A0A087XHU4_POEFO Loading...

LEM domain containing 1

AlphaFold DB , UniProt , Accession A0A087XHU4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 434 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
1M35.4Very low69.7Low237 Ų237114.1 Ų114.1100%1.16759%0.594SS**  095.70-71173.8167.600108F3M1-F3 PolarHBondContact O-N 3.32Å
2S43.9Very low71.5Confident112 Ų112110.5 Ų110.578%0.78357%0.57SS**  trans-71.1119166.2450000106.9V4S2-V4 PolarHBondContact O-N 3.38Å
3F42.3Very low73.1Confident201 Ų201108.7 Ų108.788%0.88257%0.573SS**  trans-52.3117.8170.7-68.8-87000107.7M1 Q5M1-F3 PolarHBondContact O-N 3.32Å; F3-Q5 PolarHBondContact O-N 3.4Å
4V56.1Low74.6Confident121 Ų121110.6 Ų110.673%0.73357%0.569SS**  trans-6882.8171.1-179.90000105.8S2 Y6S2-V4 PolarHBondContact O-N 3.38Å; V4-Y6 PolarHBondContact O-N 3.23Å; V4-Y6 VanDerWaalsContact O-N 3.1Å
5Q69.8Low75.8Confident133 Ų133103.2 Ų103.262%0.62153%0.531SS*.  trans-76.8102.4-179.8-170160.827.600107.2F3 L10F3-Q5 PolarHBondContact O-N 3.4Å; Q5-L10 HydrophobicContact CG-CD2 3.85Å
6Y80.4Confident76.8Confident164 Ų164100.6 Ų100.664%0.64351%0.514SS*.  trans-50.9125.5178.2-70.2-79.7000110.4V4 A8 H9V4-Y6 PolarHBondContact O-N 3.23Å; V4-Y6 VanDerWaalsContact O-N 3.1Å; Y6-A8 PolarHBondContact O-N 3.03Å; Y6-H9 PolarHBondContact O-N 3.06Å
7P82.1Confident77.7Confident7 Ų798.8 Ų98.85%0.04551%0.513CS..G310 helixtrans-62.1-19.5-172.421-31.6000113.3H9 L10 L15 V37 H40 L41P7-H9 PolarHBondContact O-N 3.48Å; P7-L10 HydrophobicContact CB-CD1 4.39Å; P7-L10 WeakPolarHBondContact O-CB 3.49Å; P7-L10 PolarHBondContact O-N 3.31Å; P7-L15 HydrophobicContact CB-CD2 3.96Å; P7-V37 HydrophobicContact CB-CG1 4.32Å; P7-V37 HydrophobicContact CG-CG1 4.36Å; P7-H40 HydrophobicContact CB-CB 4.36Å; P7-L41 HydrophobicContact CG-CD2 3.45Å; P7-L41 VanDerWaalsContact CG-CD2 3.45Å; P7-L41 HydrophobicContact CG-CG 3.74Å
8A86.3Confident78.5Confident58 Ų5894.7 Ų94.748%0.47949%0.491SS..G310 helixtrans-58.8-31.5172.600000113.4Y6 K33Y6-A8 PolarHBondContact O-N 3.03Å; A8-K33 WeakPolarHBondContact O-CE 3.38Å; A8-K33 PolarHBondContact O-NZ 2.81Å
9H88.3Confident79.2Confident146 Ų14689.7 Ų89.768%0.67647%0.466SS*.G310 helixtrans-83.3-15.4-179.1-66.6-98.5000112.9Y6 P7Y6-H9 PolarHBondContact O-N 3.06Å; P7-H9 PolarHBondContact O-N 3.48Å
10L89Confident79.9Confident16 Ų1689.4 Ų89.48%0.08447%0.468CS..SBendtrans-71.5148.6-179.9-59.4179.4000111.2Q5 P7 R14 L15 K33Q5-L10 HydrophobicContact CG-CD2 3.85Å; P7-L10 HydrophobicContact CB-CD1 4.39Å; P7-L10 WeakPolarHBondContact O-CB 3.49Å; P7-L10 PolarHBondContact O-N 3.31Å; L10-R14 HydrophobicContact CB-CB 4.36Å; L10-R14 HydrophobicContact CB-CG 4.29Å; L10-R14 HydrophobicContact CD1-CG 4.38Å; L10-R14 HydrophobicContact CD2-CG 4.13Å; L10-L15 HydrophobicContact CB-CD2 4.01Å; L10-L15 HydrophobicContact CB-CG 3.86Å; L10-L15 HydrophobicContact CD1-CD2 4Å; L10-K33 WeakPolarHBondContact O-CE 3.29Å; L10-K33 PolarHBondContact O-NZ 3.48Å
11S93.3Very high80.4Confident60 Ų6088.5 Ų88.542%0.4247%0.473SS..  trans-69.7155.7173.369.40000110.7S13 R14 L15S11-S13 PolarHBondContact O-N 3.29Å; S11-S13 PolarHBondContact OG-OG 3.28Å; S11-S13 VanDerWaalsContact OG-OG 3.1Å; S11-R14 PolarHBondContact O-N 3.19Å; S11-R14 VanDerWaalsContact OG-CB 3.32Å; S11-R14 WeakPolarHBondContact OG-CB 3.47Å; S11-R14 PolarHBondContact OG-N 3.45Å; S11-L15 WeakPolarHBondContact O-CG 3.37Å; S11-L15 PolarHBondContact O-N 3.38Å
12K91.8Very high82.8Confident71 Ų7180.8 Ų80.831%0.30943%0.434SS..Hα-helixtrans-58.9-32.6178-177.1174.6170.2176.50112.3K16 S31 K33 Y36K12-K16 VanDerWaalsContact O-CG 3.26Å; K12-K16 WeakPolarHBondContact O-CG 2.94Å; K12-K16 PolarHBondContact O-N 3.13Å; K12-S31 PolarHBondContact NZ-O 2.98Å; K12-K33 HydrophobicContact CB-CG 4.48Å; K12-Y36 HydrophobicContact CD-CE2 4.33Å; K12-Y36 VanDerWaalsContact CE-CE2 3.42Å; K12-Y36 HydrophobicContact CG-CD2 4.31Å; K12-Y36 HydrophobicContact CG-CE2 4.38Å
13S92.1Very high85Confident87 Ų8782.8 Ų82.861%0.60844%0.436SS*.Hα-helixtrans-71.3-39.3174.651.30000112.3S11 K16 S17S11-S13 PolarHBondContact O-N 3.29Å; S11-S13 PolarHBondContact OG-OG 3.28Å; S11-S13 VanDerWaalsContact OG-OG 3.1Å; S13-K16 PolarHBondContact O-N 3.07Å; S13-S17 PolarHBondContact O-N 3.3Å
14R93.3Very high87.2Confident135 Ų13574.1 Ų74.151%0.50940%0.4SS..Hα-helixtrans-64.7-47.4176.6-176.660.3-173.7-156.1-0.6111.6L10 S11 K16 S17 D18L10-R14 HydrophobicContact CB-CB 4.36Å; L10-R14 HydrophobicContact CB-CG 4.29Å; L10-R14 HydrophobicContact CD1-CG 4.38Å; L10-R14 HydrophobicContact CD2-CG 4.13Å; S11-R14 PolarHBondContact O-N 3.19Å; S11-R14 VanDerWaalsContact OG-CB 3.32Å; S11-R14 WeakPolarHBondContact OG-CB 3.47Å; S11-R14 PolarHBondContact OG-N 3.45Å; R14-K16 VanDerWaalsContact C-N 3.27Å; R14-K16 PolarHBondContact O-N 3.37Å; R14-S17 WeakPolarHBondContact O-CB 3.15Å; R14-S17 PolarHBondContact O-N 3.34Å; R14-S17 VanDerWaalsContact O-N 3.08Å; R14-D18 IonicContact CZ-OD1 3.63Å; R14-D18 IonicContact NE-OD1 3.51Å; R14-D18 PolarHBondContact NE-OD1 3.24Å; R14-D18 VanDerWaalsContact NE-OD1 3.12Å; R14-D18 IonicContact NE-OD2 3.39Å; R14-D18 PolarHBondContact NE-OD2 3.25Å; R14-D18 VanDerWaalsContact NE-OD2 3.09Å; R14-D18 IonicContact NH2-OD1 3.09Å; R14-D18 VanDerWaalsContact O-CG 3.32Å; R14-D18 PolarHBondContact O-N 3.21Å
15L92.9Very high88.8Confident0 Ų076.7 Ų76.70%040%0.404CS..Hα-helixtrans-55.5-41.1174.4-71.4164.8000112.5P7 L10 S11 L19 K33 V37 H40P7-L15 HydrophobicContact CB-CD2 3.96Å; L10-L15 HydrophobicContact CB-CD2 4.01Å; L10-L15 HydrophobicContact CB-CG 3.86Å; L10-L15 HydrophobicContact CD1-CD2 4Å; S11-L15 WeakPolarHBondContact O-CG 3.37Å; S11-L15 PolarHBondContact O-N 3.38Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CD1 3.49Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 3.25Å; L15-K33 HydrophobicContact CD1-CG 4.08Å; L15-V37 HydrophobicContact CD1-CG2 3.49Å; L15-V37 VanDerWaalsContact CD1-CG2 3.49Å; L15-V37 HydrophobicContact CD2-CG2 4.38Å; L15-H40 HydrophobicContact CD2-CB 4.05Å
16K92.1Very high89.7Confident62 Ų6274.2 Ų74.227%0.2740%0.395SS..Hα-helixtrans-64.6-45.2175.4-76.5175.3175.9-164.60112.6K12 S13 R14 D18 L19 V20 L26 Y36K12-K16 VanDerWaalsContact O-CG 3.26Å; K12-K16 WeakPolarHBondContact O-CG 2.94Å; K12-K16 PolarHBondContact O-N 3.13Å; S13-K16 PolarHBondContact O-N 3.07Å; R14-K16 VanDerWaalsContact C-N 3.27Å; R14-K16 PolarHBondContact O-N 3.37Å; K16-D18 VanDerWaalsContact C-N 3.32Å; K16-L19 PolarHBondContact O-N 3.04Å; K16-V20 VanDerWaalsContact O-CG2 3.31Å; K16-V20 WeakPolarHBondContact O-CG2 3.23Å; K16-V20 PolarHBondContact O-N 3.34Å; K16-L26 HydrophobicContact CB-CD2 4.28Å; K16-L26 HydrophobicContact CG-CD2 4.22Å; K16-Y36 HydrophobicContact CD-CE1 4.04Å; K16-Y36 WeakPolarHBondContact CE-OH 3.35Å; K16-Y36 HydrophobicContact CG-CD1 3.67Å; K16-Y36 HydrophobicContact CG-CE1 3.45Å; K16-Y36 VanDerWaalsContact CG-CE1 3.45Å
17S92.4Very high90.1Very high69 Ų6967.6 Ų67.648%0.48337%0.372SS..Hα-helixtrans-60-45.7178-173.30000110.9S13 R14 V20 A21S13-S17 PolarHBondContact O-N 3.3Å; R14-S17 WeakPolarHBondContact O-CB 3.15Å; R14-S17 PolarHBondContact O-N 3.34Å; R14-S17 VanDerWaalsContact O-N 3.08Å; S17-V20 PolarHBondContact O-N 3.25Å; S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.2Å
18D91.3Very high90.4Very high25 Ų2572.3 Ų72.313%0.13440%0.402CS..Hα-helixtrans-67.7-43-178.2-64.1-15.8000110.3R14 K16 V20 A21 H22R14-D18 IonicContact CZ-OD1 3.63Å; R14-D18 IonicContact NE-OD1 3.51Å; R14-D18 PolarHBondContact NE-OD1 3.24Å; R14-D18 VanDerWaalsContact NE-OD1 3.12Å; R14-D18 IonicContact NE-OD2 3.39Å; R14-D18 PolarHBondContact NE-OD2 3.25Å; R14-D18 VanDerWaalsContact NE-OD2 3.09Å; R14-D18 IonicContact NH2-OD1 3.09Å; R14-D18 VanDerWaalsContact O-CG 3.32Å; R14-D18 PolarHBondContact O-N 3.21Å; K16-D18 VanDerWaalsContact C-N 3.32Å; D18-V20 VanDerWaalsContact C-N 3.35Å; D18-V20 PolarHBondContact O-N 3.2Å; D18-A21 WeakPolarHBondContact O-CB 3.38Å; D18-A21 PolarHBondContact O-N 2.98Å; D18-A21 VanDerWaalsContact O-N 3.17Å; D18-H22 PolarHBondContact O-CD2 3.13Å; D18-H22 VanDerWaalsContact O-CD2 3.27Å; D18-H22 PolarHBondContact O-N 3.2Å
19L92.3Very high90.1Very high0 Ų073.8 Ų73.80%041%0.414CS..Hα-helixtrans-58.5-42.5173.4-74.9165.7000113L15 K16 H22 N23 V24 L26 Y36 L39 H40L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CD1 3.49Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 3.25Å; K16-L19 PolarHBondContact O-N 3.04Å; L19-H22 CarbonylContact O-C 3.58Å; L19-H22 PolarHBondContact O-N 3.01Å; L19-N23 PolarHBondContact O-N 3.27Å; L19-V24 HydrophobicContact CB-CB 4.33Å; L19-V24 HydrophobicContact CD2-CB 3.91Å; L19-V24 HydrophobicContact CD2-CG1 3.89Å; L19-V24 HydrophobicContact CD2-CG2 4.25Å; L19-V24 WeakPolarHBondContact O-CB 3.44Å; L19-V24 PolarHBondContact O-N 2.86Å; L19-L26 HydrophobicContact CB-CD2 3.85Å; L19-L26 HydrophobicContact CD1-CD2 4.16Å; L19-Y36 HydrophobicContact CD1-CD1 3.94Å; L19-L39 HydrophobicContact CD1-CB 4.41Å; L19-L39 HydrophobicContact CD1-CD2 4.08Å; L19-L39 HydrophobicContact CD2-CB 4.11Å; L19-L39 HydrophobicContact CD2-CD2 3.92Å; L19-L39 HydrophobicContact CD2-CG 3.9Å; L19-H40 HydrophobicContact CD2-CB 4.37Å
20V92.1Very high90Very high84 Ų8470.5 Ų70.551%0.50942%0.42SS..Hα-helixtrans-66.7-39.1176.5170.60000111.4K16 S17 D18 H22 N23 L26K16-V20 VanDerWaalsContact O-CG2 3.31Å; K16-V20 WeakPolarHBondContact O-CG2 3.23Å; K16-V20 PolarHBondContact O-N 3.34Å; S17-V20 PolarHBondContact O-N 3.25Å; D18-V20 VanDerWaalsContact C-N 3.35Å; D18-V20 PolarHBondContact O-N 3.2Å; V20-H22 VanDerWaalsContact C-N 3.26Å; V20-H22 PolarHBondContact O-N 2.81Å; V20-N23 PolarHBondContact O-N 2.7Å; V20-L26 HydrophobicContact CG2-CD1 3.88Å; V20-L26 HydrophobicContact CG2-CD2 4.07Å; V20-L26 HydrophobicContact CG2-CG 4.01Å
21A90.8Very high90Very high71 Ų7170.8 Ų70.859%0.58742%0.423SS*.Hα-helixtrans-63.3-34177.300000112.2S17 D18 N23S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.2Å; D18-A21 WeakPolarHBondContact O-CB 3.38Å; D18-A21 PolarHBondContact O-N 2.98Å; D18-A21 VanDerWaalsContact O-N 3.17Å; A21-N23 PolarHBondContact O-N 3.34Å
22H86.9Confident90Very high74 Ų7475.5 Ų75.534%0.34344%0.436SS..THydrogen-bonded Turntrans-86.815.2173.2-74.2-90.9000113.5D18 L19 V20 V24 V44D18-H22 PolarHBondContact O-CD2 3.13Å; D18-H22 VanDerWaalsContact O-CD2 3.27Å; D18-H22 PolarHBondContact O-N 3.2Å; L19-H22 CarbonylContact O-C 3.58Å; L19-H22 PolarHBondContact O-N 3.01Å; V20-H22 VanDerWaalsContact C-N 3.26Å; V20-H22 PolarHBondContact O-N 2.81Å; H22-V24 HydrophobicContact CB-CG2 4.03Å; H22-V24 WeakPolarHBondContact O-CG2 3.39Å; H22-V24 PolarHBondContact O-N 3.27Å; H22-V44 HydrophobicContact CB-CG2 4.14Å
23N88.7Confident90.1Very high154 Ų15476.1 Ų76.182%0.82444%0.439SS*.THydrogen-bonded Turntrans56.531.2178.8-59.698.7000114.3L19 V20 A21L19-N23 PolarHBondContact O-N 3.27Å; V20-N23 PolarHBondContact O-N 2.7Å; A21-N23 PolarHBondContact O-N 3.34Å
24V90.1Very high90.1Very high20 Ų2078.9 Ų78.912%0.12144%0.442CS..PPolyproline II helixtrans-95.1132179.4-171.20000110.6L19 H22 L26 L39 H43L19-V24 HydrophobicContact CB-CB 4.33Å; L19-V24 HydrophobicContact CD2-CB 3.91Å; L19-V24 HydrophobicContact CD2-CG1 3.89Å; L19-V24 HydrophobicContact CD2-CG2 4.25Å; L19-V24 WeakPolarHBondContact O-CB 3.44Å; L19-V24 PolarHBondContact O-N 2.86Å; H22-V24 HydrophobicContact CB-CG2 4.03Å; H22-V24 WeakPolarHBondContact O-CG2 3.39Å; H22-V24 PolarHBondContact O-N 3.27Å; V24-L26 PolarHBondContact O-N 3.28Å; V24-L39 HydrophobicContact CG1-CD1 4.39Å; V24-L39 HydrophobicContact CG1-CD2 3.69Å; V24-L39 HydrophobicContact CG1-CG 3.86Å; V24-H43 HydrophobicContact CG1-CB 4.36Å; V24-H43 HydrophobicContact CG2-CB 3.55Å
25E88.9Confident90.1Very high175 Ų17574.4 Ų74.482%0.81843%0.434SS*.PPolyproline II helixtrans-62.8133.8177.6-68.2-174.2174.800112.1L39E25-L39 VanDerWaalsContact O-CD2 3.27Å; E25-L39 WeakPolarHBondContact O-CD2 3.43Å
26L89.1Confident90.1Very high81 Ų8174.5 Ų74.542%0.42443%0.434SS..PPolyproline II helixtrans-76.6137-178.5-65.8-179.2000111.3K16 L19 V20 V24 Y36K16-L26 HydrophobicContact CB-CD2 4.28Å; K16-L26 HydrophobicContact CG-CD2 4.22Å; L19-L26 HydrophobicContact CB-CD2 3.85Å; L19-L26 HydrophobicContact CD1-CD2 4.16Å; V20-L26 HydrophobicContact CG2-CD1 3.88Å; V20-L26 HydrophobicContact CG2-CD2 4.07Å; V20-L26 HydrophobicContact CG2-CG 4.01Å; V24-L26 PolarHBondContact O-N 3.28Å; L26-Y36 HydrophobicContact CD2-CE1 4.43Å
27P87.9Confident90.1Very high25 Ų2572.5 Ų72.516%0.16243%0.427CS..PPolyproline II helixtrans-55.9159.9168-24.834000111.9A29 S31 Y36 L39P27-A29 PolarHBondContact O-N 2.71Å; P27-S31 WeakPolarHBondContact CB-OG 3.32Å; P27-Y36 HydrophobicContact CB-CE1 4.41Å; P27-Y36 HydrophobicContact CG-CD1 4.17Å; P27-Y36 HydrophobicContact CG-CE1 4.16Å; P27-L39 HydrophobicContact CG-CD2 3.89Å
28P89.1Confident90.1Very high106 Ų10672 Ų7269%0.68843%0.428SS*.PPolyproline II helixtrans-48142.7178.6-27.533.5000112.6G30 S31 Y36P28-G30 PolarHBondContact O-N 3.04Å; P28-S31 VanDerWaalsContact O-CB 3.29Å; P28-S31 WeakPolarHBondContact O-CB 3.41Å; P28-S31 PolarHBondContact O-N 2.94Å; P28-S31 PolarHBondContact O-OG 2.96Å; P28-Y36 PolarHBondContact O-OH 3.23Å
29A80.7Confident90.1Very high88 Ų8872.6 Ų72.673%0.72743%0.43SS*.THydrogen-bonded Turntrans-55.7-27.5-169.600000114.6P27P27-A29 PolarHBondContact O-N 2.71Å
30G84.5Confident90Very high77 Ų7773.2 Ų73.279%0.79443%0.433SS*.THydrogen-bonded Turntrans-86.41.2177.200000116.3P28P28-G30 PolarHBondContact O-N 3.04Å
31S89.9Confident89.9Confident22 Ų2273.2 Ų73.215%0.15443%0.43CS..  trans-67.5149-177.4530000113.1K12 P27 P28 Y36K12-S31 PolarHBondContact NZ-O 2.98Å; P27-S31 WeakPolarHBondContact CB-OG 3.32Å; P28-S31 VanDerWaalsContact O-CB 3.29Å; P28-S31 WeakPolarHBondContact O-CB 3.41Å; P28-S31 PolarHBondContact O-N 2.94Å; P28-S31 PolarHBondContact O-OG 2.96Å; S31-Y36 WeakPolarHBondContact OG-CE2 3.49Å; S31-Y36 VanDerWaalsContact OG-CZ 3.24Å; S31-Y36 PolarHBondContact OG-OH 3.39Å; S31-Y36 VanDerWaalsContact OG-OH 3.08Å
32K93.6Very high89.6Confident160 Ų16077.1 Ų77.170%0.69643%0.43SS*.  trans-68.2156.2177.8-63.5179.9-178.8177.30110.8E34 A35 Y36K32-E34 PolarHBondContact O-N 3.34Å; K32-A35 WeakPolarHBondContact O-CB 3.42Å; K32-A35 PolarHBondContact O-N 3.13Å; K32-A35 VanDerWaalsContact O-N 3.08Å; K32-Y36 WeakPolarHBondContact O-CD2 3.04Å
33K93Very high89.4Confident83 Ų8376.4 Ų76.436%0.36143%0.426SS..Hα-helixtrans-52.1-39179.6-179.6-175.7166.9-177.10112A8 L10 K12 L15 A35 Y36 V37A8-K33 WeakPolarHBondContact O-CE 3.38Å; A8-K33 PolarHBondContact O-NZ 2.81Å; L10-K33 WeakPolarHBondContact O-CE 3.29Å; L10-K33 PolarHBondContact O-NZ 3.48Å; K12-K33 HydrophobicContact CB-CG 4.48Å; L15-K33 HydrophobicContact CD1-CG 4.08Å; K33-A35 VanDerWaalsContact C-N 3.27Å; K33-A35 PolarHBondContact O-N 3.26Å; K33-Y36 WeakPolarHBondContact O-CB 3.24Å; K33-Y36 PolarHBondContact O-N 3.07Å; K33-V37 HydrophobicContact CG-CG2 4.27Å; K33-V37 PolarHBondContact O-N 2.85Å; K33-V37 VanDerWaalsContact O-N 3.08Å
34E91.8Very high89Confident146 Ų14669.3 Ų69.368%0.68239%0.388SS*.Hα-helixtrans-54.8-37.9178.7-67.2164.7-164.900113.5K32 Y36 V37 A38K32-E34 PolarHBondContact O-N 3.34Å; E34-Y36 VanDerWaalsContact C-N 3.28Å; E34-Y36 PolarHBondContact O-N 2.84Å; E34-V37 PolarHBondContact O-N 3.2Å; E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 2.95Å
35A93.4Very high88Confident41 Ų4171.5 Ų71.534%0.33940%0.4SS..Hα-helixtrans-64.1-34.2177.700000112.2K32 K33 L39K32-A35 WeakPolarHBondContact O-CB 3.42Å; K32-A35 PolarHBondContact O-N 3.13Å; K32-A35 VanDerWaalsContact O-N 3.08Å; K33-A35 VanDerWaalsContact C-N 3.27Å; K33-A35 PolarHBondContact O-N 3.26Å; A35-L39 WeakPolarHBondContact O-CB 3.26Å; A35-L39 PolarHBondContact O-N 3.2Å
36Y93.1Very high87Confident1 Ų169 Ų690%0.00439%0.388CS..Hα-helixtrans-75.4-37.9175.3-61.6-94.5000111.6K12 K16 L19 L26 P27 P28 S31 K32 K33 E34 L39 H40K12-Y36 HydrophobicContact CD-CE2 4.33Å; K12-Y36 VanDerWaalsContact CE-CE2 3.42Å; K12-Y36 HydrophobicContact CG-CD2 4.31Å; K12-Y36 HydrophobicContact CG-CE2 4.38Å; K16-Y36 HydrophobicContact CD-CE1 4.04Å; K16-Y36 WeakPolarHBondContact CE-OH 3.35Å; K16-Y36 HydrophobicContact CG-CD1 3.67Å; K16-Y36 HydrophobicContact CG-CE1 3.45Å; K16-Y36 VanDerWaalsContact CG-CE1 3.45Å; L19-Y36 HydrophobicContact CD1-CD1 3.94Å; L26-Y36 HydrophobicContact CD2-CE1 4.43Å; P27-Y36 HydrophobicContact CB-CE1 4.41Å; P27-Y36 HydrophobicContact CG-CD1 4.17Å; P27-Y36 HydrophobicContact CG-CE1 4.16Å; P28-Y36 PolarHBondContact O-OH 3.23Å; S31-Y36 WeakPolarHBondContact OG-CE2 3.49Å; S31-Y36 VanDerWaalsContact OG-CZ 3.24Å; S31-Y36 PolarHBondContact OG-OH 3.39Å; S31-Y36 VanDerWaalsContact OG-OH 3.08Å; K32-Y36 WeakPolarHBondContact O-CD2 3.04Å; K33-Y36 WeakPolarHBondContact O-CB 3.24Å; K33-Y36 PolarHBondContact O-N 3.07Å; E34-Y36 VanDerWaalsContact C-N 3.28Å; E34-Y36 PolarHBondContact O-N 2.84Å; Y36-L39 PolarHBondContact O-N 2.81Å; Y36-H40 WeakPolarHBondContact O-CB 3.46Å; Y36-H40 PolarHBondContact O-N 3.13Å
37V93.6Very high85.7Confident20 Ų2067.6 Ų67.612%0.12138%0.383CS..Hα-helixtrans-63.2-47.7176.1176.60000110.6P7 L15 K33 E34 L39 H40 L41P7-V37 HydrophobicContact CB-CG1 4.32Å; P7-V37 HydrophobicContact CG-CG1 4.36Å; L15-V37 HydrophobicContact CD1-CG2 3.49Å; L15-V37 VanDerWaalsContact CD1-CG2 3.49Å; L15-V37 HydrophobicContact CD2-CG2 4.38Å; K33-V37 HydrophobicContact CG-CG2 4.27Å; K33-V37 PolarHBondContact O-N 2.85Å; K33-V37 VanDerWaalsContact O-N 3.08Å; E34-V37 PolarHBondContact O-N 3.2Å; V37-L39 VanDerWaalsContact C-N 3.29Å; V37-L39 PolarHBondContact O-N 2.85Å; V37-H40 PolarHBondContact O-N 2.95Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.29Å; V37-L41 PolarHBondContact O-N 2.7Å
38A90.8Very high84.6Confident60 Ų6070.6 Ų70.650%0.49640%0.398SS..Hα-helixtrans-60.4-40177.800000112E34 R42E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 2.95Å; A38-R42 WeakPolarHBondContact O-CB 3.2Å; A38-R42 PolarHBondContact O-N 3.17Å; A38-R42 VanDerWaalsContact O-N 3.14Å
39L91.4Very high83.2Confident36 Ų3669.2 Ų69.219%0.18840%0.395CS..Hα-helixtrans-68.7-37.7177.6-161.571.3000112.3L19 V24 E25 P27 A35 Y36 V37 R42 H43L19-L39 HydrophobicContact CD1-CB 4.41Å; L19-L39 HydrophobicContact CD1-CD2 4.08Å; L19-L39 HydrophobicContact CD2-CB 4.11Å; L19-L39 HydrophobicContact CD2-CD2 3.92Å; L19-L39 HydrophobicContact CD2-CG 3.9Å; V24-L39 HydrophobicContact CG1-CD1 4.39Å; V24-L39 HydrophobicContact CG1-CD2 3.69Å; V24-L39 HydrophobicContact CG1-CG 3.86Å; E25-L39 VanDerWaalsContact O-CD2 3.27Å; E25-L39 WeakPolarHBondContact O-CD2 3.43Å; P27-L39 HydrophobicContact CG-CD2 3.89Å; A35-L39 WeakPolarHBondContact O-CB 3.26Å; A35-L39 PolarHBondContact O-N 3.2Å; Y36-L39 PolarHBondContact O-N 2.81Å; V37-L39 VanDerWaalsContact C-N 3.29Å; V37-L39 PolarHBondContact O-N 2.85Å; L39-R42 PolarHBondContact O-N 3.34Å; L39-H43 WeakPolarHBondContact CD1-CE1 3.37Å; L39-H43 PolarHBondContact O-N 2.86Å; L39-H43 PolarHBondContact O-ND1 3.41Å
40H90.6Very high82Confident13 Ų1368.1 Ų68.16%0.0639%0.386CS..Hα-helixtrans-65.4-47.5176.9-173.3-72.1000111.5P7 L15 L19 Y36 V37 R42 H43 V44P7-H40 HydrophobicContact CB-CB 4.36Å; L15-H40 HydrophobicContact CD2-CB 4.05Å; L19-H40 HydrophobicContact CD2-CB 4.37Å; Y36-H40 WeakPolarHBondContact O-CB 3.46Å; Y36-H40 PolarHBondContact O-N 3.13Å; V37-H40 PolarHBondContact O-N 2.95Å; H40-R42 PolarHBondContact O-N 3.39Å; H40-H43 PolarHBondContact O-N 2.95Å; H40-V44 WeakPolarHBondContact O-CB 3.45Å; H40-V44 PolarHBondContact O-N 2.73Å
41L89.6Confident80.6Confident84 Ų8470.5 Ų70.544%0.4438%0.38SS..Hα-helixtrans-56.3-39.2174.4-71.3165000111.4P7 V37 D45P7-L41 HydrophobicContact CG-CD2 3.45Å; P7-L41 VanDerWaalsContact CG-CD2 3.45Å; P7-L41 HydrophobicContact CG-CG 3.74Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.29Å; V37-L41 PolarHBondContact O-N 2.7Å; L41-D45 VanDerWaalsContact CD2-OD2 3.29Å; L41-D45 WeakPolarHBondContact CD2-OD2 3.44Å
42R86Confident78.7Confident154 Ų15478.6 Ų78.658%0.58141%0.413SS*.Hα-helixtrans-72.1-38.4-179.2-176.1176.6175.4-167.7-0.6113.5A38 L39 H40 Q46A38-R42 WeakPolarHBondContact O-CB 3.2Å; A38-R42 PolarHBondContact O-N 3.17Å; A38-R42 VanDerWaalsContact O-N 3.14Å; L39-R42 PolarHBondContact O-N 3.34Å; H40-R42 PolarHBondContact O-N 3.39Å; R42-Q46 VanDerWaalsContact O-CB 3.31Å; R42-Q46 WeakPolarHBondContact O-CB 3.44Å; R42-Q46 WeakPolarHBondContact O-CG 3.44Å; R42-Q46 PolarHBondContact O-NE2 3.26Å; R42-Q46 PolarHBondContact O-OE1 3.45Å
43H82.1Confident76.5Confident58 Ų5875.9 Ų75.927%0.26942%0.415SS..Hα-helixtrans-107.7-38.6-170-61.685000113V24 L39 H40 T47V24-H43 HydrophobicContact CG1-CB 4.36Å; V24-H43 HydrophobicContact CG2-CB 3.55Å; L39-H43 WeakPolarHBondContact CD1-CE1 3.37Å; L39-H43 PolarHBondContact O-N 2.86Å; L39-H43 PolarHBondContact O-ND1 3.41Å; H40-H43 PolarHBondContact O-N 2.95Å; H43-T47 VanDerWaalsContact O-CB 3.26Å; H43-T47 WeakPolarHBondContact O-CB 3.49Å; H43-T47 WeakPolarHBondContact O-CG2 3.31Å; H43-T47 PolarHBondContact O-N 3.09Å; H43-T47 VanDerWaalsContact O-N 3.11Å; H43-T47 PolarHBondContact O-OG1 3.25Å
44V79.6Confident74.6Confident5 Ų577.1 Ų77.13%0.0343%0.433CS..Hα-helixtrans-80.3-45.5-176.6-179.40000110.7H22 H40 Q46 T47 N48H22-V44 HydrophobicContact CB-CG2 4.14Å; H40-V44 WeakPolarHBondContact O-CB 3.45Å; H40-V44 PolarHBondContact O-N 2.73Å; V44-Q46 PolarHBondContact O-N 3.19Å; V44-T47 WeakPolarHBondContact CA-OG1 3.27Å; V44-T47 PolarHBondContact O-N 3.14Å; V44-T47 PolarHBondContact O-OG1 2.98Å; V44-T47 VanDerWaalsContact O-OG1 3.04Å; V44-N48 VanDerWaalsContact O-CB 3.31Å; V44-N48 WeakPolarHBondContact O-CB 3.4Å; V44-N48 PolarHBondContact O-N 2.88Å; V44-N48 PolarHBondContact O-ND2 3.2Å
45D69.6Low72.7Confident67 Ų6777.2 Ų77.236%0.35844%0.439SS..Hα-helixtrans-72.6-32.4-179.4-59.9-25.2000112L41 A49L41-D45 VanDerWaalsContact CD2-OD2 3.29Å; L41-D45 WeakPolarHBondContact CD2-OD2 3.44Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 2.62Å
46Q66.9Low70.6Confident122 Ų12282.1 Ų82.157%0.5746%0.459SS*.Hα-helixtrans-69.3-41.5172.7-68-179.112.800112.2R42 V44 A49 A50R42-Q46 VanDerWaalsContact O-CB 3.31Å; R42-Q46 WeakPolarHBondContact O-CB 3.44Å; R42-Q46 WeakPolarHBondContact O-CG 3.44Å; R42-Q46 PolarHBondContact O-NE2 3.26Å; R42-Q46 PolarHBondContact O-OE1 3.45Å; V44-Q46 PolarHBondContact O-N 3.19Å; Q46-A49 PolarHBondContact O-N 3.15Å; Q46-A50 WeakPolarHBondContact O-CB 3.45Å; Q46-A50 PolarHBondContact O-N 3.38Å
47T62.6Low68.3Low52 Ų5288.4 Ų88.432%0.31949%0.493SS..Hα-helixtrans-69.8-33.2176.153.40000112H43 V44 A50 N51H43-T47 VanDerWaalsContact O-CB 3.26Å; H43-T47 WeakPolarHBondContact O-CB 3.49Å; H43-T47 WeakPolarHBondContact O-CG2 3.31Å; H43-T47 PolarHBondContact O-N 3.09Å; H43-T47 VanDerWaalsContact O-N 3.11Å; H43-T47 PolarHBondContact O-OG1 3.25Å; V44-T47 WeakPolarHBondContact CA-OG1 3.27Å; V44-T47 PolarHBondContact O-N 3.14Å; V44-T47 PolarHBondContact O-OG1 2.98Å; V44-T47 VanDerWaalsContact O-OG1 3.04Å; T47-A50 PolarHBondContact O-N 3.4Å; T47-N51 VanDerWaalsContact O-CB 3.29Å; T47-N51 WeakPolarHBondContact O-CB 3.39Å; T47-N51 PolarHBondContact O-N 3.43Å; T47-N51 PolarHBondContact O-ND2 3.14Å
48N65.1Low66.2Low88 Ų8894.3 Ų94.347%0.47152%0.524SS..Hα-helixtrans-70.2-34.3173.8-69.6-21.5000112.4V44V44-N48 VanDerWaalsContact O-CB 3.31Å; V44-N48 WeakPolarHBondContact O-CB 3.4Å; V44-N48 PolarHBondContact O-N 2.88Å; V44-N48 PolarHBondContact O-ND2 3.2Å
49A59.5Low63.9Low77 Ų77100 Ų10064%0.63654%0.54SS*.Hα-helixtrans-74.1-34173.300000112.8D45 Q46D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 2.62Å; Q46-A49 PolarHBondContact O-N 3.15Å
50A56.1Low61.7Low65 Ų65106.5 Ų106.554%0.53757%0.569SS.*Hα-helixtrans-84-23-177.600000114.2Q46 T47 F52 S53Q46-A50 WeakPolarHBondContact O-CB 3.45Å; Q46-A50 PolarHBondContact O-N 3.38Å; T47-A50 PolarHBondContact O-N 3.4Å; A50-F52 PolarHBondContact O-N 3.21Å; A50-S53 PolarHBondContact O-N 2.83Å
51N55.3Low59.3Low126 Ų126113.3 Ų113.367%0.67461%0.607SS**THydrogen-bonded Turntrans-78.411.5178.4-81.8-55000114.5T47T47-N51 VanDerWaalsContact O-CB 3.29Å; T47-N51 WeakPolarHBondContact O-CB 3.39Å; T47-N51 PolarHBondContact O-N 3.43Å; T47-N51 PolarHBondContact O-ND2 3.14Å
52F48.3Very low57.6Low192 Ų192115.3 Ų115.384%0.84262%0.622SS**THydrogen-bonded Turntrans-133.620.1170.1-82.1-80.5000113.2A50 S54A50-F52 PolarHBondContact O-N 3.21Å; F52-S54 VanDerWaalsContact C-N 3.3Å; F52-S54 PolarHBondContact O-N 2.87Å
53S48.9Very low55.4Low104 Ų104114.9 Ų114.973%0.72764%0.636SS**  trans-88.878.5162-169.70000108A50 D55A50-S53 PolarHBondContact O-N 2.83Å; S53-D55 PolarHBondContact O-N 3.04Å
54S52.1Low53.6Low108 Ų108116.5 Ų116.576%0.75566%0.66SS**  trans-65.3113.1172.1-160.90000108.7F52F52-S54 VanDerWaalsContact C-N 3.3Å; F52-S54 PolarHBondContact O-N 2.87Å
55D53.2Low51.8Low148 Ų148120.3 Ų120.379%0.79170%0.7SS**  trans-76.9101.7166.6-177.252.5000107.6S53S53-D55 PolarHBondContact O-N 3.04Å
56D47.8Very low50Low145 Ų145120.9 Ų120.978%0.77572%0.722SS**  trans-155.6126.2159.9-105.1-60.7000107
57D46Very low48.7Very low132 Ų132122.6 Ų122.671%0.70674%0.735SS**  trans-60.9143.3-158.6-61.1-96.1000117.5
58D49.8Very low48.3Very low145 Ų145125.6 Ų125.678%0.77576%0.755SS**  trans26.2106.3133.6-55.2-36.2000119.5
59Q42.2Very low47Very low180 Ų180130.4 Ų130.484%0.84178%0.775SS**  -144.894.5129.1-167.7121.263.900108.9D61Q59-D61 PolarHBondContact O-N 2.94Å
60E44.6Very low46.1Very low171 Ų171131.4 Ų131.480%0.79978%0.777SS**  trans-56.9116.3156.346.7-175.3-179.100109.3
61D39.4Very low45.9Very low157 Ų157133.4 Ų133.484%0.8479%0.794SS**  trans-133.4130.1149.7-116.9-26.2000109.5Q59Q59-D61 PolarHBondContact O-N 2.94Å
62V54Low45.6Very low126 Ų126135.4 Ų135.476%0.76480%0.799SS**  trans-93.2103.6-158.8-175.80000108.3
63V40.2Very low46.1Very low144 Ų144135.5 Ų135.587%0.87380%0.802SS**  trans-145.9134.4157.2-169.80000112.1
64A43.5Very low46.8Very low93 Ų93135.4 Ų135.477%0.76979%0.793SS**  trans-57151.8-176.800000116.2
65G42.3Very low47.6Very low85 Ų85134.7 Ų134.788%0.87678%0.781SS**  trans37.8119.8136.500000120.1
66G32.4Very low48.4Very low79 Ų79128.1 Ų128.181%0.81475%0.746SS**  trans-177.899.7159.700000111.6
67D39.8Very low49.7Very low158 Ų158123.7 Ų123.785%0.84573%0.726SS**  trans-67.9166.5160.1-125.1-7.9000109.4E69D67-E69 PolarHBondContact O-N 3.31Å
68P53Low51.4Low115 Ų115121.6 Ų121.675%0.74773%0.727SS**  trans-82115.5-145.332.2-38000114.5
69E38.9Very low53Low188 Ų188115.6 Ų115.688%0.87970%0.695SS**  trans-101.6109.2161.5-66.4-168.7156.800107.7D67D67-E69 PolarHBondContact O-N 3.31Å
70S39.9Very low55.4Low99 Ų99110.3 Ų110.369%0.69268%0.675SS**  64.691.691-1800000112E72S70-E72 PolarHBondContact O-N 3.42Å
71A51.5Low57.8Low107 Ų107104.7 Ų104.788%0.88465%0.651SS**  trans43.743.3146.600000118.5
72E50.4Low60.3Low167 Ų167103.2 Ų103.278%0.7864%0.643SS**  trans-89.3132163.7-76.8-156.3154.500111.3S70 L74S70-E72 PolarHBondContact O-N 3.42Å; E72-L74 PolarHBondContact O-N 3.19Å
73E58.8Low62.1Low194 Ų194100.8 Ų100.891%0.90763%0.626SS**  trans-60.873.9177.4-163.7-176.8178.700110.9D75E73-D75 PolarHBondContact O-N 2.94Å
74L63Low64.6Low102 Ų10294 Ų9453%0.53458%0.584SS.*  trans-68.8112.6176.6-72.4159.8000109E72 P76E72-L74 PolarHBondContact O-N 3.19Å; L74-P76 VanDerWaalsContact O-CD 3.24Å; L74-P76 WeakPolarHBondContact O-CD 3.37Å
75D68.3Low67Low94 Ų9493.8 Ų93.850%0.50357%0.566SS.*  trans-54.7116.5171.3175.614.8000108.4E73 S77 A78 R111E73-D75 PolarHBondContact O-N 2.94Å; D75-S77 PolarHBondContact O-N 3.06Å; D75-S77 PolarHBondContact OD1-N 3.11Å; D75-S77 PolarHBondContact OD1-OG 3.02Å; D75-S77 VanDerWaalsContact OD1-OG 3.13Å; D75-A78 PolarHBondContact O-N 3.44Å; D75-R111 IonicContact OD1-NH2 3.94Å; D75-R111 PolarHBondContact OD1-NH2 3.24Å
76P70.1Confident69.4Low10 Ų1092.6 Ų92.67%0.06555%0.548CS..THydrogen-bonded Turntrans-65.2-11.4-170.817.5-25.2000113.5L74 E107 L110 R111L74-P76 VanDerWaalsContact O-CD 3.24Å; L74-P76 WeakPolarHBondContact O-CD 3.37Å; P76-E107 HydrophobicContact CB-CB 4.2Å; P76-E107 HydrophobicContact CB-CG 4.48Å; P76-E107 WeakPolarHBondContact O-CG 3.04Å; P76-L110 HydrophobicContact CB-CD2 4.31Å; P76-R111 HydrophobicContact CB-CG 4.47Å; P76-R111 HydrophobicContact CG-CG 3.32Å
77S76.2Confident72.3Confident52 Ų5290.6 Ų90.636%0.36452%0.519SS..THydrogen-bonded Turntrans-76.1-29.2175.5-37.50000113.4D75 L79 R103 R111D75-S77 PolarHBondContact O-N 3.06Å; D75-S77 PolarHBondContact OD1-N 3.11Å; D75-S77 PolarHBondContact OD1-OG 3.02Å; D75-S77 VanDerWaalsContact OD1-OG 3.13Å; S77-L79 VanDerWaalsContact C-N 3.28Å; S77-R103 PolarHBondContact O-NH2 3.11Å; S77-R111 PolarHBondContact OG-NH2 3.32Å
78A81.5Confident74.9Confident88 Ų8883.1 Ų83.173%0.72748%0.478SS*.THydrogen-bonded Turntrans-80.8-12.1-178.100000113D75D75-A78 PolarHBondContact O-N 3.44Å
79L83.8Confident76.8Confident19 Ų1984 Ų8410%0.09947%0.471CS..SBendtrans-78.3142.4-172-165.261.5000112.1S77 D83 L84 L87 R103 L110S77-L79 VanDerWaalsContact C-N 3.28Å; L79-D83 HydrophobicContact CD1-CB 3.28Å; L79-D83 HydrophobicContact CD2-CB 4.33Å; L79-D83 HydrophobicContact CG-CB 3.62Å; L79-L84 HydrophobicContact CD2-CB 3.84Å; L79-L84 HydrophobicContact CD2-CD1 4.08Å; L79-L84 HydrophobicContact CG-CB 4.22Å; L79-L87 HydrophobicContact CD1-CD1 3.98Å; L79-L87 HydrophobicContact CD2-CD1 3.32Å; L79-L87 HydrophobicContact CG-CD1 4.27Å; L79-R103 PolarHBondContact O-NH2 3.16Å; L79-L110 HydrophobicContact CD2-CD2 4.12Å
80T91.4Very high79.4Confident69 Ų6983 Ų8342%0.42346%0.463SS..  trans-72.4159.2174.678.70000111.1N82 D83 L84T80-N82 PolarHBondContact O-N 3.41Å; T80-D83 PolarHBondContact O-N 3.02Å; T80-D83 VanDerWaalsContact O-N 3.14Å; T80-D83 PolarHBondContact OG1-N 3.4Å; T80-D83 PolarHBondContact OG1-OD2 2.82Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 PolarHBondContact O-N 3.22Å
81D94.4Very high82Confident52 Ų5282.4 Ų82.428%0.27845%0.447SS..Hα-helixtrans-59.5-33.1-178.2-71-7.8000112.5K85 I98 R103D81-K85 WeakPolarHBondContact O-CB 3.11Å; D81-K85 PolarHBondContact O-N 3.48Å; D81-I98 HydrophobicContact CB-CB 4.12Å; D81-I98 HydrophobicContact CB-CG2 4.15Å; D81-I98 WeakPolarHBondContact O-CD1 3.31Å; D81-R103 VanDerWaalsContact OD1-CD 3.23Å; D81-R103 WeakPolarHBondContact OD1-CD 3.45Å; D81-R103 IonicContact OD1-CZ 2.84Å; D81-R103 IonicContact OD1-NE 3.12Å; D81-R103 IonicContact OD1-NH1 3.01Å; D81-R103 PolarHBondContact OD1-NH1 3Å
82N92.1Very high84Confident126 Ų12680.2 Ų80.267%0.67444%0.435SS*.Hα-helixtrans-73.1-42.6177.1-69-49.9000111.5T80 K85 A86T80-N82 PolarHBondContact O-N 3.41Å; N82-K85 WeakPolarHBondContact O-CB 3.49Å; N82-K85 PolarHBondContact O-N 3.38Å; N82-A86 PolarHBondContact O-N 3.34Å
83D92.3Very high86Confident76 Ų7673.1 Ų73.141%0.40640%0.403SS..Hα-helixtrans-69.5-37.8179.8-55.1-32.3000110.9L79 T80 K85 A86 L87L79-D83 HydrophobicContact CD1-CB 3.28Å; L79-D83 HydrophobicContact CD2-CB 4.33Å; L79-D83 HydrophobicContact CG-CB 3.62Å; T80-D83 PolarHBondContact O-N 3.02Å; T80-D83 VanDerWaalsContact O-N 3.14Å; T80-D83 PolarHBondContact OG1-N 3.4Å; T80-D83 PolarHBondContact OG1-OD2 2.82Å; D83-K85 VanDerWaalsContact C-N 3.29Å; D83-K85 PolarHBondContact O-N 3.04Å; D83-A86 PolarHBondContact O-N 3.2Å; D83-A86 VanDerWaalsContact O-N 3.17Å; D83-L87 WeakPolarHBondContact O-CB 3.31Å; D83-L87 PolarHBondContact O-N 3.11Å
84L93.3Very high87.6Confident0 Ų072.5 Ų72.50%040%0.397CS..Hα-helixtrans-59.2-42.1172.9-179.662.6000111.2L79 T80 L88 I98 R103 E107 L110L79-L84 HydrophobicContact CD2-CB 3.84Å; L79-L84 HydrophobicContact CD2-CD1 4.08Å; L79-L84 HydrophobicContact CG-CB 4.22Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 PolarHBondContact O-N 3.22Å; L84-L88 HydrophobicContact CD1-CD1 4.35Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.45Å; L84-L88 PolarHBondContact O-N 2.87Å; L84-I98 HydrophobicContact CB-CD1 4.09Å; L84-I98 HydrophobicContact CD2-CD1 3.89Å; L84-I98 HydrophobicContact CD2-CG2 4.49Å; L84-I98 HydrophobicContact CG-CD1 3.89Å; L84-R103 HydrophobicContact CD2-CG 4.06Å; L84-E107 HydrophobicContact CD1-CG 4.24Å; L84-E107 HydrophobicContact CD2-CG 3.71Å; L84-L110 HydrophobicContact CD1-CB 4.2Å; L84-L110 HydrophobicContact CD1-CD2 3.72Å
85K93.6Very high88.9Confident89 Ų8968.3 Ų68.339%0.38738%0.377SS..Hα-helixtrans-66.9-41.4175-175-179.5177.5-173.20112.1D81 N82 D83 F89 A95 I98D81-K85 WeakPolarHBondContact O-CB 3.11Å; D81-K85 PolarHBondContact O-N 3.48Å; N82-K85 WeakPolarHBondContact O-CB 3.49Å; N82-K85 PolarHBondContact O-N 3.38Å; D83-K85 VanDerWaalsContact C-N 3.29Å; D83-K85 PolarHBondContact O-N 3.04Å; K85-F89 WeakPolarHBondContact O-CB 3.26Å; K85-F89 PolarHBondContact O-N 3.14Å; K85-A95 WeakPolarHBondContact CE-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.39Å; K85-I98 HydrophobicContact CB-CD1 3.83Å; K85-I98 HydrophobicContact CB-CG1 4.32Å
86A93.1Very high89.9Confident60 Ų6065.3 Ų65.350%0.49637%0.368SS..Hα-helixtrans-65.3-44.4179.400000111.8N82 D83 F89 K90N82-A86 PolarHBondContact O-N 3.34Å; D83-A86 PolarHBondContact O-N 3.2Å; D83-A86 VanDerWaalsContact O-N 3.17Å; A86-F89 WeakPolarHBondContact O-CB 3.37Å; A86-F89 PolarHBondContact O-N 2.88Å; A86-K90 PolarHBondContact O-N 3.17Å
87L93.2Very high91Very high38 Ų3869.9 Ų69.920%0.19940%0.398CS..Hα-helixtrans-62.3-48.5174.9-87.1152.6000111.3L79 D83 F89 K90 Y91 L110L79-L87 HydrophobicContact CD1-CD1 3.98Å; L79-L87 HydrophobicContact CD2-CD1 3.32Å; L79-L87 HydrophobicContact CG-CD1 4.27Å; D83-L87 WeakPolarHBondContact O-CB 3.31Å; D83-L87 PolarHBondContact O-N 3.11Å; L87-F89 PolarHBondContact O-N 3.18Å; L87-K90 WeakPolarHBondContact O-CA 3.33Å; L87-K90 VanDerWaalsContact O-CB 3.27Å; L87-K90 WeakPolarHBondContact O-CB 3.34Å; L87-K90 PolarHBondContact O-N 2.91Å; L87-Y91 HydrophobicContact CD2-CE2 4.21Å; L87-Y91 WeakPolarHBondContact O-CD2 3.37Å; L87-Y91 PolarHBondContact O-N 3.4Å; L87-Y91 VanDerWaalsContact O-N 3.14Å; L87-L110 HydrophobicContact CB-CD1 4.15Å; L87-L110 HydrophobicContact CB-CD2 3.94Å; L87-L110 HydrophobicContact CD1-CD2 4.38Å
88L93.9Very high91.9Very high0 Ų068.5 Ų68.50%039%0.386CS..Hα-helixtrans-57.2-40.2174.5-77.2167.9000112.4L84 K90 Y91 G92 V93 A95 Y106 K109 L110 L113L84-L88 HydrophobicContact CD1-CD1 4.35Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.45Å; L84-L88 PolarHBondContact O-N 2.87Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.27Å; L88-Y91 CarbonylContact O-C 3.25Å; L88-Y91 PolarHBondContact O-N 2.87Å; L88-G92 PolarHBondContact O-N 3.03Å; L88-V93 CarbonylContact C-O 3.54Å; L88-V93 VanDerWaalsContact C-O 3.25Å; L88-V93 HydrophobicContact CB-CB 4.17Å; L88-V93 HydrophobicContact CB-CG1 4.38Å; L88-V93 HydrophobicContact CD2-CB 4.17Å; L88-V93 HydrophobicContact CD2-CG1 4.17Å; L88-V93 WeakPolarHBondContact O-CA 3.35Å; L88-V93 WeakPolarHBondContact O-CB 3.5Å; L88-V93 PolarHBondContact O-N 2.93Å; L88-A95 HydrophobicContact CD1-CB 4.2Å; L88-Y106 HydrophobicContact CD1-CD1 3.54Å; L88-Y106 HydrophobicContact CD1-CG 3.86Å; L88-K109 HydrophobicContact CD2-CB 4.31Å; L88-K109 HydrophobicContact CD2-CG 4.26Å; L88-L110 HydrophobicContact CD2-CB 4.04Å; L88-L110 HydrophobicContact CD2-CD1 4.41Å; L88-L110 HydrophobicContact CG-CB 4.44Å; L88-L113 HydrophobicContact CD2-CD1 3.95Å
89F94Very high92.5Very high135 Ų13569.4 Ų69.459%0.59238%0.378SS*.Hα-helixtrans-64.5-37.6176.2-171.3-95.2000112.3K85 A86 L87 Y91 G92 V93 K94K85-F89 WeakPolarHBondContact O-CB 3.26Å; K85-F89 PolarHBondContact O-N 3.14Å; A86-F89 WeakPolarHBondContact O-CB 3.37Å; A86-F89 PolarHBondContact O-N 2.88Å; L87-F89 PolarHBondContact O-N 3.18Å; F89-Y91 VanDerWaalsContact C-N 3.3Å; F89-Y91 PolarHBondContact O-N 3.25Å; F89-G92 WeakPolarHBondContact O-CA 3.27Å; F89-G92 PolarHBondContact O-N 3.01Å; F89-V93 WeakPolarHBondContact CA-O 3.36Å; F89-V93 PolarHBondContact N-O 2.79Å; F89-K94 HydrophobicContact CD2-CG 4.42Å; F89-K94 HydrophobicContact CE2-CG 4.34Å
90K93.6Very high92.9Very high165 Ų16573 Ų7372%0.71741%0.411SS*.Hα-helixtrans-59.3-39.6174.3-171.1-177.4178.2-1750111.9A86 L87 L88 G92A86-K90 PolarHBondContact O-N 3.17Å; L87-K90 WeakPolarHBondContact O-CA 3.33Å; L87-K90 VanDerWaalsContact O-CB 3.27Å; L87-K90 WeakPolarHBondContact O-CB 3.34Å; L87-K90 PolarHBondContact O-N 2.91Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.27Å; K90-G92 PolarHBondContact O-N 2.84Å
91Y92.9Very high92.9Very high88 Ų8874.5 Ų74.535%0.34542%0.424SS..THydrogen-bonded Turntrans-83.314.9173.8-64.9-80.4000113.5L87 L88 F89 V93 L110 L113 L114L87-Y91 HydrophobicContact CD2-CE2 4.21Å; L87-Y91 WeakPolarHBondContact O-CD2 3.37Å; L87-Y91 PolarHBondContact O-N 3.4Å; L87-Y91 VanDerWaalsContact O-N 3.14Å; L88-Y91 CarbonylContact O-C 3.25Å; L88-Y91 PolarHBondContact O-N 2.87Å; F89-Y91 VanDerWaalsContact C-N 3.3Å; F89-Y91 PolarHBondContact O-N 3.25Å; Y91-V93 VanDerWaalsContact C-N 3.31Å; Y91-V93 PolarHBondContact O-N 2.91Å; Y91-L110 HydrophobicContact CD2-CD1 3.75Å; Y91-L110 HydrophobicContact CE2-CD1 3.9Å; Y91-L113 HydrophobicContact CD1-CB 4.39Å; Y91-L113 HydrophobicContact CG-CB 4.25Å; Y91-L113 HydrophobicContact CG-CD1 4.34Å; Y91-L114 HydrophobicContact CE1-CD2 4.4Å; Y91-L114 HydrophobicContact CE2-CD2 4.06Å; Y91-L114 WeakPolarHBondContact OH-CD2 3.15Å
92G93.4Very high92.9Very high61 Ų6174 Ų7463%0.62942%0.423SS*.THydrogen-bonded Turntrans79.95.7175.200000115.2L88 F89 K90L88-G92 PolarHBondContact O-N 3.03Å; F89-G92 WeakPolarHBondContact O-CA 3.27Å; F89-G92 PolarHBondContact O-N 3.01Å; K90-G92 PolarHBondContact O-N 2.84Å
93V93.4Very high93Very high18 Ų1871.2 Ų71.211%0.10940%0.403CS..  trans-91.4110.5178.1177.20000110.8L88 F89 Y91 A95 K109 L113L88-V93 CarbonylContact C-O 3.54Å; L88-V93 VanDerWaalsContact C-O 3.25Å; L88-V93 HydrophobicContact CB-CB 4.17Å; L88-V93 HydrophobicContact CB-CG1 4.38Å; L88-V93 HydrophobicContact CD2-CB 4.17Å; L88-V93 HydrophobicContact CD2-CG1 4.17Å; L88-V93 WeakPolarHBondContact O-CA 3.35Å; L88-V93 WeakPolarHBondContact O-CB 3.5Å; L88-V93 PolarHBondContact O-N 2.93Å; F89-V93 WeakPolarHBondContact CA-O 3.36Å; F89-V93 PolarHBondContact N-O 2.79Å; Y91-V93 VanDerWaalsContact C-N 3.31Å; Y91-V93 PolarHBondContact O-N 2.91Å; V93-A95 PolarHBondContact O-N 3.48Å; V93-A95 VanDerWaalsContact O-N 3.14Å; V93-K109 HydrophobicContact CG1-CD 3.91Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG2-CD1 3.62Å
94K92.4Very high93.1Very high180 Ų18070.1 Ų70.178%0.78341%0.405SS*.  trans-79.196.5174.1-63177.3-175.7175.40110.3F89F89-K94 HydrophobicContact CD2-CG 4.42Å; F89-K94 HydrophobicContact CE2-CG 4.34Å
95A90.2Very high93.1Very high15 Ų1574.8 Ų74.812%0.12443%0.433CS..  trans-87.1143.4172.400000111.5K85 L88 V93 Y106K85-A95 WeakPolarHBondContact CE-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.39Å; L88-A95 HydrophobicContact CD1-CB 4.2Å; V93-A95 PolarHBondContact O-N 3.48Å; V93-A95 VanDerWaalsContact O-N 3.14Å; A95-Y106 HydrophobicContact CB-CD1 3.9Å; A95-Y106 HydrophobicContact CB-CE1 3.46Å; A95-Y106 VanDerWaalsContact CB-CE1 3.46Å; A95-Y106 HydrophobicContact CB-CE2 4.31Å
96G89.8Confident93.2Very high31 Ų3172.9 Ų72.932%0.3242%0.424SS..  trans-74.9-160.6173.300000112.1I98G96-I98 PolarHBondContact O-N 2.85Å
97P92.8Very high93.3Very high106 Ų10671.1 Ų71.169%0.68841%0.405SS*.  trans-57.9123.2166.9-18.131.2000109.3L99P97-L99 PolarHBondContact O-N 3.2Å
98I94.9Very high93.3Very high22 Ų2273.2 Ų73.211%0.11342%0.417CS..  trans-81.7119.4176.1-57.1-165.3000107.1D81 L84 K85 G96 R103 Y106D81-I98 HydrophobicContact CB-CB 4.12Å; D81-I98 HydrophobicContact CB-CG2 4.15Å; D81-I98 WeakPolarHBondContact O-CD1 3.31Å; L84-I98 HydrophobicContact CB-CD1 4.09Å; L84-I98 HydrophobicContact CD2-CD1 3.89Å; L84-I98 HydrophobicContact CD2-CG2 4.49Å; L84-I98 HydrophobicContact CG-CD1 3.89Å; K85-I98 HydrophobicContact CB-CD1 3.83Å; K85-I98 HydrophobicContact CB-CG1 4.32Å; G96-I98 PolarHBondContact O-N 2.85Å; I98-R103 HydrophobicContact CG2-CB 3.98Å; I98-R103 HydrophobicContact CG2-CG 4.19Å; I98-Y106 HydrophobicContact CD1-CD2 4.14Å; I98-Y106 HydrophobicContact CD1-CG 4.34Å; I98-Y106 HydrophobicContact CG1-CD2 4.05Å; I98-Y106 HydrophobicContact CG1-CE2 4.34Å; I98-Y106 HydrophobicContact CG2-CD2 4.42Å
99L94.5Very high93.3Very high107 Ų10777.6 Ų77.656%0.5644%0.435SS*.  trans-110.7156.8174.7-66.8142.3000108.3P97 S101 T102 R103P97-L99 PolarHBondContact O-N 3.2Å; L99-S101 PolarHBondContact O-N 3.41Å; L99-T102 PolarHBondContact N-OG1 3.03Å; L99-T102 CarbonylContact O-C 3.52Å; L99-T102 WeakPolarHBondContact O-CA 3.42Å; L99-T102 PolarHBondContact O-N 3.35Å; L99-T102 PolarHBondContact O-OG1 3.37Å; L99-R103 PolarHBondContact O-N 3.36Å
100A91.1Very high93.3Very high95 Ų9571.3 Ų71.379%0.78541%0.408SS*.Hα-helixtrans-50.2-37.6178.600000113.7T102A100-T102 VanDerWaalsContact C-N 3.29Å; A100-T102 PolarHBondContact O-N 3.02Å
101S92.6Very high93.2Very high101 Ų10167 Ų6771%0.70639%0.387SS*.Hα-helixtrans-69.6-24.3177.457.40000114.2L99L99-S101 PolarHBondContact O-N 3.41Å
102T93.3Very high93.2Very high41 Ų4169.8 Ų69.825%0.25240%0.401SS..Hα-helixtrans-104.1-15.9-177.859.80000113.2L99 A100 A104 V105 Y106L99-T102 PolarHBondContact N-OG1 3.03Å; L99-T102 CarbonylContact O-C 3.52Å; L99-T102 WeakPolarHBondContact O-CA 3.42Å; L99-T102 PolarHBondContact O-N 3.35Å; L99-T102 PolarHBondContact O-OG1 3.37Å; A100-T102 VanDerWaalsContact C-N 3.29Å; A100-T102 PolarHBondContact O-N 3.02Å; T102-A104 PolarHBondContact O-N 2.76Å; T102-V105 WeakPolarHBondContact O-CB 3.36Å; T102-V105 PolarHBondContact O-N 3.06Å; T102-V105 VanDerWaalsContact O-N 3.09Å; T102-Y106 VanDerWaalsContact O-CD2 3.29Å; T102-Y106 WeakPolarHBondContact O-CD2 3.4Å; T102-Y106 PolarHBondContact O-N 3.17Å
103R94.5Very high93.1Very high68 Ų6868.8 Ų68.826%0.25738%0.381SS..Hα-helixtrans-55.5-51.9-175.9-172.4-175167.5137.8-10111.8S77 L79 D81 L84 I98 L99 V105 Y106 E107S77-R103 PolarHBondContact O-NH2 3.11Å; L79-R103 PolarHBondContact O-NH2 3.16Å; D81-R103 VanDerWaalsContact OD1-CD 3.23Å; D81-R103 WeakPolarHBondContact OD1-CD 3.45Å; D81-R103 IonicContact OD1-CZ 2.84Å; D81-R103 IonicContact OD1-NE 3.12Å; D81-R103 IonicContact OD1-NH1 3.01Å; D81-R103 PolarHBondContact OD1-NH1 3Å; L84-R103 HydrophobicContact CD2-CG 4.06Å; I98-R103 HydrophobicContact CG2-CB 3.98Å; I98-R103 HydrophobicContact CG2-CG 4.19Å; L99-R103 PolarHBondContact O-N 3.36Å; R103-V105 PolarHBondContact O-N 2.84Å; R103-V105 VanDerWaalsContact O-N 3.15Å; R103-Y106 WeakPolarHBondContact O-CA 3.37Å; R103-Y106 PolarHBondContact O-N 2.95Å; R103-E107 WeakPolarHBondContact CD-OE1 3.4Å; R103-E107 HydrophobicContact CG-CG 4.32Å; R103-E107 VanDerWaalsContact CG-OE1 3.32Å; R103-E107 WeakPolarHBondContact CG-OE1 3.3Å; R103-E107 IonicContact CZ-OE1 3.93Å; R103-E107 IonicContact NE-OE1 3.83Å; R103-E107 PolarHBondContact NE-OE1 3Å; R103-E107 IonicContact NH2-OE1 2.71Å; R103-E107 WeakPolarHBondContact O-CG 3.18Å; R103-E107 PolarHBondContact O-N 3.27Å
104A93.9Very high92.8Very high53 Ų5370.5 Ų70.544%0.43839%0.389SS..Hα-helixtrans-59.4-30.4178.500000114T102 N108T102-A104 PolarHBondContact O-N 2.76Å; A104-N108 WeakPolarHBondContact O-CB 3.39Å; A104-N108 PolarHBondContact O-N 2.89Å; A104-N108 VanDerWaalsContact O-N 3.14Å; A104-N108 PolarHBondContact O-ND2 3.34Å
105V94.8Very high92.6Very high97 Ų9767.3 Ų67.359%0.58838%0.377SS*.Hα-helixtrans-69.3-40.8176.2-179.40000110.3T102 R103 K109T102-V105 WeakPolarHBondContact O-CB 3.36Å; T102-V105 PolarHBondContact O-N 3.06Å; T102-V105 VanDerWaalsContact O-N 3.09Å; R103-V105 PolarHBondContact O-N 2.84Å; R103-V105 VanDerWaalsContact O-N 3.15Å; V105-K109 WeakPolarHBondContact O-CB 3.44Å; V105-K109 PolarHBondContact O-N 3.3Å
106Y94.9Very high92.1Very high50 Ų5069.9 Ų69.920%0.19639%0.394CS..Hα-helixtrans-74.6-37.9179.6-77.1-54.9000112.8L88 A95 I98 T102 R103 K109 L110L88-Y106 HydrophobicContact CD1-CD1 3.54Å; L88-Y106 HydrophobicContact CD1-CG 3.86Å; A95-Y106 HydrophobicContact CB-CD1 3.9Å; A95-Y106 HydrophobicContact CB-CE1 3.46Å; A95-Y106 VanDerWaalsContact CB-CE1 3.46Å; A95-Y106 HydrophobicContact CB-CE2 4.31Å; I98-Y106 HydrophobicContact CD1-CD2 4.14Å; I98-Y106 HydrophobicContact CD1-CG 4.34Å; I98-Y106 HydrophobicContact CG1-CD2 4.05Å; I98-Y106 HydrophobicContact CG1-CE2 4.34Å; I98-Y106 HydrophobicContact CG2-CD2 4.42Å; T102-Y106 VanDerWaalsContact O-CD2 3.29Å; T102-Y106 WeakPolarHBondContact O-CD2 3.4Å; T102-Y106 PolarHBondContact O-N 3.17Å; R103-Y106 WeakPolarHBondContact O-CA 3.37Å; R103-Y106 PolarHBondContact O-N 2.95Å; Y106-K109 WeakPolarHBondContact O-CB 3.39Å; Y106-K109 PolarHBondContact O-N 3.02Å; Y106-L110 PolarHBondContact O-N 2.89Å
107E94.4Very high91.2Very high23 Ų2370.6 Ų70.611%0.10740%0.397CS..Hα-helixtrans-58.9-49.7171.5-68.1173.6179.800111.1P76 L84 R103 K109 L110 R111P76-E107 HydrophobicContact CB-CB 4.2Å; P76-E107 HydrophobicContact CB-CG 4.48Å; P76-E107 WeakPolarHBondContact O-CG 3.04Å; L84-E107 HydrophobicContact CD1-CG 4.24Å; L84-E107 HydrophobicContact CD2-CG 3.71Å; R103-E107 WeakPolarHBondContact CD-OE1 3.4Å; R103-E107 HydrophobicContact CG-CG 4.32Å; R103-E107 VanDerWaalsContact CG-OE1 3.32Å; R103-E107 WeakPolarHBondContact CG-OE1 3.3Å; R103-E107 IonicContact CZ-OE1 3.93Å; R103-E107 IonicContact NE-OE1 3.83Å; R103-E107 PolarHBondContact NE-OE1 3Å; R103-E107 IonicContact NH2-OE1 2.71Å; R103-E107 WeakPolarHBondContact O-CG 3.18Å; R103-E107 PolarHBondContact O-N 3.27Å; E107-K109 VanDerWaalsContact C-N 3.26Å; E107-K109 PolarHBondContact O-N 3.33Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.14Å; E107-R111 WeakPolarHBondContact O-CG 3.18Å; E107-R111 PolarHBondContact O-N 3.14Å
108N93.5Very high89.6Confident82 Ų8272.3 Ų72.344%0.43940%0.396SS..Hα-helixtrans-63.8-32.5176.1-77.5-19.2000112.7A104 R111 K112A104-N108 WeakPolarHBondContact O-CB 3.39Å; A104-N108 PolarHBondContact O-N 2.89Å; A104-N108 VanDerWaalsContact O-N 3.14Å; A104-N108 PolarHBondContact O-ND2 3.34Å; N108-R111 PolarHBondContact OD1-NH1 2.94Å; N108-K112 WeakPolarHBondContact O-CG 3.41Å; N108-K112 PolarHBondContact O-N 2.67Å
109K94.3Very high87.3Confident91 Ų9178.1 Ų78.140%0.39642%0.423SS..Hα-helixtrans-68.1-39.7174.7-168.7170.4-175.5-178.30111.2L88 V93 V105 Y106 E107 K112 L113L88-K109 HydrophobicContact CD2-CB 4.31Å; L88-K109 HydrophobicContact CD2-CG 4.26Å; V93-K109 HydrophobicContact CG1-CD 3.91Å; V105-K109 WeakPolarHBondContact O-CB 3.44Å; V105-K109 PolarHBondContact O-N 3.3Å; Y106-K109 WeakPolarHBondContact O-CB 3.39Å; Y106-K109 PolarHBondContact O-N 3.02Å; E107-K109 VanDerWaalsContact C-N 3.26Å; E107-K109 PolarHBondContact O-N 3.33Å; K109-K112 PolarHBondContact O-N 3.17Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 2.8Å; K109-L113 VanDerWaalsContact O-N 3.17Å
110L93.5Very high85.1Confident4 Ų476 Ų762%0.02143%0.427CS..Hα-helixtrans-65.5-44.6175.2-175.659.5000111.2P76 L79 L84 L87 L88 Y91 Y106 E107 K112 L113 L114P76-L110 HydrophobicContact CB-CD2 4.31Å; L79-L110 HydrophobicContact CD2-CD2 4.12Å; L84-L110 HydrophobicContact CD1-CB 4.2Å; L84-L110 HydrophobicContact CD1-CD2 3.72Å; L87-L110 HydrophobicContact CB-CD1 4.15Å; L87-L110 HydrophobicContact CB-CD2 3.94Å; L87-L110 HydrophobicContact CD1-CD2 4.38Å; L88-L110 HydrophobicContact CD2-CB 4.04Å; L88-L110 HydrophobicContact CD2-CD1 4.41Å; L88-L110 HydrophobicContact CG-CB 4.44Å; Y91-L110 HydrophobicContact CD2-CD1 3.75Å; Y91-L110 HydrophobicContact CE2-CD1 3.9Å; Y106-L110 PolarHBondContact O-N 2.89Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.14Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 3.49Å; L110-L113 PolarHBondContact O-N 3.33Å; L110-L114 HydrophobicContact CD1-CG 4.46Å; L110-L114 HydrophobicContact CG-CD1 4.24Å; L110-L114 WeakPolarHBondContact O-CG 3.35Å; L110-L114 PolarHBondContact O-N 2.99Å
111R92.8Very high82.9Confident74 Ų7480.2 Ų80.228%0.27943%0.43SS..Hα-helixtrans-51.1-46.5173.1-70.5-175.8178.8110.98112.1D75 P76 S77 E107 N108 L113 L114 Q115D75-R111 IonicContact OD1-NH2 3.94Å; D75-R111 PolarHBondContact OD1-NH2 3.24Å; P76-R111 HydrophobicContact CB-CG 4.47Å; P76-R111 HydrophobicContact CG-CG 3.32Å; S77-R111 PolarHBondContact OG-NH2 3.32Å; E107-R111 WeakPolarHBondContact O-CG 3.18Å; E107-R111 PolarHBondContact O-N 3.14Å; N108-R111 PolarHBondContact OD1-NH1 2.94Å; R111-L113 PolarHBondContact O-N 3.28Å; R111-L114 PolarHBondContact O-N 2.94Å; R111-Q115 VanDerWaalsContact O-CG 3.3Å; R111-Q115 WeakPolarHBondContact O-CG 3.29Å; R111-Q115 PolarHBondContact O-N 3.17Å
112K92.2Very high80.5Confident147 Ų14779.2 Ų79.264%0.63942%0.424SS*.Hα-helixtrans-65.1-37.6179.5-73.6-179.1178.4-168.60113.1N108 K109 L110 S116N108-K112 WeakPolarHBondContact O-CG 3.41Å; N108-K112 PolarHBondContact O-N 2.67Å; K109-K112 PolarHBondContact O-N 3.17Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 3.49Å; K112-S116 WeakPolarHBondContact O-CB 3.39Å; K112-S116 PolarHBondContact O-N 3.27Å; K112-S116 PolarHBondContact O-OG 3.36Å; K112-S116 VanDerWaalsContact O-OG 3.05Å
113L91.3Very high77.9Confident40 Ų4084.2 Ų84.221%0.20945%0.449CS..Hα-helixtrans-69-38.9178.3-66.6167.6000111.1L88 Y91 V93 K109 L110 R111 S116 A117L88-L113 HydrophobicContact CD2-CD1 3.95Å; Y91-L113 HydrophobicContact CD1-CB 4.39Å; Y91-L113 HydrophobicContact CG-CB 4.25Å; Y91-L113 HydrophobicContact CG-CD1 4.34Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG2-CD1 3.62Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 2.8Å; K109-L113 VanDerWaalsContact O-N 3.17Å; L110-L113 PolarHBondContact O-N 3.33Å; R111-L113 PolarHBondContact O-N 3.28Å; L113-S116 WeakPolarHBondContact CA-OG 3.29Å; L113-S116 PolarHBondContact O-OG 3.27Å; L113-A117 WeakPolarHBondContact O-CB 3.21Å; L113-A117 PolarHBondContact O-N 3.49Å
114L88.4Confident75.6Confident53 Ų5390.3 Ų90.328%0.27748%0.48SS..Hα-helixtrans-63.9-48.9174.6-66.1173.1000111.1Y91 L110 R111 S116 A117 E118Y91-L114 HydrophobicContact CE1-CD2 4.4Å; Y91-L114 HydrophobicContact CE2-CD2 4.06Å; Y91-L114 WeakPolarHBondContact OH-CD2 3.15Å; L110-L114 HydrophobicContact CD1-CG 4.46Å; L110-L114 HydrophobicContact CG-CD1 4.24Å; L110-L114 WeakPolarHBondContact O-CG 3.35Å; L110-L114 PolarHBondContact O-N 2.99Å; R111-L114 PolarHBondContact O-N 2.94Å; L114-S116 PolarHBondContact O-N 3.14Å; L114-A117 PolarHBondContact O-N 3.03Å; L114-A117 VanDerWaalsContact O-N 3.13Å; L114-E118 WeakPolarHBondContact O-CB 3.18Å; L114-E118 PolarHBondContact O-N 3.06Å
115Q87.2Confident73.3Confident114 Ų11491.9 Ų91.953%0.53349%0.493SS..Hα-helixtrans-58.7-44.6176-72.5169.5-4.900112.4R111 A117 E118 E119R111-Q115 VanDerWaalsContact O-CG 3.3Å; R111-Q115 WeakPolarHBondContact O-CG 3.29Å; R111-Q115 PolarHBondContact O-N 3.17Å; Q115-A117 VanDerWaalsContact C-N 3.31Å; Q115-A117 PolarHBondContact O-N 3.4Å; Q115-E118 PolarHBondContact O-N 3.48Å; Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 2.99Å
116S80Confident71.2Confident68 Ų6895.8 Ų95.848%0.47651%0.505SS..Hα-helixtrans-71.9-23.5177.964.70000114.2K112 L113 L114K112-S116 WeakPolarHBondContact O-CB 3.39Å; K112-S116 PolarHBondContact O-N 3.27Å; K112-S116 PolarHBondContact O-OG 3.36Å; K112-S116 VanDerWaalsContact O-OG 3.05Å; L113-S116 WeakPolarHBondContact CA-OG 3.29Å; L113-S116 PolarHBondContact O-OG 3.27Å; L114-S116 PolarHBondContact O-N 3.14Å
117A70.3Confident68.6Low47 Ų47101.6 Ų101.639%0.38854%0.54SS..Hα-helixtrans-79.5-37.5176.900000110.7L113 L114 Q115 G120L113-A117 WeakPolarHBondContact O-CB 3.21Å; L113-A117 PolarHBondContact O-N 3.49Å; L114-A117 PolarHBondContact O-N 3.03Å; L114-A117 VanDerWaalsContact O-N 3.13Å; Q115-A117 VanDerWaalsContact C-N 3.31Å; Q115-A117 PolarHBondContact O-N 3.4Å; A117-G120 PolarHBondContact O-N 3.05Å
118E59Low66.6Low142 Ų142104.9 Ų104.966%0.66457%0.571SS**Hα-helixtrans-69.2-38.1175.4-165.4176175.200111.9L114 Q115 G120 E121L114-E118 WeakPolarHBondContact O-CB 3.18Å; L114-E118 PolarHBondContact O-N 3.06Å; Q115-E118 PolarHBondContact O-N 3.48Å; E118-G120 PolarHBondContact O-N 2.94Å; E118-G120 VanDerWaalsContact O-N 3.1Å; E118-E121 PolarHBondContact O-N 3.37Å
119E48Very low64.2Low143 Ų143106.9 Ų106.967%0.66859%0.586SS**THydrogen-bonded Turntrans-67.1-7.1172.3-75.4178.7169.100114Q115Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 2.99Å
120G48.3Very low61.8Low63 Ų63109.1 Ų109.165%0.64960%0.601SS**THydrogen-bonded Turntrans-86.5-9.7174.900000115.3A117 E118A117-G120 PolarHBondContact O-N 3.05Å; E118-G120 PolarHBondContact O-N 2.94Å; E118-G120 VanDerWaalsContact O-N 3.1Å
121E44.6Very low59.3Low183 Ų183119.4 Ų119.486%0.85564%0.641SS**SBendtrans-1204.4-176.6-78.3179.8116.300114.4E118E118-E121 PolarHBondContact O-N 3.37Å
122S41.8Very low56.9Low81 Ų81121.4 Ų121.457%0.56667%0.666SS**SBendtrans-135.266.9173.669.90000112.6
123N38.3Very low54.8Low145 Ų145121.8 Ų121.878%0.77568%0.676SS**  trans-149.759.1159-76.2-56000110
124E46.9Very low52.5Low196 Ų196123.9 Ų123.992%0.91669%0.693SS**SBendtrans-99.9115.9153.9-168.8166.2-176.200106.8
125A44.8Very low50.3Low87 Ų87128.8 Ų128.872%0.71972%0.72SS**SBendtrans89.1124.1-17700000118
126E51Low48Very low179 Ų179131.8 Ų131.884%0.83673%0.734SS**  trans70.175160.869.3174.9-147.400121
127N40.6Very low46Very low172 Ų172137.9 Ų137.992%0.9276%0.755SS**  -158.671.9126.9-112.3-13.3000110.5
128A51.3Low44.3Very low92 Ų92143.5 Ų143.576%0.7678%0.778SS**  trans-79.4120.9155.100000107
129V44.4Very low43.2Very low124 Ų124143.3 Ų143.375%0.75279%0.787SS**  trans155.8103.9150.8162.90000110.1
130L44Very low42.4Very low138 Ų138141.1 Ų141.172%0.72379%0.787SS**  trans68.2120.5144.4-54.4170.6000118.2
131Y39.5Very low41.8Very low220 Ų220146.3 Ų146.386%0.86379%0.794SS**  cis-146.612048.6-92.9-101.5000112.1
132S43Very low41.3Very low115 Ų115145.8 Ų145.880%0.80479%0.792SS**  trans-101.8117.3158.6-139.20000106.5S134S132-S134 PolarHBondContact O-N 2.96Å
133D49.2Very low40.8Very low156 Ų156149.3 Ų149.383%0.83481%0.805SS**  trans-89.695.4170.9-170.916.1000107.1
134S42.2Very low40.8Very low83 Ų83150.3 Ų150.358%0.5881%0.805SS**  trans-136.1103.6177.5-161.40000107.7S132 E136S132-S134 PolarHBondContact O-N 2.96Å; S134-E136 PolarHBondContact O-N 3.13Å
135D41.5Very low40.1Very low157 Ų157147.4 Ų147.484%0.8480%0.796SS**  trans-61.6124170.8-72.2-56.6000110
136E38.8Very low39.9Very low176 Ų176150.5 Ų150.582%0.82280%0.795SS**  trans-138.2127166.742.5-151.6162.700111.3S134S134-E136 PolarHBondContact O-N 3.13Å
137E37.8Very low39.2Very low196 Ų196148.9 Ų148.992%0.91679%0.788SS**  trans-76.2149.5-175.3-66.9-173.9157.900112.5
138D34.8Very low39.1Very low165 Ų165149.9 Ų149.988%0.88278%0.784SS**  trans-45.8133.5177.2-75.8-57000115.5
139V36.2Very low38.1Very low139 Ų139154.4 Ų154.484%0.84279%0.789SS**  trans-139.2125145.3-161.50000110.4
140S31.3Very low37.7Very low97 Ų97156.1 Ų156.168%0.67879%0.793SS**  trans-55.3150.3175.948.70000116
141E36.3Very low37Very low171 Ų171156.5 Ų156.580%0.79980%0.801SS**  178.7105.2124.6-94.4170-148.600107.7
142E33.7Very low36.5Very low172 Ų172149.1 Ų149.180%0.80479%0.792SS**  60.6112.4104.1-76.6-171.9173.500114
143N31.9Very low35.8Very low156 Ų156148.2 Ų148.283%0.83479%0.791SS**  trans-167.7107.4135.7-82.6-51.4000109.6
144E37.3Very low35.1Very low166 Ų166149 Ų14978%0.77679%0.79SS**  trans21.7114.8133.6-57.7-179.2172.100118.3
145D32.1Very low34.7Very low135 Ų135151.6 Ų151.672%0.72279%0.793SS**  167.4135.795.9-90.3-32.3000114.5
146E40.6Very low34.4Very low152 Ų152151.4 Ų151.471%0.7179%0.785SS**  trans71.9106145.5-64-174.8179.400123
147E37.8Very low33.9Very low145 Ų145152.6 Ų152.668%0.67879%0.787SS**  77108.8125.7-58-176.9-14700121.3
148K37.9Very low33.8Very low193 Ų193147 Ų14784%0.83977%0.774SS**  176.6108.4104.8-90160.2-156.7-1740113.7
149E29Very low33.6Very low187 Ų187147.3 Ų147.387%0.87477%0.77SS**  trans19.3123.6144.4-135.2-177.5162.600121.8
150L37.6Very low33.3Very low159 Ų159144.7 Ų144.783%0.83276%0.764SS**  trans-70.7157.9157.3-71.7154.9000112.4
151V28.4Very low33.3Very low146 Ų146148.1 Ų148.189%0.88577%0.774SS**  trans-145128136.5-169.10000106.7
152G28.3Very low33.1Very low65 Ų65148 Ų14867%0.6777%0.773SS**  cis152152.97.200000108.9
153A29.8Very low33.6Very low97 Ų97144.6 Ų144.680%0.80277%0.766SS**  trans128.991162.800000110.9
154Q33.8Very low33.6Very low173 Ų173143.7 Ų143.781%0.80876%0.761SS**  47.6129.986.6-72.2-162.2-13.800112.8
155E34.8Very low33.3Very low137 Ų137143.4 Ų143.464%0.6476%0.76SS**  cis-171.2136.149.5-159.7175.616600113.2
156K34.2Very low33.3Very low153 Ų153144.3 Ų144.367%0.66576%0.76SS**  trans51.5123.8140.2-63.7174.6-159.1157.30121.5
157K29.1Very low33.2Very low200 Ų200145.5 Ų145.587%0.8777%0.765SS**  75.4134.971.5-171.7-175.6-178.9-1770111.6
158A35.3Very low32.8Very low78 Ų78143.6 Ų143.665%0.64577%0.768SS**  cis-153.4176.8-1.500000105.4
159E29.7Very low32.5Very low172 Ų172141.8 Ų141.880%0.80477%0.767SS**  173.6114.257.2-174.1171.8149.400106.1
160A30.7Very low32.7Very low85 Ų85140.3 Ų140.370%0.70276%0.76SS**  55.2118.4108.500000117.7
161L30Very low32.5Very low169 Ų169140.1 Ų140.189%0.88575%0.753SS**  161.1116.5121.6-85.1158.3000111.4
162E32.4Very low32.6Very low168 Ų168139.5 Ų139.579%0.78575%0.745SS**  trans-59.5177.2164.1-91.1-99107.700112.6
163P44.9Very low32.9Very low101 Ų101142.5 Ų142.566%0.65675%0.749SS**  cis-138.1164.32.318.78.1000116.4
164N31.6Very low33.4Very low137 Ų137143.4 Ų143.473%0.73375%0.747SS**  trans47.2126.3135-148.3-42.8000121.2
165Q31.1Very low33.4Very low160 Ų160139.5 Ų139.575%0.74874%0.744SS**  179.9144.5130-97-169.171.900114.7
166Q33.2Very low33.5Very low154 Ų154142.7 Ų142.772%0.7276%0.759SS**  trans65.7113.8145.8-98.880.5-3600124.2
167Q38.1Very low33.5Very low177 Ų177143.2 Ų143.283%0.82776%0.762SS**  trans-54.7144.7150.2-164.6177.820.800115.1
168S28Very low33.7Very low105 Ų105137.3 Ų137.373%0.73476%0.757SS**  trans166.7113.914044.40000111.2
169N32.5Very low34.1Very low155 Ų155139.3 Ų139.383%0.82976%0.757SS**  63119.6101.8-68.6-15.2000116.3
170E32.5Very low34.6Very low156 Ų156141.5 Ų141.573%0.72976%0.764SS**  171.7130.895.4-143.6-177.2134.500114.1
171K33.6Very low35Very low154 Ų154143 Ų14367%0.6777%0.77SS**  trans32.6131.5145.7-75.1-174.2-161128.20124.3
172N30.1Very low35.5Very low134 Ų134145 Ų14572%0.71777%0.767SS**  164.9110.991.7-93.1-48.8000114.2
173V36.3Very low36.3Very low127 Ų127141.8 Ų141.877%0.7776%0.761SS**  26.7140122.7-168.20000118.7
174P39.9Very low36.2Very low117 Ų117144.4 Ų144.476%0.7676%0.764SS**  -148.8150.852.237.2-14000122.6
175A33Very low36.8Very low90 Ų90142.4 Ų142.474%0.74476%0.76SS**  trans38.5129136.300000123.3
176Q36.9Very low37.5Very low205 Ų205143.8 Ų143.896%0.95876%0.764SS**  -166159.3108-101.9-175.135.200112.9
177K34.3Very low37.8Very low164 Ų164144.3 Ų144.371%0.71376%0.764SS**  trans-109.7145.3-154.3-170.2-179.5-173.5-67.70110.2D179K177-D179 VanDerWaalsContact NZ-CG 3.34Å; K177-D179 IonicContact NZ-OD1 2.73Å; K177-D179 PolarHBondContact NZ-OD1 3.4Å; K177-D179 IonicContact NZ-OD2 2.85Å; K177-D179 PolarHBondContact NZ-OD2 2.95Å
178G34.3Very low37.9Very low75 Ų75143.5 Ų143.577%0.77376%0.764SS**  trans-152.6107170.100000110.7
179D43.6Very low38.4Very low121 Ų121143.5 Ų143.565%0.64777%0.765SS**  trans-76138.7-176-62.5-48.3000111.6K177K177-D179 VanDerWaalsContact NZ-CG 3.34Å; K177-D179 IonicContact NZ-OD1 2.73Å; K177-D179 PolarHBondContact NZ-OD1 3.4Å; K177-D179 IonicContact NZ-OD2 2.85Å; K177-D179 PolarHBondContact NZ-OD2 2.95Å
180F40Very low39.1Very low217 Ų217142 Ų14295%0.95277%0.767SS**  trans-131.6112.7154.5-100.6-88.1000109.7
181S39.1Very low39.8Very low117 Ų117145.1 Ų145.182%0.81877%0.771SS**  trans-86.9122.8177.3-172.80000109.3
182Y40.3Very low40.2Very low211 Ų211146.4 Ų146.483%0.82779%0.785SS**  trans-93.6132.3172.5-152-90.4000108.9Q184Y182-Q184 PolarHBondContact O-N 3.45Å
183P48.3Very low40.7Very low101 Ų101151.2 Ų151.266%0.65679%0.793SS**  trans-73.4104.2177.629-30.5000109.3C185P183-C185 PolarHBondContact O-N 2.96Å; P183-C185 VanDerWaalsContact O-N 3.11Å
184Q44Very low40.6Very low156 Ų156151 Ų15173%0.72979%0.794SS**  trans-78.684.3170.8-168.8163.335.300109.2Y182 F187Y182-Q184 PolarHBondContact O-N 3.45Å; Q184-F187 HydrophobicContact CG-CD2 4.34Å; Q184-F187 HydrophobicContact CG-CE2 4.15Å; Q184-F187 VanDerWaalsContact NE2-CE2 3.32Å
185C44Very low40.5Very low95 Ų95151.4 Ų151.464%0.64280%0.798SS**  trans-92.7132.1169.9-67.30000109.8P183P183-C185 PolarHBondContact O-N 2.96Å; P183-C185 VanDerWaalsContact O-N 3.11Å
186F44.4Very low41.1Very low189 Ų189152.6 Ų152.683%0.82980%0.798SS**  trans92.964.1178.1-48.8-69.4000117.9
187F41.2Very low41.2Very low165 Ų165148.9 Ų148.972%0.72479%0.792SS**  trans-102.1117.8137.8-76.8-71.5000109.1Q184 S189Q184-F187 HydrophobicContact CG-CD2 4.34Å; Q184-F187 HydrophobicContact CG-CE2 4.15Å; Q184-F187 VanDerWaalsContact NE2-CE2 3.32Å; F187-S189 PolarHBondContact O-N 3.49Å
188L40.3Very low41.3Very low159 Ų159151.8 Ų151.883%0.83280%0.799SS**  trans-62.9105166-98.169.2000108.5S190L188-S190 PolarHBondContact O-N 3.48Å
189S38.3Very low41.6Very low106 Ų106155.4 Ų155.474%0.74180%0.8SS**  trans-65.5118.7168.5-90.70000110.2F187 R191F187-S189 PolarHBondContact O-N 3.49Å; S189-R191 VanDerWaalsContact C-N 3.32Å; S189-R191 PolarHBondContact O-N 2.97Å
190S46.8Very low41.2Very low124 Ų124155.4 Ų155.487%0.86780%0.8SS**  trans-68.484.6169.8-34.20000109.9L188L188-S190 PolarHBondContact O-N 3.48Å
191R46.9Very low41.1Very low220 Ų220153.7 Ų153.783%0.8380%0.795SS**  trans-141.272.1169.7-72.2-165-167.9-106.32.9112S189S189-R191 VanDerWaalsContact C-N 3.32Å; S189-R191 PolarHBondContact O-N 2.97Å
192L41.4Very low40.8Very low181 Ų181159.9 Ų159.995%0.94880%0.8SS**  trans-153.791.9147.7-74.1-175.5000108.6
193R41.6Very low41Very low235 Ų235155.1 Ų155.189%0.88780%0.798SS**  trans-133.5128.1156.8-141-173.2-65.2-147.23.4108.2
194P35.1Very low40.6Very low122 Ų122156 Ų15679%0.79281%0.806SS**PPolyproline II helixtrans-68.1140-176.7-16.629.8000112.2
195C37.2Very low40.4Very low127 Ų127156.7 Ų156.786%0.85881%0.807SS**PPolyproline II helixtrans-76131167-61.60000110.3
196P45.4Very low40Very low114 Ų114161.5 Ų161.574%0.7481%0.812SS**PPolyproline II helixtrans-84.5153.6158.533.4-27.9000110.2
197P38.6Very low39.6Very low127 Ų127158.7 Ų158.783%0.82581%0.806SS**PPolyproline II helixtrans-75.7146.9-174.531.1-32.8000112.2
198R36.9Very low39.7Very low226 Ų226155.5 Ų155.585%0.85380%0.803SS**PPolyproline II helixtrans-76.2122.9176.7-172.6-179.9102-177.87.4110.3
199N39.9Very low39.7Very low151 Ų151156.2 Ų156.281%0.80780%0.8SS**  trans-133.2115.7152.163.7-9.7000112.2
200N35.7Very low39.9Very low120 Ų120158.2 Ų158.264%0.64280%0.802SS**  trans-5.7125.1165.5-52.4-15.2000120.2
201E37Very low39.2Very low182 Ų182156.3 Ų156.385%0.8579%0.794SS**  trans38.8117.5131.7-67.3178.6134.300120.2
202R34.3Very low38.7Very low246 Ų246153.4 Ų153.493%0.92879%0.794SS**  -163.6128105.8-106.5172-172.3-173.72.4111.7
203S43.8Very low38.4Very low112 Ų112153.6 Ų153.678%0.78379%0.787SS**  trans-54.9142.8166.554.50000113.3
204S40.8Very low38Very low118 Ų118147.6 Ų147.683%0.82578%0.782SS**  -173.6132.8118.959.60000113.1
205K39.1Very low37.9Very low172 Ų172148.2 Ų148.275%0.74879%0.789SS**  trans-31.9149.4163.8-88.5166.1172.6166.60117.6
206R35.2Very low37.7Very low195 Ų195151 Ų15174%0.73679%0.789SS**  trans87.8132.5130.4-88.1-178.8-165.7166.81.2120.6
207N37.1Very low37.3Very low131 Ų131156.2 Ų156.270%0.70179%0.794SS**  trans83.1114.6141.2-57.5-10.5000116.4
208S42Very low36.9Very low97 Ų97156.1 Ų156.168%0.67879%0.791SS**  82131.475.388.60000114.1
209K40.3Very low37Very low174 Ų174156.4 Ų156.476%0.75779%0.792SS**  trans77.8113.3157.5-63.2178.8-178.61790119.8
210N42.1Very low37.4Very low148 Ų148154.9 Ų154.979%0.79179%0.791SS**  70.7137.8122.4-48.4-6.6000121.4
211A33.5Very low37.4Very low84 Ų84158.5 Ų158.569%0.69480%0.803SS**  trans93.110913600000120.8
212L36.3Very low37.1Very low160 Ų160160.6 Ų160.684%0.83880%0.803SS**  90.6137.3125.9-74.4168.3000121.7
213K34.1Very low37.3Very low184 Ų184153.7 Ų153.780%0.879%0.793SS**  trans87.897.4158.5-72.6169.9178.7-177.50116.2
214S33Very low37.1Very low110 Ų110156.9 Ų156.977%0.76980%0.795SS**  77115.180.969.80000113.2
215S33.5Very low37Very low134 Ų134158.1 Ų158.194%0.93779%0.791SS**  trans-149.6134.5147.5-166.30000110
216E33.6Very low37.6Very low185 Ų185156.1 Ų156.186%0.86480%0.796SS**  trans-100.5158.3-159.5-159170.2176.600110.9
217R37.4Very low37.5Very low225 Ų225151.7 Ų151.785%0.84980%0.801SS**  trans-61.1159.8174.1-174.1176.2177.8162-1.6111.6
218T29.7Very low37.4Very low124 Ų124148.5 Ų148.576%0.76180%0.799SS**  134.3126.2127.7-29.70000115.7
219R37.7Very low37.2Very low232 Ų232151.4 Ų151.488%0.87581%0.805SS**  trans-63-180161.2-70.3-179.6177.7171.2-1.3110.6
220P49.5Very low36.9Very low120 Ų120153.8 Ų153.878%0.77981%0.81SS**  cis-154.4-172.926.840.6-14.7000119.7
221H34.7Very low36.6Very low195 Ų195155.3 Ų155.390%0.90381%0.809SS**  trans-13.3146166.4-81-69.7000122.9
222R32.4Very low36.6Very low226 Ų226156.8 Ų156.885%0.85381%0.81SS**  trans-150.5131.8143.9-161.8173.5-176.8-145.60.9112.5
223S37.5Very low36.6Very low101 Ų101154.1 Ų154.171%0.70680%0.804SS**  trans-86.9158.9178.946.90000113
224Q38.7Very low36.6Very low179 Ų179150.1 Ų150.184%0.83680%0.799SS**  trans-153.2137.4142.7-69.6-156.147.200111.4
225I40.1Very low36.8Very low145 Ų145151.5 Ų151.574%0.74480%0.803SS**  trans-99.3169.4175.8-47.3168.6000107.8
226P50.7Low36.8Very low129 Ų129149.4 Ų149.484%0.83879%0.794SS**  -145.6161.898.833.7-14.7000115.9
227A34.4Very low37.2Very low102 Ų102149.2 Ų149.284%0.84379%0.793SS**  trans-79.6162.7-174.900000115
228G33.8Very low37.3Very low65 Ų65147.6 Ų147.667%0.6779%0.794SS**  trans169.199.6157.700000119.9
229I38.6Very low37.6Very low157 Ų157147.1 Ų147.181%0.80580%0.797SS**  trans75131.2132.6-8.1-177.2000124
230R33.3Very low37.5Very low225 Ų225139.2 Ų139.285%0.84979%0.787SS**  trans87.5146.5150.3-59.5-169.3-175.9-172.71.2117.8
231K36.4Very low37Very low179 Ų179141.8 Ų141.878%0.77879%0.793SS**  cis178.4130.8-15.1-174.1165.4-177.8-178.70106
232V32.6Very low36.9Very low116 Ų116144 Ų14470%0.70379%0.793SS**  trans73.5137.5142.7173.40000123
233S36.4Very low36.9Very low104 Ų104139 Ų13973%0.72779%0.794SS**  trans73.5152.5151.5710000118.2
234S35.3Very low36.6Very low99 Ų99137.2 Ų137.269%0.69279%0.791SS**  cis-177.9152.4-17.550.80000105.4
235V37.4Very low36.7Very low139 Ų139135.2 Ų135.284%0.84279%0.79SS**  trans37.6116.2140.6166.50000118.2
236A33.4Very low37.1Very low91 Ų91134.4 Ų134.475%0.75280%0.795SS**  170.7126.6108.400000110.5
237Q42Very low36.4Very low181 Ų181134 Ų13485%0.84680%0.795SS**  trans-66.7149.3160.6-60.7-171-24.400109.5
238H39.1Very low36.3Very low190 Ų190132.4 Ų132.488%0.8879%0.789SS**  trans-159.9129.2132.5-96.3-69.6000110.3
239S35.9Very low36.3Very low115 Ų115134.4 Ų134.480%0.80479%0.792SS**  trans-34.7147160.8-36.30000112.7
240G34.3Very low36.1Very low65 Ų65134.9 Ų134.967%0.6780%0.796SS**  123.8162.953.800000108.4
241L40.8Very low36Very low175 Ų175129 Ų12992%0.91679%0.789SS**  trans84.9101.3175.6-49.7169.6000113.8
242R32.3Very low35.8Very low240 Ų240127.4 Ų127.491%0.90679%0.794SS**  70.1131.255-159.7-177.4-170.1-1433.9113.8
243S31.7Very low35.9Very low123 Ų123127.9 Ų127.986%0.8680%0.797SS**  trans85136.1164.3-158.90000114.3
244G31.1Very low35.6Very low63 Ų63128.1 Ų128.165%0.64980%0.798SS**  cis174.2161.59.900000108.5
245V41.9Very low35.4Very low136 Ų136129 Ų12982%0.82481%0.805SS**  trans-52.4162.8178.3-176.50000112.7
246P48.1Very low35.3Very low128 Ų128128.3 Ų128.383%0.83181%0.806SS**  trans-132.3154.7134.636.1-24.2000114.5
247S35.9Very low35.1Very low122 Ų122130.3 Ų130.385%0.85381%0.813SS**  trans-130.6145.2177.1-1700000109.2
248G31.3Very low34.8Very low68 Ų68126.3 Ų126.370%0.70181%0.805SS**  trans86.2148.4166.900000116.5
249S34.9Very low34.8Very low107 Ų107123.1 Ų123.175%0.74880%0.804SS**  cis179.9171.1-5.4350000108.6
250L34.9Very low34.8Very low167 Ų167126.9 Ų126.987%0.87481%0.806SS**  trans83.1146.6168.5-49.7170.5000116.4
251S30.6Very low35.1Very low102 Ų102128.8 Ų128.871%0.71381%0.807SS**  cis-176.4162.5-21.260.30000105.3
252V31.5Very low35Very low144 Ų144126.2 Ų126.287%0.87380%0.804SS**  trans139.7135.7155.1171.70000112.7
253V34.2Very low35.8Very low126 Ų126123.3 Ų123.376%0.76480%0.8SS**  trans-100.8158.4-161.9141.50000112.7
254S31.4Very low36.9Very low109 Ų109122 Ų12276%0.76280%0.796SS**  trans107.9130.4162.8-53.90000113.1
255S31.1Very low37.8Very low119 Ų119127 Ų12783%0.83280%0.801SS**  cis-159.9151.129.540.90000112.2
256S35.4Very low39.1Very low124 Ų124123.6 Ų123.687%0.86778%0.783SS**  trans-50.4141.5-179.6-40.10000117.1
257C29.7Very low40.1Very low133 Ų133123.4 Ų123.490%0.89977%0.774SS**  -157.8143.7118.371.40000111.3
258S34.8Very low41.8Very low96 Ų96122.3 Ų122.367%0.67176%0.762SS**  trans-91.7144.9-160.649.30000114.2
259S38Very low43.5Very low123 Ų123125.9 Ų125.986%0.8676%0.761SS**  trans-158.4140.2137.4-800000110.4
260F36Very low45.3Very low194 Ų194125.4 Ų125.485%0.85175%0.747SS**  trans-74.7168.2-154.1-79.8-88.1000117.1
261P42.2Very low47.1Very low106 Ų106120.1 Ų120.169%0.68872%0.722SS**  trans-104.1152.5-142.938.8-34.3000114.6
262S37.5Very low49Very low121 Ų121121.5 Ų121.585%0.84672%0.717SS**  trans-79.4112.2153.6-55.10000108.3A264S262-A264 PolarHBondContact O-N 3Å
263Q50.3Low50.7Low178 Ų178120.9 Ų120.983%0.83270%0.703SS**  trans-68.997179.8-174.2175.222.100110.2
264A53.9Low52.2Low95 Ų95119.2 Ų119.279%0.78569%0.688SS**  trans-77.1122.317000000109.5S262 S266S262-A264 PolarHBondContact O-N 3Å; A264-S266 PolarHBondContact O-N 3.08Å
265F49.7Very low53.8Low169 Ų169120.6 Ų120.674%0.74168%0.682SS**  trans-79.9105.7179-141.4-90.9000108.8M270F265-M270 HydrophobicContact CE1-SD 4.37Å
266S70.2Confident54.9Low64 Ų64120.2 Ų120.245%0.44868%0.675SS.*  trans-97.5114.8176-158.60000110A264 T268 Q269A264-S266 PolarHBondContact O-N 3.08Å; S266-T268 PolarHBondContact O-N 3.07Å; S266-T268 PolarHBondContact OG-OG1 3.12Å; S266-Q269 PolarHBondContact O-N 3.41Å; S266-Q269 VanDerWaalsContact O-N 3.13Å
267I69Low55.5Low124 Ų124124.5 Ų124.564%0.63667%0.672SS**Hα-helixtrans-58.7-34-178.4-63.1168.5000111.1Q269 M270 V271I267-Q269 VanDerWaalsContact C-N 3.32Å; I267-Q269 PolarHBondContact O-N 3.23Å; I267-M270 PolarHBondContact O-N 3.29Å; I267-V271 PolarHBondContact O-N 2.91Å
268T71.4Confident56.5Low100 Ų100122.8 Ų122.861%0.61366%0.662SS**Hα-helixtrans-61.8-36.5177.946.60000113.1S266 M270 V271 E272S266-T268 PolarHBondContact O-N 3.07Å; S266-T268 PolarHBondContact OG-OG1 3.12Å; T268-M270 VanDerWaalsContact C-N 3.31Å; T268-M270 PolarHBondContact O-N 3.38Å; T268-V271 PolarHBondContact O-N 2.94Å; T268-E272 WeakPolarHBondContact O-CB 3.47Å; T268-E272 PolarHBondContact O-N 3.2Å; T268-E272 VanDerWaalsContact O-N 3.07Å
269Q66.6Low56.7Low143 Ų143122.2 Ų122.267%0.66866%0.663SS**Hα-helixtrans-71.1-28.9178.5-171179.470.100112.3S266 I267 K273S266-Q269 PolarHBondContact O-N 3.41Å; S266-Q269 VanDerWaalsContact O-N 3.13Å; I267-Q269 VanDerWaalsContact C-N 3.32Å; I267-Q269 PolarHBondContact O-N 3.23Å; Q269-K273 WeakPolarHBondContact O-CB 3.46Å; Q269-K273 PolarHBondContact O-N 3.14Å
270M73.9Confident56.9Low96 Ų96122.5 Ų122.547%0.47366%0.662SS.*Hα-helixtrans-73.3-40.1176-167.6175.662.700110.9F265 I267 T268 K273 M274F265-M270 HydrophobicContact CE1-SD 4.37Å; I267-M270 PolarHBondContact O-N 3.29Å; T268-M270 VanDerWaalsContact C-N 3.31Å; T268-M270 PolarHBondContact O-N 3.38Å; M270-K273 PolarHBondContact O-N 3.44Å; M270-M274 HydrophobicContact CB-CE 4.41Å; M270-M274 HydrophobicContact CE-CE 4.07Å; M270-M274 HydrophobicContact CG-CE 3.99Å; M270-M274 WeakPolarHBondContact O-CG 3.48Å; M270-M274 PolarHBondContact O-N 2.95Å
271V72.4Confident56.8Low57 Ų57119.1 Ų119.135%0.34566%0.663SS.*Hα-helixtrans-65.1-45.8178.1176.30000111.3I267 T268 K273 M274 E275I267-V271 PolarHBondContact O-N 2.91Å; T268-V271 PolarHBondContact O-N 2.94Å; V271-K273 VanDerWaalsContact C-N 3.25Å; V271-K273 PolarHBondContact O-N 3.06Å; V271-M274 VanDerWaalsContact CA-CE 3.49Å; V271-M274 HydrophobicContact CB-CE 4.14Å; V271-M274 HydrophobicContact CG2-CE 3.62Å; V271-M274 HydrophobicContact CG2-SD 4.42Å; V271-M274 WeakPolarHBondContact O-CG 2.99Å; V271-M274 PolarHBondContact O-N 3.39Å; V271-M274 VanDerWaalsContact O-N 3.13Å; V271-E275 PolarHBondContact O-N 2.96Å
272E70.5Confident56.3Low130 Ų130118.2 Ų118.261%0.60766%0.664SS**Hα-helixtrans-60.6-36.7176-168.1173.6-172.600111.8T268 M274 E275 T276T268-E272 WeakPolarHBondContact O-CB 3.47Å; T268-E272 PolarHBondContact O-N 3.2Å; T268-E272 VanDerWaalsContact O-N 3.07Å; E272-M274 PolarHBondContact O-N 3.42Å; E272-E275 PolarHBondContact O-N 3.32Å; E272-T276 PolarHBondContact O-N 2.98Å; E272-T276 PolarHBondContact O-OG1 2.92Å
273K67Low55.9Low132 Ų132118.4 Ų118.457%0.57466%0.664SS**Hα-helixtrans-68.2-31.6177.3-173170176.11620113.5Q269 M270 V271 T276Q269-K273 WeakPolarHBondContact O-CB 3.46Å; Q269-K273 PolarHBondContact O-N 3.14Å; M270-K273 PolarHBondContact O-N 3.44Å; V271-K273 VanDerWaalsContact C-N 3.25Å; V271-K273 PolarHBondContact O-N 3.06Å; K273-T276 WeakPolarHBondContact CA-OG1 3.37Å; K273-T276 PolarHBondContact O-OG1 3.23Å; K273-T276 VanDerWaalsContact O-OG1 3.06Å
274M65.1Low54.9Low91 Ų91115.5 Ų115.545%0.44866%0.663SS.*Hα-helixtrans-72.8-37.7176.3-16.9166174.500111.4M270 V271 E272 W277 S278M270-M274 HydrophobicContact CB-CE 4.41Å; M270-M274 HydrophobicContact CE-CE 4.07Å; M270-M274 HydrophobicContact CG-CE 3.99Å; M270-M274 WeakPolarHBondContact O-CG 3.48Å; M270-M274 PolarHBondContact O-N 2.95Å; V271-M274 VanDerWaalsContact CA-CE 3.49Å; V271-M274 HydrophobicContact CB-CE 4.14Å; V271-M274 HydrophobicContact CG2-CE 3.62Å; V271-M274 HydrophobicContact CG2-SD 4.42Å; V271-M274 WeakPolarHBondContact O-CG 2.99Å; V271-M274 PolarHBondContact O-N 3.39Å; V271-M274 VanDerWaalsContact O-N 3.13Å; E272-M274 PolarHBondContact O-N 3.42Å; M274-W277 PolarHBondContact O-N 2.96Å; M274-S278 PolarHBondContact O-OG 3.48Å
275E64.7Low54.1Low138 Ų138121.7 Ų121.765%0.64567%0.668SS**Hα-helixtrans-69.5-34.7-178.3-71.5179.7158.400111.7V271 E272 W277 S278V271-E275 PolarHBondContact O-N 2.96Å; E272-E275 PolarHBondContact O-N 3.32Å; E275-W277 VanDerWaalsContact C-N 3.27Å; E275-W277 PolarHBondContact O-N 3.24Å; E275-S278 PolarHBondContact O-N 3.1Å
276T55.6Low53.4Low110 Ų110118.5 Ų118.568%0.67567%0.667SS**THydrogen-bonded Turntrans-66.6-19173.127.80000115.4E272 K273E272-T276 PolarHBondContact O-N 2.98Å; E272-T276 PolarHBondContact O-OG1 2.92Å; K273-T276 WeakPolarHBondContact CA-OG1 3.37Å; K273-T276 PolarHBondContact O-OG1 3.23Å; K273-T276 VanDerWaalsContact O-OG1 3.06Å
277W48Very low51.8Low214 Ų214123.6 Ų123.681%0.81168%0.681SS**THydrogen-bonded Turntrans-93.6-1177.3-91.1-21.3000114.5M274 E275M274-W277 PolarHBondContact O-N 2.96Å; E275-W277 VanDerWaalsContact C-N 3.27Å; E275-W277 PolarHBondContact O-N 3.24Å
278S49.5Very low50.2Low97 Ų97123.6 Ų123.668%0.67869%0.689SS**  trans-111.815.7-171-58.90000115.4M274 E275M274-S278 PolarHBondContact O-OG 3.48Å; E275-S278 PolarHBondContact O-N 3.1Å
279A38.6Very low48.3Very low85 Ų85126.7 Ų126.770%0.70270%0.696SS**  trans-95.7119.1172.100000111.6S281A279-S281 PolarHBondContact O-N 2.64Å
280P42.7Very low46.5Very low128 Ų128127.4 Ų127.483%0.83170%0.699SS**  trans-79.5114.1174.130.7-28.4000109.7
281S33.6Very low44.3Very low124 Ų124134.7 Ų134.787%0.86772%0.722SS**  trans-75.8125.2170.1-1740000110.1A279A279-S281 PolarHBondContact O-N 2.64Å
282A33Very low42.4Very low87 Ų87135.1 Ų135.172%0.71973%0.727SS**  trans-74.8155.3175.700000113.1
283C28.2Very low40.4Very low125 Ų125140.6 Ų140.685%0.84574%0.742SS**  trans70.5114.9165.3-79.40000119.6
284S30.1Very low38.6Very low116 Ų116140 Ų14081%0.81176%0.755SS**  179.9148.884.847.30000112.4
285Y35.5Very low37.2Very low226 Ų226141.4 Ų141.489%0.88677%0.774SS**  trans-74.6122.7179.3-171.8-91.7000110.8
286S35.4Very low35.5Very low102 Ų102144.8 Ų144.871%0.71378%0.78SS**  trans-162.4116.915253.80000111.2
287K38Very low34.6Very low171 Ų171148 Ų14874%0.74379%0.793SS**  trans-64.1148164-158179.3-170.8-175.70109
288P34.8Very low33.9Very low124 Ų124142.8 Ų142.881%0.80578%0.78SS**  -143.8164.3125.327.2-7.3000115.1
289E30.9Very low33.3Very low164 Ų164146.3 Ų146.377%0.76679%0.792SS**  trans-84.7162.1-164.4-58.9-178.1141.500114.7
290H30.1Very low33.2Very low159 Ų159149.8 Ų149.874%0.73680%0.798SS**  trans-27.8125.5153.7179.4-94.8000115.9S292H290-S292 PolarHBondContact NE2-OG 2.88Å
291W26.3Very low32.8Very low249 Ų249148.7 Ų148.794%0.94380%0.8SS**  trans-139.9121.8147.1-156.4-70000110.6
292S33Very low33.1Very low66 Ų66152.5 Ų152.546%0.46280%0.804SS.*  trans-87.9152.8175.5-78.30000112H290H290-S292 PolarHBondContact NE2-OG 2.88Å
293R29.1Very low33Very low244 Ų244152.2 Ų152.292%0.92181%0.81SS**  trans70.2120.6151.7-81.6177.5141.1167.4-4.9118.9
294S29.6Very low33.6Very low121 Ų121155.2 Ų155.285%0.84681%0.809SS**  -154.5116.9128.3-1740000111.1
295S34.8Very low33.8Very low120 Ų120156.3 Ų156.384%0.83981%0.805SS**  trans-161.889.5140.462.80000107.4
296R28.7Very low33.8Very low208 Ų208153.1 Ų153.179%0.78580%0.802SS**  trans-94.8127.5160.8-75.5-170.8179.4-148.73.2107.7D298R296-D298 IonicContact NH1-OD2 3.52Å
297L37.6Very low33.6Very low179 Ų179156 Ų15694%0.93781%0.806SS**  trans-126.6111.9143.7-82.3175.1000105.7
298D33.3Very low33.4Very low103 Ų103153 Ų15355%0.55180%0.802SS**  trans-80.6150.3168.6-69.5-57000109.1R296R296-D298 IonicContact NH1-OD2 3.52Å
299N36.2Very low33.3Very low172 Ų172153.6 Ų153.692%0.9280%0.799SS**  trans-161.9121.3142.4-89.4-37000109
300D35.6Very low33.3Very low157 Ų157154.4 Ų154.484%0.8480%0.802SS**  trans-74.3153.7-179.5-60.7-77.2000113.8
301A34.7Very low33.2Very low105 Ų105150.7 Ų150.787%0.86880%0.799SS**  trans-160.4127.1147.500000111.8
302E39.4Very low33.4Very low205 Ų205146.2 Ų146.296%0.95879%0.794SS**  trans-59.5161.2174.1-73.2175.8110.600114.9
303G32.8Very low33.4Very low81 Ų81149.1 Ų149.184%0.83581%0.809SS**  trans169.4115.3154.200000115.1
304K40.7Very low33.8Very low188 Ų188142.9 Ų142.982%0.81780%0.8SS**  trans-83.8154.1-178.8-86.1173.5175.5167.60114.5
305D34.1Very low33.8Very low139 Ų139146.3 Ų146.374%0.74380%0.799SS**  trans67.3146.8143.1-56.7-26.5000123.2
306I35.6Very low33.5Very low159 Ų159147.8 Ų147.882%0.81580%0.798SS**  trans123.8101.5145.7-57.6176.7000117
307M31.4Very low33.8Very low161 Ų161143.1 Ų143.179%0.79380%0.797SS**  33.3128.3128-78.7168.356.300124.8
308V33.1Very low33.5Very low109 Ų109140.7 Ų140.766%0.66179%0.79SS**  79.8142.3119.3178.50000122.1
309D31.6Very low33.3Very low137 Ų137141.3 Ų141.373%0.73380%0.801SS**  trans78.5117166.4-70.6-20000118.5
310Q32.3Very low33.2Very low181 Ų181140.7 Ų140.785%0.84680%0.797SS**  88.9137.955.3-167.2162.157.500112.7
311A27.6Very low33.8Very low81 Ų81138.9 Ų138.967%0.66979%0.794SS**  trans88.6126.9177.100000114.1
312D30.6Very low34.2Very low155 Ų155137 Ų13783%0.82979%0.785SS**  cis-150.2148.726.7-83.2-56.7000112
313T33.5Very low34.5Very low127 Ų127138.3 Ų138.378%0.77978%0.781SS**  trans-111.2148.5153.853.40000107.7
314P36.7Very low35.5Very low112 Ų112138 Ų13873%0.72776%0.76SS**  -138.1134.5107.124.2-5.1000111.9
315K30.5Very low36.3Very low194 Ų194135.7 Ų135.784%0.84376%0.756SS**  45.1120.1104-62.5-178.4-179.61720111.9
316D27.9Very low37.4Very low150 Ų150133.5 Ų133.580%0.80274%0.743SS**  cis-179.4137.348.9-1655.9000107.9
317S34Very low38.2Very low110 Ų110131.2 Ų131.277%0.76973%0.727SS**  trans166.4100.4139.669.60000109.6C319S317-C319 PolarHBondContact O-N 3.43Å
318T31.8Very low39.4Very low128 Ų128130.7 Ų130.779%0.78573%0.728SS**  trans-49128.4154.1-59.20000110.1
319C29.1Very low40.6Very low116 Ų116131.9 Ų131.978%0.78473%0.73SS**  170.1128.4128.3-86.10000112.7S317S317-C319 PolarHBondContact O-N 3.43Å
320D34.1Very low41.6Very low159 Ų159130 Ų13085%0.8572%0.719SS**  trans77.7125.9156-93.6-29.9000122.8
321P49.1Very low42.5Very low119 Ų119126.9 Ų126.977%0.77372%0.715SS**SBendtrans-83.2143.3169.235.5-28.3000109.9
322G42.6Very low43.5Very low65 Ų65130.3 Ų130.367%0.6772%0.722SS**  trans101.375.5162.400000114
323R46.1Very low44.7Very low234 Ų234125.3 Ų125.388%0.88370%0.697SS**  trans-13684.5145.3-57.8-167.5-66.5-176.8-0.2106.9I325R323-I325 PolarHBondContact O-N 3.34Å
324D54Low45.7Very low73 Ų73128.9 Ų128.939%0.3970%0.702SS.*  trans-60.2104.6169.3-60.6-47.1000106.7L326 K327D324-L326 PolarHBondContact O-N 3.27Å; D324-K327 HydrophobicContact CB-CB 4.37Å; D324-K327 HydrophobicContact CB-CD 3.93Å; D324-K327 HydrophobicContact CB-CG 3.89Å; D324-K327 WeakPolarHBondContact O-CB 3.32Å; D324-K327 PolarHBondContact O-N 3.45Å; D324-K327 WeakPolarHBondContact OD2-CE 3.26Å; D324-K327 IonicContact OD2-NZ 3.42Å; D324-K327 PolarHBondContact OD2-NZ 3.42Å
325I57.1Low46.7Very low141 Ų141128.7 Ų128.772%0.72370%0.699SS**Hα-helixtrans-54.2-21.2177.1-61.9169.3000111R323R323-I325 PolarHBondContact O-N 3.34Å
326L56.7Low47.5Very low93 Ų93122.7 Ų122.749%0.48768%0.681SS.*Hα-helixtrans-73.1-20173.7-81.2158.5000115D324 Y341D324-L326 PolarHBondContact O-N 3.27Å; L326-Y341 HydrophobicContact CB-CE1 4.25Å; L326-Y341 HydrophobicContact CD1-CD2 4.49Å; L326-Y341 HydrophobicContact CD1-CE1 4.41Å; L326-Y341 HydrophobicContact CD1-CE2 4.06Å
327K53.4Low48.7Very low110 Ų110121.9 Ų121.948%0.47868%0.684SS.*Hα-helixtrans-79.4-27.3177.2-75.1177.3176.5154.80113D324D324-K327 HydrophobicContact CB-CB 4.37Å; D324-K327 HydrophobicContact CB-CD 3.93Å; D324-K327 HydrophobicContact CB-CG 3.89Å; D324-K327 WeakPolarHBondContact O-CB 3.32Å; D324-K327 PolarHBondContact O-N 3.45Å; D324-K327 WeakPolarHBondContact OD2-CE 3.26Å; D324-K327 IonicContact OD2-NZ 3.42Å; D324-K327 PolarHBondContact OD2-NZ 3.42Å
328D54.7Low49.8Very low151 Ų151121.8 Ų121.881%0.80768%0.679SS**Hα-helixtrans-78.2-21.7179.2-87.5-5.9000113.3
329L59.1Low50.9Low133 Ų133118.6 Ų118.670%0.69667%0.672SS**Hα-helixtrans-84.8-22.3-179.9-77.8154.8000113.1
330L53.1Low52.3Low97 Ų97119.1 Ų119.151%0.50867%0.665SS.*  trans-149.989.8-175-71.7156.4000110.1D332 T333L330-D332 PolarHBondContact O-N 3.44Å; L330-T333 HydrophobicContact CB-CG2 4.13Å
331P50.1Low53.4Low117 Ų117117.9 Ų117.976%0.7665%0.65SS**THydrogen-bonded Turntrans-66.2-5.9-17223-32.1000115.7
332D49.2Very low54Low153 Ų153115.7 Ų115.782%0.81864%0.642SS**THydrogen-bonded Turntrans-11412.8-172-69.5-30.2000115.8L330 K334L330-D332 PolarHBondContact O-N 3.44Å; D332-K334 PolarHBondContact O-N 3.01Å
333T56.5Low54.9Low50 Ų50116.8 Ų116.831%0.30764%0.639SS.*  trans-89.698.7178.1610000112L330 T335L330-T333 HydrophobicContact CB-CG2 4.13Å; T333-T335 PolarHBondContact O-N 3.02Å
334K55Low55.7Low202 Ų202111.2 Ų111.288%0.87863%0.633SS**  trans-62.1126.4167.660.5174.4-176.2149.60110.9D332 S336D332-K334 PolarHBondContact O-N 3.01Å; K334-S336 PolarHBondContact O-N 3.08Å
335T56.5Low56Low107 Ų107118.6 Ų118.666%0.65666%0.656SS**  trans-63.4114.4179.8-44.20000110.6T333T333-T335 PolarHBondContact O-N 3.02Å
336S47.3Very low56.5Low68 Ų68123 Ų12348%0.47666%0.663SS.*  trans-78.5136.5168.6-176.90000109.1K334 T338 G339K334-S336 PolarHBondContact O-N 3.08Å; S336-T338 PolarHBondContact O-N 2.71Å; S336-G339 PolarHBondContact O-N 3.35Å
337P52.8Low56.8Low133 Ų133124 Ų12486%0.86468%0.676SS**THydrogen-bonded Turntrans-67.410.3-170.626.6-34.2000115.5
338T57.3Low57.3Low108 Ų108126 Ų12666%0.66369%0.69SS**THydrogen-bonded Turntrans-113.47.1-179.8-33.40000113.1S336 I340S336-T338 PolarHBondContact O-N 2.71Å; T338-I340 PolarHBondContact O-N 3.24Å
339G54.8Low57.2Low62 Ų62127.8 Ų127.864%0.63969%0.691SS**  trans70.811.6172.500000115.8S336S336-G339 PolarHBondContact O-N 3.35Å
340I59.5Low57.3Low126 Ų126124.4 Ų124.465%0.64669%0.687SS**  trans-94.2110.4178.1-52.3-175.7000109.3T338 A342T338-I340 PolarHBondContact O-N 3.24Å; I340-A342 PolarHBondContact O-N 3.28Å
341Y56.3Low57.5Low133 Ų133124.1 Ų124.152%0.52270%0.699SS.*  trans-76.299168-73.3-90000109.1L326L326-Y341 HydrophobicContact CB-CE1 4.25Å; L326-Y341 HydrophobicContact CD1-CD2 4.49Å; L326-Y341 HydrophobicContact CD1-CE1 4.41Å; L326-Y341 HydrophobicContact CD1-CE2 4.06Å
342A61.4Low57.6Low74 Ų74121.9 Ų121.961%0.61269%0.691SS**  trans-118.3117.4167.600000108I340 P344I340-A342 PolarHBondContact O-N 3.28Å; A342-P344 WeakPolarHBondContact O-CD 3.46Å
343S61.5Low57.8Low87 Ų87124.5 Ų124.561%0.60870%0.698SS**  trans-67123.7167.868.80000107.6R345S343-R345 PolarHBondContact O-N 2.95Å
344P62.6Low57.8Low117 Ų117132.2 Ų132.276%0.7672%0.722SS**  trans-61.9113.1174.2-17.530.1000107.4A342 R346A342-P344 WeakPolarHBondContact O-CD 3.46Å; P344-R346 PolarHBondContact O-N 3.06Å
345R60.6Low57.6Low229 Ų229128.8 Ų128.886%0.86472%0.72SS**PPolyproline II helixtrans-58.3131165.7-68.6-175.4176.9-165.5-0.9106.7S343S343-R345 PolarHBondContact O-N 2.95Å
346R67.8Low57.4Low232 Ų232127.7 Ų127.788%0.87571%0.709SS**PPolyproline II helixtrans-50.2132.7175.8-68.2-179.8-179.7-175.5-0.9108.2P344 I348P344-R346 PolarHBondContact O-N 3.06Å; R346-I348 PolarHBondContact O-N 3.19Å
347P62.4Low57.5Low116 Ų116133.7 Ų133.775%0.75373%0.729SS**PPolyproline II helixtrans-51132.4174-23.331000109.1K349P347-K349 VanDerWaalsContact C-N 3.34Å; P347-K349 PolarHBondContact O-N 3.09Å
348I64.2Low57.5Low152 Ų152135.6 Ų135.678%0.77972%0.721SS**  trans-65.2100.2177.5-55.5172.7000106.5R346 G350R346-I348 PolarHBondContact O-N 3.19Å; I348-G350 PolarHBondContact O-N 3.37Å
349K53.9Low57.2Low188 Ų188135.2 Ų135.282%0.81773%0.729SS**THydrogen-bonded Turntrans-62.8126.1175.6-68.3-177.5177.2-174.90107.7P347P347-K349 VanDerWaalsContact C-N 3.34Å; P347-K349 PolarHBondContact O-N 3.09Å
350G61Low56.4Low61 Ų61140.3 Ų140.363%0.62973%0.73SS**THydrogen-bonded Turntrans107.9-4.1170.200000117.5I348I348-G350 PolarHBondContact O-N 3.37Å
351A56.3Low55.9Low92 Ų92139.2 Ų139.276%0.7673%0.73SS**SBendtrans-89.5-23.1177.800000114
352A52.8Low55.5Low70 Ų70141.1 Ų141.158%0.57975%0.75SS**SBendtrans-111.4130.3171.100000108R354A352-R354 PolarHBondContact O-N 3.08Å
353Q52.6Low54.9Low207 Ų207142 Ų14297%0.96775%0.747SS**  trans-66.650.9-175.6-151.5151.4-11.300113.1
354R56.1Low54.4Low213 Ų213143.6 Ų143.680%0.80476%0.756SS**  trans-91.5130.6167.6-73-170.2178.3-167.9-0.4108.2A352 I356A352-R354 PolarHBondContact O-N 3.08Å; R354-I356 PolarHBondContact O-N 3.26Å
355P51.5Low53.6Low129 Ų129143.2 Ų143.284%0.83875%0.751SS**  trans-59.4116.1179.223-30.6000109.2Q357P355-Q357 PolarHBondContact O-N 3.18Å; P355-Q357 VanDerWaalsContact O-N 3.13Å
356I51.8Low52.5Low85 Ų85136 Ų13644%0.43674%0.736SS.*  trans-67.6108.9172.3-64.6169.8000105.7R354 Y358R354-I356 PolarHBondContact O-N 3.26Å; I356-Y358 VanDerWaalsContact C-N 3.34Å; I356-Y358 HydrophobicContact CB-CD2 4.31Å; I356-Y358 HydrophobicContact CB-CE2 4.1Å; I356-Y358 HydrophobicContact CG2-CD2 3.83Å; I356-Y358 HydrophobicContact CG2-CE2 3.69Å; I356-Y358 HydrophobicContact CG2-CG 4.48Å; I356-Y358 PolarHBondContact O-N 3.08Å
357Q49.6Very low51.5Low193 Ų193130.3 Ų130.390%0.90273%0.729SS**  trans-64.4100.3164.8-88.9-175.3-3.100107.6P355 A359P355-Q357 PolarHBondContact O-N 3.18Å; P355-Q357 VanDerWaalsContact O-N 3.13Å; Q357-A359 PolarHBondContact O-N 3.23Å
358Y53.8Low50.6Low174 Ų174130.2 Ų130.268%0.68273%0.727SS**  trans-73104.9162.3-79.9-91.7000106.9I356 Y360I356-Y358 VanDerWaalsContact C-N 3.34Å; I356-Y358 HydrophobicContact CB-CD2 4.31Å; I356-Y358 HydrophobicContact CB-CE2 4.1Å; I356-Y358 HydrophobicContact CG2-CD2 3.83Å; I356-Y358 HydrophobicContact CG2-CE2 3.69Å; I356-Y358 HydrophobicContact CG2-CG 4.48Å; I356-Y358 PolarHBondContact O-N 3.08Å; Y358-Y360 PolarHBondContact O-N 3.36Å
359A49.5Very low49.9Very low100 Ų100126.1 Ų126.183%0.82671%0.709SS**  trans-67.891.5156.700000106.6Q357Q357-A359 PolarHBondContact O-N 3.23Å
360Y39Very low49.4Very low169 Ų169122.2 Ų122.266%0.66370%0.696SS**  trans-69.3129.5164.2-107-92.6000106.9Y358 D362 T363Y358-Y360 PolarHBondContact O-N 3.36Å; Y360-D362 PolarHBondContact O-N 3.01Å; Y360-T363 WeakPolarHBondContact CD1-OG1 3.45Å
361P48Very low48.7Very low102 Ų102126.6 Ų126.666%0.66270%0.7SS**  trans-60.3133.7156.528-30.3000106.6T363P361-T363 PolarHBondContact O-N 2.89Å; P361-T363 PolarHBondContact O-OG1 3Å
362D49.6Very low48.5Very low174 Ų174131.8 Ų131.893%0.9370%0.7SS**  trans-46.7100.8178.6-69.1-50.2000109.6Y360Y360-D362 PolarHBondContact O-N 3.01Å
363T48.3Very low48.3Very low91 Ų91137.2 Ų137.256%0.55871%0.706SS**  trans-98.1136.3178.718.60000107.1Y360 P361 V365Y360-T363 WeakPolarHBondContact CD1-OG1 3.45Å; P361-T363 PolarHBondContact O-N 2.89Å; P361-T363 PolarHBondContact O-OG1 3Å; T363-V365 PolarHBondContact O-N 3.29Å; T363-V365 VanDerWaalsContact O-N 3.16Å
364P50.7Low48.1Very low122 Ų122133 Ų13379%0.79269%0.686SS**  trans-65.3122.3-166.426.3-33.5000110
365V45.4Very low47.8Very low108 Ų108127.8 Ų127.866%0.65568%0.677SS**  trans-5.3123.9156.7-1620000114.9T363 T369T363-V365 PolarHBondContact O-N 3.29Å; T363-V365 VanDerWaalsContact O-N 3.16Å; V365-T369 HydrophobicContact CG1-CG2 3.43Å; V365-T369 VanDerWaalsContact CG1-CG2 3.43Å; V365-T369 WeakPolarHBondContact CG1-OG1 3.42Å
366S38.1Very low47.5Very low79 Ų79127.6 Ų127.655%0.55267%0.666SS**  trans-37.4145.9171.7-47.80000114.6T368 T369S366-T368 PolarHBondContact O-N 3.4Å; S366-T369 PolarHBondContact O-N 3.1Å; S366-T369 VanDerWaalsContact O-N 3.11Å; S366-T369 PolarHBondContact O-OG1 2.76Å
367P46.1Very low47.5Very low112 Ų112134 Ų13473%0.72768%0.684SS**THydrogen-bonded Turntrans-69.33.4-174.730.1-35.8000114.5T369P367-T369 VanDerWaalsContact C-N 3.33Å
368T44.3Very low47.8Very low114 Ų114136 Ų13670%0.69968%0.683SS**THydrogen-bonded Turntrans-82.7-11.2171.450.90000113.1S366S366-T368 PolarHBondContact O-N 3.4Å
369T48.5Very low48Very low66 Ų66133.2 Ų133.241%0.40568%0.68SS.*THydrogen-bonded Turntrans-92-20.2172.261.50000113.4V365 S366 P367 R372 R373V365-T369 HydrophobicContact CG1-CG2 3.43Å; V365-T369 VanDerWaalsContact CG1-CG2 3.43Å; V365-T369 WeakPolarHBondContact CG1-OG1 3.42Å; S366-T369 PolarHBondContact O-N 3.1Å; S366-T369 VanDerWaalsContact O-N 3.11Å; S366-T369 PolarHBondContact O-OG1 2.76Å; P367-T369 VanDerWaalsContact C-N 3.33Å; T369-R372 PolarHBondContact O-N 3.33Å; T369-R373 WeakPolarHBondContact O-CB 3.48Å; T369-R373 PolarHBondContact O-N 3.03Å
370L44.6Very low48.9Very low105 Ų105132.7 Ų132.755%0.5567%0.666SS.*Hα-helixtrans-73.6-41.6-179-157.2161.2000111.2R372 R373 E374L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.37Å; L370-R373 CarbonylContact O-C 3.52Å; L370-R373 WeakPolarHBondContact O-CA 3.5Å; L370-R373 WeakPolarHBondContact O-CB 2.96Å; L370-R373 PolarHBondContact O-N 3.1Å; L370-E374 PolarHBondContact O-N 2.76Å
371E46.9Very low50.9Low153 Ų153127 Ų12772%0.71565%0.65SS**Hα-helixtrans-62-35.1172.3-100.2-159.1147.400112.4R373 E374 V375E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.38Å; E371-E374 PolarHBondContact O-N 3.13Å; E371-V375 WeakPolarHBondContact O-CG2 3.44Å; E371-V375 PolarHBondContact O-N 3.23Å
372R50.2Low52.5Low202 Ų202127.1 Ų127.176%0.76265%0.649SS**Hα-helixtrans-71-25.9174.8-153.8176.8-156.4-130.93.2112.5T369 L370 Q376T369-R372 PolarHBondContact O-N 3.33Å; L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.37Å; R372-Q376 PolarHBondContact O-N 2.89Å
373R49.8Very low54Low183 Ų183126.7 Ų126.769%0.69164%0.635SS**Hα-helixtrans-82.4-22.5177.8-140.5173.6-172173.21.7112.9T369 L370 E371T369-R373 WeakPolarHBondContact O-CB 3.48Å; T369-R373 PolarHBondContact O-N 3.03Å; L370-R373 CarbonylContact O-C 3.52Å; L370-R373 WeakPolarHBondContact O-CA 3.5Å; L370-R373 WeakPolarHBondContact O-CB 2.96Å; L370-R373 PolarHBondContact O-N 3.1Å; E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.38Å
374E48.5Very low55.9Low120 Ų120125.5 Ų125.556%0.56162%0.624SS**Hα-helixtrans-80-34.5170.8-92.2174153.700112.9L370 E371 Q376 R377L370-E374 PolarHBondContact O-N 2.76Å; E371-E374 PolarHBondContact O-N 3.13Å; E374-Q376 PolarHBondContact O-N 3.2Å; E374-R377 PolarHBondContact O-N 2.95Å; E374-R377 VanDerWaalsContact O-N 3.13Å
375V49.2Very low57.5Low102 Ų102126 Ų12662%0.61862%0.617SS**Hα-helixtrans-66-28.4170.7179.50000111.4E371 R377 R378 L379E371-V375 WeakPolarHBondContact O-CG2 3.44Å; E371-V375 PolarHBondContact O-N 3.23Å; V375-R377 VanDerWaalsContact C-N 3.27Å; V375-R377 PolarHBondContact O-N 3.48Å; V375-R378 PolarHBondContact O-N 3.33Å; V375-R378 VanDerWaalsContact O-N 3.15Å; V375-L379 PolarHBondContact O-N 3.15Å
376Q46.5Very low59.7Low126 Ų126125.1 Ų125.159%0.58961%0.611SS**THydrogen-bonded Turntrans-69.6-16.4172.9-83.3-173-36.100114.6R372 E374 R378R372-Q376 PolarHBondContact O-N 2.89Å; E374-Q376 PolarHBondContact O-N 3.2Å; Q376-R378 PolarHBondContact O-N 3.49Å
377R50.8Low62.4Low220 Ų220127 Ų12783%0.8361%0.614SS**THydrogen-bonded Turntrans-830.2171-63.2-165.9-168.4177.94.6113.5E374 V375E374-R377 PolarHBondContact O-N 2.95Å; E374-R377 VanDerWaalsContact O-N 3.13Å; V375-R377 VanDerWaalsContact C-N 3.27Å; V375-R377 PolarHBondContact O-N 3.48Å
378R55.7Low64.7Low233 Ų233125.5 Ų125.588%0.87960%0.603SS**SBendtrans-119.53170.8-67.2-171.6179.4-119.81.1113.2V375 Q376V375-R378 PolarHBondContact O-N 3.33Å; V375-R378 VanDerWaalsContact O-N 3.15Å; Q376-R378 PolarHBondContact O-N 3.49Å
379L58.1Low67.1Low117 Ų117127.1 Ų127.161%0.61360%0.6SS**SBendtrans-102.1108.7174.8-160.965.9000106.7V375 P381V375-L379 PolarHBondContact O-N 3.15Å; L379-P381 WeakPolarHBondContact O-CD 3.2Å
380V67.8Low69.4Low88 Ų88130.5 Ų130.553%0.53361%0.61SS.*  trans-48.9117171.5174.60000106.5V382 I384V380-V382 PolarHBondContact O-N 2.81Å; V380-I384 HydrophobicContact CG1-CB 3.71Å; V380-I384 HydrophobicContact CG1-CG2 3.9Å
381P81.9Confident71.8Confident49 Ų49127.5 Ų127.532%0.31860%0.6SS.*  trans-53.8136.5178.9-26.833.7000109.8L379 Y383 I384 Q385L379-P381 WeakPolarHBondContact O-CD 3.2Å; P381-Y383 HydrophobicContact CB-CD1 3.29Å; P381-Y383 HydrophobicContact CB-CE1 2.98Å; P381-Y383 HydrophobicContact CB-CE2 4.42Å; P381-Y383 HydrophobicContact CB-CG 4.14Å; P381-Y383 HydrophobicContact CG-CD1 4.41Å; P381-Y383 HydrophobicContact CG-CE1 3.65Å; P381-Y383 PolarHBondContact O-N 3.39Å; P381-I384 HydrophobicContact CB-CD1 4.47Å; P381-I384 HydrophobicContact CB-CG1 4.23Å; P381-I384 HydrophobicContact CG-CD1 4.05Å; P381-I384 HydrophobicContact CG-CG1 4.36Å; P381-I384 WeakPolarHBondContact O-CB 3.38Å; P381-I384 PolarHBondContact O-N 3.23Å; P381-Q385 PolarHBondContact O-N 2.89Å
382V80.9Confident74.2Confident106 Ų106123.8 Ų123.864%0.64259%0.588SS**Hα-helixtrans-54.1-31-174.4178.50000111.5V380 I384 Q385 V386V380-V382 PolarHBondContact O-N 2.81Å; V382-I384 VanDerWaalsContact C-N 3.35Å; V382-I384 PolarHBondContact O-N 3.43Å; V382-Q385 PolarHBondContact O-N 3.49Å; V382-V386 HydrophobicContact CG1-CG2 4.45Å; V382-V386 WeakPolarHBondContact O-CG2 3.28Å; V382-V386 PolarHBondContact O-N 2.91Å
383Y81.9Confident76.4Confident164 Ų164117.1 Ų117.164%0.64357%0.569SS**Hα-helixtrans-62.6-35.8174.571.4-100.1000113.4P381 V386 L387P381-Y383 HydrophobicContact CB-CD1 3.29Å; P381-Y383 HydrophobicContact CB-CE1 2.98Å; P381-Y383 HydrophobicContact CB-CE2 4.42Å; P381-Y383 HydrophobicContact CB-CG 4.14Å; P381-Y383 HydrophobicContact CG-CD1 4.41Å; P381-Y383 HydrophobicContact CG-CE1 3.65Å; P381-Y383 PolarHBondContact O-N 3.39Å; Y383-V386 PolarHBondContact O-N 3.34Å; Y383-L387 VanDerWaalsContact O-CB 3.28Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.01Å
384I87.2Confident78.6Confident66 Ų66110.6 Ų110.634%0.33855%0.551SS.*Hα-helixtrans-69.5-38.8176.3-56-172.3000110V380 P381 V382 L387 V388V380-I384 HydrophobicContact CG1-CB 3.71Å; V380-I384 HydrophobicContact CG1-CG2 3.9Å; P381-I384 HydrophobicContact CB-CD1 4.47Å; P381-I384 HydrophobicContact CB-CG1 4.23Å; P381-I384 HydrophobicContact CG-CD1 4.05Å; P381-I384 HydrophobicContact CG-CG1 4.36Å; P381-I384 WeakPolarHBondContact O-CB 3.38Å; P381-I384 PolarHBondContact O-N 3.23Å; V382-I384 VanDerWaalsContact C-N 3.35Å; V382-I384 PolarHBondContact O-N 3.43Å; I384-L387 PolarHBondContact O-N 3Å; I384-V388 HydrophobicContact CG2-CG2 4.39Å; I384-V388 VanDerWaalsContact O-CG2 3.28Å; I384-V388 WeakPolarHBondContact O-CG2 3.48Å; I384-V388 PolarHBondContact O-N 3.43Å
385Q84.6Confident80.8Confident134 Ų134109.6 Ų109.663%0.62655%0.549SS*.Hα-helixtrans-63.8-41.6175.8-175.8177.6-1900111.7P381 V382 F389P381-Q385 PolarHBondContact O-N 2.89Å; V382-Q385 PolarHBondContact O-N 3.49Å; Q385-F389 PolarHBondContact O-N 3.38Å
386V92.6Very high83Confident89 Ų89109.8 Ų109.854%0.53955%0.546SS..Hα-helixtrans-66.6-40.2175.2175.40000111.3V382 Y383 F389 F390V382-V386 HydrophobicContact CG1-CG2 4.45Å; V382-V386 WeakPolarHBondContact O-CG2 3.28Å; V382-V386 PolarHBondContact O-N 2.91Å; Y383-V386 PolarHBondContact O-N 3.34Å; V386-F389 WeakPolarHBondContact O-CB 3.35Å; V386-F389 PolarHBondContact O-N 2.88Å; V386-F390 PolarHBondContact O-N 2.94Å
387L93.7Very high85.2Confident117 Ų117109.9 Ų109.961%0.61354%0.544SS*.Hα-helixtrans-66-40.3178.1-167.4149.1000112Y383 I384 F390 A391Y383-L387 VanDerWaalsContact O-CB 3.28Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.01Å; I384-L387 PolarHBondContact O-N 3Å; L387-F390 PolarHBondContact O-N 3.24Å; L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 3.04Å
388V94.9Very high87.1Confident82 Ų82104.1 Ų104.150%0.49753%0.529SS..Hα-helixtrans-65.3-40.1173.6172.20000111I384 A391 V392I384-V388 HydrophobicContact CG2-CG2 4.39Å; I384-V388 VanDerWaalsContact O-CG2 3.28Å; I384-V388 WeakPolarHBondContact O-CG2 3.48Å; I384-V388 PolarHBondContact O-N 3.43Å; V388-A391 PolarHBondContact O-N 3.26Å; V388-V392 WeakPolarHBondContact O-CG2 3.41Å; V388-V392 PolarHBondContact O-N 3.44Å
389F95.4Very high88.8Confident147 Ų14797.3 Ų97.365%0.64551%0.51SS*.Hα-helixtrans-61.6-46.4174.6178.4-98.8000111.5Q385 V386 A391 V392 V393Q385-F389 PolarHBondContact O-N 3.38Å; V386-F389 WeakPolarHBondContact O-CB 3.35Å; V386-F389 PolarHBondContact O-N 2.88Å; F389-A391 VanDerWaalsContact C-N 3.35Å; F389-A391 PolarHBondContact O-N 2.85Å; F389-V392 PolarHBondContact O-N 3.47Å; F389-V393 HydrophobicContact CD1-CG2 4.27Å; F389-V393 HydrophobicContact CE1-CG2 3.88Å; F389-V393 HydrophobicContact CE2-CG2 4.33Å; F389-V393 HydrophobicContact CZ-CG2 3.91Å; F389-V393 WeakPolarHBondContact O-CG2 3.34Å; F389-V393 PolarHBondContact O-N 3.42Å
390F96.2Very high90.4Very high138 Ų13897 Ų9761%0.60550%0.503SS*.Hα-helixtrans-62.9-41.3176.6-163.4-99.4000111.7V386 L387 V392 V393 C394V386-F390 PolarHBondContact O-N 2.94Å; L387-F390 PolarHBondContact O-N 3.24Å; F390-V392 PolarHBondContact O-N 3.36Å; F390-V393 PolarHBondContact O-N 2.8Å; F390-C394 WeakPolarHBondContact CE1-SG 3.45Å; F390-C394 WeakPolarHBondContact O-CB 3.35Å; F390-C394 PolarHBondContact O-N 3.3Å; F390-C394 PolarHBondContact O-SG 3.33Å
391A95.6Very high91.3Very high42 Ų4294.9 Ų94.935%0.34749%0.491SS..Hα-helixtrans-60.8-42.3174.900000112.3L387 V388 F389 C394 I395L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 3.04Å; V388-A391 PolarHBondContact O-N 3.26Å; F389-A391 VanDerWaalsContact C-N 3.35Å; F389-A391 PolarHBondContact O-N 2.85Å; A391-C394 PolarHBondContact O-N 3.26Å; A391-I395 WeakPolarHBondContact O-CB 3.45Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.2Å; A391-I395 PolarHBondContact O-N 2.95Å
392V96.8Very high91.3Very high74 Ų7497.1 Ų97.145%0.44850%0.5SS..Hα-helixtrans-64.7-43.8175.3172.10000111V388 F389 F390 I395 L396V388-V392 WeakPolarHBondContact O-CG2 3.41Å; V388-V392 PolarHBondContact O-N 3.44Å; F389-V392 PolarHBondContact O-N 3.47Å; F390-V392 PolarHBondContact O-N 3.36Å; V392-I395 PolarHBondContact O-N 2.89Å; V392-L396 HydrophobicContact CG1-CD1 3.99Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CB 3.38Å; V392-L396 VanDerWaalsContact O-CG 3.28Å; V392-L396 WeakPolarHBondContact O-CG 3.28Å; V392-L396 PolarHBondContact O-N 3.3Å
393V96.6Very high91.6Very high63 Ų6395.3 Ų95.338%0.38249%0.489SS..Hα-helixtrans-62.3-43.2176.2172.80000111.1F389 F390 L396 F397F389-V393 HydrophobicContact CD1-CG2 4.27Å; F389-V393 HydrophobicContact CE1-CG2 3.88Å; F389-V393 HydrophobicContact CE2-CG2 4.33Å; F389-V393 HydrophobicContact CZ-CG2 3.91Å; F389-V393 WeakPolarHBondContact O-CG2 3.34Å; F389-V393 PolarHBondContact O-N 3.42Å; F390-V393 PolarHBondContact O-N 2.8Å; V393-L396 PolarHBondContact O-N 2.81Å; V393-F397 VanDerWaalsContact O-CB 3.31Å; V393-F397 WeakPolarHBondContact O-CB 3.46Å; V393-F397 PolarHBondContact O-N 3.29Å
394C95.6Very high91.5Very high46 Ų4692.6 Ų92.631%0.31148%0.482SS..Hα-helixtrans-62-43.8174.7-73.10000112F390 A391 F397 L398F390-C394 WeakPolarHBondContact CE1-SG 3.45Å; F390-C394 WeakPolarHBondContact O-CB 3.35Å; F390-C394 PolarHBondContact O-N 3.3Å; F390-C394 PolarHBondContact O-SG 3.33Å; A391-C394 PolarHBondContact O-N 3.26Å; C394-F397 PolarHBondContact O-N 2.81Å; C394-L398 WeakPolarHBondContact O-CB 3.28Å; C394-L398 VanDerWaalsContact O-CG 3.28Å; C394-L398 WeakPolarHBondContact O-CG 3.26Å; C394-L398 PolarHBondContact O-N 2.88Å
395I95.4Very high91Very high98 Ų9893.9 Ų93.950%0.50349%0.49SS..Hα-helixtrans-63.7-43.2176.9-69.1163.1000110.5A391 V392 F397 L398 I399A391-I395 WeakPolarHBondContact O-CB 3.45Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.2Å; A391-I395 PolarHBondContact O-N 2.95Å; V392-I395 PolarHBondContact O-N 2.89Å; I395-F397 VanDerWaalsContact C-N 3.33Å; I395-F397 PolarHBondContact O-N 2.85Å; I395-L398 PolarHBondContact O-N 3.32Å; I395-I399 HydrophobicContact CG2-CD1 3.86Å; I395-I399 HydrophobicContact CG2-CG1 4.47Å; I395-I399 VanDerWaalsContact O-CG1 3.26Å; I395-I399 WeakPolarHBondContact O-CG1 3.31Å; I395-I399 PolarHBondContact O-N 3.5Å
396L93.9Very high90.5Very high107 Ų10791.1 Ų91.156%0.5648%0.482SS*.Hα-helixtrans-64.7-38.1176-70.5173.8000112V392 V393 I399 F400V392-L396 HydrophobicContact CG1-CD1 3.99Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CB 3.38Å; V392-L396 VanDerWaalsContact O-CG 3.28Å; V392-L396 WeakPolarHBondContact O-CG 3.28Å; V392-L396 PolarHBondContact O-N 3.3Å; V393-L396 PolarHBondContact O-N 2.81Å; L396-I399 PolarHBondContact O-N 3.41Å; L396-F400 VanDerWaalsContact O-CB 3.29Å; L396-F400 WeakPolarHBondContact O-CB 3.31Å; L396-F400 PolarHBondContact O-N 3.47Å
397F94.1Very high89.5Confident127 Ų12791 Ų9156%0.55748%0.479SS*.Hα-helixtrans-65.5-43174.1179.2-100.1000111.5V393 C394 I395 F400 V401V393-F397 VanDerWaalsContact O-CB 3.31Å; V393-F397 WeakPolarHBondContact O-CB 3.46Å; V393-F397 PolarHBondContact O-N 3.29Å; C394-F397 PolarHBondContact O-N 2.81Å; I395-F397 VanDerWaalsContact C-N 3.33Å; I395-F397 PolarHBondContact O-N 2.85Å; F397-F400 WeakPolarHBondContact O-CB 3.38Å; F397-F400 PolarHBondContact O-N 2.73Å; F397-V401 HydrophobicContact CD1-CG2 4.23Å; F397-V401 HydrophobicContact CE1-CG2 3.77Å; F397-V401 HydrophobicContact CE2-CG2 4.12Å; F397-V401 HydrophobicContact CZ-CG2 3.71Å; F397-V401 WeakPolarHBondContact O-CG2 3.42Å; F397-V401 PolarHBondContact O-N 3.48Å
398L90.6Very high88.4Confident99 Ų9987.1 Ų87.152%0.51847%0.467SS..Hα-helixtrans-63.3-42.3174.1-71.5174.8000111.1C394 I395 F400 V401 N402C394-L398 WeakPolarHBondContact O-CB 3.28Å; C394-L398 VanDerWaalsContact O-CG 3.28Å; C394-L398 WeakPolarHBondContact O-CG 3.26Å; C394-L398 PolarHBondContact O-N 2.88Å; I395-L398 PolarHBondContact O-N 3.32Å; L398-F400 VanDerWaalsContact C-N 3.3Å; L398-F400 PolarHBondContact O-N 2.84Å; L398-V401 PolarHBondContact O-N 3.2Å; L398-N402 VanDerWaalsContact O-CB 3.31Å; L398-N402 WeakPolarHBondContact O-CB 3.29Å; L398-N402 PolarHBondContact O-N 2.82Å; L398-N402 PolarHBondContact O-ND2 2.77Å
399I91.9Very high87.1Confident91 Ų9187.7 Ų87.747%0.46747%0.47SS..Hα-helixtrans-62.5-41.6174.2-68.5164.5000110.1I395 L396 N402 V403I395-I399 HydrophobicContact CG2-CD1 3.86Å; I395-I399 HydrophobicContact CG2-CG1 4.47Å; I395-I399 VanDerWaalsContact O-CG1 3.26Å; I395-I399 WeakPolarHBondContact O-CG1 3.31Å; I395-I399 PolarHBondContact O-N 3.5Å; L396-I399 PolarHBondContact O-N 3.41Å; I399-N402 PolarHBondContact O-N 3.39Å; I399-V403 HydrophobicContact CG2-CG2 4.1Å; I399-V403 VanDerWaalsContact O-CB 3.28Å; I399-V403 WeakPolarHBondContact O-CB 3.18Å; I399-V403 WeakPolarHBondContact O-CG2 3.28Å; I399-V403 PolarHBondContact O-N 2.83Å
400F89.9Confident85.9Confident109 Ų10984.4 Ų84.448%0.47846%0.462SS..Hα-helixtrans-61.1-51177.5178.2-101.4000111.4L396 F397 L398 N402 V403 E404L396-F400 VanDerWaalsContact O-CB 3.29Å; L396-F400 WeakPolarHBondContact O-CB 3.31Å; L396-F400 PolarHBondContact O-N 3.47Å; F397-F400 WeakPolarHBondContact O-CB 3.38Å; F397-F400 PolarHBondContact O-N 2.73Å; L398-F400 VanDerWaalsContact C-N 3.3Å; L398-F400 PolarHBondContact O-N 2.84Å; F400-N402 PolarHBondContact O-N 3.46Å; F400-V403 PolarHBondContact O-N 3.13Å; F400-E404 WeakPolarHBondContact CE1-OE2 3.34Å; F400-E404 VanDerWaalsContact CZ-CD 3.47Å; F400-E404 VanDerWaalsContact CZ-OE1 3.29Å; F400-E404 WeakPolarHBondContact CZ-OE1 3.15Å; F400-E404 WeakPolarHBondContact CZ-OE2 3.28Å; F400-E404 VanDerWaalsContact O-CB 3.28Å; F400-E404 WeakPolarHBondContact O-CB 3.02Å; F400-E404 PolarHBondContact O-N 3.24Å
401V88.3Confident84.7Confident45 Ų4582.9 Ų82.927%0.27346%0.46SS..Hα-helixtrans-59.7-46.8175.2171.70000110.9F397 L398 V403 E404 D405F397-V401 HydrophobicContact CD1-CG2 4.23Å; F397-V401 HydrophobicContact CE1-CG2 3.77Å; F397-V401 HydrophobicContact CE2-CG2 4.12Å; F397-V401 HydrophobicContact CZ-CG2 3.71Å; F397-V401 WeakPolarHBondContact O-CG2 3.42Å; F397-V401 PolarHBondContact O-N 3.48Å; L398-V401 PolarHBondContact O-N 3.2Å; V401-V403 VanDerWaalsContact C-N 3.32Å; V401-V403 PolarHBondContact O-N 3.26Å; V401-E404 PolarHBondContact O-N 2.8Å; V401-D405 VanDerWaalsContact CG1-OD2 3.23Å; V401-D405 WeakPolarHBondContact CG1-OD2 3.21Å; V401-D405 VanDerWaalsContact O-CB 3.23Å; V401-D405 WeakPolarHBondContact O-CB 3.23Å; V401-D405 PolarHBondContact O-N 2.73Å
402N82.3Confident83.6Confident96 Ų9686.3 Ų86.351%0.51347%0.472SS..Hα-helixtrans-63.8-36177.2-78.3-74000112.5L398 I399 F400 T406L398-N402 VanDerWaalsContact O-CB 3.31Å; L398-N402 WeakPolarHBondContact O-CB 3.29Å; L398-N402 PolarHBondContact O-N 2.82Å; L398-N402 PolarHBondContact O-ND2 2.77Å; I399-N402 PolarHBondContact O-N 3.39Å; F400-N402 PolarHBondContact O-N 3.46Å; N402-T406 WeakPolarHBondContact O-CB 2.92Å; N402-T406 WeakPolarHBondContact O-CG2 3.29Å; N402-T406 PolarHBondContact O-N 2.77Å; N402-T406 PolarHBondContact O-OG1 2.78Å
403V86.9Confident82.6Confident67 Ų6787.7 Ų87.741%0.40648%0.476SS..Hα-helixtrans-69.4-43.4176166.40000110I399 F400 V401 T406 N407I399-V403 HydrophobicContact CG2-CG2 4.1Å; I399-V403 VanDerWaalsContact O-CB 3.28Å; I399-V403 WeakPolarHBondContact O-CB 3.18Å; I399-V403 WeakPolarHBondContact O-CG2 3.28Å; I399-V403 PolarHBondContact O-N 2.83Å; F400-V403 PolarHBondContact O-N 3.13Å; V401-V403 VanDerWaalsContact C-N 3.32Å; V401-V403 PolarHBondContact O-N 3.26Å; V403-T406 VanDerWaalsContact CA-OG1 3.31Å; V403-T406 WeakPolarHBondContact CA-OG1 3.39Å; V403-T406 PolarHBondContact O-N 3.36Å; V403-T406 PolarHBondContact O-OG1 3.19Å; V403-N407 WeakPolarHBondContact O-CB 3.31Å; V403-N407 PolarHBondContact O-N 2.82Å; V403-N407 PolarHBondContact O-ND2 3.14Å; V403-N407 VanDerWaalsContact O-ND2 3.13Å; V403-N407 PolarHBondContact O-OD1 3.48Å
404E78.9Confident81.5Confident108 Ų10890 Ų9051%0.50548%0.483SS..Hα-helixtrans-68.1-37.5179-150.2153.1-131.300111.5F400 V401 N407 G408F400-E404 WeakPolarHBondContact CE1-OE2 3.34Å; F400-E404 VanDerWaalsContact CZ-CD 3.47Å; F400-E404 VanDerWaalsContact CZ-OE1 3.29Å; F400-E404 WeakPolarHBondContact CZ-OE1 3.15Å; F400-E404 WeakPolarHBondContact CZ-OE2 3.28Å; F400-E404 VanDerWaalsContact O-CB 3.28Å; F400-E404 WeakPolarHBondContact O-CB 3.02Å; F400-E404 PolarHBondContact O-N 3.24Å; V401-E404 PolarHBondContact O-N 2.8Å; E404-N407 PolarHBondContact O-N 3.35Å; E404-G408 PolarHBondContact O-N 3.44Å
405D76.8Confident80.4Confident92 Ų9291.6 Ų91.649%0.49250%0.495SS..Hα-helixtrans-68.3-39.4170.9-68.5-27.8000111.2V401 N407 G408 V409V401-D405 VanDerWaalsContact CG1-OD2 3.23Å; V401-D405 WeakPolarHBondContact CG1-OD2 3.21Å; V401-D405 VanDerWaalsContact O-CB 3.23Å; V401-D405 WeakPolarHBondContact O-CB 3.23Å; V401-D405 PolarHBondContact O-N 2.73Å; D405-N407 VanDerWaalsContact C-N 3.35Å; D405-G408 PolarHBondContact O-N 2.81Å; D405-V409 WeakPolarHBondContact O-CB 3.23Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.34Å
406T73.8Confident79.3Confident77 Ų7793 Ų9347%0.47250%0.503SS..Hα-helixtrans-67.8-36.2173.760.90000111.7N402 V403 V409 V410N402-T406 WeakPolarHBondContact O-CB 2.92Å; N402-T406 WeakPolarHBondContact O-CG2 3.29Å; N402-T406 PolarHBondContact O-N 2.77Å; N402-T406 PolarHBondContact O-OG1 2.78Å; V403-T406 VanDerWaalsContact CA-OG1 3.31Å; V403-T406 WeakPolarHBondContact CA-OG1 3.39Å; V403-T406 PolarHBondContact O-N 3.36Å; V403-T406 PolarHBondContact O-OG1 3.19Å; T406-V409 PolarHBondContact O-N 2.8Å; T406-V410 WeakPolarHBondContact O-CB 3.19Å; T406-V410 WeakPolarHBondContact O-CG2 3.45Å; T406-V410 PolarHBondContact O-N 2.81Å
407N71.5Confident78Confident87 Ų8793.9 Ų93.947%0.46551%0.508SS..Hα-helixtrans-66.7-42173.4-65.8-27.4000110V403 E404 D405 V409 V410 D411V403-N407 WeakPolarHBondContact O-CB 3.31Å; V403-N407 PolarHBondContact O-N 2.82Å; V403-N407 PolarHBondContact O-ND2 3.14Å; V403-N407 VanDerWaalsContact O-ND2 3.13Å; V403-N407 PolarHBondContact O-OD1 3.48Å; E404-N407 PolarHBondContact O-N 3.35Å; D405-N407 VanDerWaalsContact C-N 3.35Å; N407-V409 PolarHBondContact O-N 3.49Å; N407-V410 PolarHBondContact O-N 3.38Å; N407-D411 WeakPolarHBondContact O-CB 3.35Å; N407-D411 PolarHBondContact O-N 2.8Å
408G71.6Confident76.5Confident35 Ų3594.3 Ų94.336%0.36151%0.512SS..Hα-helixtrans-64.8-36.917500000113.4E404 D405 L412E404-G408 PolarHBondContact O-N 3.44Å; D405-G408 PolarHBondContact O-N 2.81Å; G408-L412 WeakPolarHBondContact O-CB 3.07Å; G408-L412 PolarHBondContact O-N 2.79Å
409V68Low74.6Confident94 Ų9494.2 Ų94.257%0.5752%0.518SS*.Hα-helixtrans-73.8-37.5174.7171.40000111.5D405 T406 N407 L412 L413D405-V409 WeakPolarHBondContact O-CB 3.23Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.34Å; T406-V409 PolarHBondContact O-N 2.8Å; N407-V409 PolarHBondContact O-N 3.49Å; V409-L412 PolarHBondContact O-N 3.2Å; V409-L413 VanDerWaalsContact O-CB 3.31Å; V409-L413 WeakPolarHBondContact O-CB 3.38Å; V409-L413 PolarHBondContact O-N 2.9Å
410V69.4Low72.9Confident78 Ų7895.3 Ų95.347%0.47353%0.531SS..Hα-helixtrans-67.6-40.8174.8168.90000110.8T406 N407 L413 E414T406-V410 WeakPolarHBondContact O-CB 3.19Å; T406-V410 WeakPolarHBondContact O-CG2 3.45Å; T406-V410 PolarHBondContact O-N 2.81Å; N407-V410 PolarHBondContact O-N 3.38Å; V410-L413 CarbonylContact O-C 3.6Å; V410-L413 PolarHBondContact O-N 3.45Å; V410-E414 WeakPolarHBondContact O-CB 3.31Å; V410-E414 PolarHBondContact O-N 3.05Å
411D71.4Confident71.1Confident106 Ų10697.8 Ų97.857%0.56755%0.55SS*.Hα-helixtrans-63.9-40.4173.8-81.5-10.2000111.6N407 L413 E414 S415N407-D411 WeakPolarHBondContact O-CB 3.35Å; N407-D411 PolarHBondContact O-N 2.8Å; D411-L413 VanDerWaalsContact C-N 3.35Å; D411-E414 PolarHBondContact O-N 3.37Å; D411-S415 VanDerWaalsContact O-CB 3.31Å; D411-S415 WeakPolarHBondContact O-CB 3.31Å; D411-S415 PolarHBondContact O-N 2.88Å
412L73.1Confident69.6Low114 Ų11499.2 Ų99.260%0.59757%0.573SS**Hα-helixtrans-63.7-40172.3-107160.4000112G408 V409 S415 L416G408-L412 WeakPolarHBondContact O-CB 3.07Å; G408-L412 PolarHBondContact O-N 2.79Å; V409-L412 PolarHBondContact O-N 3.2Å; L412-S415 PolarHBondContact O-N 2.93Å; L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 3.44Å
413L73.9Confident68.3Low102 Ų102103.6 Ų103.653%0.53459%0.591SS.*Hα-helixtrans-69.7-36.9177.9-166.671000111.5V409 V410 D411 L416 N417V409-L413 VanDerWaalsContact O-CB 3.31Å; V409-L413 WeakPolarHBondContact O-CB 3.38Å; V409-L413 PolarHBondContact O-N 2.9Å; V410-L413 CarbonylContact O-C 3.6Å; V410-L413 PolarHBondContact O-N 3.45Å; D411-L413 VanDerWaalsContact C-N 3.35Å; L413-L416 PolarHBondContact O-N 3.43Å; L413-N417 WeakPolarHBondContact O-CB 3.47Å; L413-N417 VanDerWaalsContact O-CG 3.25Å; L413-N417 PolarHBondContact O-N 2.98Å; L413-N417 PolarHBondContact O-ND2 2.88Å
414E74.3Confident67Low111 Ų111108.1 Ų108.152%0.51961%0.613SS.*Hα-helixtrans-68.2-39.1173.6-175.8154-17300111.4V410 D411 L416 N417 Q418V410-E414 WeakPolarHBondContact O-CB 3.31Å; V410-E414 PolarHBondContact O-N 3.05Å; D411-E414 PolarHBondContact O-N 3.37Å; E414-L416 VanDerWaalsContact C-N 3.32Å; E414-L416 PolarHBondContact O-N 3.09Å; E414-N417 PolarHBondContact O-N 3.04Å; E414-Q418 WeakPolarHBondContact O-CG 3.42Å; E414-Q418 PolarHBondContact O-N 3.46Å; E414-Q418 VanDerWaalsContact O-N 3.09Å
415S73.3Confident66Low81 Ų81112.4 Ų112.457%0.56663%0.633SS**Hα-helixtrans-69.1-27.2173.5-157.60000113.1D411 L412D411-S415 VanDerWaalsContact O-CB 3.31Å; D411-S415 WeakPolarHBondContact O-CB 3.31Å; D411-S415 PolarHBondContact O-N 2.88Å; L412-S415 PolarHBondContact O-N 2.93Å
416L70.9Confident65.2Low128 Ų128113.2 Ų113.267%0.6764%0.641SS**Hα-helixtrans-80.8-31.6172.5-110.1128.6000113L412 L413 E414 Q418L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 3.44Å; L413-L416 PolarHBondContact O-N 3.43Å; E414-L416 VanDerWaalsContact C-N 3.32Å; E414-L416 PolarHBondContact O-N 3.09Å; L416-Q418 VanDerWaalsContact C-N 3.25Å
417N67.2Low64.1Low125 Ų125119.5 Ų119.567%0.66866%0.656SS**Hα-helixtrans-72.6-20.8173.8-77.7-42.2000112.2L413 E414 C419L413-N417 WeakPolarHBondContact O-CB 3.47Å; L413-N417 VanDerWaalsContact O-CG 3.25Å; L413-N417 PolarHBondContact O-N 2.98Å; L413-N417 PolarHBondContact O-ND2 2.88Å; E414-N417 PolarHBondContact O-N 3.04Å; N417-C419 PolarHBondContact O-N 3.34Å
418Q62.7Low63.1Low136 Ų136122 Ų12264%0.63667%0.67SS**  trans-79.162.5165.1-69.6168.830.800110.2E414 L416E414-Q418 WeakPolarHBondContact O-CG 3.42Å; E414-Q418 PolarHBondContact O-N 3.46Å; E414-Q418 VanDerWaalsContact O-N 3.09Å; L416-Q418 VanDerWaalsContact C-N 3.25Å
419C50Low62.1Low96 Ų96124.9 Ų124.965%0.64969%0.69SS**  trans-72.4135.4167-166.90000108.8N417 D421N417-C419 PolarHBondContact O-N 3.34Å; C419-D421 PolarHBondContact O-N 2.85Å
420P57.7Low61.4Low114 Ų114125 Ų12574%0.7470%0.701SS**  trans-70.1118.8178.128-32.4000109.1G422P420-G422 VanDerWaalsContact C-N 3.29Å; P420-G422 PolarHBondContact O-N 3.27Å
421D50.3Low60.3Low162 Ų162127.9 Ų127.987%0.86672%0.723SS**  trans-63.396.6166.2-76.8-36.2000108.1C419 E423C419-D421 PolarHBondContact O-N 2.85Å; D421-E423 PolarHBondContact O-N 3.41Å
422G58.5Low59.4Low75 Ų75126.4 Ų126.477%0.77373%0.732SS**  trans-74.2110.6167.200000109P420P420-G422 VanDerWaalsContact C-N 3.29Å; P420-G422 PolarHBondContact O-N 3.27Å
423E54.3Low58.5Low187 Ų187130.2 Ų130.287%0.87475%0.747SS**  trans-103.889159.746.5-171.314800109.1D421D421-E423 PolarHBondContact O-N 3.41Å
424D58.6Low57.3Low162 Ų162137 Ų13787%0.86678%0.783SS**  trans-89.3110.8154-82.5-39.9000107.5
425E58.9Low56.5Low198 Ų198138.4 Ų138.493%0.92580%0.796SS**  trans-130.6106.8156.7-158.6168.6174.400110.9
426T60Low55.6Low110 Ų110141.4 Ų141.468%0.67581%0.808SS**  trans-78.1138.6172.8-26.50000109.6
427R49.7Very low54.7Low209 Ų209142.1 Ų142.179%0.78982%0.816SS**  trans141.1116134-77.8178162.41070.9115.2
428D50.9Low54Low140 Ų140143.1 Ų143.175%0.74982%0.824SS**  63.2137.3122.7-52.4-28.7000122.9
429A50.2Low53.5Low95 Ų95143.6 Ų143.679%0.78584%0.836SS**  trans95.699.2145.900000119.7
430A53.2Low53.7Low96 Ų96146.7 Ų146.779%0.79385%0.849SS**  51.7117.9117.800000121.1
431C47.2Very low53.4Low139 Ų139149.1 Ų149.194%0.93986%0.857SS**  trans155.1127.8139.6-88.60000106
432G51.8Low53.7Low74 Ų74148.1 Ų148.176%0.76386%0.856SS**  cis131.9113.830.800000106.5
433E55.9Low53.3Low195 Ų195154.2 Ų154.291%0.91186%0.863SS**  trans38.9126.6163.5-65.6-162.6115.300122.3
434L48.3Very low53.2Low245 Ų245151.2 Ų151.2100%1.28386%0.862SS**  -154.40105.3-99.7168000111.1

Retrieved 434 of 434 residues in 273.3 ms (Link to these results)