeakPolarHBondContact O-CB 3.41Å; Y345-K349 PolarHBondContact O-N 2.65Å; Y345-F352 HydrophobicContact CD2-CB 4.47Å; Y345-F352 AromaticContact CD2-CD2 3.75Å; Y345-F352 HydrophobicContact CD2-CD2 3.75Å; Y345-F352 HydrophobicContact CD2-CE2 4.43Å; Y345-F352 HydrophobicContact CD2-CG 4.41Å; Y345-F352 HydrophobicContact CE2-CB 4.08Å; Y345-F352 HydrophobicContact CE2-CD2 4.2Å
346E93.5Very high91.8Very high103 Ų10358.6 Ų58.648%0.48128%0.281SS..Hα-helixtrans-67.6-38.8-179.3-73.1-62.3141.300112.3K342 Q343 H348 K349K342-E346 PolarHBondContact O-N 3.4Å; Q343-E346 PolarHBondContact O-N 3.45Å; Q343-E346 VanDerWaalsContact O-N 3.15Å; E346-H348 PolarHBondContact O-N 3.01Å; E346-K349 PolarHBondContact O-N 3.44Å; E346-K349 IonicContact OE1-NZ 3.88Å; E346-K349 PolarHBondContact OE1-NZ 3.17Å; E346-K349 WeakPolarHBondContact OE2-CD 3.45Å; E346-K349 IonicContact OE2-NZ 3.89Å; E346-K349 PolarHBondContact OE2-NZ 2.99Å
347D88.3Confident91.6Very high100 Ų10061.9 Ų61.954%0.53529%0.285SS..Hα-helixtrans-61.4-33.7176.9-68.6-21.7000112.3Q343Q343-D347 PolarHBondContact NE2-OD1 2.95Å; Q343-D347 PolarHBondContact NE2-OD2 3.39Å; Q343-D347 WeakPolarHBondContact O-CB 3.45Å; Q343-D347 VanDerWaalsContact O-CG 3.24Å; Q343-D347 PolarHBondContact O-N 3.22Å
348H87.2Confident91.4Very high23 Ų2361 Ų6111%0.10628%0.281CS..THydrogen-bonded Turntrans-117.320.7-174.8-51.6109000113.3H344 Y345 E346 E350 L351 F352 W413H344-H348 AromaticContact CD2-CE1 3.9Å; H344-H348 AromaticContact CD2-ND1 3.65Å; H344-H348 AromaticContact NE2-ND1 3.77Å; H344-H348 PolarHBondContact O-N 2.93Å; H344-H348 PolarHBondContact O-ND1 3.5Å; Y345-H348 CarbonylContact O-C 3.25Å; Y345-H348 PolarHBondContact O-N 2.83Å; E346-H348 PolarHBondContact O-N 3.01Å; H348-E350 VanDerWaalsContact C-N 3.32Å; H348-E350 PolarHBondContact O-N 3.45Å; H348-L351 HydrophobicContact CB-CD1 4.45Å; H348-L351 WeakPolarHBondContact O-CB 3.28Å; H348-L351 PolarHBondContact O-N 3.49Å; H348-F352 HydrophobicContact CB-CD2 4.1Å; H348-F352 HydrophobicContact CB-CE2 3.64Å; H348-F352 HydrophobicContact CB-CZ 4.25Å; H348-F352 WeakPolarHBondContact O-CD2 3.44Å; H348-F352 PolarHBondContact O-N 2.98Å; H348-W413 AromaticContact CD2-CD1 3.21Å; H348-W413 AromaticContact CD2-NE1 2.89Å; H348-W413 PolarHBondContact CD2-NE1 2.83Å; H348-W413 AromaticContact CE1-NE1 3.72Å; H348-W413 AromaticContact CG-NE1 3.59Å; H348-W413 AromaticContact NE2-CD1 3.55Å; H348-W413 AromaticContact NE2-NE1 2.94Å; H348-W413 PolarHBondContact NE2-NE1 3.31Å
349K89.8Confident91.1Very high64 Ų6463.3 Ų63.328%0.27829%0.292SS..Hα-helixtrans-57-43.4-171-174.2173.6-170.2154.70113.5Y345 E346 L351 F352 E353Y345-K349 HydrophobicContact CE1-CD 4.35Å; Y345-K349 HydrophobicContact CE1-CG 4.15Å; Y345-K349 WeakPolarHBondContact O-CA 3.48Å; Y345-K349 WeakPolarHBondContact O-CB 3.41Å; Y345-K349 PolarHBondContact O-N 2.65Å; E346-K349 PolarHBondContact O-N 3.44Å; E346-K349 IonicContact OE1-NZ 3.88Å; E346-K349 PolarHBondContact OE1-NZ 3.17Å; E346-K349 WeakPolarHBondContact OE2-CD 3.45Å; E346-K349 IonicContact OE2-NZ 3.89Å; E346-K349 PolarHBondContact OE2-NZ 2.99Å; K349-L351 PolarHBondContact O-N 3.32Å; K349-F352 PolarHBondContact O-N 3.4Å; K349-E353 WeakPolarHBondContact CE-OE1 3.38Å; K349-E353 HydrophobicContact CG-CG 4.16Å; K349-E353 WeakPolarHBondContact CG-OE1 3.48Å; K349-E353 WeakPolarHBondContact O-CB 3.27Å; K349-E353 WeakPolarHBondContact O-CG 3.44Å; K349-E353 PolarHBondContact O-N 2.91Å
350E87.9Confident90.8Very high134 Ų13462.1 Ų62.163%0.62629%0.286SS*.Hα-helixtrans-61.9-32.8-179.1-63.8-164.6174.300112.7H348 G354 Q409H348-E350 VanDerWaalsContact C-N 3.32Å; H348-E350 PolarHBondContact O-N 3.45Å; E350-G354 PolarHBondContact O-N 3.21Å; E350-Q409 PolarHBondContact OE2-NE2 2.89Å
351L87.9Confident90.6Very high13 Ų1357.3 Ų57.37%0.06827%0.272CS..Hα-helixtrans-70.3-51.7176.1-75.7163.3000110.4H348 K349 G354 V355 Q409 I410 W413H348-L351 HydrophobicContact CB-CD1 4.45Å; H348-L351 WeakPolarHBondContact O-CB 3.28Å; H348-L351 PolarHBondContact O-N 3.49Å; K349-L351 PolarHBondContact O-N 3.32Å; L351-G354 WeakPolarHBondContact O-CA 3.4Å; L351-G354 PolarHBondContact O-N 3.45Å; L351-G354 VanDerWaalsContact O-N 3.14Å; L351-V355 WeakPolarHBondContact O-CG2 3.31Å; L351-V355 PolarHBondContact O-N 2.9Å; L351-Q409 HydrophobicContact CD2-CB 3.47Å; L351-Q409 VanDerWaalsContact CD2-CB 3.47Å; L351-Q409 HydrophobicContact CG-CB 4.4Å; L351-I410 HydrophobicContact CD2-CG1 3.79Å; L351-W413 HydrophobicContact CD1-CB 3.76Å; L351-W413 HydrophobicContact CD1-CD2 4.48Å; L351-W413 HydrophobicContact CD1-CG 3.66Å
352F89.9Confident90.5Very high7 Ų757.6 Ų57.63%0.03127%0.273CS..Hα-helixtrans-62.2-46-179.5-64.6-50.5000112.5C308 F309 H344 Y345 H348 K349 G354 V355 Q356 F421C308-F352 HydrophobicContact CB-CE1 4.13Å; C308-F352 HydrophobicContact CB-CE2 4.2Å; C308-F352 HydrophobicContact CB-CZ 3.9Å; C308-F352 WeakPolarHBondContact O-CE1 3.39Å; F309-F352 AromaticContact CD2-CD1 3.96Å; F309-F352 HydrophobicContact CD2-CD1 3.96Å; F309-F352 HydrophobicContact CE2-CD1 4.35Å; H344-F352 AromaticContact CE1-CZ 3.67Å; Y345-F352 HydrophobicContact CD2-CB 4.47Å; Y345-F352 AromaticContact CD2-CD2 3.75Å; Y345-F352 HydrophobicContact CD2-CD2 3.75Å; Y345-F352 HydrophobicContact CD2-CE2 4.43Å; Y345-F352 HydrophobicContact CD2-CG 4.41Å; Y345-F352 HydrophobicContact CE2-CB 4.08Å; Y345-F352 HydrophobicContact CE2-CD2 4.2Å; H348-F352 HydrophobicContact CB-CD2 4.1Å; H348-F352 HydrophobicContact CB-CE2 3.64Å; H348-F352 HydrophobicContact CB-CZ 4.25Å; H348-F352 WeakPolarHBondContact O-CD2 3.44Å; H348-F352 PolarHBondContact O-N 2.98Å; K349-F352 PolarHBondContact O-N 3.4Å; F352-G354 VanDerWaalsContact C-N 3.26Å; F352-G354 PolarHBondContact O-N 2.97Å; F352-V355 PolarHBondContact O-N 2.99Å; F352-Q356 WeakPolarHBondContact O-CB 3.47Å; F352-Q356 PolarHBondContact O-N 3.33Å; F352-F421 HydrophobicContact CD1-CE2 4.45Å; F352-F421 HydrophobicContact CD1-CZ 4.27Å; F352-F421 AromaticContact CE1-CE2 3.89Å; F352-F421 HydrophobicContact CE1-CE2 3.89Å; F352-F421 HydrophobicContact CE1-CZ 4.09Å
353E90.8Very high90.3Very high91 Ų9160.7 Ų60.743%0.42528%0.282SS..Hα-helixtrans-62.8-35.5174.5-71-177.817900111.7K349 K357K349-E353 WeakPolarHBondContact CE-OE1 3.38Å; K349-E353 HydrophobicContact CG-CG 4.16Å; K349-E353 WeakPolarHBondContact CG-OE1 3.48Å; K349-E353 WeakPolarHBondContact O-CB 3.27Å; K349-E353 WeakPolarHBondContact O-CG 3.44Å; K349-E353 PolarHBondContact O-N 2.91Å; E353-K357 WeakPolarHBondContact O-CB 3.47Å; E353-K357 PolarHBondContact O-N 3.42Å
354G89.9Confident90.1Very high10 Ų1059.4 Ų59.410%0.10328%0.278CS..Hα-helixtrans-63.4-46.7174.500000112.8E350 L351 F352 K357 W358 L406E350-G354 PolarHBondContact O-N 3.21Å; L351-G354 WeakPolarHBondContact O-CA 3.4Å; L351-G354 PolarHBondContact O-N 3.45Å; L351-G354 VanDerWaalsContact O-N 3.14Å; F352-G354 VanDerWaalsContact C-N 3.26Å; F352-G354 PolarHBondContact O-N 2.97Å; G354-K357 PolarHBondContact O-N 2.92Å; G354-W358 PolarHBondContact O-N 3.34Å; G354-L406 WeakPolarHBondContact O-CD1 3.15Å
355V89.9Confident90Very high2 Ų257.1 Ų57.11%0.01227%0.268CS..Hα-helixtrans-61.6-49.3175.8169.60000110.4F309 L351 F352 K357 W358 E359 F421 V423 F428F309-V355 HydrophobicContact CD2-CG1 4.18Å; F309-V355 HydrophobicContact CE1-CG1 4.21Å; F309-V355 HydrophobicContact CE2-CB 4.04Å; F309-V355 HydrophobicContact CE2-CG1 3.65Å; F309-V355 HydrophobicContact CZ-CB 4.35Å; F309-V355 HydrophobicContact CZ-CG1 3.67Å; L351-V355 WeakPolarHBondContact O-CG2 3.31Å; L351-V355 PolarHBondContact O-N 2.9Å; F352-V355 PolarHBondContact O-N 2.99Å; V355-K357 VanDerWaalsContact C-N 3.33Å; V355-K357 PolarHBondContact O-N 3.47Å; V355-W358 WeakPolarHBondContact O-CB 3.31Å; V355-W358 PolarHBondContact O-N 2.97Å; V355-W358 VanDerWaalsContact O-N 3.11Å; V355-E359 PolarHBondContact O-N 2.87Å; V355-F421 HydrophobicContact CG2-CE1 3.87Å; V355-F421 HydrophobicContact CG2-CZ 4.11Å; V355-V423 HydrophobicContact CG1-CG1 4.31Å; V355-V423 HydrophobicContact CG1-CG2 4.14Å; V355-V423 HydrophobicContact CG2-CG2 4.47Å; V355-F428 HydrophobicContact CB-CE2 4.28Å; V355-F428 HydrophobicContact CG1-CD2 3.95Å; V355-F428 HydrophobicContact CG1-CE2 3.7Å; V355-F428 HydrophobicContact CG1-CZ 4.41Å; V355-F428 HydrophobicContact CG2-CD1 4.4Å; V355-F428 HydrophobicContact CG2-CD2 4.11Å; V355-F428 HydrophobicContact CG2-CE1 4.36Å; V355-F428 HydrophobicContact CG2-CE2 4.08Å; V355-F428 HydrophobicContact CG2-CG 4.28Å; V355-F428 HydrophobicContact CG2-CZ 4.19Å
356Q90.1Very high89.7Confident84 Ų8458.4 Ų58.439%0.39328%0.276SS..Hα-helixtrans-58-46.6177.2-176.3-177.8-1200111.2F309 F352 W358 E359 E360F309-Q356 HydrophobicContact CZ-CB 4.25Å; F352-Q356 WeakPolarHBondContact O-CB 3.47Å; F352-Q356 PolarHBondContact O-N 3.33Å; Q356-W358 VanDerWaalsContact C-N 3.28Å; Q356-W358 PolarHBondContact O-N 2.89Å; Q356-E359 PolarHBondContact O-N 3.39Å; Q356-E359 VanDerWaalsContact O-N 3.17Å; Q356-E360 HydrophobicContact CG-CG 4.48Å; Q356-E360 WeakPolarHBondContact CG-OE1 3.32Å; Q356-E360 PolarHBondContact NE2-OE1 3.48Å; Q356-E360 WeakPolarHBondContact O-CG 3.28Å; Q356-E360 PolarHBondContact O-N 3.01Å
357K91.4Very high89.4Confident124 Ų12456.7 Ų56.754%0.53927%0.27SS..Hα-helixtrans-62.2-36177.7-175.5175.3-174.4169.10112.3E353 G354 V355 S361 L402E353-K357 WeakPolarHBondContact O-CB 3.47Å; E353-K357 PolarHBondContact O-N 3.42Å; G354-K357 PolarHBondContact O-N 2.92Å; V355-K357 VanDerWaalsContact C-N 3.33Å; V355-K357 PolarHBondContact O-N 3.47Å; K357-S361 WeakPolarHBondContact O-CB 3.37Å; K357-S361 PolarHBondContact O-N 3.46Å; K357-S361 PolarHBondContact O-OG 3.43Å; K357-L402 HydrophobicContact CB-CD2 4.49Å; K357-L402 HydrophobicContact CG-CD2 4.2Å
358W91.4Very high89.3Confident0 Ų052.4 Ų52.40%025%0.247CC..Hα-helixtrans-65.5-47.1174-179.492.1000110.6G354 V355 Q356 E360 S361 W362 L399 L402 E403 L406 F428 Y431 V432 Q435G354-W358 PolarHBondContact O-N 3.34Å; V355-W358 WeakPolarHBondContact O-CB 3.31Å; V355-W358 PolarHBondContact O-N 2.97Å; V355-W358 VanDerWaalsContact O-N 3.11Å; Q356-W358 VanDerWaalsContact C-N 3.28Å; Q356-W358 PolarHBondContact O-N 2.89Å; W358-E360 PolarHBondContact O-N 3.36Å; W358-S361 PolarHBondContact O-N 3.25Å; W358-W362 HydrophobicContact CE3-CB 4.45Å; W358-W362 HydrophobicContact CH2-CB 4.16Å; W358-W362 HydrophobicContact CH2-CD2 4.25Å; W358-W362 AromaticContact CH2-CG 3.89Å; W358-W362 HydrophobicContact CH2-CG 3.89Å; W358-W362 HydrophobicContact CZ2-CB 4.26Å; W358-W362 HydrophobicContact CZ2-CD2 4.2Å; W358-W362 HydrophobicContact CZ2-CE3 4.38Å; W358-W362 HydrophobicContact CZ2-CG 4.14Å; W358-W362 HydrophobicContact CZ3-CB 4.25Å; W358-W362 HydrophobicContact CZ3-CG 4.33Å; W358-W362 VanDerWaalsContact O-CB 3.3Å; W358-W362 WeakPolarHBondContact O-CB 3.46Å; W358-W362 PolarHBondContact O-N 2.86Å; W358-L399 HydrophobicContact CG-CD2 4.34Å; W358-L402 HydrophobicContact CB-CD2 3.73Å; W358-L402 HydrophobicContact CB-CG 4.36Å; W358-L402 HydrophobicContact CG-CD2 4.42Å; W358-E403 PolarHBondContact NE1-OE1 3.46Å; W358-L406 HydrophobicContact CB-CD1 3.88Å; W358-L406 HydrophobicContact CG-CD1 4.43Å; W358-F428 HydrophobicContact CB-CZ 4.12Å; W358-F428 HydrophobicContact CD2-CE2 4.34Å; W358-F428 AromaticContact CD2-CZ 3.84Å; W358-F428 HydrophobicContact CD2-CZ 3.84Å; W358-F428 AromaticContact CE3-CE2 3.85Å; W358-F428 HydrophobicContact CE3-CE2 3.85Å; W358-F428 AromaticContact CE3-CZ 3.83Å; W358-F428 HydrophobicContact CE3-CZ 3.83Å; W358-F428 AromaticContact CG-CZ 3.95Å; W358-F428 HydrophobicContact CG-CZ 3.95Å; W358-F428 HydrophobicContact CZ3-CE2 4.38Å; W358-Y431 HydrophobicContact CH2-CE1 4.33Å; W358-Y431 HydrophobicContact CZ3-CD1 4.21Å; W358-Y431 AromaticContact CZ3-CE1 3.75Å; W358-Y431 HydrophobicContact CZ3-CE1 3.75Å; W358-V432 HydrophobicContact CD2-CG2 4.1Å; W358-V432 HydrophobicContact CE3-CG2 4.21Å; W358-V432 HydrophobicContact CH2-CB 4.23Å; W358-V432 HydrophobicContact CH2-CG1 4.39Å; W358-V432 HydrophobicContact CH2-CG2 3.76Å; W358-V432 HydrophobicContact CZ2-CB 3.98Å; W358-V432 HydrophobicContact CZ2-CG1 3.67Å; W358-V432 HydrophobicContact CZ2-CG2 3.62Å; W358-V432 HydrophobicContact CZ3-CG2 4.06Å; W358-Q435 HydrophobicContact CH2-CB 4.19Å; W358-Q435 HydrophobicContact CH2-CG 4.18Å
359E88.4Confident89.2Confident54 Ų5451.9 Ų51.925%0.25225%0.245SC..Hα-helixtrans-62.1-43.3179.3-161.8-170.5150.700111.9V355 Q356 W362 R363V355-E359 PolarHBondContact O-N 2.87Å; Q356-E359 PolarHBondContact O-N 3.39Å; Q356-E359 VanDerWaalsContact O-N 3.17Å; E359-W362 PolarHBondContact O-N 3.19Å; E359-R363 VanDerWaalsContact O-CB 3.31Å; E359-R363 WeakPolarHBondContact O-CB 3.41Å; E359-R363 PolarHBondContact O-N 2.81Å; E359-R363 IonicContact OE1-CZ 2.67Å; E359-R363 IonicContact OE1-NH2 3.88Å; E359-R363 PolarHBondContact OE1-NH2 3.25Å
360E91.1Very high88.9Confident107 Ų10755.9 Ų55.950%0.526%0.262SS..Hα-helixtrans-61.7-44.1174.3-72.2173.7-174.300111.9Q356 W358 W362 R363 L364Q356-E360 HydrophobicContact CG-CG 4.48Å; Q356-E360 WeakPolarHBondContact CG-OE1 3.32Å; Q356-E360 PolarHBondContact NE2-OE1 3.48Å; Q356-E360 WeakPolarHBondContact O-CG 3.28Å; Q356-E360 PolarHBondContact O-N 3.01Å; W358-E360 PolarHBondContact O-N 3.36Å; E360-W362 VanDerWaalsContact C-N 3.34Å; E360-R363 PolarHBondContact O-N 3.43Å; E360-L364 WeakPolarHBondContact O-CB 3.08Å; E360-L364 PolarHBondContact O-N 2.99Å
361S91Very high88.7Confident25 Ų2554.8 Ų54.818%0.17526%0.255CS..Hα-helixtrans-65.5-38.6177.9-62.30000111.8K357 W358 Y365K357-S361 WeakPolarHBondContact O-CB 3.37Å; K357-S361 PolarHBondContact O-N 3.46Å; K357-S361 PolarHBondContact O-OG 3.43Å; W358-S361 PolarHBondContact O-N 3.25Å; S361-Y365 WeakPolarHBondContact O-CB 3.37Å; S361-Y365 PolarHBondContact O-N 3.4Å
362W90.5Very high88.3Confident7 Ų755.5 Ų55.53%0.02726%0.263CS..Hα-helixtrans-68.3-46.1177.2-178.5-113.9000111.4W358 E359 E360 L364 Y365 L366 L399 Q435 W436 H439W358-W362 HydrophobicContact CE3-CB 4.45Å; W358-W362 HydrophobicContact CH2-CB 4.16Å; W358-W362 HydrophobicContact CH2-CD2 4.25Å; W358-W362 AromaticContact CH2-CG 3.89Å; W358-W362 HydrophobicContact CH2-CG 3.89Å; W358-W362 HydrophobicContact CZ2-CB 4.26Å; W358-W362 HydrophobicContact CZ2-CD2 4.2Å; W358-W362 HydrophobicContact CZ2-CE3 4.38Å; W358-W362 HydrophobicContact CZ2-CG 4.14Å; W358-W362 HydrophobicContact CZ3-CB 4.25Å; W358-W362 HydrophobicContact CZ3-CG 4.33Å; W358-W362 VanDerWaalsContact O-CB 3.3Å; W358-W362 WeakPolarHBondContact O-CB 3.46Å; W358-W362 PolarHBondContact O-N 2.86Å; E359-W362 PolarHBondContact O-N 3.19Å; E360-W362 VanDerWaalsContact C-N 3.34Å; W362-L364 PolarHBondContact O-N 2.88Å; W362-Y365 HydrophobicContact CE3-CD1 4.25Å; W362-Y365 AromaticContact CZ3-CD1 3.97Å; W362-Y365 HydrophobicContact CZ3-CD1 3.97Å; W362-Y365 HydrophobicContact CZ3-CE1 4.31Å; W362-Y365 WeakPolarHBondContact O-CB 3.3Å; W362-Y365 PolarHBondContact O-N 3.2Å; W362-Y365 VanDerWaalsContact O-N 3.15Å; W362-L366 HydrophobicContact CZ2-CD2 4.23Å; W362-L366 HydrophobicContact CZ2-CG 4.48Å; W362-L366 WeakPolarHBondContact O-CG 3.32Å; W362-L366 PolarHBondContact O-N 3.16Å; W362-L399 HydrophobicContact CB-CD2 4.32Å; W362-L399 HydrophobicContact CE3-CD1 3.87Å; W362-L399 HydrophobicContact CE3-CD2 4.48Å; W362-L399 HydrophobicContact CZ3-CD1 4.38Å; W362-Q435 HydrophobicContact CZ2-CB 3.9Å; W362-Q435 WeakPolarHBondContact CZ2-O 3.41Å; W362-W436 HydrophobicContact CE3-CZ2 4.31Å; W362-W436 AromaticContact CH2-CD2 3.64Å; W362-W436 HydrophobicContact CH2-CD2 3.64Å; W362-W436 AromaticContact CH2-CE3 3.63Å; W362-W436 HydrophobicContact CH2-CE3 3.63Å; W362-W436 HydrophobicContact CH2-CG 4.12Å; W362-W436 HydrophobicContact CH2-CH2 4.37Å; W362-W436 HydrophobicContact CH2-CZ2 4.37Å; W362-W436 HydrophobicContact CH2-CZ3 4Å; W362-W436 AromaticContact CZ3-CD2 3.64Å; W362-W436 HydrophobicContact CZ3-CD2 3.64Å; W362-W436 AromaticContact CZ3-CE2 3.49Å; W362-W436 VanDerWaalsContact CZ3-CE2 3.49Å; W362-W436 AromaticContact CZ3-CE3 3.77Å; W362-W436 HydrophobicContact CZ3-CE3 3.77Å; W362-W436 HydrophobicContact CZ3-CG 4.36Å; W362-W436 AromaticContact CZ3-CH2 3.68Å; W362-W436 HydrophobicContact CZ3-CH2 3.68Å; W362-W436 AromaticContact CZ3-CZ2 3.54Å; W362-W436 HydrophobicContact CZ3-CZ2 3.54Å; W362-W436 AromaticContact CZ3-CZ3 3.79Å; W362-W436 HydrophobicContact CZ3-CZ3 3.79Å; W362-H439 HydrophobicContact CH2-CB 3.98Å; W362-H439 HydrophobicContact CZ2-CB 4.02Å
363R90.9Very high87.6Confident143 Ų14358 Ų5854%0.5428%0.279SS..Hα-helixtrans-59.5-46.1175.1-168.3-179.1-64.2169.11.6111.3E359 E360 Y365 L366 D367E359-R363 VanDerWaalsContact O-CB 3.31Å; E359-R363 WeakPolarHBondContact O-CB 3.41Å; E359-R363 PolarHBondContact O-N 2.81Å; E359-R363 IonicContact OE1-CZ 2.67Å; E359-R363 IonicContact OE1-NH2 3.88Å; E359-R363 PolarHBondContact OE1-NH2 3.25Å; E360-R363 PolarHBondContact O-N 3.43Å; R363-Y365 VanDerWaalsContact C-N 3.32Å; R363-Y365 PolarHBondContact O-N 3.34Å; R363-L366 PolarHBondContact O-N 3.44Å; R363-D367 PolarHBondContact O-N 2.91Å
364L89.6Confident86.9Confident83 Ų8357 Ų5744%0.43528%0.276SS..Hα-helixtrans-62.1-39.3175.1-17961000112.1E360 W362 D367 L368 L395E360-L364 WeakPolarHBondContact O-CB 3.08Å; E360-L364 PolarHBondContact O-N 2.99Å; W362-L364 PolarHBondContact O-N 2.88Å; L364-D367 PolarHBondContact O-N 2.9Å; L364-L368 HydrophobicContact CD1-CG 4.44Å; L364-L368 HydrophobicContact CG-CD1 4.36Å; L364-L368 WeakPolarHBondContact O-CG 3.39Å; L364-L368 PolarHBondContact O-N 3.37Å; L364-L395 HydrophobicContact CB-CD1 4.32Å; L364-L395 HydrophobicContact CD2-CD1 3.9Å; L364-L395 HydrophobicContact CG-CD1 3.85Å
365Y88.4Confident86Confident4 Ų461.8 Ų61.82%0.01631%0.306CS..Hα-helixtrans-61.4-47.2175.3178.1-96.1000111.6S361 W362 R363 D367 L368 E369 R392 L395 Q396 L399S361-Y365 WeakPolarHBondContact O-CB 3.37Å; S361-Y365 PolarHBondContact O-N 3.4Å; W362-Y365 HydrophobicContact CE3-CD1 4.25Å; W362-Y365 AromaticContact CZ3-CD1 3.97Å; W362-Y365 HydrophobicContact CZ3-CD1 3.97Å; W362-Y365 HydrophobicContact CZ3-CE1 4.31Å; W362-Y365 WeakPolarHBondContact O-CB 3.3Å; W362-Y365 PolarHBondContact O-N 3.2Å; W362-Y365 VanDerWaalsContact O-N 3.15Å; R363-Y365 VanDerWaalsContact C-N 3.32Å; R363-Y365 PolarHBondContact O-N 3.34Å; Y365-D367 VanDerWaalsContact C-N 3.34Å; Y365-D367 PolarHBondContact O-N 2.73Å; Y365-L368 PolarHBondContact O-N 2.99Å; Y365-E369 HydrophobicContact CD1-CG 4.2Å; Y365-E369 HydrophobicContact CE1-CG 3.78Å; Y365-E369 WeakPolarHBondContact CE1-OE1 3.38Å; Y365-E369 VanDerWaalsContact CZ-OE1 3.25Å; Y365-E369 WeakPolarHBondContact O-CB 3.37Å; Y365-E369 WeakPolarHBondContact O-CG 3.42Å; Y365-E369 PolarHBondContact O-N 2.94Å; Y365-E369 PolarHBondContact OH-OE1 3.43Å; Y365-R392 HydrophobicContact CD2-CG 4.1Å; Y365-R392 HydrophobicContact CE2-CG 3.76Å; Y365-L395 HydrophobicContact CD2-CB 4.06Å; Y365-Q396 HydrophobicContact CE2-CB 4.03Å; Y365-Q396 HydrophobicContact CE2-CG 4.43Å; Y365-L399 HydrophobicContact CD2-CD1 4.35Å; Y365-L399 HydrophobicContact CG-CD1 4.07Å
366L86.7Confident85.2Confident48 Ų4866.1 Ų66.125%0.25133%0.333SS..Hα-helixtrans-62.1-38.6175.8-70.3176.9000112.6W362 R363 E369 K370W362-L366 HydrophobicContact CZ2-CD2 4.23Å; W362-L366 HydrophobicContact CZ2-CG 4.48Å; W362-L366 WeakPolarHBondContact O-CG 3.32Å; W362-L366 PolarHBondContact O-N 3.16Å; R363-L366 PolarHBondContact O-N 3.44Å; L366-E369 WeakPolarHBondContact O-CB 3.32Å; L366-E369 PolarHBondContact O-N 3.44Å; L366-K370 WeakPolarHBondContact O-CG 3.48Å; L366-K370 PolarHBondContact O-N 3.17Å
367D86.9Confident84.3Confident68 Ų6863.6 Ų63.636%0.36432%0.319SS..Hα-helixtrans-67.2-40.8177-75-16.6000112.1R363 L364 Y365 E369 K370 K371R363-D367 PolarHBondContact O-N 2.91Å; L364-D367 PolarHBondContact O-N 2.9Å; Y365-D367 VanDerWaalsContact C-N 3.34Å; Y365-D367 PolarHBondContact O-N 2.73Å; D367-E369 VanDerWaalsContact C-N 3.31Å; D367-K370 PolarHBondContact O-N 3.38Å; D367-K371 WeakPolarHBondContact O-CB 3.37Å; D367-K371 VanDerWaalsContact O-CG 3.26Å; D367-K371 WeakPolarHBondContact O-CG 3.49Å; D367-K371 PolarHBondContact O-N 2.99Å
368L86.4Confident83.2Confident10 Ų1065.5 Ų65.55%0.05233%0.328CS..Hα-helixtrans-65.9-35.2173.5-71.3174.7000111.8L364 Y365 A372 E388 Q391 R392 L395L364-L368 HydrophobicContact CD1-CG 4.44Å; L364-L368 HydrophobicContact CG-CD1 4.36Å; L364-L368 WeakPolarHBondContact O-CG 3.39Å; L364-L368 PolarHBondContact O-N 3.37Å; Y365-L368 PolarHBondContact O-N 2.99Å; L368-A372 WeakPolarHBondContact O-CB 3.39Å; L368-A372 PolarHBondContact O-N 3.34Å; L368-E388 HydrophobicContact CD2-CB 4.14Å; L368-E388 HydrophobicContact CD2-CG 4.08Å; L368-Q391 HydrophobicContact CD1-CB 4.1Å; L368-R392 HydrophobicContact CB-CB 4.48Å; L368-R392 HydrophobicContact CD1-CB 4.28Å; L368-L395 HydrophobicContact CD1-CD1 3.87Å
369E84.6Confident82.1Confident12 Ų1269.5 Ų69.56%0.05636%0.361CS..Hα-helixtrans-63.8-48.5173-79.6-120.3166.100112.5Y365 L366 D367 K371 A372 T373 R392 H439 K443Y365-E369 HydrophobicContact CD1-CG 4.2Å; Y365-E369 HydrophobicContact CE1-CG 3.78Å; Y365-E369 WeakPolarHBondContact CE1-OE1 3.38Å; Y365-E369 VanDerWaalsContact CZ-OE1 3.25Å; Y365-E369 WeakPolarHBondContact O-CB 3.37Å; Y365-E369 WeakPolarHBondContact O-CG 3.42Å; Y365-E369 PolarHBondContact O-N 2.94Å; Y365-E369 PolarHBondContact OH-OE1 3.43Å; L366-E369 WeakPolarHBondContact O-CB 3.32Å; L366-E369 PolarHBondContact O-N 3.44Å; D367-E369 VanDerWaalsContact C-N 3.31Å; E369-K371 VanDerWaalsContact C-N 3.32Å; E369-K371 PolarHBondContact O-N 2.94Å; E369-A372 WeakPolarHBondContact O-CB 3.46Å; E369-A372 PolarHBondContact O-N 3.36Å; E369-T373 PolarHBondContact O-N 2.9Å; E369-T373 VanDerWaalsContact O-N 3.12Å; E369-R392 VanDerWaalsContact CD-NH2 3.32Å; E369-R392 IonicContact OE1-CZ 3.55Å; E369-R392 IonicContact OE1-NE 3.05Å; E369-R392 IonicContact OE1-NH2 3.18Å; E369-R392 PolarHBondContact OE1-NH2 2.88Å; E369-R392 IonicContact OE2-NH2 3.01Å; E369-H439 VanDerWaalsContact CD-CE1 3.49Å; E369-H439 IonicContact OE1-CE1 2.72Å; E369-H439 PolarHBondContact OE1-CE1 3.35Å; E369-H439 VanDerWaalsContact OE1-CE1 3.27Å; E369-H439 IonicContact OE1-NE2 3.53Å; E369-H439 PolarHBondContact OE1-NE2 3.47Å; E369-H439 IonicContact OE2-CD2 3.55Å; E369-H439 IonicContact OE2-CE1 3.91Å; E369-H439 PolarHBondContact OE2-CE1 2.93Å; E369-H439 IonicContact OE2-NE2 2.9Å; E369-H439 PolarHBondContact OE2-NE2 3.27Å; E369-K443 WeakPolarHBondContact OE2-CD 3.36Å; E369-K443 IonicContact OE2-NZ 3.5Å; E369-K443 PolarHBondContact OE2-NZ 2.82Å
370K84.3Confident80.8Confident147 Ų14771.9 Ų71.964%0.63938%0.376SS*.Hα-helixtrans-58.6-46175.7-73172.2-176171.50111L366 D367 A372 T373 D374L366-K370 WeakPolarHBondContact O-CG 3.48Å; L366-K370 PolarHBondContact O-N 3.17Å; D367-K370 PolarHBondContact O-N 3.38Å; K370-A372 VanDerWaalsContact C-N 3.26Å; K370-A372 PolarHBondContact O-N 3.15Å; K370-T373 PolarHBondContact O-N 3.25Å; K370-T373 VanDerWaalsContact O-N 3.16Å; K370-D374 PolarHBondContact O-N 2.83Å
371K82.3Confident79.2Confident112 Ų11279.1 Ų79.149%0.48740%0.398SS..Hα-helixtrans-60-35.6174.5-73.4171.9-176.9174.30112.2D367 E369 T373 D374 R377D367-K371 WeakPolarHBondContact O-CB 3.37Å; D367-K371 VanDerWaalsContact O-CG 3.26Å; D367-K371 WeakPolarHBondContact O-CG 3.49Å; D367-K371 PolarHBondContact O-N 2.99Å; E369-K371 VanDerWaalsContact C-N 3.32Å; E369-K371 PolarHBondContact O-N 2.94Å; K371-T373 VanDerWaalsContact C-N 3.32Å; K371-T373 PolarHBondContact O-N 2.9Å; K371-D374 PolarHBondContact O-N 3.3Å; K371-R377 WeakPolarHBondContact O-CD 3.34Å
372A79.1Confident77.9Confident28 Ų2881.2 Ų81.223%0.23142%0.424CS..Hα-helixtrans-69.7-27.2177.800000113.6L368 E369 K370L368-A372 WeakPolarHBondContact O-CB 3.39Å; L368-A372 PolarHBondContact O-N 3.34Å; E369-A372 WeakPolarHBondContact O-CB 3.46Å; E369-A372 PolarHBondContact O-N 3.36Å; K370-A372 VanDerWaalsContact C-N 3.26Å; K370-A372 PolarHBondContact O-N 3.15Å
373T75.2Confident76.9Confident58 Ų5883.2 Ų83.236%0.35645%0.446SS..Hα-helixtrans-83.3-17.4177.6-72.10000113.3E369 K370 K371 P375 E446E369-T373 PolarHBondContact O-N 2.9Å; E369-T373 VanDerWaalsContact O-N 3.12Å; K370-T373 PolarHBondContact O-N 3.25Å; K370-T373 VanDerWaalsContact O-N 3.16Å; K371-T373 VanDerWaalsContact C-N 3.32Å; K371-T373 PolarHBondContact O-N 2.9Å; T373-P375 WeakPolarHBondContact O-CD 3.34Å; T373-E446 WeakPolarHBondContact CG2-OE1 3.38Å; T373-E446 PolarHBondContact OG1-OE1 2.88Å
374D76.3Confident76.3Confident70 Ų7080.1 Ų80.137%0.37444%0.441SS..  trans-69.5120.6-178.3-169.9-20.4000112.8K370 K371 T376 R377K370-D374 PolarHBondContact O-N 2.83Å; K371-D374 PolarHBondContact O-N 3.3Å; D374-T376 PolarHBondContact O-N 3.45Å; D374-T376 WeakPolarHBondContact OD1-CB 3.48Å; D374-T376 PolarHBondContact OD1-N 2.89Å; D374-T376 PolarHBondContact OD1-OG1 2.96Å; D374-T376 PolarHBondContact OD2-OG1 3.32Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; D374-R377 WeakPolarHBondContact O-CB 3.5Å; D374-R377 PolarHBondContact O-N 3.41Å
375P72.3Confident75.6Confident111 Ų11179.5 Ų79.572%0.72144%0.437SS*.G310 helixtrans-61.6-26.2176.4-22.734.2000114.5T373 R377T373-P375 WeakPolarHBondContact O-CD 3.34Å; P375-R377 PolarHBondContact O-N 3.33Å
376T72.4Confident75.2Confident94 Ų9485.7 Ų85.758%0.57747%0.47SS*.G310 helixtrans-75.4-9.9-179.668.50000113.1D374 F378 A379D374-T376 PolarHBondContact O-N 3.45Å; D374-T376 WeakPolarHBondContact OD1-CB 3.48Å; D374-T376 PolarHBondContact OD1-N 2.89Å; D374-T376 PolarHBondContact OD1-OG1 2.96Å; D374-T376 PolarHBondContact OD2-OG1 3.32Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; T376-F378 PolarHBondContact O-N 2.88Å; T376-F378 VanDerWaalsContact O-N 3.09Å; T376-A379 WeakPolarHBondContact O-CB 3.35Å; T376-A379 PolarHBondContact O-N 3.35Å; T376-A379 VanDerWaalsContact O-N 3.08Å
377R70.6Confident74.9Confident31 Ų3189.8 Ų89.812%0.11749%0.486CS..G310 helixtrans-55.5-29-178.7-169.6-167.7-172.5-145.8-10.7114.3K371 D374 P375 A379 L385 E388K371-R377 WeakPolarHBondContact O-CD 3.34Å; D374-R377 WeakPolarHBondContact O-CB 3.5Å; D374-R377 PolarHBondContact O-N 3.41Å; P375-R377 PolarHBondContact O-N 3.33Å; R377-A379 VanDerWaalsContact C-N 3.27Å; R377-A379 PolarHBondContact O-N 2.93Å; R377-L385 VanDerWaalsContact CD-CD1 3.5Å; R377-L385 HydrophobicContact CG-CD1 3.66Å; R377-E388 IonicContact CZ-OE2 2.8Å; R377-E388 IonicContact NE-OE2 3.95Å; R377-E388 PolarHBondContact NE-OE2 2.98Å; R377-E388 IonicContact NH2-OE2 2.88Å; R377-E388 PolarHBondContact NH2-OE2 3.1Å
378F69.1Low74.7Confident163 Ų16387.6 Ų87.672%0.71547%0.473SS*.G310 helixtrans-76.9-6.6-178.8-62.9-75.6000114.5T376 N380T376-F378 PolarHBondContact O-N 2.88Å; T376-F378 VanDerWaalsContact O-N 3.09Å; F378-N380 PolarHBondContact O-N 3.45Å
379A67.6Low74.5Confident84 Ų8490.9 Ų90.969%0.69449%0.489SS*.G310 helixtrans-72.9-14.4175.700000113.3T376 R377 R381T376-A379 WeakPolarHBondContact O-CB 3.35Å; T376-A379 PolarHBondContact O-N 3.35Å; T376-A379 VanDerWaalsContact O-N 3.08Å; R377-A379 VanDerWaalsContact C-N 3.27Å; R377-A379 PolarHBondContact O-N 2.93Å; A379-R381 PolarHBondContact O-N 3.03Å
380N60.9Low74.5Confident105 Ų10597.4 Ų97.456%0.56152%0.517SS*.  trans-85.9100.8-175.9-64.3-38.5000111.7F378F378-N380 PolarHBondContact O-N 3.45Å
381R58.7Low74.5Confident258 Ų25895.1 Ų95.197%0.97451%0.508SS*.  trans-77129.1169-81178.5169.7172.2-2.6110.1A379A379-R381 PolarHBondContact O-N 3.03Å
382G63.7Low74.7Confident70 Ų7091.9 Ų91.972%0.72249%0.493SS*.SBendtrans134.927.2169.200000118.3N384G382-N384 PolarHBondContact O-N 3.33Å; G382-N384 VanDerWaalsContact O-N 3.16Å
383G69.9Low74.9Confident48 Ų4892.4 Ų92.450%0.49550%0.495SS..SBendtrans73.45.4172.500000115.8L385 L386 K387G383-L385 VanDerWaalsContact C-N 3.32Å; G383-L385 PolarHBondContact O-N 2.7Å; G383-L386 PolarHBondContact O-N 2.71Å; G383-K387 PolarHBondContact O-N 2.71Å
384N77Confident75.5Confident78 Ų7894.6 Ų94.642%0.41750%0.501SS..Hα-helixtrans-63.8-37.3178-152.546.4000112.2G382 L386 K387 E388G382-N384 PolarHBondContact O-N 3.33Å; G382-N384 VanDerWaalsContact O-N 3.16Å; N384-L386 VanDerWaalsContact C-N 3.27Å; N384-L386 PolarHBondContact O-N 2.86Å; N384-K387 WeakPolarHBondContact O-CB 3.43Å; N384-K387 PolarHBondContact O-N 3.41Å; N384-K387 VanDerWaalsContact O-N 3.08Å; N384-E388 PolarHBondContact ND2-OE1 3.2Å; N384-E388 WeakPolarHBondContact O-CG 3.24Å; N384-E388 PolarHBondContact O-N 3.4Å
385L76Confident76.1Confident70 Ų7092.3 Ų92.337%0.36649%0.489SS..Hα-helixtrans-54.2-43175.9-158.983.5000112.7R377 G383 E389R377-L385 VanDerWaalsContact CD-CD1 3.5Å; R377-L385 HydrophobicContact CG-CD1 3.66Å; G383-L385 VanDerWaalsContact C-N 3.32Å; G383-L385 PolarHBondContact O-N 2.7Å; L385-E389 WeakPolarHBondContact O-CB 3.35Å; L385-E389 PolarHBondContact O-N 3.2Å
386L78.4Confident76.7Confident135 Ų13591.8 Ų91.871%0.70748%0.477SS*.Hα-helixtrans-73.5-34.1-179.2-171.766.5000111.1G383 N384 K390G383-L386 PolarHBondContact O-N 2.71Å; N384-L386 VanDerWaalsContact C-N 3.27Å; N384-L386 PolarHBondContact O-N 2.86Å; L386-K390 WeakPolarHBondContact O-CB 3.39Å; L386-K390 PolarHBondContact O-N 3.48Å
387K80.6Confident77.4Confident133 Ų13393.4 Ų93.458%0.57848%0.476SS*.Hα-helixtrans-67.9-45.5174.3-67.9179.6-179.1178.60111.3G383 N384 K390 Q391G383-K387 PolarHBondContact O-N 2.71Å; N384-K387 WeakPolarHBondContact O-CB 3.43Å; N384-K387 PolarHBondContact O-N 3.41Å; N384-K387 VanDerWaalsContact O-N 3.08Å; K387-K390 PolarHBondContact O-N 3.37Å; K387-Q391 WeakPolarHBondContact O-CB 3.36Å; K387-Q391 VanDerWaalsContact O-CG 3.28Å; K387-Q391 WeakPolarHBondContact O-CG 3.29Å; K387-Q391 PolarHBondContact O-N 3.02Å
388E83.9Confident78.2Confident22 Ų2295 Ų9510%0.10349%0.487CS..Hα-helixtrans-59.2-47.5174.5-72.2168.8-169.900111.5L368 R377 N384 K390 Q391 R392L368-E388 HydrophobicContact CD2-CB 4.14Å; L368-E388 HydrophobicContact CD2-CG 4.08Å; R377-E388 IonicContact CZ-OE2 2.8Å; R377-E388 IonicContact NE-OE2 3.95Å; R377-E388 PolarHBondContact NE-OE2 2.98Å; R377-E388 IonicContact NH2-OE2 2.88Å; R377-E388 PolarHBondContact NH2-OE2 3.1Å; N384-E388 PolarHBondContact ND2-OE1 3.2Å; N384-E388 WeakPolarHBondContact O-CG 3.24Å; N384-E388 PolarHBondContact O-N 3.4Å; E388-K390 PolarHBondContact O-N 2.87Å; E388-Q391 PolarHBondContact O-N 3.31Å; E388-R392 WeakPolarHBondContact O-CB 3.42Å; E388-R392 PolarHBondContact O-N 3.46Å
389E81.8Confident79.2Confident80 Ų8087.3 Ų87.337%0.37445%0.453SS..Hα-helixtrans-66.9-38.1179.1-168.461.9-146.200111.6L385 R392 S393L385-E389 WeakPolarHBondContact O-CB 3.35Å; L385-E389 PolarHBondContact O-N 3.2Å; E389-R392 PolarHBondContact O-N 3.46Å; E389-R392 IonicContact OE1-NH1 3.3Å; E389-R392 IonicContact OE2-NH1 3.82Å; E389-S393 WeakPolarHBondContact O-CB 3.36Å; E389-S393 PolarHBondContact O-N 3.28Å
390K85.4Confident80.2Confident148 Ų14886.1 Ų86.164%0.64344%0.438SS*.Hα-helixtrans-62.4-47.6173.7-175.6-178.1177.4-1740111.1L386 K387 E388 S393 E394L386-K390 WeakPolarHBondContact O-CB 3.39Å; L386-K390 PolarHBondContact O-N 3.48Å; K387-K390 PolarHBondContact O-N 3.37Å; E388-K390 PolarHBondContact O-N 2.87Å; K390-S393 PolarHBondContact O-N 3.16Å; K390-E394 VanDerWaalsContact O-CB 3.31Å; K390-E394 WeakPolarHBondContact O-CB 3.43Å; K390-E394 PolarHBondContact O-N 3.08Å
391Q84.1Confident81.5Confident99 Ų9987.5 Ų87.546%0.46344%0.439SS..Hα-helixtrans-62.5-41.7176.9-76.4175.6-23.600111.5L368 K387 E388 E394 L395L368-Q391 HydrophobicContact CD1-CB 4.1Å; K387-Q391 WeakPolarHBondContact O-CB 3.36Å; K387-Q391 VanDerWaalsContact O-CG 3.28Å; K387-Q391 WeakPolarHBondContact O-CG 3.29Å; K387-Q391 PolarHBondContact O-N 3.02Å; E388-Q391 PolarHBondContact O-N 3.31Å; Q391-E394 PolarHBondContact O-N 2.86Å; Q391-L395 WeakPolarHBondContact O-CB 3.32Å; Q391-L395 WeakPolarHBondContact O-CG 3.46Å; Q391-L395 PolarHBondContact O-N 3.34Å
392R85.6Confident82.9Confident44 Ų4476.7 Ų76.717%0.16640%0.401CS..Hα-helixtrans-62.4-47.2174.9-175.7-174.9173.2-154.82.2111.9Y365 L368 E369 E388 E389 E394 L395 Q396Y365-R392 HydrophobicContact CD2-CG 4.1Å; Y365-R392 HydrophobicContact CE2-CG 3.76Å; L368-R392 HydrophobicContact CB-CB 4.48Å; L368-R392 HydrophobicContact CD1-CB 4.28Å; E369-R392 VanDerWaalsContact CD-NH2 3.32Å; E369-R392 IonicContact OE1-CZ 3.55Å; E369-R392 IonicContact OE1-NE 3.05Å; E369-R392 IonicContact OE1-NH2 3.18Å; E369-R392 PolarHBondContact OE1-NH2 2.88Å; E369-R392 IonicContact OE2-NH2 3.01Å; E388-R392 WeakPolarHBondContact O-CB 3.42Å; E388-R392 PolarHBondContact O-N 3.46Å; E389-R392 PolarHBondContact O-N 3.46Å; E389-R392 IonicContact OE1-NH1 3.3Å; E389-R392 IonicContact OE2-NH1 3.82Å; R392-E394 VanDerWaalsContact C-N 3.26Å; R392-E394 PolarHBondContact O-N 2.86Å; R392-L395 PolarHBondContact O-N 2.57Å; R392-Q396 WeakPolarHBondContact O-CB 3.31Å; R392-Q396 PolarHBondContact O-N 3.34Å
393S84.4Confident84.2Confident39 Ų3975 Ų7527%0.27337%0.374SS..Hα-helixtrans-63.6-34177.1-172.60000112.1E389 K390 K397E389-S393 WeakPolarHBondContact O-CB 3.36Å; E389-S393 PolarHBondContact O-N 3.28Å; K390-S393 PolarHBondContact O-N 3.16Å; S393-K397 VanDerWaalsContact O-CG 3.3Å; S393-K397 WeakPolarHBondContact O-CG 3.42Å; S393-K397 PolarHBondContact O-N 3.33Å
394E87.1Confident85.1Confident104 Ų10480.9 Ų80.949%0.48639%0.386SS..Hα-helixtrans-69.1-46.3174.6-177165-165.500111.7K390 Q391 R392 Q396 K397 N398K390-E394 VanDerWaalsContact O-CB 3.31Å; K390-E394 WeakPolarHBondContact O-CB 3.43Å; K390-E394 PolarHBondContact O-N 3.08Å; Q391-E394 PolarHBondContact O-N 2.86Å; R392-E394 VanDerWaalsContact C-N 3.26Å; R392-E394 PolarHBondContact O-N 2.86Å; E394-Q396 PolarHBondContact O-N 2.74Å; E394-K397 PolarHBondContact O-N 3.03Å; E394-K397 VanDerWaalsContact O-N 3.16Å; E394-N398 VanDerWaalsContact CG-ND2 3.32Å; E394-N398 WeakPolarHBondContact CG-ND2 3.46Å; E394-N398 VanDerWaalsContact O-CB 3.27Å; E394-N398 WeakPolarHBondContact O-CB 3.29Å; E394-N398 PolarHBondContact O-N 3.48Å; E394-N398 PolarHBondContact O-ND2 3Å
395L88Confident85.7Confident22 Ų2282.9 Ų82.912%0.11539%0.391CS..Hα-helixtrans-61.2-42.9173.5-72.2169.9000111.8L364 Y365 L368 Q391 R392 K397 N398 L399L364-L395 HydrophobicContact CB-CD1 4.32Å; L364-L395 HydrophobicContact CD2-CD1 3.9Å; L364-L395 HydrophobicContact CG-CD1 3.85Å; Y365-L395 HydrophobicContact CD2-CB 4.06Å; L368-L395 HydrophobicContact CD1-CD1 3.87Å; Q391-L395 WeakPolarHBondContact O-CB 3.32Å; Q391-L395 WeakPolarHBondContact O-CG 3.46Å; Q391-L395 PolarHBondContact O-N 3.34Å; R392-L395 PolarHBondContact O-N 2.57Å; L395-K397 PolarHBondContact O-N 3.3Å; L395-N398 PolarHBondContact O-N 3.45Å; L395-N398 VanDerWaalsContact O-N 3.11Å; L395-L399 HydrophobicContact CB-CD1 4.48Å; L395-L399 VanDerWaalsContact O-CB 3.31Å; L395-L399 WeakPolarHBondContact O-CB 3.26Å; L395-L399 WeakPolarHBondContact O-CG 3.43Å; L395-L399 PolarHBondContact O-N 2.73Å
396Q85.5Confident86.3Confident101 Ų10179.5 Ų79.547%0.47237%0.373SS..Hα-helixtrans-60.5-28.9176.4-165.8179.414.100112.7Y365 R392 E394 P400Y365-Q396 HydrophobicContact CE2-CB 4.03Å; Y365-Q396 HydrophobicContact CE2-CG 4.43Å; R392-Q396 WeakPolarHBondContact O-CB 3.31Å; R392-Q396 PolarHBondContact O-N 3.34Å; E394-Q396 PolarHBondContact O-N 2.74Å; Q396-P400 WeakPolarHBondContact O-CD 3.47Å; Q396-P400 WeakPolarHBondContact O-CG 3.41Å
397K87.2Confident86.9Confident128 Ų12877.3 Ų77.356%0.55736%0.358SS*.Hα-helixtrans-87.8-30.7175-70.3169.6-173.4169.40112.9S393 E394 L395 K401S393-K397 VanDerWaalsContact O-CG 3.3Å; S393-K397 WeakPolarHBondContact O-CG 3.42Å; S393-K397 PolarHBondContact O-N 3.33Å; E394-K397 PolarHBondContact O-N 3.03Å; E394-K397 VanDerWaalsContact O-N 3.16Å; L395-K397 PolarHBondContact O-N 3.3Å; K397-K401 WeakPolarHBondContact O-CD 3Å; K397-K401 WeakPolarHBondContact O-CG 3.32Å
398N87.7Confident87.3Confident65 Ų6574 Ų7435%0.34836%0.355SS..Hα-helixtrans-87.7-31.7-174.3-71.4-15.5000112.7E394 L395 K401 L402E394-N398 VanDerWaalsContact CG-ND2 3.32Å; E394-N398 WeakPolarHBondContact CG-ND2 3.46Å; E394-N398 VanDerWaalsContact O-CB 3.27Å; E394-N398 WeakPolarHBondContact O-CB 3.29Å; E394-N398 PolarHBondContact O-N 3.48Å; E394-N398 PolarHBondContact O-ND2 3Å; L395-N398 PolarHBondContact O-N 3.45Å; L395-N398 VanDerWaalsContact O-N 3.11Å; N398-K401 WeakPolarHBondContact O-CB 3.49Å; N398-K401 PolarHBondContact O-N 2.97Å; N398-L402 WeakPolarHBondContact O-CB 3.47Å; N398-L402 PolarHBondContact O-N 2.89Å
399L89.1Confident87.5Confident1 Ų174.9 Ų74.91%0.00536%0.359CS..Hα-helixtrans-57.4-53.6175.5-82.6161.8000111.7W358 W362 Y365 L395 K401 L402 E403 W436W358-L399 HydrophobicContact CG-CD2 4.34Å; W362-L399 HydrophobicContact CB-CD2 4.32Å; W362-L399 HydrophobicContact CE3-CD1 3.87Å; W362-L399 HydrophobicContact CE3-CD2 4.48Å; W362-L399 HydrophobicContact CZ3-CD1 4.38Å; Y365-L399 HydrophobicContact CD2-CD1 4.35Å; Y365-L399 HydrophobicContact CG-CD1 4.07Å; L395-L399 HydrophobicContact CB-CD1 4.48Å; L395-L399 VanDerWaalsContact O-CB 3.31Å; L395-L399 WeakPolarHBondContact O-CB 3.26Å; L395-L399 WeakPolarHBondContact O-CG 3.43Å; L395-L399 PolarHBondContact O-N 2.73Å; L399-K401 VanDerWaalsContact C-N 3.25Å; L399-K401 PolarHBondContact O-N 3.38Å; L399-L402 WeakPolarHBondContact O-CB 3.41Å; L399-L402 PolarHBondContact O-N 3.41Å; L399-L402 VanDerWaalsContact O-N 3.07Å; L399-E403 VanDerWaalsContact O-CG 3.28Å; L399-E403 WeakPolarHBondContact O-CG 3.38Å; L399-E403 PolarHBondContact O-N 3.37Å; L399-W436 HydrophobicContact CB-CZ2 4.29Å; L399-W436 HydrophobicContact CD1-CZ2 4.44Å
400P88.9Confident87.8Confident58 Ų5871.2 Ų71.238%0.37734%0.342SS..Hα-helixtrans-62.2-29176.1-25.235000114.3Q396 K404Q396-P400 WeakPolarHBondContact O-CD 3.47Å; Q396-P400 WeakPolarHBondContact O-CG 3.41Å; P400-K404 WeakPolarHBondContact O-CB 3.26Å; P400-K404 PolarHBondContact O-N 2.87Å
401K87.8Confident87.9Confident135 Ų13566.8 Ų66.859%0.58733%0.326SS*.Hα-helixtrans-71.7-40.5175.2-68.5174.5-172.11730111.3K397 N398 L399 K404 K405K397-K401 WeakPolarHBondContact O-CD 3Å; K397-K401 WeakPolarHBondContact O-CG 3.32Å; N398-K401 WeakPolarHBondContact O-CB 3.49Å; N398-K401 PolarHBondContact O-N 2.97Å; L399-K401 VanDerWaalsContact C-N 3.25Å; L399-K401 PolarHBondContact O-N 3.38Å; K401-K404 PolarHBondContact O-N 2.98Å; K401-K405 PolarHBondContact O-N 3.09Å
402L88.8Confident88.1Confident31 Ų3164.2 Ų64.216%0.16232%0.322CS..Hα-helixtrans-67-43.2176.2-173.462.3000110.3K357 W358 N398 L399 K404 K405 L406K357-L402 HydrophobicContact CB-CD2 4.49Å; K357-L402 HydrophobicContact CG-CD2 4.2Å; W358-L402 HydrophobicContact CB-CD2 3.73Å; W358-L402 HydrophobicContact CB-CG 4.36Å; W358-L402 HydrophobicContact CG-CD2 4.42Å; N398-L402 WeakPolarHBondContact O-CB 3.47Å; N398-L402 PolarHBondContact O-N 2.89Å; L399-L402 WeakPolarHBondContact O-CB 3.41Å; L399-L402 PolarHBondContact O-N 3.41Å; L399-L402 VanDerWaalsContact O-N 3.07Å; L402-K404 PolarHBondContact O-N 3.1Å; L402-K405 WeakPolarHBondContact O-CB 3.39Å; L402-K405 PolarHBondContact O-N 3.46Å; L402-L406 HydrophobicContact CD1-CD1 4.49Å; L402-L406 HydrophobicContact CG-CD1 4.03Å; L402-L406 HydrophobicContact CG-CG 4.5Å; L402-L406 WeakPolarHBondContact O-CB 3.32Å; L402-L406 WeakPolarHBondContact O-CG 3.43Å; L402-L406 PolarHBondContact O-N 2.95Å
403E90.1Very high88.2Confident34 Ų3463.6 Ų63.616%0.15932%0.319CS..Hα-helixtrans-58.5-45.4173.5-70.3164.7-160.400111.9W358 L399 K405 L406 K407 V432 W436W358-E403 PolarHBondContact NE1-OE1 3.46Å; L399-E403 VanDerWaalsContact O-CG 3.28Å; L399-E403 WeakPolarHBondContact O-CG 3.38Å; L399-E403 PolarHBondContact O-N 3.37Å; E403-K405 VanDerWaalsContact C-N 3.33Å; E403-K405 PolarHBondContact O-N 3.25Å; E403-L406 PolarHBondContact O-N 3.42Å; E403-K407 VanDerWaalsContact O-CB 3.28Å; E403-K407 WeakPolarHBondContact O-CB 3.42Å; E403-K407 PolarHBondContact O-N 3.26Å; E403-V432 HydrophobicContact CG-CG1 3.89Å; E403-W436 PolarHBondContact OE1-NE1 3.44Å
404K89.2Confident88.4Confident172 Ų17264 Ų6475%0.74832%0.317SS*.Hα-helixtrans-64.5-38176.7-172.2176.1-179.6178.60112.3P400 K401 L402 A408P400-K404 WeakPolarHBondContact O-CB 3.26Å; P400-K404 PolarHBondContact O-N 2.87Å; K401-K404 PolarHBondContact O-N 2.98Å; L402-K404 PolarHBondContact O-N 3.1Å; K404-A408 PolarHBondContact O-N 3.07Å
405K89.3Confident88.4Confident119 Ų11965.9 Ų65.952%0.51733%0.33SS..Hα-helixtrans-65.5-49.9175.2-174.1-168.8173.1-1650110.5K401 L402 E403 K407 A408 Q409K401-K405 PolarHBondContact O-N 3.09Å; L402-K405 WeakPolarHBondContact O-CB 3.39Å; L402-K405 PolarHBondContact O-N 3.46Å; E403-K405 VanDerWaalsContact C-N 3.33Å; E403-K405 PolarHBondContact O-N 3.25Å; K405-K407 VanDerWaalsContact C-N 3.32Å; K405-K407 PolarHBondContact O-N 3.48Å; K405-A408 PolarHBondContact O-N 3.47Å; K405-Q409 WeakPolarHBondContact O-CG 3.4Å; K405-Q409 PolarHBondContact O-N 2.96Å
406L89.9Confident88.3Confident0 Ų072 Ų720%036%0.358CS..Hα-helixtrans-60.9-42.2178.6-75.3170.2000111.2G354 W358 L402 E403 A408 Q409 I410 F428G354-L406 WeakPolarHBondContact O-CD1 3.15Å; W358-L406 HydrophobicContact CB-CD1 3.88Å; W358-L406 HydrophobicContact CG-CD1 4.43Å; L402-L406 HydrophobicContact CD1-CD1 4.49Å; L402-L406 HydrophobicContact CG-CD1 4.03Å; L402-L406 HydrophobicContact CG-CG 4.5Å; L402-L406 WeakPolarHBondContact O-CB 3.32Å; L402-L406 WeakPolarHBondContact O-CG 3.43Å; L402-L406 PolarHBondContact O-N 2.95Å; E403-L406 PolarHBondContact O-N 3.42Å; L406-A408 VanDerWaalsContact C-N 3.33Å; L406-A408 PolarHBondContact O-N 2.97Å; L406-Q409 PolarHBondContact O-N 3.19Å; L406-Q409 VanDerWaalsContact O-N 3.16Å; L406-I410 HydrophobicContact CB-CD1 4.47Å; L406-I410 WeakPolarHBondContact O-CB 3.45Å; L406-I410 VanDerWaalsContact O-CG1 3.23Å; L406-I410 WeakPolarHBondContact O-CG1 3.47Å; L406-I410 PolarHBondContact O-N 2.99Å; L406-F428 HydrophobicContact CB-CE1 4.23Å; L406-F428 HydrophobicContact CD1-CE1 3.7Å; L406-F428 HydrophobicContact CD1-CZ 3.93Å
407K90Very high88.2Confident88 Ų8871.9 Ų71.938%0.38336%0.358SS..Hα-helixtrans-55.2-48.1173.7176.5160.2-179.447.50111.9E403 K405 Q409 I410 D411 L429E403-K407 VanDerWaalsContact O-CB 3.28Å; E403-K407 WeakPolarHBondContact O-CB 3.42Å; E403-K407 PolarHBondContact O-N 3.26Å; K405-K407 VanDerWaalsContact C-N 3.32Å; K405-K407 PolarHBondContact O-N 3.48Å; K407-Q409 VanDerWaalsContact C-N 3.31Å; K407-Q409 PolarHBondContact O-N 2.89Å; K407-I410 PolarHBondContact O-N 2.84Å; K407-D411 WeakPolarHBondContact CE-OD2 2.93Å; K407-D411 WeakPolarHBondContact CG-OD2 3.48Å; K407-D411 VanDerWaalsContact NZ-CG 3.27Å; K407-D411 IonicContact NZ-OD1 3.59Å; K407-D411 PolarHBondContact NZ-OD1 3.42Å; K407-D411 IonicContact NZ-OD2 2.78Å; K407-D411 PolarHBondContact NZ-OD2 3.16Å; K407-D411 WeakPolarHBondContact O-CB 3.48Å; K407-D411 PolarHBondContact O-N 3.46Å; K407-L429 HydrophobicContact CB-CD1 4.3Å; K407-L429 HydrophobicContact CB-CD2 4.01Å; K407-L429 HydrophobicContact CD-CD1 3.91Å; K407-L429 HydrophobicContact CG-CD1 3.92Å; K407-L429 HydrophobicContact CG-CD2 4.5Å
408A89.2Confident87.8Confident63 Ų6369 Ų6952%0.52136%0.364SS..Hα-helixtrans-64.9-35.9179.100000112.8K404 K405 L406 A412K404-A408 PolarHBondContact O-N 3.07Å; K405-A408 PolarHBondContact O-N 3.47Å; L406-A408 VanDerWaalsContact C-N 3.33Å; L406-A408 PolarHBondContact O-N 2.97Å; A408-A412 WeakPolarHBondContact O-CB 3.26Å; A408-A412 PolarHBondContact O-N 3.16Å
409Q87.6Confident87.4Confident41 Ų4175.3 Ų75.319%0.19238%0.383CS..Hα-helixtrans-72.2-39.6176.6-67179.3-66.200111.8E350 L351 K405 L406 K407 W413E350-Q409 PolarHBondContact OE2-NE2 2.89Å; L351-Q409 HydrophobicContact CD2-CB 3.47Å; L351-Q409 VanDerWaalsContact CD2-CB 3.47Å; L351-Q409 HydrophobicContact CG-CB 4.4Å; K405-Q409 WeakPolarHBondContact O-CG 3.4Å; K405-Q409 PolarHBondContact O-N 2.96Å; L406-Q409 PolarHBondContact O-N 3.19Å; L406-Q409 VanDerWaalsContact O-N 3.16Å; K407-Q409 VanDerWaalsContact C-N 3.31Å; K407-Q409 PolarHBondContact O-N 2.89Å; Q409-W413 WeakPolarHBondContact O-CB 3.41Å; Q409-W413 PolarHBondContact O-N 3.18Å
410I88.9Confident87.1Confident3 Ų381 Ų812%0.01541%0.41CS..Hα-helixtrans-67.1-47.9177-69.7165.9000110.2L351 L406 K407 A412 W413 E414 F421 F428L351-I410 HydrophobicContact CD2-CG1 3.79Å; L406-I410 HydrophobicContact CB-CD1 4.47Å; L406-I410 WeakPolarHBondContact O-CB 3.45Å; L406-I410 VanDerWaalsContact O-CG1 3.23Å; L406-I410 WeakPolarHBondContact O-CG1 3.47Å; L406-I410 PolarHBondContact O-N 2.99Å; K407-I410 PolarHBondContact O-N 2.84Å; I410-A412 VanDerWaalsContact C-N 3.28Å; I410-A412 PolarHBondContact O-N 3.4Å; I410-W413 CarbonylContact O-C 3.59Å; I410-W413 WeakPolarHBondContact O-CA 3.08Å; I410-W413 WeakPolarHBondContact O-CB 3.41Å; I410-W413 PolarHBondContact O-N 2.87Å; I410-E414 HydrophobicContact CG2-CG 4.04Å; I410-E414 WeakPolarHBondContact O-CG 3.27Å; I410-E414 PolarHBondContact O-N 3.26Å; I410-F421 HydrophobicContact CD1-CD1 3.81Å; I410-F421 HydrophobicContact CD1-CE1 4.14Å; I410-F421 HydrophobicContact CG1-CD1 3.87Å; I410-F421 HydrophobicContact CG1-CE1 4.3Å; I410-F421 HydrophobicContact CG1-CG 4.28Å; I410-F421 HydrophobicContact CG2-CB 3.69Å; I410-F421 HydrophobicContact CG2-CD1 4.32Å; I410-F421 HydrophobicContact CG2-CG 4.26Å; I410-F428 HydrophobicContact CD1-CB 4.18Å; I410-F428 HydrophobicContact CD1-CD1 3.57Å; I410-F428 HydrophobicContact CD1-CE1 4.42Å; I410-F428 HydrophobicContact CD1-CG 4.25Å
411D87.9Confident86.9Confident56 Ų5678.6 Ų78.630%0.29939%0.394SS..Hα-helixtrans-58.1-42.9179.5-65.5-16.8000110.5K407 W413 E414 D415K407-D411 WeakPolarHBondContact CE-OD2 2.93Å; K407-D411 WeakPolarHBondContact CG-OD2 3.48Å; K407-D411 VanDerWaalsContact NZ-CG 3.27Å; K407-D411 IonicContact NZ-OD1 3.59Å; K407-D411 PolarHBondContact NZ-OD1 3.42Å; K407-D411 IonicContact NZ-OD2 2.78Å; K407-D411 PolarHBondContact NZ-OD2 3.16Å; K407-D411 WeakPolarHBondContact O-CB 3.48Å; K407-D411 PolarHBondContact O-N 3.46Å; D411-W413 VanDerWaalsContact C-N 3.35Å; D411-W413 PolarHBondContact O-N 3.35Å; D411-E414 PolarHBondContact O-N 2.95Å; D411-D415 WeakPolarHBondContact O-CB 3.36Å; D411-D415 PolarHBondContact O-N 2.64Å; D411-D415 VanDerWaalsContact O-N 3.08Å
412A87.9Confident86.7Confident45 Ų4575 Ų7537%0.37238%0.381SS..Hα-helixtrans-64.4-38.1175.300000112.8A408 I410 E416A408-A412 WeakPolarHBondContact O-CB 3.26Å; A408-A412 PolarHBondContact O-N 3.16Å; I410-A412 VanDerWaalsContact C-N 3.28Å; I410-A412 PolarHBondContact O-N 3.4Å; A412-E416 VanDerWaalsContact O-CG 3.31Å; A412-E416 WeakPolarHBondContact O-CG 3.39Å; A412-E416 PolarHBondContact O-N 2.86Å; A412-E416 VanDerWaalsContact O-N 3.07Å
413W87.9Confident86.5Confident30 Ų3074 Ų7411%0.11438%0.376CS..Hα-helixtrans-69.5-42177.5179.985.7000112.7H348 L351 Q409 I410 D411 D415 E416 Q417 R419 F421H348-W413 AromaticContact CD2-CD1 3.21Å; H348-W413 AromaticContact CD2-NE1 2.89Å; H348-W413 PolarHBondContact CD2-NE1 2.83Å; H348-W413 AromaticContact CE1-NE1 3.72Å; H348-W413 AromaticContact CG-NE1 3.59Å; H348-W413 AromaticContact NE2-CD1 3.55Å; H348-W413 AromaticContact NE2-NE1 2.94Å; H348-W413 PolarHBondContact NE2-NE1 3.31Å; L351-W413 HydrophobicContact CD1-CB 3.76Å; L351-W413 HydrophobicContact CD1-CD2 4.48Å; L351-W413 HydrophobicContact CD1-CG 3.66Å; Q409-W413 WeakPolarHBondContact O-CB 3.41Å; Q409-W413 PolarHBondContact O-N 3.18Å; I410-W413 CarbonylContact O-C 3.59Å; I410-W413 WeakPolarHBondContact O-CA 3.08Å; I410-W413 WeakPolarHBondContact O-CB 3.41Å; I410-W413 PolarHBondContact O-N 2.87Å; D411-W413 VanDerWaalsContact C-N 3.35Å; D411-W413 PolarHBondContact O-N 3.35Å; W413-D415 VanDerWaalsContact C-N 3.29Å; W413-D415 PolarHBondContact O-N 3.02Å; W413-E416 PolarHBondContact O-N 3.41Å; W413-Q417 HydrophobicContact CD2-CB 4.45Å; W413-Q417 HydrophobicContact CD2-CG 4.02Å; W413-Q417 HydrophobicContact CG-CG 4.31Å; W413-Q417 HydrophobicContact CH2-CB 4.4Å; W413-Q417 HydrophobicContact CZ2-CB 4.19Å; W413-Q417 HydrophobicContact CZ2-CG 3.84Å; W413-Q417 WeakPolarHBondContact O-CB 3.39Å; W413-Q417 WeakPolarHBondContact O-CG 3.31Å; W413-Q417 PolarHBondContact O-N 2.96Å; W413-R419 WeakPolarHBondContact CZ3-O 3.42Å; W413-F421 HydrophobicContact CD2-CD2 4.27Å; W413-F421 HydrophobicContact CE3-CB 3.73Å; W413-F421 AromaticContact CE3-CD2 3.98Å; W413-F421 HydrophobicContact CE3-CD2 3.98Å; W413-F421 HydrophobicContact CE3-CG 4.3Å; W413-F421 HydrophobicContact CH2-CD2 4.17Å; W413-F421 HydrophobicContact CZ2-CD2 4.44Å; W413-F421 HydrophobicContact CZ3-CB 3.63Å; W413-F421 AromaticContact CZ3-CD2 3.94Å; W413-F421 HydrophobicContact CZ3-CD2 3.94Å; W413-F421 HydrophobicContact CZ3-CG 4.3Å
414E89Confident86Confident47 Ų4777.3 Ų77.322%0.2239%0.394CS..Hα-helixtrans-63.8-37.1176.7-67.8-175.9156.800110.8I410 D411 G418 R419 E420 F421I410-E414 HydrophobicContact CG2-CG 4.04Å; I410-E414 WeakPolarHBondContact O-CG 3.27Å; I410-E414 PolarHBondContact O-N 3.26Å; D411-E414 PolarHBondContact O-N 2.95Å; E414-G418 VanDerWaalsContact O-CA 3.3Å; E414-G418 WeakPolarHBondContact O-CA 3.5Å; E414-G418 PolarHBondContact O-N 3.16Å; E414-R419 WeakPolarHBondContact CG-O 3.44Å; E414-E420 WeakPolarHBondContact OE1-CA 3.42Å; E414-F421 HydrophobicContact CG-CB 4.26Å; E414-F421 PolarHBondContact OE1-N 3.03Å
415D86.8Confident85.6Confident145 Ų14571.2 Ų71.278%0.77538%0.38SS*.Hα-helixtrans-65.4-38.9173-76.6-19.5000112.3D411 W413D411-D415 WeakPolarHBondContact O-CB 3.36Å; D411-D415 PolarHBondContact O-N 2.64Å; D411-D415 VanDerWaalsContact O-N 3.08Å; W413-D415 VanDerWaalsContact C-N 3.29Å; W413-D415 PolarHBondContact O-N 3.02Å
416E86.3Confident85.3Confident151 Ų15168.1 Ų68.171%0.70637%0.368SS*.Hα-helixtrans-75.2-41.4179.6-75.9174.6-17200113.1A412 W413A412-E416 VanDerWaalsContact O-CG 3.31Å; A412-E416 WeakPolarHBondContact O-CG 3.39Å; A412-E416 PolarHBondContact O-N 2.86Å; A412-E416 VanDerWaalsContact O-N 3.07Å; W413-E416 PolarHBondContact O-N 3.41Å
417Q82.4Confident85.1Confident97 Ų9770.3 Ų70.345%0.45338%0.378SS..Hα-helixtrans-94.1-15.8-174.5-62-60-39.700113.7W413 R419W413-Q417 HydrophobicContact CD2-CB 4.45Å; W413-Q417 HydrophobicContact CD2-CG 4.02Å; W413-Q417 HydrophobicContact CG-CG 4.31Å; W413-Q417 HydrophobicContact CH2-CB 4.4Å; W413-Q417 HydrophobicContact CZ2-CB 4.19Å; W413-Q417 HydrophobicContact CZ2-CG 3.84Å; W413-Q417 WeakPolarHBondContact O-CB 3.39Å; W413-Q417 WeakPolarHBondContact O-CG 3.31Å; W413-Q417 PolarHBondContact O-N 2.96Å; Q417-R419 PolarHBondContact O-N 3.42Å
418G78.6Confident84.9Confident68 Ų6866.2 Ų66.270%0.70136%0.361SS*.SBendtrans64.524-179.400000114E414E414-G418 VanDerWaalsContact O-CA 3.3Å; E414-G418 WeakPolarHBondContact O-CA 3.5Å; E414-G418 PolarHBondContact O-N 3.16Å
419R80.3Confident84.8Confident197 Ų19765.9 Ų65.974%0.74335%0.35SS*.SBendtrans-138.9154.7179.1-60.5-174.1-162.9-149.83.8109.9W413 E414 Q417W413-R419 WeakPolarHBondContact CZ3-O 3.42Å; E414-R419 WeakPolarHBondContact CG-O 3.44Å; Q417-R419 PolarHBondContact O-N 3.42Å
420E82.9Confident84.8Confident122 Ų12268.6 Ų68.657%0.5736%0.363SS*.  trans-73.9141.2178.8-60.6-179.9163.900111.5E414 L422E414-E420 WeakPolarHBondContact OE1-CA 3.42Å; E420-L422 HydrophobicContact CB-CD2 4.41Å; E420-L422 PolarHBondContact O-N 2.87Å
421F84.8Confident84.6Confident7 Ų771.2 Ų71.23%0.03137%0.373CS..  trans-83.1104.5177.8-176.5-102.6000110.6F352 V355 I410 W413 E414 V423 F428F352-F421 HydrophobicContact CD1-CE2 4.45Å; F352-F421 HydrophobicContact CD1-CZ 4.27Å; F352-F421 AromaticContact CE1-CE2 3.89Å; F352-F421 HydrophobicContact CE1-CE2 3.89Å; F352-F421 HydrophobicContact CE1-CZ 4.09Å; V355-F421 HydrophobicContact CG2-CE1 3.87Å; V355-F421 HydrophobicContact CG2-CZ 4.11Å; I410-F421 HydrophobicContact CD1-CD1 3.81Å; I410-F421 HydrophobicContact CD1-CE1 4.14Å; I410-F421 HydrophobicContact CG1-CD1 3.87Å; I410-F421 HydrophobicContact CG1-CE1 4.3Å; I410-F421 HydrophobicContact CG1-CG 4.28Å; I410-F421 HydrophobicContact CG2-CB 3.69Å; I410-F421 HydrophobicContact CG2-CD1 4.32Å; I410-F421 HydrophobicContact CG2-CG 4.26Å; W413-F421 HydrophobicContact CD2-CD2 4.27Å; W413-F421 HydrophobicContact CE3-CB 3.73Å; W413-F421 AromaticContact CE3-CD2 3.98Å; W413-F421 HydrophobicContact CE3-CD2 3.98Å; W413-F421 HydrophobicContact CE3-CG 4.3Å; W413-F421 HydrophobicContact CH2-CD2 4.17Å; W413-F421 HydrophobicContact CZ2-CD2 4.44Å; W413-F421 HydrophobicContact CZ3-CB 3.63Å; W413-F421 AromaticContact CZ3-CD2 3.94Å; W413-F421 HydrophobicContact CZ3-CD2 3.94Å; W413-F421 HydrophobicContact CZ3-CG 4.3Å; E414-F421 HydrophobicContact CG-CB 4.26Å; E414-F421 PolarHBondContact OE1-N 3.03Å; F421-V423 HydrophobicContact CD1-CG2 4.18Å; F421-V423 HydrophobicContact CE1-CG2 3.48Å; F421-V423 VanDerWaalsContact CE1-CG2 3.48Å; F421-V423 HydrophobicContact CZ-CG2 4.04Å; F421-F428 HydrophobicContact CD1-CB 4.02Å; F421-F428 HydrophobicContact CE1-CB 4.13Å
422L83.8Confident84.6Confident60 Ų6068.9 Ų68.931%0.31436%0.361SS..EExtended strand (participates in β ladder)trans-101.7132.5-178-56.5177.1000110.9E420 Q426 M427E420-L422 HydrophobicContact CB-CD2 4.41Å; E420-L422 PolarHBondContact O-N 2.87Å; L422-Q426 WeakPolarHBondContact CA-O 3.4Å; L422-M427 HydrophobicContact CD2-CG 4Å
423V83.4Confident84.6Confident10 Ų1069.5 Ų69.56%0.06137%0.366CS..EExtended strand (participates in β ladder)trans-113.4115.2171.41730000107F309 V355 F421 G425 Q426 F428F309-V423 HydrophobicContact CB-CB 4.31Å; F309-V423 HydrophobicContact CB-CG1 3.8Å; F309-V423 HydrophobicContact CB-CG2 4.5Å; F309-V423 HydrophobicContact CD1-CG1 3.82Å; F309-V423 HydrophobicContact CG-CG1 3.83Å; V355-V423 HydrophobicContact CG1-CG1 4.31Å; V355-V423 HydrophobicContact CG1-CG2 4.14Å; V355-V423 HydrophobicContact CG2-CG2 4.47Å; F421-V423 HydrophobicContact CD1-CG2 4.18Å; F421-V423 HydrophobicContact CE1-CG2 3.48Å; F421-V423 VanDerWaalsContact CE1-CG2 3.48Å; F421-V423 HydrophobicContact CZ-CG2 4.04Å; V423-G425 PolarHBondContact O-N 3.46Å; V423-G425 VanDerWaalsContact O-N 3.14Å; V423-Q426 PolarHBondContact N-O 3.36Å; V423-Q426 PolarHBondContact O-N 2.89Å; V423-Q426 VanDerWaalsContact O-N 3.08Å; V423-F428 HydrophobicContact CB-CB 4.46Å; V423-F428 HydrophobicContact CB-CD2 4.43Å; V423-F428 HydrophobicContact CG2-CB 3.83Å; V423-F428 HydrophobicContact CG2-CD2 3.95Å; V423-F428 HydrophobicContact CG2-CG 4.23Å
424N80.4Confident84.5Confident102 Ų10272.5 Ų72.555%0.54538%0.381SS..THydrogen-bonded Turntrans52.930.6-174.4-59.8-41.4000114F309F309-N424 PolarHBondContact O-N 3.5Å
425G80.3Confident84.4Confident44 Ų4472.2 Ų72.245%0.45438%0.379SS..THydrogen-bonded Turntrans87.84.4179.800000115.6V423V423-G425 PolarHBondContact O-N 3.46Å; V423-G425 VanDerWaalsContact O-N 3.14Å
426Q83.8Confident84.4Confident55 Ų5568.4 Ų68.426%0.25735%0.354SS..EExtended strand (participates in β ladder)trans-122145.6176.2-171.2178.618.200110.9L422 V423 F428 E434L422-Q426 WeakPolarHBondContact CA-O 3.4Å; V423-Q426 PolarHBondContact N-O 3.36Å; V423-Q426 PolarHBondContact O-N 2.89Å; V423-Q426 VanDerWaalsContact O-N 3.08Å; Q426-F428 PolarHBondContact O-N 3.36Å; Q426-E434 PolarHBondContact NE2-OE1 3.44Å; Q426-E434 PolarHBondContact NE2-OE2 3.3Å
427M86Confident84.5Confident45 Ų4564.5 Ų64.522%0.22234%0.336CS..EExtended strand (participates in β ladder)trans-60.3125.9173.7-63.9-178.479.200110.3L422 L429 Q430 Y431L422-M427 HydrophobicContact CD2-CG 4Å; M427-L429 VanDerWaalsContact C-N 3.28Å; M427-L429 PolarHBondContact O-N 3.39Å; M427-Q430 HydrophobicContact CB-CB 4.19Å; M427-Q430 HydrophobicContact CB-CG 3.93Å; M427-Q430 WeakPolarHBondContact O-CB 3.44Å; M427-Q430 PolarHBondContact O-N 3.02Å; M427-Q430 HydrophobicContact SD-CG 4.34Å; M427-Q430 PolarHBondContact SD-NE2 3.48Å; M427-Y431 PolarHBondContact O-N 3.48Å
428F85.6Confident84.7Confident3 Ų364.7 Ų64.71%0.01334%0.34CS..Hα-helixtrans-55.5-41.8-173.9177.9-109.5000113V355 W358 L406 I410 F421 V423 Q426 Q430 Y431 V432V355-F428 HydrophobicContact CB-CE2 4.28Å; V355-F428 HydrophobicContact CG1-CD2 3.95Å; V355-F428 HydrophobicContact CG1-CE2 3.7Å; V355-F428 HydrophobicContact CG1-CZ 4.41Å; V355-F428 HydrophobicContact CG2-CD1 4.4Å; V355-F428 HydrophobicContact CG2-CD2 4.11Å; V355-F428 HydrophobicContact CG2-CE1 4.36Å; V355-F428 HydrophobicContact CG2-CE2 4.08Å; V355-F428 HydrophobicContact CG2-CG 4.28Å; V355-F428 HydrophobicContact CG2-CZ 4.19Å; W358-F428 HydrophobicContact CB-CZ 4.12Å; W358-F428 HydrophobicContact CD2-CE2 4.34Å; W358-F428 AromaticContact CD2-CZ 3.84Å; W358-F428 HydrophobicContact CD2-CZ 3.84Å; W358-F428 AromaticContact CE3-CE2 3.85Å; W358-F428 HydrophobicContact CE3-CE2 3.85Å; W358-F428 AromaticContact CE3-CZ 3.83Å; W358-F428 HydrophobicContact CE3-CZ 3.83Å; W358-F428 AromaticContact CG-CZ 3.95Å; W358-F428 HydrophobicContact CG-CZ 3.95Å; W358-F428 HydrophobicContact CZ3-CE2 4.38Å; L406-F428 HydrophobicContact CB-CE1 4.23Å; L406-F428 HydrophobicContact CD1-CE1 3.7Å; L406-F428 HydrophobicContact CD1-CZ 3.93Å; I410-F428 HydrophobicContact CD1-CB 4.18Å; I410-F428 HydrophobicContact CD1-CD1 3.57Å; I410-F428 HydrophobicContact CD1-CE1 4.42Å; I410-F428 HydrophobicContact CD1-CG 4.25Å; F421-F428 HydrophobicContact CD1-CB 4.02Å; F421-F428 HydrophobicContact CE1-CB 4.13Å; V423-F428 HydrophobicContact CB-CB 4.46Å; V423-F428 HydrophobicContact CB-CD2 4.43Å; V423-F428 HydrophobicContact CG2-CB 3.83Å; V423-F428 HydrophobicContact CG2-CD2 3.95Å; V423-F428 HydrophobicContact CG2-CG 4.23Å; Q426-F428 PolarHBondContact O-N 3.36Å; F428-Q430 VanDerWaalsContact C-N 3.32Å; F428-Q430 PolarHBondContact O-N 2.83Å; F428-Y431 HydrophobicContact CD2-CD1 4.48Å; F428-Y431 WeakPolarHBondContact O-CB 3.34Å; F428-Y431 PolarHBondContact O-N 3.18Å; F428-V432 HydrophobicContact CD1-CG2 4.09Å; F428-V432 HydrophobicContact CD2-CG2 4.23Å; F428-V432 HydrophobicContact CE1-CG2 3.66Å; F428-V432 HydrophobicContact CE2-CG2 3.79Å; F428-V432 HydrophobicContact CG-CG2 4.37Å; F428-V432 HydrophobicContact CZ-CG2 3.5Å; F428-V432 VanDerWaalsContact O-CG2 3.24Å; F428-V432 WeakPolarHBondContact O-CG2 3.41Å; F428-V432 PolarHBondContact O-N 2.91Å
429L86.1Confident85Confident55 Ų5562.7 Ų62.729%0.28831%0.312SS..Hα-helixtrans-67.3-32.1179.8-63.7177.6000113.1K407 M427 A433K407-L429 HydrophobicContact CB-CD1 4.3Å; K407-L429 HydrophobicContact CB-CD2 4.01Å; K407-L429 HydrophobicContact CD-CD1 3.91Å; K407-L429 HydrophobicContact CG-CD1 3.92Å; K407-L429 HydrophobicContact CG-CD2 4.5Å; M427-L429 VanDerWaalsContact C-N 3.28Å; M427-L429 PolarHBondContact O-N 3.39Å; L429-A433 WeakPolarHBondContact O-CB 3.43Å; L429-A433 PolarHBondContact O-N 3.37Å; L429-A433 VanDerWaalsContact O-N 3.13Å
430Q86.9Confident85.3Confident99 Ų9959.6 Ų59.646%0.46330%0.3SS..Hα-helixtrans-69.4-46.2173.6-66.6179.8-400110.2M427 F428 V432 A433 E434M427-Q430 HydrophobicContact CB-CB 4.19Å; M427-Q430 HydrophobicContact CB-CG 3.93Å; M427-Q430 WeakPolarHBondContact O-CB 3.44Å; M427-Q430 PolarHBondContact O-N 3.02Å; M427-Q430 HydrophobicContact SD-CG 4.34Å; M427-Q430 PolarHBondContact SD-NE2 3.48Å; F428-Q430 VanDerWaalsContact C-N 3.32Å; F428-Q430 PolarHBondContact O-N 2.83Å; Q430-V432 VanDerWaalsContact C-N 3.35Å; Q430-V432 PolarHBondContact O-N 3.03Å; Q430-A433 PolarHBondContact O-N 3.37Å; Q430-A433 VanDerWaalsContact O-N 3.15Å; Q430-E434 WeakPolarHBondContact O-CG 3.44Å; Q430-E434 PolarHBondContact O-N 2.96Å
431Y85.8Confident85.5Confident58 Ų5856.7 Ų56.723%0.22729%0.288CS..Hα-helixtrans-55.9-47.6175172.4-107.9000112W358 M427 F428 A433 E434 Q435W358-Y431 HydrophobicContact CH2-CE1 4.33Å; W358-Y431 HydrophobicContact CZ3-CD1 4.21Å; W358-Y431 AromaticContact CZ3-CE1 3.75Å; W358-Y431 HydrophobicContact CZ3-CE1 3.75Å; M427-Y431 PolarHBondContact O-N 3.48Å; F428-Y431 HydrophobicContact CD2-CD1 4.48Å; F428-Y431 WeakPolarHBondContact O-CB 3.34Å; F428-Y431 PolarHBondContact O-N 3.18Å; Y431-A433 VanDerWaalsContact C-N 3.34Å; Y431-A433 PolarHBondContact O-N 3.31Å; Y431-E434 PolarHBondContact O-N 3Å; Y431-Q435 HydrophobicContact CD1-CG 4.42Å; Y431-Q435 HydrophobicContact CD2-CG 4.28Å; Y431-Q435 HydrophobicContact CE1-CG 4.01Å; Y431-Q435 HydrophobicContact CE2-CG 3.83Å; Y431-Q435 VanDerWaalsContact CE2-NE2 3.34Å; Y431-Q435 WeakPolarHBondContact O-CG 3.24Å; Y431-Q435 PolarHBondContact O-N 2.97Å
432V87.4Confident85.5Confident7 Ų761.9 Ų61.94%0.04231%0.312CS..Hα-helixtrans-56.9-46.6175.9168.20000111.5W358 E403 F428 Q430 Q435 W436W358-V432 HydrophobicContact CD2-CG2 4.1Å; W358-V432 HydrophobicContact CE3-CG2 4.21Å; W358-V432 HydrophobicContact CH2-CB 4.23Å; W358-V432 HydrophobicContact CH2-CG1 4.39Å; W358-V432 HydrophobicContact CH2-CG2 3.76Å; W358-V432 HydrophobicContact CZ2-CB 3.98Å; W358-V432 HydrophobicContact CZ2-CG1 3.67Å; W358-V432 HydrophobicContact CZ2-CG2 3.62Å; W358-V432 HydrophobicContact CZ3-CG2 4.06Å; E403-V432 HydrophobicContact CG-CG1 3.89Å; F428-V432 HydrophobicContact CD1-CG2 4.09Å; F428-V432 HydrophobicContact CD2-CG2 4.23Å; F428-V432 HydrophobicContact CE1-CG2 3.66Å; F428-V432 HydrophobicContact CE2-CG2 3.79Å; F428-V432 HydrophobicContact CG-CG2 4.37Å; F428-V432 HydrophobicContact CZ-CG2 3.5Å; F428-V432 VanDerWaalsContact O-CG2 3.24Å; F428-V432 WeakPolarHBondContact O-CG2 3.41Å; F428-V432 PolarHBondContact O-N 2.91Å; Q430-V432 VanDerWaalsContact C-N 3.35Å; Q430-V432 PolarHBondContact O-N 3.03Å; V432-Q435 PolarHBondContact O-N 3.32Å; V432-W436 VanDerWaalsContact O-CD1 3.31Å; V432-W436 PolarHBondContact O-N 2.99Å; V432-W436 VanDerWaalsContact O-N 3.08Å
433A87.4Confident85.5Confident58 Ų5861.9 Ų61.948%0.47931%0.31SS..Hα-helixtrans-64.2-41.3179.300000112L429 Q430 Y431 W436 E437L429-A433 WeakPolarHBondContact O-CB 3.43Å; L429-A433 PolarHBondContact O-N 3.37Å; L429-A433 VanDerWaalsContact O-N 3.13Å; Q430-A433 PolarHBondContact O-N 3.37Å; Q430-A433 VanDerWaalsContact O-N 3.15Å; Y431-A433 VanDerWaalsContact C-N 3.34Å; Y431-A433 PolarHBondContact O-N 3.31Å; A433-W436 PolarHBondContact O-N 3.49Å; A433-E437 WeakPolarHBondContact O-CB 3.27Å; A433-E437 PolarHBondContact O-N 2.84Å
434E87.2Confident85.5Confident92 Ų9266.4 Ų66.443%0.4333%0.33SS..Hα-helixtrans-62.8-41.4174.8-74.1174.4-166.800111.9Q426 Q430 Y431 W436 E437 L438Q426-E434 PolarHBondContact NE2-OE1 3.44Å; Q426-E434 PolarHBondContact NE2-OE2 3.3Å; Q430-E434 WeakPolarHBondContact O-CG 3.44Å; Q430-E434 PolarHBondContact O-N 2.96Å; Y431-E434 PolarHBondContact O-N 3Å; E434-W436 PolarHBondContact O-N 2.93Å; E434-E437 PolarHBondContact O-N 3.4Å; E434-L438 WeakPolarHBondContact O-CB 3.5Å; E434-L438 VanDerWaalsContact O-CG 3.28Å; E434-L438 WeakPolarHBondContact O-CG 3.48Å; E434-L438 PolarHBondContact O-N 3.39Å
435Q86.9Confident85.7Confident41 Ų4167.2 Ų67.219%0.19233%0.329CS..Hα-helixtrans-61.6-44175.8-70.5-52-59.700112W358 W362 Y431 V432 E437 H439W358-Q435 HydrophobicContact CH2-CB 4.19Å; W358-Q435 HydrophobicContact CH2-CG 4.18Å; W362-Q435 HydrophobicContact CZ2-CB 3.9Å; W362-Q435 WeakPolarHBondContact CZ2-O 3.41Å; Y431-Q435 HydrophobicContact CD1-CG 4.42Å; Y431-Q435 HydrophobicContact CD2-CG 4.28Å; Y431-Q435 HydrophobicContact CE1-CG 4.01Å; Y431-Q435 HydrophobicContact CE2-CG 3.83Å; Y431-Q435 VanDerWaalsContact CE2-NE2 3.34Å; Y431-Q435 WeakPolarHBondContact O-CG 3.24Å; Y431-Q435 PolarHBondContact O-N 2.97Å; V432-Q435 PolarHBondContact O-N 3.32Å; Q435-E437 VanDerWaalsContact C-N 3.35Å; Q435-H439 WeakPolarHBondContact O-CB 3.35Å; Q435-H439 PolarHBondContact O-N 3.28Å
436W86.8Confident85.8Confident66 Ų6666.3 Ų66.325%0.2531%0.313CS..Hα-helixtrans-64.1-38.7174.3-84110.7000112.6W362 L399 E403 V432 A433 E434 H439 R440W362-W436 HydrophobicContact CE3-CZ2 4.31Å; W362-W436 AromaticContact CH2-CD2 3.64Å; W362-W436 HydrophobicContact CH2-CD2 3.64Å; W362-W436 AromaticContact CH2-CE3 3.63Å; W362-W436 HydrophobicContact CH2-CE3 3.63Å; W362-W436 HydrophobicContact CH2-CG 4.12Å; W362-W436 HydrophobicContact CH2-CH2 4.37Å; W362-W436 HydrophobicContact CH2-CZ2 4.37Å; W362-W436 HydrophobicContact CH2-CZ3 4Å; W362-W436 AromaticContact CZ3-CD2 3.64Å; W362-W436 HydrophobicContact CZ3-CD2 3.64Å; W362-W436 AromaticContact CZ3-CE2 3.49Å; W362-W436 VanDerWaalsContact CZ3-CE2 3.49Å; W362-W436 AromaticContact CZ3-CE3 3.77Å; W362-W436 HydrophobicContact CZ3-CE3 3.77Å; W362-W436 HydrophobicContact CZ3-CG 4.36Å; W362-W436 AromaticContact CZ3-CH2 3.68Å; W362-W436 HydrophobicContact CZ3-CH2 3.68Å; W362-W436 AromaticContact CZ3-CZ2 3.54Å; W362-W436 HydrophobicContact CZ3-CZ2 3.54Å; W362-W436 AromaticContact CZ3-CZ3 3.79Å; W362-W436 HydrophobicContact CZ3-CZ3 3.79Å; L399-W436 HydrophobicContact CB-CZ2 4.29Å; L399-W436 HydrophobicContact CD1-CZ2 4.44Å; E403-W436 PolarHBondContact OE1-NE1 3.44Å; V432-W436 VanDerWaalsContact O-CD1 3.31Å; V432-W436 PolarHBondContact O-N 2.99Å; V432-W436 VanDerWaalsContact O-N 3.08Å; A433-W436 PolarHBondContact O-N 3.49Å; E434-W436 PolarHBondContact O-N 2.93Å; W436-H439 PolarHBondContact O-N 3.05Å; W436-R440 WeakPolarHBondContact O-CB 3.38Å; W436-R440 PolarHBondContact O-N 2.99Å
437E87.1Confident85.7Confident68 Ų6869.9 Ų69.932%0.31833%0.327SS..Hα-helixtrans-69.2-44.1178.7-176.554.2-148.200111.8A433 E434 Q435 H439 R440 I441A433-E437 WeakPolarHBondContact O-CB 3.27Å; A433-E437 PolarHBondContact O-N 2.84Å; E434-E437 PolarHBondContact O-N 3.4Å; Q435-E437 VanDerWaalsContact C-N 3.35Å; E437-H439 VanDerWaalsContact C-N 3.29Å; E437-H439 PolarHBondContact O-N 3.34Å; E437-R440 WeakPolarHBondContact O-CB 3.42Å; E437-R440 PolarHBondContact O-N 3.49Å; E437-R440 VanDerWaalsContact O-N 3.16Å; E437-R440 IonicContact OE1-CZ 3.31Å; E437-R440 VanDerWaalsContact OE1-CZ 3.28Å; E437-R440 IonicContact OE1-NE 2.72Å; E437-R440 PolarHBondContact OE1-NE 3.49Å; E437-R440 IonicContact OE1-NH2 3.27Å; E437-R440 PolarHBondContact OE1-NH2 3Å; E437-R440 IonicContact OE2-CZ 2.7Å; E437-R440 IonicContact OE2-NE 3.15Å; E437-R440 PolarHBondContact OE2-NE 3.35Å; E437-R440 IonicContact OE2-NH1 2.85Å; E437-R440 IonicContact OE2-NH2 3.37Å; E437-R440 PolarHBondContact OE2-NH2 3.43Å; E437-R440 VanDerWaalsContact OE2-NH2 3.08Å; E437-I441 HydrophobicContact CG-CD1 4.01Å; E437-I441 VanDerWaalsContact O-CG1 3.31Å; E437-I441 WeakPolarHBondContact O-CG1 3.11Å; E437-I441 PolarHBondContact O-N 2.9Å; E437-I441 WeakPolarHBondContact OE1-CG1 3.37Å
438L86.9Confident85.5Confident102 Ų10272.8 Ų72.853%0.53434%0.344SS..Hα-helixtrans-58.2-44.2172.9-74.5173.1000111.1E434 I441 E442E434-L438 WeakPolarHBondContact O-CB 3.5Å; E434-L438 VanDerWaalsContact O-CG 3.28Å; E434-L438 WeakPolarHBondContact O-CG 3.48Å; E434-L438 PolarHBondContact O-N 3.39Å; L438-I441 PolarHBondContact O-N 2.96Å; L438-E442 WeakPolarHBondContact O-CB 3.47Å; L438-E442 PolarHBondContact O-N 2.97Å
439H86.1Confident85.4Confident25 Ų2577.4 Ų77.412%0.11637%0.365CS..Hα-helixtrans-59.6-47.2174.5-179.8-100.3000111.6W362 E369 Q435 W436 E437 I441 E442 K443W362-H439 HydrophobicContact CH2-CB 3.98Å; W362-H439 HydrophobicContact CZ2-CB 4.02Å; E369-H439 VanDerWaalsContact CD-CE1 3.49Å; E369-H439 IonicContact OE1-CE1 2.72Å; E369-H439 PolarHBondContact OE1-CE1 3.35Å; E369-H439 VanDerWaalsContact OE1-CE1 3.27Å; E369-H439 IonicContact OE1-NE2 3.53Å; E369-H439 PolarHBondContact OE1-NE2 3.47Å; E369-H439 IonicContact OE2-CD2 3.55Å; E369-H439 IonicContact OE2-CE1 3.91Å; E369-H439 PolarHBondContact OE2-CE1 2.93Å; E369-H439 IonicContact OE2-NE2 2.9Å; E369-H439 PolarHBondContact OE2-NE2 3.27Å; Q435-H439 WeakPolarHBondContact O-CB 3.35Å; Q435-H439 PolarHBondContact O-N 3.28Å; W436-H439 PolarHBondContact O-N 3.05Å; E437-H439 VanDerWaalsContact C-N 3.29Å; E437-H439 PolarHBondContact O-N 3.34Å; H439-I441 PolarHBondContact O-N 3.49Å; H439-E442 PolarHBondContact O-N 3.47Å; H439-K443 WeakPolarHBondContact O-CG 3.36Å; H439-K443 PolarHBondContact O-N 2.94Å
440R86.6Confident85Confident133 Ų13380.6 Ų80.650%0.50237%0.373SS..Hα-helixtrans-58.1-48.3177.2-172.6-176.875.41534.1111.9W436 E437 E442 K443 E444W436-R440 WeakPolarHBondContact O-CB 3.38Å; W436-R440 PolarHBondContact O-N 2.99Å; E437-R440 WeakPolarHBondContact O-CB 3.42Å; E437-R440 PolarHBondContact O-N 3.49Å; E437-R440 VanDerWaalsContact O-N 3.16Å; E437-R440 IonicContact OE1-CZ 3.31Å; E437-R440 VanDerWaalsContact OE1-CZ 3.28Å; E437-R440 IonicContact OE1-NE 2.72Å; E437-R440 PolarHBondContact OE1-NE 3.49Å; E437-R440 IonicContact OE1-NH2 3.27Å; E437-R440 PolarHBondContact OE1-NH2 3Å; E437-R440 IonicContact OE2-CZ 2.7Å; E437-R440 IonicContact OE2-NE 3.15Å; E437-R440 PolarHBondContact OE2-NE 3.35Å; E437-R440 IonicContact OE2-NH1 2.85Å; E437-R440 IonicContact OE2-NH2 3.37Å; E437-R440 PolarHBondContact OE2-NH2 3.43Å; E437-R440 VanDerWaalsContact OE2-NH2 3.08Å; R440-E442 VanDerWaalsContact C-N 3.31Å; R440-E442 PolarHBondContact O-N 3.21Å; R440-K443 PolarHBondContact O-N 3.04Å; R440-E444 WeakPolarHBondContact O-CG 3.39Å; R440-E444 PolarHBondContact O-N 2.86Å
441I86.1Confident84.5Confident61 Ų6180.9 Ų80.931%0.31338%0.375SS..Hα-helixtrans-60.3-42.6177.5-68.5166.6000110.4E437 L438 H439 E444 K445E437-I441 HydrophobicContact CG-CD1 4.01Å; E437-I441 VanDerWaalsContact O-CG1 3.31Å; E437-I441 WeakPolarHBondContact O-CG1 3.11Å; E437-I441 PolarHBondContact O-N 2.9Å; E437-I441 WeakPolarHBondContact OE1-CG1 3.37Å; L438-I441 PolarHBondContact O-N 2.96Å; H439-I441 PolarHBondContact O-N 3.49Å; I441-E444 PolarHBondContact O-N 3.47Å; I441-K445 HydrophobicContact CG2-CD 4.22Å; I441-K445 HydrophobicContact CG2-CG 4.42Å; I441-K445 WeakPolarHBondContact O-CG 3.49Å; I441-K445 PolarHBondContact O-N 3.15Å
442E85.1Confident84.3Confident115 Ų11582.5 Ų82.554%0.53739%0.387SS..Hα-helixtrans-64.3-41.2178-166.960.2-152.300111.6L438 H439 R440 E444 K445 E446L438-E442 WeakPolarHBondContact O-CB 3.47Å; L438-E442 PolarHBondContact O-N 2.97Å; H439-E442 PolarHBondContact O-N 3.47Å; R440-E442 VanDerWaalsContact C-N 3.31Å; R440-E442 PolarHBondContact O-N 3.21Å; E442-E444 VanDerWaalsContact C-N 3.33Å; E442-E444 PolarHBondContact O-N 3.19Å; E442-K445 PolarHBondContact O-N 2.8Å; E442-E446 WeakPolarHBondContact O-CB 3.43Å; E442-E446 PolarHBondContact O-N 3.02Å
443K83.6Confident83.9Confident61 Ų6187.8 Ų87.827%0.26541%0.409SS..Hα-helixtrans-63.3-37.9172.8-62.6-52.9-75.7177.90112.4E369 H439 R440 E446 K447E369-K443 WeakPolarHBondContact OE2-CD 3.36Å; E369-K443 IonicContact OE2-NZ 3.5Å; E369-K443 PolarHBondContact OE2-NZ 2.82Å; H439-K443 WeakPolarHBondContact O-CG 3.36Å; H439-K443 PolarHBondContact O-N 2.94Å; R440-K443 PolarHBondContact O-N 3.04Å; K443-E446 WeakPolarHBondContact CE-OE2 3.38Å; K443-E446 IonicContact NZ-OE2 3.45Å; K443-E446 PolarHBondContact NZ-OE2 2.91Å; K443-K447 VanDerWaalsContact O-CB 3.28Å; K443-K447 WeakPolarHBondContact O-CB 3.34Å; K443-K447 PolarHBondContact O-N 3.41Å
444E84.1Confident83.4Confident104 Ų10492 Ų9249%0.48642%0.417SS..Hα-helixtrans-67.9-42.7175.8-73.9-173.1170.600111.8R440 I441 E442 K447 L448R440-E444 WeakPolarHBondContact O-CG 3.39Å; R440-E444 PolarHBondContact O-N 2.86Å; I441-E444 PolarHBondContact O-N 3.47Å; E442-E444 VanDerWaalsContact C-N 3.33Å; E442-E444 PolarHBondContact O-N 3.19Å; E444-K447 WeakPolarHBondContact O-CB 3.48Å; E444-K447 PolarHBondContact O-N 3.35Å; E444-L448 WeakPolarHBondContact O-CB 3.36Å; E444-L448 WeakPolarHBondContact O-CG 3.38Å; E444-L448 PolarHBondContact O-N 3.28Å
445K82.9Confident82.9Confident120 Ų12090.1 Ų90.152%0.52241%0.413SS..Hα-helixtrans-60-47.9172.2-74.8177-178.3172.90111.6I441 E442 K447 L448 E449I441-K445 HydrophobicContact CG2-CD 4.22Å; I441-K445 HydrophobicContact CG2-CG 4.42Å; I441-K445 WeakPolarHBondContact O-CG 3.49Å; I441-K445 PolarHBondContact O-N 3.15Å; E442-K445 PolarHBondContact O-N 2.8Å; K445-K447 VanDerWaalsContact C-N 3.27Å; K445-K447 PolarHBondContact O-N 3Å; K445-L448 PolarHBondContact O-N 3.45Å; K445-E449 WeakPolarHBondContact O-CB 3.34Å; K445-E449 PolarHBondContact O-N 3.04Å
446E82.8Confident82.4Confident25 Ų2594 Ų9412%0.11743%0.43CS..Hα-helixtrans-58.4-40.7175.8-175.4-171.6-173.300111T373 E442 K443 R450T373-E446 WeakPolarHBondContact CG2-OE1 3.38Å; T373-E446 PolarHBondContact OG1-OE1 2.88Å; E442-E446 WeakPolarHBondContact O-CB 3.43Å; E442-E446 PolarHBondContact O-N 3.02Å; K443-E446 WeakPolarHBondContact CE-OE2 3.38Å; K443-E446 IonicContact NZ-OE2 3.45Å; K443-E446 PolarHBondContact NZ-OE2 2.91Å; E446-R450 WeakPolarHBondContact O-CB 3.38Å; E446-R450 VanDerWaalsContact O-CG 3.23Å; E446-R450 WeakPolarHBondContact O-CG 3.4Å; E446-R450 PolarHBondContact O-N 3.44Å; E446-R450 IonicContact OE1-CZ 2.84Å; E446-R450 IonicContact OE1-NE 3.42Å; E446-R450 IonicContact OE1-NH1 2.78Å; E446-R450 PolarHBondContact OE1-NH1 3.44Å; E446-R450 IonicContact OE1-NH2 3.59Å; E446-R450 PolarHBondContact OE1-NH2 3.27Å
447K82.4Confident81.7Confident129 Ų12996.5 Ų96.556%0.56144%0.444SS*.Hα-helixtrans-66.8-45.2176.6-173.8-174.5177.1-173.30111.9K443 E444 K445 R450 Q451K443-K447 VanDerWaalsContact O-CB 3.28Å; K443-K447 WeakPolarHBondContact O-CB 3.34Å; K443-K447 PolarHBondContact O-N 3.41Å; E444-K447 WeakPolarHBondContact O-CB 3.48Å; E444-K447 PolarHBondContact O-N 3.35Å; K445-K447 VanDerWaalsContact C-N 3.27Å; K445-K447 PolarHBondContact O-N 3Å; K447-R450 PolarHBondContact O-N 3.31Å; K447-Q451 WeakPolarHBondContact O-CG 3.31Å; K447-Q451 PolarHBondContact O-N 3.15Å
448L82.1Confident80.9Confident107 Ų10797 Ų9756%0.5645%0.452SS*.Hα-helixtrans-65.2-40.5176.9-73.7171.6000111.3E444 K445 R450 Q451 L452E444-L448 WeakPolarHBondContact O-CB 3.36Å; E444-L448 WeakPolarHBondContact O-CG 3.38Å; E444-L448 PolarHBondContact O-N 3.28Å; K445-L448 PolarHBondContact O-N 3.45Å; L448-R450 PolarHBondContact O-N 3.43Å; L448-Q451 CarbonylContact O-C 3.59Å; L448-Q451 PolarHBondContact O-N 3Å; L448-Q451 VanDerWaalsContact O-N 3.17Å; L448-L452 WeakPolarHBondContact O-CB 3.17Å; L448-L452 PolarHBondContact O-N 3.5Å
449E82.3Confident80.2Confident100 Ų10097.3 Ų97.347%0.46745%0.451SS..Hα-helixtrans-64.1-41.4175.3-164.8-164.617100111K445 Q451 L452 K453K445-E449 WeakPolarHBondContact O-CB 3.34Å; K445-E449 PolarHBondContact O-N 3.04Å; E449-Q451 VanDerWaalsContact C-N 3.34Å; E449-Q451 PolarHBondContact O-N 2.99Å; E449-L452 PolarHBondContact O-N 3.41Å; E449-K453 HydrophobicContact CG-CD 4.45Å; E449-K453 WeakPolarHBondContact O-CB 3.43Å; E449-K453 VanDerWaalsContact O-CG 3.29Å; E449-K453 WeakPolarHBondContact O-CG 3.25Å; E449-K453 PolarHBondContact O-N 3.04Å; E449-K453 WeakPolarHBondContact OE1-CE 3.33Å; E449-K453 IonicContact OE1-NZ 2.67Å; E449-K453 PolarHBondContact OE1-NZ 2.74Å; E449-K453 IonicContact OE2-NZ 2.58Å
450R77.6Confident79.4Confident122 Ų122101.8 Ų101.846%0.4647%0.472SS..Hα-helixtrans-62.4-39.2171.6-76.3170.7174.7161.81.5112.2E446 K447 L448 K454E446-R450 WeakPolarHBondContact O-CB 3.38Å; E446-R450 VanDerWaalsContact O-CG 3.23Å; E446-R450 WeakPolarHBondContact O-CG 3.4Å; E446-R450 PolarHBondContact O-N 3.44Å; E446-R450 IonicContact OE1-CZ 2.84Å; E446-R450 IonicContact OE1-NE 3.42Å; E446-R450 IonicContact OE1-NH1 2.78Å; E446-R450 PolarHBondContact OE1-NH1 3.44Å; E446-R450 IonicContact OE1-NH2 3.59Å; E446-R450 PolarHBondContact OE1-NH2 3.27Å; K447-R450 PolarHBondContact O-N 3.31Å; L448-R450 PolarHBondContact O-N 3.43Å; R450-K454 WeakPolarHBondContact O-CB 2.98Å; R450-K454 VanDerWaalsContact O-CG 3.27Å; R450-K454 WeakPolarHBondContact O-CG 3.27Å; R450-K454 PolarHBondContact O-N 2.85Å
451Q78.1Confident78.6Confident104 Ų10498.3 Ų98.349%0.48646%0.463SS..Hα-helixtrans-69-41.1176.4-76178.1-8.500111.8K447 L448 E449 K454 S455K447-Q451 WeakPolarHBondContact O-CG 3.31Å; K447-Q451 PolarHBondContact O-N 3.15Å; L448-Q451 CarbonylContact O-C 3.59Å; L448-Q451 PolarHBondContact O-N 3Å; L448-Q451 VanDerWaalsContact O-N 3.17Å; E449-Q451 VanDerWaalsContact C-N 3.34Å; E449-Q451 PolarHBondContact O-N 2.99Å; Q451-K454 CarbonylContact O-C 3.46Å; Q451-K454 PolarHBondContact O-N 3.37Å; Q451-S455 WeakPolarHBondContact O-CB 3.37Å; Q451-S455 PolarHBondContact O-N 2.83Å
452L80.1Confident77.8Confident93 Ų93103 Ų10349%0.48749%0.486SS..Hα-helixtrans-65.1-43.2175.2-167.796.4000111L448 E449 K454 S455 K456L448-L452 WeakPolarHBondContact O-CB 3.17Å; L448-L452 PolarHBondContact O-N 3.5Å; E449-L452 PolarHBondContact O-N 3.41Å; L452-K454 VanDerWaalsContact C-N 3.32Å; L452-K454 PolarHBondContact O-N 3.01Å; L452-S455 PolarHBondContact O-N 3.47Å; L452-K456 HydrophobicContact CD2-CD 4.22Å; L452-K456 HydrophobicContact CG-CD 4.35Å; L452-K456 WeakPolarHBondContact O-CB 3.33Å; L452-K456 VanDerWaalsContact O-CG 3.3Å; L452-K456 WeakPolarHBondContact O-CG 3.48Å; L452-K456 PolarHBondContact O-N 3.27Å
453K79.6Confident76.9Confident117 Ų117103.9 Ų103.951%0.50949%0.493SS..Hα-helixtrans-60.6-42.2173.3-76.8173.7-177.2167.20111.2E449 Q457E449-K453 HydrophobicContact CG-CD 4.45Å; E449-K453 WeakPolarHBondContact O-CB 3.43Å; E449-K453 VanDerWaalsContact O-CG 3.29Å; E449-K453 WeakPolarHBondContact O-CG 3.25Å; E449-K453 PolarHBondContact O-N 3.04Å; E449-K453 WeakPolarHBondContact OE1-CE 3.33Å; E449-K453 IonicContact OE1-NZ 2.67Å; E449-K453 PolarHBondContact OE1-NZ 2.74Å; E449-K453 IonicContact OE2-NZ 2.58Å; K453-Q457 WeakPolarHBondContact O-CB 3.17Å; K453-Q457 PolarHBondContact O-N 3.47Å
454K77.2Confident75.9Confident148 Ų148109.7 Ų109.764%0.64352%0.515SS*.Hα-helixtrans-64.6-42.4173-76.1176.6179.3-174.70112.4R450 Q451 L452 Q457 T458R450-K454 WeakPolarHBondContact O-CB 2.98Å; R450-K454 VanDerWaalsContact O-CG 3.27Å; R450-K454 WeakPolarHBondContact O-CG 3.27Å; R450-K454 PolarHBondContact O-N 2.85Å; Q451-K454 CarbonylContact O-C 3.46Å; Q451-K454 PolarHBondContact O-N 3.37Å; L452-K454 VanDerWaalsContact C-N 3.32Å; L452-K454 PolarHBondContact O-N 3.01Å; K454-Q457 PolarHBondContact O-N 3.42Å; K454-T458 WeakPolarHBondContact O-CG2 3.24Å; K454-T458 PolarHBondContact O-N 3.17Å; K454-T458 PolarHBondContact O-OG1 3.29Å; K454-T458 VanDerWaalsContact O-OG1 3.08Å
455S76.3Confident74.6Confident51 Ų51106.9 Ų106.936%0.35751%0.514SS..Hα-helixtrans-64.5-47.7178.2-164.40000111.4Q451 L452 Q457 T458 E459Q451-S455 WeakPolarHBondContact O-CB 3.37Å; Q451-S455 PolarHBondContact O-N 2.83Å; L452-S455 PolarHBondContact O-N 3.47Å; S455-Q457 VanDerWaalsContact C-N 3.32Å; S455-Q457 PolarHBondContact O-N 3.15Å; S455-T458 VanDerWaalsContact CA-OG1 3.28Å; S455-T458 WeakPolarHBondContact CA-OG1 3.49Å; S455-T458 CarbonylContact O-C 3.57Å; S455-T458 PolarHBondContact O-N 3.47Å; S455-T458 PolarHBondContact O-OG1 3.38Å; S455-E459 WeakPolarHBondContact O-CB 3.5Å; S455-E459 WeakPolarHBondContact O-CG 3.27Å; S455-E459 PolarHBondContact O-N 3.34Å; S455-E459 PolarHBondContact OG-OE1 2.96Å
456K77.1Confident73.1Confident124 Ų124106 Ų10654%0.53952%0.519SS..Hα-helixtrans-59.9-43173.8-74.3179.7175.9-175.40111.3L452 E459 E460L452-K456 HydrophobicContact CD2-CD 4.22Å; L452-K456 HydrophobicContact CG-CD 4.35Å; L452-K456 WeakPolarHBondContact O-CB 3.33Å; L452-K456 VanDerWaalsContact O-CG 3.3Å; L452-K456 WeakPolarHBondContact O-CG 3.48Å; L452-K456 PolarHBondContact O-N 3.27Å; K456-E459 PolarHBondContact O-N 3.16Å; K456-E460 VanDerWaalsContact O-CB 3.23Å; K456-E460 WeakPolarHBondContact O-CB 3.33Å; K456-E460 PolarHBondContact O-N 3.21Å
457Q71.3Confident71.5Confident117 Ų117109.5 Ų109.555%0.54755%0.552SS.*Hα-helixtrans-64.2-40.8175.5-175.2151.125.200111.8K453 K454 S455 E460 D461K453-Q457 WeakPolarHBondContact O-CB 3.17Å; K453-Q457 PolarHBondContact O-N 3.47Å; K454-Q457 PolarHBondContact O-N 3.42Å; S455-Q457 VanDerWaalsContact C-N 3.32Å; S455-Q457 PolarHBondContact O-N 3.15Å; Q457-E460 PolarHBondContact O-N 2.99Å; Q457-D461 VanDerWaalsContact O-CB 3.25Å; Q457-D461 WeakPolarHBondContact O-CB 3.44Å; Q457-D461 PolarHBondContact O-N 3.25Å
458T69.6Low69.8Low79 Ų79109 Ų10949%0.48556%0.559SS.*Hα-helixtrans-68.6-34.9174.150.70000113.1K454 S455 M462K454-T458 WeakPolarHBondContact O-CG2 3.24Å; K454-T458 PolarHBondContact O-N 3.17Å; K454-T458 PolarHBondContact O-OG1 3.29Å; K454-T458 VanDerWaalsContact O-OG1 3.08Å; S455-T458 VanDerWaalsContact CA-OG1 3.28Å; S455-T458 WeakPolarHBondContact CA-OG1 3.49Å; S455-T458 CarbonylContact O-C 3.57Å; S455-T458 PolarHBondContact O-N 3.47Å; S455-T458 PolarHBondContact O-OG1 3.38Å; T458-M462 WeakPolarHBondContact O-CB 3.38Å; T458-M462 VanDerWaalsContact O-CG 3.26Å; T458-M462 WeakPolarHBondContact O-CG 3.45Å; T458-M462 PolarHBondContact O-N 3.07Å
459E73.4Confident67.9Low108 Ų108115.8 Ų115.851%0.50558%0.577SS.*Hα-helixtrans-68.1-42.5174.7-77.7169.4-15800111.3S455 K456 M462 L463S455-E459 WeakPolarHBondContact O-CB 3.5Å; S455-E459 WeakPolarHBondContact O-CG 3.27Å; S455-E459 PolarHBondContact O-N 3.34Å; S455-E459 PolarHBondContact OG-OE1 2.96Å; K456-E459 PolarHBondContact O-N 3.16Å; E459-M462 PolarHBondContact O-N 2.93Å; E459-L463 WeakPolarHBondContact O-CB 3.36Å; E459-L463 PolarHBondContact O-N 3.13Å
460E69.9Low65.9Low120 Ų120116.4 Ų116.456%0.56159%0.588SS**Hα-helixtrans-64.2-42.3174.2-162.4174-164.300111K456 Q457 M462 L463 Y464K456-E460 VanDerWaalsContact O-CB 3.23Å; K456-E460 WeakPolarHBondContact O-CB 3.33Å; K456-E460 PolarHBondContact O-N 3.21Å; Q457-E460 PolarHBondContact O-N 2.99Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.17Å; E460-L463 PolarHBondContact O-N 2.85Å; E460-Y464 HydrophobicContact CG-CD2 3.96Å; E460-Y464 HydrophobicContact CG-CE2 4.39Å; E460-Y464 PolarHBondContact O-N 3.1Å
461D68.6Low64.4Low59 Ų59117 Ų11732%0.31661%0.608SS.*Hα-helixtrans-64.6-31.7173.6-74.7-24000112.7Q457 G465 T466Q457-D461 VanDerWaalsContact O-CB 3.25Å; Q457-D461 WeakPolarHBondContact O-CB 3.44Å; Q457-D461 PolarHBondContact O-N 3.25Å; D461-G465 CarbonylContact O-C 3.58Å; D461-G465 VanDerWaalsContact O-C 3.25Å; D461-G465 WeakPolarHBondContact O-CA 3.32Å; D461-G465 PolarHBondContact O-N 3.44Å; D461-T466 HydrophobicContact CB-CG2 4.21Å; D461-T466 PolarHBondContact O-N 3.09Å
462M69.1Low62.5Low160 Ų160116.2 Ų116.279%0.78862%0.619SS**Hα-helixtrans-78.4-31.9174.4-75.3-165.4-35.800113T458 E459 E460T458-M462 WeakPolarHBondContact O-CB 3.38Å; T458-M462 VanDerWaalsContact O-CG 3.26Å; T458-M462 WeakPolarHBondContact O-CG 3.45Å; T458-M462 PolarHBondContact O-N 3.07Å; E459-M462 PolarHBondContact O-N 2.93Å; E460-M462 VanDerWaalsContact C-N 3.32Å; E460-M462 PolarHBondContact O-N 3.17Å
463L66.5Low60.4Low133 Ų133121.4 Ų121.470%0.69664%0.638SS**Hα-helixtrans-83.6-33.9-177.3-16666.6000112.6E459 E460E459-L463 WeakPolarHBondContact O-CB 3.36Å; E459-L463 PolarHBondContact O-N 3.13Å; E460-L463 PolarHBondContact O-N 2.85Å
464Y64Low58.5Low184 Ų184127.2 Ų127.272%0.72266%0.656SS**Hα-helixtrans-111.9-4-178.2-63.3-76.7000114.2E460E460-Y464 HydrophobicContact CG-CD2 3.96Å; E460-Y464 HydrophobicContact CG-CE2 4.39Å; E460-Y464 PolarHBondContact O-N 3.1Å
465G54.8Low56.6Low45 Ų45131 Ų13146%0.46467%0.666SS.*  trans77.7136.1-175.700000112.1D461 A467D461-G465 CarbonylContact O-C 3.58Å; D461-G465 VanDerWaalsContact O-C 3.25Å; D461-G465 WeakPolarHBondContact O-CA 3.32Å; D461-G465 PolarHBondContact O-N 3.44Å; G465-A467 PolarHBondContact O-N 3.22Å; G465-A467 VanDerWaalsContact O-N 3.09Å
466T53Low54.7Low102 Ų102138.1 Ų138.163%0.62669%0.692SS**  trans-49.9116.6176.725.80000111.7D461 V468D461-T466 HydrophobicContact CB-CG2 4.21Å; D461-T466 PolarHBondContact O-N 3.09Å; T466-V468 PolarHBondContact O-N 2.78Å
467A48.4Very low53Low98 Ų98140 Ų14081%0.8171%0.706SS**  trans-67.397170.800000109.8G465 R469G465-A467 PolarHBondContact O-N 3.22Å; G465-A467 VanDerWaalsContact O-N 3.09Å; A467-R469 PolarHBondContact O-N 3.03Å
468V46Very low51.2Low118 Ų118137.5 Ų137.572%0.71571%0.713SS**  trans-59.2117.9173.81760000109.8T466 T470T466-V468 PolarHBondContact O-N 2.78Å; V468-T470 HydrophobicContact CG1-CG2 4.35Å
469R42.3Very low49.6Very low249 Ų249140.1 Ų140.194%0.9473%0.729SS**  trans-124.4103154.7-97-170163.3-175-3.2110.8A467A467-R469 PolarHBondContact O-N 3.03Å
470T41.5Very low47.8Very low114 Ų114140.7 Ų140.770%0.69974%0.74SS**  trans-68.2164.8170.225.90000112.2V468V468-T470 HydrophobicContact CG1-CG2 4.35Å
471P46Very low46.2Very low134 Ų134141.2 Ų141.287%0.8775%0.751SS**  -131.3149.5105.231.7-19.5000113.9
472A37.3Very low45.2Very low87 Ų87143.5 Ų143.572%0.71977%0.769SS**  trans-83148-17300000114.3
473K36.9Very low43.6Very low202 Ų202143.4 Ų143.488%0.87877%0.772SS**  trans50.7119.4144.1-74.2-179.7175.1176.40120.3
474R39.9Very low42.2Very low240 Ų240147.1 Ų147.191%0.90678%0.783SS**  -156.1127.6104.1-109.9179.1-167177.94.5111.4
475R37Very low40.9Very low226 Ų226143.1 Ų143.185%0.85378%0.781SS**  trans-85143.1166.9-79.5179.9-172.6168.51.9109.1
476F35.3Very low40.1Very low202 Ų202151.8 Ų151.889%0.88680%0.8SS**  trans-136133.3143-101.2-85.8000108.4
477L41.9Very low39.4Very low162 Ų162155.2 Ų155.285%0.84881%0.806SS**  trans-83.9147175.9-86.4107.1000110.6
478G33.8Very low39.1Very low66 Ų66158.2 Ų158.268%0.6881%0.808SS**  trans129.4120.3135.900000117.8
479T35.2Very low38.6Very low134 Ų134159.9 Ų159.982%0.82281%0.813SS**  trans117.496.8153.2600000115
480T35.7Very low38.3Very low120 Ų120152.4 Ų152.474%0.73680%0.804SS**  52.6127.3100.6620000113.4
481T37Very low38.1Very low131 Ų131153.7 Ų153.780%0.80481%0.812SS**  cis-176.8-166.416.225.10000105.2
482P47.7Very low37.6Very low107 Ų107152.3 Ų152.370%0.69581%0.805SS**  -127.5161.6-75.438.3-20.1000115.2
483N36.5Very low37.4Very low157 Ų157152.9 Ų152.984%0.8480%0.804SS**  trans27.8127.8143.5-69.4-24.5000122
484K37Very low37.2Very low212 Ų212151.4 Ų151.492%0.92280%0.802SS**  -148.9149120.1-124.6169.8-174.6173.20112
485S35.6Very low36.9Very low99 Ų99144 Ų14469%0.69279%0.787SS**  trans-110.8-175.3-148.646.60000112.7
486R38.6Very low36.6Very low227 Ų227138.8 Ų138.886%0.85779%0.786SS**  trans88.7135.4160.9-81.6-179.1-170.5-176.53.8116
487K37.7Very low36.4Very low174 Ų174133.1 Ų133.176%0.75778%0.784SS**  cis-165.3134.60.6-162.1174.1173.3-174.50105.7
488L41.6Very low35.9Very low161 Ų161130 Ų13084%0.84378%0.782SS**  trans-66.5149.5164.7-66.5165000109.2
489N35.6Very low35.7Very low154 Ų154132 Ų13282%0.82479%0.785SS**  trans-148.5108.7136.2-95.1-6.3000107.9
490A36.3Very low35.6Very low91 Ų91132.8 Ų132.875%0.75279%0.785SS**  trans-76.3145.4161.500000108.8
491T37.4Very low35.4Very low142 Ų142132 Ų13287%0.87178%0.784SS**  trans-155.6121.7140.522.20000109
492S35Very low35Very low104 Ų104131.4 Ų131.473%0.72778%0.78SS**  trans-61.8158.9168.742.90000113.5
493S34.1Very low34.3Very low100 Ų100133.1 Ų133.170%0.69978%0.781SS**  135.8128.211366.50000114.8
494M33.3Very low34Very low170 Ų170135.8 Ų135.884%0.83778%0.779SS**  trans67.4149.8144.9-53.1-92.282.900117.2
495S32.6Very low33.7Very low84 Ų84130.4 Ų130.459%0.58777%0.768SS**  cis-178.5151.8-17.9470000105.5
496S31.8Very low33.4Very low118 Ų118131.4 Ų131.483%0.82577%0.769SS**  trans60134.814860.50000121.6
497G30Very low33Very low82 Ų82128.7 Ų128.785%0.84577%0.766SS**  trans150.5109.7148.800000114.6
498A31.1Very low32.6Very low97 Ų97126.6 Ų126.680%0.80277%0.772SS**  trans-84.6167178.700000113.6
499S30.2Very low32.1Very low107 Ų107121.9 Ų121.975%0.74876%0.762SS**  trans115.9114.3143-520000118.7
500N32.3Very low32Very low152 Ų152120.8 Ų120.881%0.81376%0.761SS**  51.4134.4123.7-64.1-3.8000124.4
501S31.6Very low32Very low104 Ų104122 Ų12273%0.72776%0.759SS**  trans86.5118.2133.173.10000122.1
502T30.1Very low31.8Very low117 Ų117120.3 Ų120.372%0.71875%0.752SS**  51.6118119.7-30.10000121.2
503M32.3Very low31.6Very low143 Ų143126.6 Ų126.670%0.70476%0.76SS**  152.3132.8111.9-87.8-59.9-111.300115.1
504R31Very low31.7Very low214 Ų214126.8 Ų126.881%0.80876%0.761SS**  trans49.7128.5140.6-80.5-173.9-177.3-147.1-1.2123.5
505S29.5Very low32.5Very low98 Ų98124.5 Ų124.569%0.68576%0.759SS**  54.5137.2122.4-152.50000117.6
506V30.4Very low32.8Very low120 Ų120125.4 Ų125.473%0.72776%0.761SS**  -168.6142.261.3-163.50000110.4
507H29.8Very low33.6Very low170 Ų170125.6 Ų125.679%0.78776%0.759SS**  trans20134.5150.8-62.565.5000123.5
508C28.4Very low33.7Very low131 Ų131130.8 Ų130.889%0.88575%0.753SS**  143.8140100.1-143.40000114.4
509G31.1Very low33.7Very low62 Ų62134 Ų13464%0.63975%0.75SS**  trans106.287.2159.100000116.7
510T33.3Very low33.6Very low130 Ų130136 Ų13680%0.79875%0.751SS**  54.5127.689.4-21.80000112.5
511V37.2Very low33.6Very low117 Ų117135.8 Ų135.871%0.70975%0.749SS**  cis-171.8150.947.7-147.70000111.8
512C33.1Very low33.6Very low107 Ų107136.1 Ų136.172%0.72375%0.751SS**  trans69.5139.1139.1-87.20000121
513R31.1Very low33.7Very low236 Ų236134.3 Ų134.389%0.89175%0.748SS**  cis-156.41559-78.1-156.4170.9-158-2.7112
514S35.5Very low33.7Very low104 Ų104133.9 Ų133.973%0.72775%0.749SS**  trans-60.5176161.4-147.60000113.1
515P49.2Very low33.8Very low122 Ų122132.5 Ų132.579%0.79275%0.748SS**  cis-149.1168.223.640.5-16.4000121.9
516V39.7Very low34Very low103 Ų103133.8 Ų133.862%0.62475%0.753SS**  trans-51.1155.7158.1173.90000111.6R518V516-R518 HydrophobicContact CG1-CB 4.47Å
517P48.6Very low34.5Very low121 Ų121134.4 Ų134.479%0.78676%0.759SS**  -146.915661.531.3-5.6000116.6
518R33.3Very low34.7Very low192 Ų192131.2 Ų131.273%0.72576%0.762SS**  82.8121.853.4-106.4-155.7-107-159.93116.4V516V516-R518 HydrophobicContact CG1-CB 4.47Å
519F29.1Very low34.9Very low165 Ų165130 Ų13072%0.72476%0.761SS**  trans74.8142.1160.5-58-61000118.9
520L28.9Very low35Very low148 Ų148138.8 Ų138.878%0.77578%0.775SS**  -160.2153.456.1-72.6159.2000115.2
521L33Very low35.1Very low147 Ų147138.9 Ų138.977%0.7778%0.776SS**  trans33.3126.5133.8-55.3166.1000120.2
522S32Very low35.4Very low111 Ų111139.2 Ų139.278%0.77678%0.78SS**  79119.164.8-166.20000116.4
523A31.9Very low35.3Very low79 Ų79138 Ų13865%0.65379%0.786SS**  trans123.2134.9136.800000119.9
524N31.9Very low35.2Very low135 Ų135130.9 Ų130.972%0.72279%0.786SS**  trans93107.3154.6-64.4-20.1000119.1
525K32.1Very low34.9Very low184 Ų184129.9 Ų129.980%0.879%0.792SS**  72.5130.286.6-77.5-177.9178.7-179.60111.1
526T33.9Very low34.2Very low126 Ų126134 Ų13477%0.77380%0.798SS**  cis-175.1174.135.650000107.2
527P41.9Very low35.1Very low132 Ų132134.7 Ų134.786%0.85780%0.804SS**  -149.6174.594.134.9-12.8000116.4
528A33.1Very low35.1Very low104 Ų104134.8 Ų134.886%0.8681%0.805SS**  trans-72.8166.2-16400000117.6
529A32.2Very low35.2Very low104 Ų104133.9 Ų133.986%0.8681%0.809SS**  trans-126.6141.6161.200000110.8
530R33.1Very low35.4Very low247 Ų247133.4 Ų133.493%0.93281%0.813SS**  trans-111.4141.4168.6-75.5-177.6172.3178.8-2.3108.7
531T35.7Very low35.5Very low133 Ų133136.6 Ų136.682%0.81682%0.815SS**  trans-70.9171162.5-1.40000110.9
532P44.7Very low35.5Very low123 Ų123134.3 Ų134.380%0.79981%0.807SS**  cis-155.1176.446.940-16.5000119.4
533G29.7Very low35.6Very low83 Ų83136.4 Ų136.486%0.85680%0.804SS**  trans75.7147.2153.400000117.2
534G29.8Very low35.5Very low86 Ų86138.2 Ų138.289%0.88780%0.803SS**  cis141.5132.914.600000107.8
535G29.9Very low35.5Very low83 Ų83137 Ų13786%0.85680%0.804SS**  trans136125.6166.100000117.2
536K33.3Very low35.6Very low208 Ų208136 Ų13690%0.90481%0.807SS**  trans-83.9-165.7168.4-63.5177.1164.5176.30111.7
537P59.9Low35.7Very low117 Ų117139.3 Ų139.376%0.7681%0.811SS**  -99.5-170.1-117.840.1-17.9000112.4
538P48.3Very low35.4Very low124 Ų124140.8 Ų140.881%0.80581%0.806SS**  -158.9178.981.138.4-14.4000117.4
539H34.9Very low35.6Very low172 Ų172141.7 Ų141.780%0.79680%0.797SS**  trans-33.8150.2166.9-105-75.4000119.6
540L32.6Very low35.4Very low156 Ų156144.1 Ų144.182%0.81779%0.79SS**  trans-172.2117.5130.2-97142.3000107.5
541R30.7Very low35.3Very low215 Ų215137.3 Ų137.381%0.81179%0.787SS**  44.212884.1-96.5-173.6178.8-177.90.3110.9
542T34.4Very low35.2Very low98 Ų98139.3 Ų139.360%0.60179%0.787SS**  cis-178.3153.948.2-15.10000109.6
543Q33.4Very low34.6Very low156 Ų156137.2 Ų137.273%0.72979%0.788SS**  trans65.6147.4138.6-83.9-179.9-64.300119.9
544D30Very low34.8Very low116 Ų116143.1 Ų143.162%0.6279%0.79SS**  cis-153.9137.918.2-95.6-42.1000106.9
545C32.3Very low34.8Very low109 Ų109143.8 Ų143.874%0.73679%0.787SS**  58.1113.185.9-70.60000116.2
546N33.8Very low35.1Very low164 Ų164146.3 Ų146.388%0.87779%0.786SS**  trans-171.5113.7139.6-87.2-19.8000105.6
547K35.1Very low35.7Very low195 Ų195141.6 Ų141.685%0.84878%0.776SS**  48.3113.554.5-87.9-169.7176.9-1750110.3
548E36.2Very low34.3Very low164 Ų164143 Ų14377%0.76678%0.783SS**  -173.7171.657.4-79.4-169.8130.100107.4
549N36.4Very low33.6Very low122 Ų122142.7 Ų142.765%0.65278%0.784SS**  cis-163.3151.3-6.3-111.1-23.9000109.4
550E29.5Very low33.4Very low155 Ų155138.2 Ų138.272%0.72478%0.784SS**  trans-4.5146.4154.2-60-167.515000122.9
551A31.4Very low33.4Very low105 Ų105135.4 Ų135.487%0.86878%0.783SS**  -142133.1124.400000110.5
552Q33.5Very low33.4Very low174 Ų174133.6 Ų133.681%0.81379%0.789SS**  trans-74.7156.2-175-68.5165-33.200114.2
553G30.8Very low33.4Very low79 Ų79137.9 Ų137.981%0.81480%0.802SS**  trans-163.2114.5161.200000112
554K33.9Very low33.6Very low208 Ų208136.6 Ų136.690%0.90481%0.805SS**  trans-70.6150.6-169.1-62.6165.1174.4174.80114.7
555A29.5Very low34.2Very low99 Ų99137.1 Ų137.182%0.81881%0.814SS**  150.1140.3116.400000113
556T36.3Very low34.3Very low137 Ų137141 Ų14184%0.8482%0.822SS**  trans-94.2-171.8-171.5-22.70000111.9
557P47Very low34.4Very low108 Ų108143.4 Ų143.470%0.70182%0.819SS**  -117.5164.8-112.440.9-24000113.9
558V30.6Very low34.4Very low147 Ų147141.9 Ų141.989%0.89182%0.819SS**  trans-149.6135.7155.2177.80000111.5
559S33.4Very low34.4Very low118 Ų118141.9 Ų141.983%0.82582%0.817SS**  trans-44.1153.1168.8-59.50000116.7
560G29.8Very low34.3Very low78 Ų78141.8 Ų141.880%0.80483%0.826SS**  trans-149.183.7163.100000111.3
561A32.6Very low34.5Very low96 Ų96142.3 Ų142.379%0.79383%0.831SS**  trans-88.9124.6162.400000107.9Q563A561-Q563 PolarHBondContact O-N 3.2Å
562L32.2Very low34.6Very low178 Ų178142 Ų14293%0.93283%0.828SS**  trans-74.7115.4171.8-88.794.7000109.5
563Q33.1Very low34.5Very low187 Ų187138.4 Ų138.487%0.87482%0.822SS**  trans-114.6127.5157.8-82.6-176.8-3.900108.6A561A561-Q563 PolarHBondContact O-N 3.2Å
564T38.4Very low34.7Very low129 Ų129141.3 Ų141.379%0.79182%0.824SS**PPolyproline II helixtrans-72.6140.5171.346.50000111.1
565P41.4Very low34.6Very low127 Ų127136 Ų13683%0.82582%0.819SS**PPolyproline II helixtrans-89.1116175.731.5-28.2000111.7
566Q34.8Very low34.9Very low192 Ų192136.4 Ų136.490%0.89782%0.816SS**PPolyproline II helixtrans-76121.3159.9-91.9-178.1-45.200109.6
567R35.8Very low34.9Very low214 Ų214136.4 Ų136.481%0.80882%0.816SS**PPolyproline II helixtrans-85.1120.8168-94.5173.1162.8-179.7-1.2109.1F569R567-F569 HydrophobicContact CB-CD2 4.36Å; R567-F569 HydrophobicContact CB-CE2 4.4Å
568N35.8Very low34.4Very low162 Ų162141.4 Ų141.487%0.86682%0.822SS**  trans-79.6111.4164-73.1-28.9000109.3
569F36.1Very low34.7Very low165 Ų165139.2 Ų139.272%0.72481%0.813SS**  trans-112.2113.6158.5-81.1-75.4000108R567R567-F569 HydrophobicContact CB-CD2 4.36Å; R567-F569 HydrophobicContact CB-CE2 4.4Å
570S34.6Very low35.2Very low119 Ų119141.9 Ų141.983%0.83281%0.812SS**  trans-89113.2167.2-179.20000107.8
571M34.2Very low35.7Very low167 Ų167147.1 Ų147.182%0.82381%0.813SS**  trans-125.395.2164.9-81.4-17860.500107.3
572A32.8Very low36.2Very low98 Ų98148.8 Ų148.881%0.8181%0.813SS**  trans-89.1123.4161.300000107.7
573S31.3Very low36.9Very low99 Ų99145.9 Ų145.969%0.69280%0.803SS**  trans-115.7128.6172.6-95.40000109.8
574V34.8Very low37Very low139 Ų139148 Ų14884%0.84282%0.821SS**  trans70.6106.4139.6-169.70000117.9
575A33.3Very low37Very low98 Ų98149 Ų14981%0.8182%0.822SS**  trans-129.2112147.600000109.3
576S33.9Very low36.7Very low107 Ų107150.2 Ų150.275%0.74882%0.822SS**  trans11.6119.8148.2-163.50000119.1
577T37.8Very low36.9Very low137 Ų137147.8 Ų147.884%0.8482%0.818SS**  trans-151.9103.9136.7-35.50000109.6
578Y35Very low36.9Very low213 Ų213143.9 Ų143.984%0.83582%0.818SS**  trans-94.5114.5165.4-169.3-95.9000106.9
579S38.5Very low37Very low100 Ų100142.8 Ų142.870%0.69982%0.815SS**  trans-159.281.6171.2-155.40000109.8
580E42.3Very low37Very low174 Ų174141.3 Ų141.381%0.81382%0.821SS**  trans-95.5115.4162.7-81.8-174.3160.400109.2
581F40.4Very low37.2Very low188 Ų188142.9 Ų142.983%0.82582%0.821SS**  trans-132.3147.5159.9-100.4-83.5000107.4
582V43.3Very low37.5Very low131 Ų131141.1 Ų141.179%0.79482%0.82SS**  trans115.790.8176.9179.70000109.3
583V47.4Very low37.8Very low118 Ų118144.7 Ų144.772%0.71582%0.821SS**  64.1133.166.7-1740000112.7
584N36.2Very low38.4Very low232 Ų232148.8 Ų148.8100%1.24183%0.833SS**  trans-3.80159.7-73.2-29.8000118.1

Retrieved 584 of 584 residues in 683.4 ms (Link to these results)