A0A096MPW9_PAPAN Loading...

Solute carrier family 39 member 5

AlphaFold DB , UniProt , Accession A0A096MPW9, Species PAPAN (Papio anubis, Olive baboon), Gene SLC39A5, Length 540 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
1M37.6Very low45.2Very low246 Ų246119.5 Ų119.5100%1.21270%0.698SS**  0920-69.9164.289.200107.3
2M35.1Very low45.5Very low197 Ų197112.8 Ų112.897%0.9767%0.674SS**  trans-110.4104174.9-77.7161.410300106.1
3G37.1Very low46.4Very low76 Ų76113.8 Ų113.878%0.78467%0.665SS**  trans-71.2137.8171.800000109.9
4S42Very low46.4Very low77 Ų77110.9 Ų110.954%0.53865%0.653SS.*  trans-61131.3-178.5170.10000111.8V6S4-V6 PolarHBondContact O-N 2.94Å; S4-V6 VanDerWaalsContact O-N 3.09Å; S4-V6 PolarHBondContact OG-N 2.9Å
5P49.3Very low46.8Very low95 Ų95109 Ų10962%0.61764%0.642SS**THydrogen-bonded Turntrans-69.1-5-179.627.7-33.9000114
6V49.5Very low47Very low85 Ų85113.8 Ų113.852%0.51565%0.646SS.*Hα-helixtrans-75.5-27.3-175.5-175.30000112.5S4 H8 L9 L10S4-V6 PolarHBondContact O-N 2.94Å; S4-V6 VanDerWaalsContact O-N 3.09Å; S4-V6 PolarHBondContact OG-N 2.9Å; V6-H8 PolarHBondContact O-N 3.3Å; V6-L9 PolarHBondContact O-N 3.25Å; V6-L10 HydrophobicContact CG1-CD1 4.25Å; V6-L10 PolarHBondContact O-N 3.41Å
7S46Very low47.4Very low86 Ų86112.2 Ų112.260%0.60164%0.639SS**Hα-helixtrans-71.8-30-178.6-163.90000113.4A11S7-A11 PolarHBondContact O-N 3.36Å
8H49.9Very low47.5Very low156 Ų156112.9 Ų112.972%0.72264%0.639SS**Hα-helixtrans-80.8-26.9177.9-68.8-68.2000112.5V6 G12V6-H8 PolarHBondContact O-N 3.3Å; H8-G12 PolarHBondContact O-N 3.23Å
9L49.6Very low47.2Very low128 Ų128113.1 Ų113.167%0.6764%0.638SS**Hα-helixtrans-71.7-38.4175.7-82.9158.4000112.4V6 F13V6-L9 PolarHBondContact O-N 3.25Å; L9-F13 WeakPolarHBondContact O-CB 2.93Å; L9-F13 PolarHBondContact O-N 2.93Å
10L51.2Low46.9Very low112 Ų112110.2 Ų110.259%0.58663%0.634SS**Hα-helixtrans-70.9-41.2176.1-84.8154.9000112.4V6 G12 F13 C14V6-L10 HydrophobicContact CG1-CD1 4.25Å; V6-L10 PolarHBondContact O-N 3.41Å; L10-G12 VanDerWaalsContact C-N 3.34Å; L10-F13 PolarHBondContact O-N 2.74Å; L10-C14 PolarHBondContact O-N 2.74Å; L10-C14 VanDerWaalsContact O-N 3.07Å; L10-C14 PolarHBondContact O-SG 3.05Å
11A49.8Very low46.5Very low56 Ų56116.6 Ų116.646%0.46365%0.648SS.*Hα-helixtrans-64.3-39.3173.600000111.9S7 V15S7-A11 PolarHBondContact O-N 3.36Å; A11-V15 VanDerWaalsContact O-CG2 3.28Å; A11-V15 WeakPolarHBondContact O-CG2 3.46Å; A11-V15 PolarHBondContact O-N 3.03Å; A11-V15 VanDerWaalsContact O-N 3.09Å
12G48.6Very low46.5Very low40 Ų40110.7 Ų110.741%0.41263%0.625SS.*Hα-helixtrans-66.2-36.8174.800000113.5H8 L10 W16H8-G12 PolarHBondContact O-N 3.23Å; L10-G12 VanDerWaalsContact C-N 3.34Å; G12-W16 VanDerWaalsContact O-CB 3.31Å; G12-W16 WeakPolarHBondContact O-CB 3.14Å; G12-W16 PolarHBondContact O-N 3.12Å
13F57.9Low46.4Very low126 Ų126104.1 Ų104.155%0.55361%0.609SS**Hα-helixtrans-70.7-39.7177.6-164.4-99.1000112.1L9 L10 W16 V17L9-F13 WeakPolarHBondContact O-CB 2.93Å; L9-F13 PolarHBondContact O-N 2.93Å; L10-F13 PolarHBondContact O-N 2.74Å; F13-W16 HydrophobicContact CE2-CE3 4.35Å; F13-W16 HydrophobicContact CE2-CZ3 4.49Å; F13-W16 PolarHBondContact O-N 3.41Å; F13-V17 HydrophobicContact CD1-CG2 4.11Å; F13-V17 HydrophobicContact CE1-CG2 3.88Å; F13-V17 HydrophobicContact CZ-CG2 4.32Å; F13-V17 VanDerWaalsContact O-CG2 3.3Å; F13-V17 WeakPolarHBondContact O-CG2 3.41Å; F13-V17 PolarHBondContact O-N 3.12Å
14C46.8Very low46.3Very low73 Ų73104.2 Ų104.249%0.49361%0.61SS.*Hα-helixtrans-64.9-39.9174-70.80000112.2L10 V17 I18L10-C14 PolarHBondContact O-N 2.74Å; L10-C14 VanDerWaalsContact O-N 3.07Å; L10-C14 PolarHBondContact O-SG 3.05Å; C14-V17 PolarHBondContact O-N 3.31Å; C14-I18 WeakPolarHBondContact O-CB 3.41Å; C14-I18 WeakPolarHBondContact O-CD1 3.4Å; C14-I18 WeakPolarHBondContact O-CG1 3.13Å; C14-I18 PolarHBondContact O-N 3.26Å
15V52.4Low46Very low82 Ų82105.9 Ų105.950%0.49762%0.621SS.*Hα-helixtrans-68.2-35.4175.3171.70000111.6A11 I18 L19A11-V15 VanDerWaalsContact O-CG2 3.28Å; A11-V15 WeakPolarHBondContact O-CG2 3.46Å; A11-V15 PolarHBondContact O-N 3.03Å; A11-V15 VanDerWaalsContact O-N 3.09Å; V15-I18 PolarHBondContact O-N 3.26Å; V15-L19 HydrophobicContact CG1-CD1 3.49Å; V15-L19 VanDerWaalsContact CG1-CD1 3.49Å; V15-L19 HydrophobicContact CG1-CG 4.29Å; V15-L19 VanDerWaalsContact O-CB 3.26Å; V15-L19 WeakPolarHBondContact O-CB 3.41Å; V15-L19 WeakPolarHBondContact O-CG 3.22Å; V15-L19 PolarHBondContact O-N 3.24Å
16W49.2Very low45.8Very low186 Ų186107.6 Ų107.671%0.70563%0.63SS**Hα-helixtrans-72.1-34.9176.7-167.663.3000113.1G12 F13 G20G12-W16 VanDerWaalsContact O-CB 3.31Å; G12-W16 WeakPolarHBondContact O-CB 3.14Å; G12-W16 PolarHBondContact O-N 3.12Å; F13-W16 HydrophobicContact CE2-CE3 4.35Å; F13-W16 HydrophobicContact CE2-CZ3 4.49Å; F13-W16 PolarHBondContact O-N 3.41Å; W16-G20 WeakPolarHBondContact O-CA 3.4Å; W16-G20 PolarHBondContact O-N 3Å
17V54.5Low45.5Very low87 Ų87108.2 Ų108.253%0.52764%0.635SS.*Hα-helixtrans-70.4-35173.5172.20000111.5F13 C14F13-V17 HydrophobicContact CD1-CG2 4.11Å; F13-V17 HydrophobicContact CE1-CG2 3.88Å; F13-V17 HydrophobicContact CZ-CG2 4.32Å; F13-V17 VanDerWaalsContact O-CG2 3.3Å; F13-V17 WeakPolarHBondContact O-CG2 3.41Å; F13-V17 PolarHBondContact O-N 3.12Å; C14-V17 PolarHBondContact O-N 3.31Å
18I48.6Very low45.4Very low124 Ų124110.7 Ų110.764%0.63664%0.642SS**Hα-helixtrans-77.9-36.6178.3-66.8168.9000111.9C14 V15C14-I18 WeakPolarHBondContact O-CB 3.41Å; C14-I18 WeakPolarHBondContact O-CD1 3.4Å; C14-I18 WeakPolarHBondContact O-CG1 3.13Å; C14-I18 PolarHBondContact O-N 3.26Å; V15-I18 PolarHBondContact O-N 3.26Å
19L42.7Very low45.5Very low117 Ų117109.3 Ų109.361%0.61364%0.639SS**Hα-helixtrans-87.8-21.4179-69.8171000113.9V15 W21 V22V15-L19 HydrophobicContact CG1-CD1 3.49Å; V15-L19 VanDerWaalsContact CG1-CD1 3.49Å; V15-L19 HydrophobicContact CG1-CG 4.29Å; V15-L19 VanDerWaalsContact O-CB 3.26Å; V15-L19 WeakPolarHBondContact O-CB 3.41Å; V15-L19 WeakPolarHBondContact O-CG 3.22Å; V15-L19 PolarHBondContact O-N 3.24Å; L19-W21 PolarHBondContact O-N 2.91Å; L19-V22 PolarHBondContact O-N 3.36Å
20G40Very low45.9Very low55 Ų55105.1 Ų105.157%0.56763%0.627SS**THydrogen-bonded Turntrans-69-11.6179.400000114.5W16W16-G20 WeakPolarHBondContact O-CA 3.4Å; W16-G20 PolarHBondContact O-N 3Å
21W39.2Very low46.6Very low244 Ų244103.4 Ų103.492%0.92462%0.622SS**THydrogen-bonded Turntrans-96.9-9.1178.3-119.340.5000114.3L19 G23L19-W21 PolarHBondContact O-N 2.91Å; W21-G23 VanDerWaalsContact C-N 3.32Å; W21-G23 PolarHBondContact O-N 3.2Å
22V37.5Very low47.1Very low122 Ų122103.5 Ų103.574%0.73962%0.623SS**  trans-101.946.7176.9-168.30000110.1L19 G24L19-V22 PolarHBondContact O-N 3.36Å; V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 2.86Å
23G33.6Very low48.1Very low60 Ų60107.1 Ų107.162%0.61963%0.63SS**  trans-8578.4166.300000109.5W21 S25W21-G23 VanDerWaalsContact C-N 3.32Å; W21-G23 PolarHBondContact O-N 3.2Å; G23-S25 PolarHBondContact O-N 3.15Å
24G34.9Very low48.9Very low78 Ų78108.2 Ų108.280%0.80464%0.636SS**  trans-56.899.617500000110.8V22V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 2.86Å
25S36.1Very low50.4Low111 Ų111110.5 Ų110.578%0.77664%0.64SS**PPolyproline II helixtrans-75122.5167.9-580000107.2G23G23-S25 PolarHBondContact O-N 3.15Å
26V43.9Very low51.7Low132 Ų132111.2 Ų111.280%0.864%0.638SS**PPolyproline II helixtrans-46.3125.3168.9177.60000108.1N28V26-N28 PolarHBondContact O-N 3.38Å
27P42.7Very low53.1Low98 Ų98106.4 Ų106.464%0.63663%0.626SS**PPolyproline II helixtrans-63.6117.9-17823.3-30.2000108.3L29P27-L29 PolarHBondContact O-N 2.94Å; P27-L29 VanDerWaalsContact O-N 3.11Å
28N44.4Very low54.5Low137 Ų137107.4 Ų107.473%0.73362%0.624SS**  trans-65.7106.2161.3-126.3-28.4000104.9V26 G30 P31V26-N28 PolarHBondContact O-N 3.38Å; N28-G30 PolarHBondContact O-N 2.9Å; N28-P31 HydrophobicContact CB-CG 4.36Å; N28-P31 WeakPolarHBondContact O-CD 3.32Å; N28-P31 VanDerWaalsContact O-CG 3.31Å; N28-P31 WeakPolarHBondContact O-CG 3.22Å
29L51.1Low56.3Low127 Ų127108.5 Ų108.567%0.66562%0.622SS**Hα-helixtrans-66.8-16.4-177.8-89.289.6000113.2P27 A32 E33P27-L29 PolarHBondContact O-N 2.94Å; P27-L29 VanDerWaalsContact O-N 3.11Å; L29-A32 PolarHBondContact O-N 3.38Å; L29-E33 WeakPolarHBondContact O-CB 3.45Å; L29-E33 PolarHBondContact O-N 3.32Å
30G58.8Low58.3Low40 Ų40103.7 Ų103.741%0.41260%0.597SS.*Hα-helixtrans-56.7-52.6-179.100000115.2N28 Q34N28-G30 PolarHBondContact O-N 2.9Å; G30-Q34 WeakPolarHBondContact O-CB 3.29Å; G30-Q34 PolarHBondContact O-N 3.15Å
31P66.5Low60.4Low76 Ų76104.3 Ų104.349%0.49460%0.596SS.*Hα-helixtrans-63.5-40.3177.218.2-31.5000113.8N28 Q34 E35N28-P31 HydrophobicContact CB-CG 4.36Å; N28-P31 WeakPolarHBondContact O-CD 3.32Å; N28-P31 VanDerWaalsContact O-CG 3.31Å; N28-P31 WeakPolarHBondContact O-CG 3.22Å; P31-Q34 PolarHBondContact O-N 3.42Å; P31-E35 PolarHBondContact O-N 2.76Å
32A60.5Low62.6Low59 Ų5997.5 Ų97.549%0.48858%0.575SS.*Hα-helixtrans-68.7-40.2-178.700000112.5L29 Q34 E35 Q36L29-A32 PolarHBondContact O-N 3.38Å; A32-Q34 VanDerWaalsContact C-N 3.29Å; A32-Q34 PolarHBondContact O-N 3.4Å; A32-E35 PolarHBondContact O-N 3.45Å; A32-Q36 WeakPolarHBondContact O-CB 3.41Å; A32-Q36 PolarHBondContact O-N 3.41Å
33E69.1Low65.1Low116 Ų11693.7 Ų93.754%0.54255%0.55SS..Hα-helixtrans-65.2-35.6174.6-172.5178-178.200111.3L29 N37L29-E33 WeakPolarHBondContact O-CB 3.45Å; L29-E33 PolarHBondContact O-N 3.32Å; E33-N37 WeakPolarHBondContact O-CB 3.37Å; E33-N37 VanDerWaalsContact O-CG 3.23Å; E33-N37 PolarHBondContact O-N 3.41Å; E33-N37 PolarHBondContact O-ND2 3.19Å
34Q75.5Confident67.7Low149 Ų14991.4 Ų91.470%0.69652%0.523SS*.Hα-helixtrans-69.2-40.7177.4-168.9163.71.900112.3G30 P31 A32 H38G30-Q34 WeakPolarHBondContact O-CB 3.29Å; G30-Q34 PolarHBondContact O-N 3.15Å; P31-Q34 PolarHBondContact O-N 3.42Å; A32-Q34 VanDerWaalsContact C-N 3.29Å; A32-Q34 PolarHBondContact O-N 3.4Å; Q34-H38 PolarHBondContact O-N 2.96Å
35E77.1Confident70.1Confident121 Ų12190.8 Ų90.857%0.56552%0.517SS*.Hα-helixtrans-66.4-45173.2-74.6-176.2169.700111.9P31 A32 N37 H38 Y39P31-E35 PolarHBondContact O-N 2.76Å; A32-E35 PolarHBondContact O-N 3.45Å; E35-N37 VanDerWaalsContact C-N 3.3Å; E35-N37 PolarHBondContact O-N 2.93Å; E35-H38 WeakPolarHBondContact O-CA 3.37Å; E35-H38 VanDerWaalsContact O-CB 3.31Å; E35-H38 WeakPolarHBondContact O-CB 3.32Å; E35-H38 PolarHBondContact O-N 3.4Å; E35-Y39 HydrophobicContact CB-CE2 4.35Å; E35-Y39 WeakPolarHBondContact O-CD2 3.29Å; E35-Y39 PolarHBondContact O-N 2.81Å
36Q79.2Confident72.3Confident97 Ų9792 Ų9245%0.45351%0.514SS..Hα-helixtrans-57.3-45.2176.5-175.3178.812.900111.5A32 H38 Y39 L40A32-Q36 WeakPolarHBondContact O-CB 3.41Å; A32-Q36 PolarHBondContact O-N 3.41Å; Q36-H38 VanDerWaalsContact C-N 3.3Å; Q36-H38 PolarHBondContact O-N 3.49Å; Q36-Y39 PolarHBondContact O-N 3.09Å; Q36-L40 HydrophobicContact CG-CD1 4.14Å; Q36-L40 WeakPolarHBondContact O-CB 3.41Å; Q36-L40 WeakPolarHBondContact O-CG 3.49Å; Q36-L40 PolarHBondContact O-N 3.45Å
37N79.4Confident74.3Confident85 Ų8588.6 Ų88.646%0.45549%0.487SS..Hα-helixtrans-64.7-34.2176.7-74.9-40.5000112.5E33 E35 A41E33-N37 WeakPolarHBondContact O-CB 3.37Å; E33-N37 VanDerWaalsContact O-CG 3.23Å; E33-N37 PolarHBondContact O-N 3.41Å; E33-N37 PolarHBondContact O-ND2 3.19Å; E35-N37 VanDerWaalsContact C-N 3.3Å; E35-N37 PolarHBondContact O-N 2.93Å; N37-A41 WeakPolarHBondContact O-CB 3.21Å; N37-A41 PolarHBondContact O-N 3.48Å
38H84.6Confident76.3Confident107 Ų10784.8 Ų84.850%0.49547%0.466SS..Hα-helixtrans-63.1-48174.5-175.678.3000111.8Q34 E35 Q36 A41 Q42Q34-H38 PolarHBondContact O-N 2.96Å; E35-H38 WeakPolarHBondContact O-CA 3.37Å; E35-H38 VanDerWaalsContact O-CB 3.31Å; E35-H38 WeakPolarHBondContact O-CB 3.32Å; E35-H38 PolarHBondContact O-N 3.4Å; Q36-H38 VanDerWaalsContact C-N 3.3Å; Q36-H38 PolarHBondContact O-N 3.49Å; H38-A41 PolarHBondContact O-N 3.36Å; H38-Q42 PolarHBondContact NE2-NE2 2.88Å; H38-Q42 PolarHBondContact O-N 3.33Å; H38-Q42 VanDerWaalsContact O-N 3.11Å
39Y84.9Confident78.2Confident147 Ų14783.4 Ų83.458%0.57646%0.455SS*.Hα-helixtrans-67.8-39.8178.7-69.4-64.5000112.7E35 Q36 A41 Q42 L43E35-Y39 HydrophobicContact CB-CE2 4.35Å; E35-Y39 WeakPolarHBondContact O-CD2 3.29Å; E35-Y39 PolarHBondContact O-N 2.81Å; Q36-Y39 PolarHBondContact O-N 3.09Å; Y39-A41 VanDerWaalsContact C-N 3.3Å; Y39-A41 PolarHBondContact O-N 2.7Å; Y39-Q42 PolarHBondContact O-N 3.5Å; Y39-L43 WeakPolarHBondContact O-CB 3.46Å; Y39-L43 PolarHBondContact O-N 3.39Å
40L85.6Confident79.6Confident17 Ų1785.4 Ų85.49%0.08947%0.466CS..Hα-helixtrans-60.7-40.3173.9-73.6174.7000111.6Q36 L43 F44 F181 A182Q36-L40 HydrophobicContact CG-CD1 4.14Å; Q36-L40 WeakPolarHBondContact O-CB 3.41Å; Q36-L40 WeakPolarHBondContact O-CG 3.49Å; Q36-L40 PolarHBondContact O-N 3.45Å; L40-L43 PolarHBondContact O-N 3.39Å; L40-F44 WeakPolarHBondContact O-CB 3.38Å; L40-F44 VanDerWaalsContact O-CD2 3.25Å; L40-F44 WeakPolarHBondContact O-CD2 3.38Å; L40-F44 PolarHBondContact O-N 3.08Å; L40-F181 HydrophobicContact CD2-CD1 3.67Å; L40-F181 HydrophobicContact CD2-CE1 4.15Å; L40-A182 HydrophobicContact CD1-CB 4.25Å
41A83.2Confident80.6Confident67 Ų6785.9 Ų85.955%0.55447%0.471SS*.Hα-helixtrans-64.7-41.5177.200000112.4N37 H38 Y39 G45N37-A41 WeakPolarHBondContact O-CB 3.21Å; N37-A41 PolarHBondContact O-N 3.48Å; H38-A41 PolarHBondContact O-N 3.36Å; Y39-A41 VanDerWaalsContact C-N 3.3Å; Y39-A41 PolarHBondContact O-N 2.7Å; A41-G45 PolarHBondContact O-N 2.85Å
42Q86.7Confident81.6Confident102 Ų10284 Ų8448%0.47746%0.458SS..Hα-helixtrans-64-46.1174.9-69.4-173.2300111.8H38 Y39 F44 G45 L46H38-Q42 PolarHBondContact NE2-NE2 2.88Å; H38-Q42 PolarHBondContact O-N 3.33Å; H38-Q42 VanDerWaalsContact O-N 3.11Å; Y39-Q42 PolarHBondContact O-N 3.5Å; Q42-F44 PolarHBondContact O-N 3.11Å; Q42-G45 PolarHBondContact O-N 3.17Å; Q42-G45 VanDerWaalsContact O-N 3.12Å; Q42-L46 WeakPolarHBondContact O-CG 3.28Å; Q42-L46 PolarHBondContact O-N 3.32Å
43L88.3Confident82.8Confident41 Ų4181.2 Ų81.222%0.21544%0.435CS..Hα-helixtrans-61.8-43.8-179.9-174.4152.2000111.4Y39 L40 G45 L46 Y47 L61 F181Y39-L43 WeakPolarHBondContact O-CB 3.46Å; Y39-L43 PolarHBondContact O-N 3.39Å; L40-L43 PolarHBondContact O-N 3.39Å; L43-G45 VanDerWaalsContact C-N 3.29Å; L43-G45 PolarHBondContact O-N 3.42Å; L43-L46 PolarHBondContact O-N 3Å; L43-Y47 HydrophobicContact CG-CD2 4.44Å; L43-Y47 WeakPolarHBondContact O-CD2 3.39Å; L43-Y47 PolarHBondContact O-N 3.37Å; L43-L61 HydrophobicContact CD1-CD1 3.96Å; L43-L61 HydrophobicContact CD1-CD2 4.24Å; L43-L61 HydrophobicContact CD2-CD1 4.3Å; L43-L61 HydrophobicContact CD2-CD2 3.82Å; L43-L61 HydrophobicContact CG-CD1 4.02Å; L43-L61 HydrophobicContact CG-CD2 4.36Å; L43-F181 HydrophobicContact CD1-CE1 3.94Å; L43-F181 HydrophobicContact CD1-CZ 4.16Å; L43-F181 HydrophobicContact CD2-CD1 4.45Å; L43-F181 HydrophobicContact CD2-CE1 3.97Å; L43-F181 HydrophobicContact CD2-CZ 4.14Å
44F89.6Confident83.6Confident12 Ų1277.7 Ų77.75%0.05342%0.422CS..Hα-helixtrans-70.8-25.8176.5-84.1-121.2000112.6L40 Q42 G48 L53 L176 P178 F181L40-F44 WeakPolarHBondContact O-CB 3.38Å; L40-F44 VanDerWaalsContact O-CD2 3.25Å; L40-F44 WeakPolarHBondContact O-CD2 3.38Å; L40-F44 PolarHBondContact O-N 3.08Å; Q42-F44 PolarHBondContact O-N 3.11Å; F44-G48 CarbonylContact O-C 3.31Å; F44-G48 WeakPolarHBondContact O-CA 3.43Å; F44-G48 PolarHBondContact O-N 3.14Å; F44-L53 HydrophobicContact CD1-CB 4.38Å; F44-L53 HydrophobicContact CE1-CB 3.82Å; F44-L53 HydrophobicContact CZ-CB 3.89Å; F44-L176 WeakPolarHBondContact CE1-O 3.29Å; F44-P178 HydrophobicContact CD1-CG 3.89Å; F44-P178 HydrophobicContact CE1-CB 4.39Å; F44-P178 HydrophobicContact CE1-CG 3.76Å; F44-P178 HydrophobicContact CE2-CB 4.49Å; F44-P178 HydrophobicContact CG-CG 4.36Å; F44-P178 VanDerWaalsContact CZ-CA 3.49Å; F44-P178 HydrophobicContact CZ-CB 4.27Å; F44-P178 HydrophobicContact CZ-CG 4.14Å; F44-F181 HydrophobicContact CE2-CB 3.82Å; F44-F181 AromaticContact CE2-CD1 3.87Å; F44-F181 HydrophobicContact CE2-CD1 3.87Å; F44-F181 AromaticContact CE2-CG 3.85Å; F44-F181 HydrophobicContact CE2-CG 3.85Å; F44-F181 HydrophobicContact CZ-CB 3.64Å; F44-F181 HydrophobicContact CZ-CG 4.12Å
45G84Confident83.6Confident66 Ų6673 Ų7368%0.6841%0.408SS*.Hα-helixtrans-70.5-30.9170.900000113.6A41 Q42 L43A41-G45 PolarHBondContact O-N 2.85Å; Q42-G45 PolarHBondContact O-N 3.17Å; Q42-G45 VanDerWaalsContact O-N 3.12Å; L43-G45 VanDerWaalsContact C-N 3.29Å; L43-G45 PolarHBondContact O-N 3.42Å
46L83.8Confident83.5Confident136 Ų13669 Ų6971%0.71240%0.399SS*.Hα-helixtrans-86.9-39.6-179.7-70.3172.4000113.2Q42 L43Q42-L46 WeakPolarHBondContact O-CG 3.28Å; Q42-L46 PolarHBondContact O-N 3.32Å; L43-L46 PolarHBondContact O-N 3Å
47Y84.6Confident83.6Confident61 Ų6164.4 Ų64.424%0.23938%0.378CS..Hα-helixtrans-114.6-16.3-171.5-63.2-88.8000114.2L43 L53 G57 R60 L61 S64L43-Y47 HydrophobicContact CG-CD2 4.44Å; L43-Y47 WeakPolarHBondContact O-CD2 3.39Å; L43-Y47 PolarHBondContact O-N 3.37Å; Y47-L53 WeakPolarHBondContact O-CD1 3.38Å; Y47-G57 WeakPolarHBondContact O-CA 3.42Å; Y47-R60 HydrophobicContact CD1-CB 4.06Å; Y47-R60 HydrophobicContact CE1-CB 4.47Å; Y47-R60 PolarHBondContact O-NH2 3.21Å; Y47-L61 HydrophobicContact CD1-CB 3.9Å; Y47-L61 HydrophobicContact CD1-CD1 4.33Å; Y47-L61 HydrophobicContact CD2-CD1 3.7Å; Y47-L61 HydrophobicContact CE1-CB 4.31Å; Y47-L61 HydrophobicContact CE1-CD1 4.32Å; Y47-L61 HydrophobicContact CE2-CD1 3.72Å; Y47-L61 HydrophobicContact CG-CB 4.03Å; Y47-L61 HydrophobicContact CG-CD1 4.02Å; Y47-S64 WeakPolarHBondContact CE1-OG 3.41Å; Y47-S64 WeakPolarHBondContact OH-CB 3.48Å; Y47-S64 PolarHBondContact OH-OG 3.28Å
48G85.8Confident83.9Confident18 Ų1860.5 Ų60.519%0.18636%0.357CS..  trans-97.4170.6-176.700000114.5F44 T52F44-G48 CarbonylContact O-C 3.31Å; F44-G48 WeakPolarHBondContact O-CA 3.43Å; F44-G48 PolarHBondContact O-N 3.14Å; G48-T52 CarbonylContact C-O 3.57Å; G48-T52 WeakPolarHBondContact CA-O 3.29Å
49E83.6Confident83.4Confident108 Ų10858.2 Ų58.251%0.50536%0.356SS..BIsolated β-bridgetrans-132.2133.4175.3-70.8173.2-163.300108.5G51 T52E49-G51 PolarHBondContact O-N 2.89Å; E49-T52 PolarHBondContact N-O 2.55Å; E49-T52 PolarHBondContact O-N 3.15Å; E49-T52 PolarHBondContact O-OG1 3.18Å
50N81.9Confident83.2Confident168 Ų16857 Ų5790%0.89835%0.351SS*.THydrogen-bonded Turntrans53.335.8-179.4-62.8-31000114.7T52N50-T52 PolarHBondContact O-N 3.24Å
51G79.4Confident83.1Confident50 Ų5056.4 Ų56.452%0.51535%0.348SS..THydrogen-bonded Turntrans7412.7179.900000114.3E49E49-G51 PolarHBondContact O-N 2.89Å
52T86.3Confident83Confident38 Ų3853.8 Ų53.823%0.23332%0.324CS..BIsolated β-bridgetrans-129.2155.417664.30000110.9G48 E49 N50 L176G48-T52 CarbonylContact C-O 3.57Å; G48-T52 WeakPolarHBondContact CA-O 3.29Å; E49-T52 PolarHBondContact N-O 2.55Å; E49-T52 PolarHBondContact O-N 3.15Å; E49-T52 PolarHBondContact O-OG1 3.18Å; N50-T52 PolarHBondContact O-N 3.24Å; T52-L176 CarbonylContact C-O 3.25Å; T52-L176 VanDerWaalsContact CA-O 3.28Å; T52-L176 WeakPolarHBondContact CA-O 3.37Å; T52-L176 WeakPolarHBondContact CB-O 3.45Å
53L86.3Confident82.5Confident0 Ų055.4 Ų55.40%033%0.331CS..BIsolated β-bridgetrans-104.4108.4179.7-170.672.1000109.2F44 Y47 L58 L61 L176 F181F44-L53 HydrophobicContact CD1-CB 4.38Å; F44-L53 HydrophobicContact CE1-CB 3.82Å; F44-L53 HydrophobicContact CZ-CB 3.89Å; Y47-L53 WeakPolarHBondContact O-CD1 3.38Å; L53-L58 HydrophobicContact CD2-CB 3.94Å; L53-L58 HydrophobicContact CD2-CD1 3.79Å; L53-L58 HydrophobicContact CD2-CG 4.49Å; L53-L58 HydrophobicContact CG-CB 4.18Å; L53-L61 HydrophobicContact CD2-CD2 4.2Å; L53-L176 HydrophobicContact CB-CB 4.19Å; L53-L176 HydrophobicContact CD2-CD1 4.4Å; L53-L176 PolarHBondContact N-O 2.95Å; L53-L176 PolarHBondContact O-N 3.4Å; L53-F181 HydrophobicContact CD2-CD2 3.74Å; L53-F181 HydrophobicContact CD2-CE2 3.99Å
54T86.2Confident82Confident42 Ų4256.4 Ų56.426%0.25834%0.342SS..  trans-70.1163.717662.10000110.7G56 G57 L58T54-G56 PolarHBondContact O-N 3.19Å; T54-G57 CarbonylContact O-C 3.59Å; T54-G57 WeakPolarHBondContact O-CA 3.28Å; T54-G57 PolarHBondContact O-N 3.16Å; T54-G57 PolarHBondContact OG1-N 3.35Å; T54-G57 VanDerWaalsContact OG1-N 3.13Å; T54-L58 PolarHBondContact O-N 3.39Å
55A76.2Confident81.3Confident50 Ų5059.1 Ų59.141%0.41336%0.357SS..Hα-helixtrans-55-37.8174.100000112.3A59A55-A59 WeakPolarHBondContact O-CB 3.45Å; A55-A59 PolarHBondContact O-N 2.81Å
56G74.1Confident80.4Confident37 Ų3757.9 Ų57.938%0.38134%0.344SS..Hα-helixtrans-67.9-38.5173.600000113.3T54 A59 R60T54-G56 PolarHBondContact O-N 3.19Å; G56-A59 PolarHBondContact O-N 3.06Å; G56-R60 WeakPolarHBondContact O-CG 3.28Å; G56-R60 PolarHBondContact O-N 3.27Å; G56-R60 VanDerWaalsContact O-N 3.11Å
57G82.1Confident79.7Confident0 Ų051.9 Ų51.90%031%0.312CS..Hα-helixtrans-63.9-44.9173.300000112.8Y47 T54 R60 L61Y47-G57 WeakPolarHBondContact O-CA 3.42Å; T54-G57 CarbonylContact O-C 3.59Å; T54-G57 WeakPolarHBondContact O-CA 3.28Å; T54-G57 PolarHBondContact O-N 3.16Å; T54-G57 PolarHBondContact OG1-N 3.35Å; T54-G57 VanDerWaalsContact OG1-N 3.13Å; G57-R60 PolarHBondContact O-N 3.35Å; G57-L61 PolarHBondContact O-N 3.49Å
58L83.9Confident78.2Confident4 Ų450.7 Ų50.72%0.02132%0.319CS..Hα-helixtrans-61.1-45.2174.5-179.668.3000111L53 T54 R60 L61 L62 L165 L176 F181L53-L58 HydrophobicContact CD2-CB 3.94Å; L53-L58 HydrophobicContact CD2-CD1 3.79Å; L53-L58 HydrophobicContact CD2-CG 4.49Å; L53-L58 HydrophobicContact CG-CB 4.18Å; T54-L58 PolarHBondContact O-N 3.39Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 3.09Å; L58-L61 HydrophobicContact CD1-CD2 4.46Å; L58-L61 WeakPolarHBondContact O-CB 3.24Å; L58-L61 PolarHBondContact O-N 3.09Å; L58-L61 VanDerWaalsContact O-N 3.16Å; L58-L62 HydrophobicContact CD1-CD1 4.34Å; L58-L62 HydrophobicContact CD1-CD2 4.47Å; L58-L62 HydrophobicContact CD1-CG 4.2Å; L58-L62 HydrophobicContact CD2-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 4Å; L58-L62 HydrophobicContact CG-CG 4.23Å; L58-L62 VanDerWaalsContact O-CG 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.41Å; L58-L62 PolarHBondContact O-N 3.45Å; L58-L165 HydrophobicContact CD2-CD1 3.78Å; L58-L165 HydrophobicContact CD2-CD2 4.26Å; L58-L165 HydrophobicContact CD2-CG 4.05Å; L58-L176 HydrophobicContact CD1-CD1 4.43Å; L58-L176 HydrophobicContact CD2-CD1 3.98Å; L58-F181 HydrophobicContact CD1-CD2 4.33Å; L58-F181 HydrophobicContact CD1-CE2 4Å
59A75.9Confident76.5Confident58 Ų5860.8 Ų60.848%0.47935%0.351SS..Hα-helixtrans-59.8-41.117800000112.4A55 G56 H63A55-A59 WeakPolarHBondContact O-CB 3.45Å; A55-A59 PolarHBondContact O-N 2.81Å; G56-A59 PolarHBondContact O-N 3.06Å; A59-H63 VanDerWaalsContact O-CB 3.29Å; A59-H63 WeakPolarHBondContact O-CB 3.24Å; A59-H63 PolarHBondContact O-N 2.81Å
60R79.3Confident74.5Confident123 Ų12360.2 Ų60.246%0.46436%0.355SS..Hα-helixtrans-64.6-40.6174.7-72.2-172.2-59.7-100.25.5112.4Y47 G56 G57 L58 H63 S64Y47-R60 HydrophobicContact CD1-CB 4.06Å; Y47-R60 HydrophobicContact CE1-CB 4.47Å; Y47-R60 PolarHBondContact O-NH2 3.21Å; G56-R60 WeakPolarHBondContact O-CG 3.28Å; G56-R60 PolarHBondContact O-N 3.27Å; G56-R60 VanDerWaalsContact O-N 3.11Å; G57-R60 PolarHBondContact O-N 3.35Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 3.09Å; R60-H63 PolarHBondContact O-N 3.18Å; R60-S64 PolarHBondContact O-N 3.09Å; R60-S64 PolarHBondContact O-OG 3.2Å
61L84.8Confident72.2Confident4 Ų460.9 Ų60.92%0.02135%0.353CS..Hα-helixtrans-62.5-52176.4177.570000111L43 Y47 L53 G57 L58 H63 S64 L65 F181L43-L61 HydrophobicContact CD1-CD1 3.96Å; L43-L61 HydrophobicContact CD1-CD2 4.24Å; L43-L61 HydrophobicContact CD2-CD1 4.3Å; L43-L61 HydrophobicContact CD2-CD2 3.82Å; L43-L61 HydrophobicContact CG-CD1 4.02Å; L43-L61 HydrophobicContact CG-CD2 4.36Å; Y47-L61 HydrophobicContact CD1-CB 3.9Å; Y47-L61 HydrophobicContact CD1-CD1 4.33Å; Y47-L61 HydrophobicContact CD2-CD1 3.7Å; Y47-L61 HydrophobicContact CE1-CB 4.31Å; Y47-L61 HydrophobicContact CE1-CD1 4.32Å; Y47-L61 HydrophobicContact CE2-CD1 3.72Å; Y47-L61 HydrophobicContact CG-CB 4.03Å; Y47-L61 HydrophobicContact CG-CD1 4.02Å; L53-L61 HydrophobicContact CD2-CD2 4.2Å; G57-L61 PolarHBondContact O-N 3.49Å; L58-L61 HydrophobicContact CD1-CD2 4.46Å; L58-L61 WeakPolarHBondContact O-CB 3.24Å; L58-L61 PolarHBondContact O-N 3.09Å; L58-L61 VanDerWaalsContact O-N 3.16Å; L61-H63 VanDerWaalsContact C-N 3.26Å; L61-H63 PolarHBondContact O-N 3Å; L61-S64 PolarHBondContact O-N 3.09Å; L61-S64 VanDerWaalsContact O-N 3.08Å; L61-S64 PolarHBondContact O-OG 3.41Å; L61-L65 HydrophobicContact CD1-CD1 4.24Å; L61-L65 HydrophobicContact CG-CD1 4.05Å; L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 2.97Å; L61-F181 HydrophobicContact CD2-CE1 4.5Å; L61-F181 HydrophobicContact CD2-CE2 3.48Å; L61-F181 VanDerWaalsContact CD2-CE2 3.48Å; L61-F181 HydrophobicContact CD2-CZ 3.43Å; L61-F181 VanDerWaalsContact CD2-CZ 3.43Å
62L79.8Confident69.9Low11 Ų1162 Ų626%0.05836%0.364CS..Hα-helixtrans-58.9-40.3178.1-65.1178.4000111.3L58 L65 G66 L67 L188L58-L62 HydrophobicContact CD1-CD1 4.34Å; L58-L62 HydrophobicContact CD1-CD2 4.47Å; L58-L62 HydrophobicContact CD1-CG 4.2Å; L58-L62 HydrophobicContact CD2-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 4Å; L58-L62 HydrophobicContact CG-CG 4.23Å; L58-L62 VanDerWaalsContact O-CG 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.41Å; L58-L62 PolarHBondContact O-N 3.45Å; L62-L65 CarbonylContact O-C 3.58Å; L62-L65 PolarHBondContact O-N 3.33Å; L62-G66 PolarHBondContact O-N 3.41Å; L62-L67 HydrophobicContact CB-CB 4.27Å; L62-L67 HydrophobicContact CD2-CB 4.46Å; L62-L67 HydrophobicContact CD2-CD1 3.97Å; L62-L67 WeakPolarHBondContact O-CA 3.41Å; L62-L67 WeakPolarHBondContact O-CB 3.37Å; L62-L67 PolarHBondContact O-N 2.88Å; L62-L188 HydrophobicContact CD2-CD1 4.4Å; L62-L188 HydrophobicContact CD2-CD2 3.34Å
63H76.8Confident67.1Low136 Ų13667.5 Ų67.563%0.6339%0.391SS*.Hα-helixtrans-63-43.8174.3-176.2-85000112.5A59 R60 L61 L65 G66A59-H63 VanDerWaalsContact O-CB 3.29Å; A59-H63 WeakPolarHBondContact O-CB 3.24Å; A59-H63 PolarHBondContact O-N 2.81Å; R60-H63 PolarHBondContact O-N 3.18Å; L61-H63 VanDerWaalsContact C-N 3.26Å; L61-H63 PolarHBondContact O-N 3Å; H63-L65 PolarHBondContact O-N 3.49Å; H63-G66 PolarHBondContact O-N 3.33Å
64S78.4Confident64.1Low63 Ų6379 Ų7944%0.44144%0.435SS..Hα-helixtrans-66.3-23.7176.565.30000113.6Y47 R60 L61 G66Y47-S64 WeakPolarHBondContact CE1-OG 3.41Å; Y47-S64 WeakPolarHBondContact OH-CB 3.48Å; Y47-S64 PolarHBondContact OH-OG 3.28Å; R60-S64 PolarHBondContact O-N 3.09Å; R60-S64 PolarHBondContact O-OG 3.2Å; L61-S64 PolarHBondContact O-N 3.09Å; L61-S64 VanDerWaalsContact O-N 3.08Å; L61-S64 PolarHBondContact O-OG 3.41Å; S64-G66 VanDerWaalsContact C-N 3.29Å
65L74.5Confident61.4Low69 Ų6984.9 Ų84.936%0.36146%0.463SS..THydrogen-bonded Turntrans-85.92.2173.7-65171.5000112.9L61 L62 H63 L67 I192L61-L65 HydrophobicContact CD1-CD1 4.24Å; L61-L65 HydrophobicContact CG-CD1 4.05Å; L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 2.97Å; L62-L65 CarbonylContact O-C 3.58Å; L62-L65 PolarHBondContact O-N 3.33Å; H63-L65 PolarHBondContact O-N 3.49Å; L65-L67 VanDerWaalsContact C-N 3.25Å; L65-L67 HydrophobicContact CB-CD1 4.09Å; L65-L67 HydrophobicContact CB-CG 4.11Å; L65-L67 HydrophobicContact CD1-CD1 4.44Å; L65-L67 PolarHBondContact O-N 3.29Å; L65-I192 HydrophobicContact CD2-CD1 4.46Å
66G65.5Low59Low39 Ų3985.6 Ų85.640%0.40248%0.475SS..THydrogen-bonded Turntrans77.94.8-17800000114.8L62 H63 S64 G68L62-G66 PolarHBondContact O-N 3.41Å; H63-G66 PolarHBondContact O-N 3.33Å; S64-G66 VanDerWaalsContact C-N 3.29Å; G66-G68 VanDerWaalsContact C-N 3.31Å; G66-G68 PolarHBondContact O-N 3.32Å
67L69.1Low56.8Low10 Ų1093 Ų935%0.05250%0.5CS..  trans-88.59.6-176.9-56.2174000113.3L62 L65 L188 Q191 I192 C197L62-L67 HydrophobicContact CB-CB 4.27Å; L62-L67 HydrophobicContact CD2-CB 4.46Å; L62-L67 HydrophobicContact CD2-CD1 3.97Å; L62-L67 WeakPolarHBondContact O-CA 3.41Å; L62-L67 WeakPolarHBondContact O-CB 3.37Å; L62-L67 PolarHBondContact O-N 2.88Å; L65-L67 VanDerWaalsContact C-N 3.25Å; L65-L67 HydrophobicContact CB-CD1 4.09Å; L65-L67 HydrophobicContact CB-CG 4.11Å; L65-L67 HydrophobicContact CD1-CD1 4.44Å; L65-L67 PolarHBondContact O-N 3.29Å; L67-L188 HydrophobicContact CD1-CD2 3.85Å; L67-Q191 HydrophobicContact CD2-CB 4.13Å; L67-I192 HydrophobicContact CD1-CD1 4.35Å; L67-I192 HydrophobicContact CD1-CG1 4.06Å; L67-I192 HydrophobicContact CD2-CG1 4.05Å; L67-I192 HydrophobicContact CG-CG1 4.33Å; L67-C197 HydrophobicContact CD2-CB 3.52Å
68G53Low54.2Low36 Ų36102.9 Ų102.937%0.37155%0.546SS..  trans-101.44.1-167.600000117.3G66 V70G66-G68 VanDerWaalsContact C-N 3.31Å; G66-G68 PolarHBondContact O-N 3.32Å; G68-V70 PolarHBondContact O-N 3.12Å
69R48.8Very low51.4Low231 Ų231105.7 Ų105.787%0.87258%0.576SS**  trans-88.695.9-178.1-81.3-173.3175.2176.31.1111.9
70V42.9Very low49.1Very low95 Ų95109 Ų10958%0.57659%0.593SS**  trans-100.9107.5159.8-1750000107.9G68 G72 N160G68-V70 PolarHBondContact O-N 3.12Å; V70-G72 PolarHBondContact O-N 3.48Å; V70-G72 VanDerWaalsContact O-N 3.16Å; V70-N160 HydrophobicContact CG2-CB 4.3Å
71Q34.1Very low46.7Very low183 Ų183111.5 Ų111.586%0.85562%0.615SS**  trans-64.7111.9160.9-86.3-179.91100107.3L73Q71-L73 PolarHBondContact O-N 3.13Å
72G30.9Very low44Very low73 Ų73118.1 Ų118.175%0.75366%0.655SS**  trans-64.495.3172.300000110.3V70 R74V70-G72 PolarHBondContact O-N 3.48Å; V70-G72 VanDerWaalsContact O-N 3.16Å; G72-R74 VanDerWaalsContact C-N 3.35Å; G72-R74 PolarHBondContact O-N 2.63Å
73L25.8Very low41.5Very low154 Ų154121.7 Ų121.781%0.80669%0.694SS**  trans-70.595.3165.6-125.1138.3000107.2Q71 L75Q71-L73 PolarHBondContact O-N 3.13Å; L73-L75 PolarHBondContact O-N 2.89Å
74R25Very low39Very low242 Ų242127.2 Ų127.291%0.91371%0.71SS**  trans-60.799.8166.4-103.2-175.4173.2164.6-0.9107.8G72 G76G72-R74 VanDerWaalsContact C-N 3.35Å; G72-R74 PolarHBondContact O-N 2.63Å; R74-G76 VanDerWaalsContact C-N 3.3Å; R74-G76 PolarHBondContact O-N 3.41Å
75L28.1Very low36.6Very low164 Ų164129.1 Ų129.186%0.85973%0.729SS**  trans-6594.8158.1-88.8138.6000107.7L73 Q77L73-L75 PolarHBondContact O-N 2.89Å; L75-Q77 PolarHBondContact O-N 2.83Å
76G26.5Very low34.3Very low65 Ų65130.3 Ų130.367%0.6775%0.749SS**  trans-65.5109.4166.700000109R74 H78R74-G76 VanDerWaalsContact C-N 3.3Å; R74-G76 PolarHBondContact O-N 3.41Å; G76-H78 PolarHBondContact O-N 3.48Å
77Q28.6Very low32.8Very low194 Ų194134.3 Ų134.391%0.90777%0.768SS**  trans-58119.5165.7-83.9175.7-35.100109.2L75 G79L75-Q77 PolarHBondContact O-N 2.83Å; Q77-G79 PolarHBondContact O-N 3.3Å
78H27.4Very low30.9Very low206 Ų206139.5 Ų139.595%0.95480%0.802SS**  trans-65.6116.8164.8-92.7-61.6000109.9G76G76-H78 PolarHBondContact O-N 3.48Å
79G24.1Very low29.6Very low64 Ų64142.6 Ų142.666%0.6682%0.824SS**  trans-152.3146.1164.500000108.8Q77Q77-G79 PolarHBondContact O-N 3.3Å
80P27.1Very low28.6Very low128 Ų128136 Ų13683%0.83182%0.819SS**  trans-85.2157.8-134.831.2-35.2000117
81L30.2Very low27.8Very low175 Ų175139.7 Ų139.792%0.91684%0.835SS**  trans-34.9118.8170.8-77.3139.8000115.9
82T26.9Very low27.4Very low143 Ų143138.4 Ų138.488%0.87783%0.834SS**  trans-156.3133.5142.351.90000110.1
83G27.1Very low27.1Very low85 Ų85140.2 Ų140.288%0.87684%0.835SS**  trans121.595.7156.800000116.5
84R26Very low27.2Very low253 Ų253138.6 Ų138.696%0.95583%0.832SS**  trans-73.7134.6175.8-176.7172.3-172.1125.5-5.2112.4
85A26.6Very low27.1Very low102 Ų102135.9 Ų135.984%0.84383%0.83SS**  trans-169.8143.414600000112.7
86A26.3Very low26.8Very low94 Ų94138.6 Ų138.678%0.77783%0.828SS**  trans-88174.6-171.300000113.4
87P33.7Very low26.8Very low123 Ų123141.7 Ų141.780%0.79984%0.837SS**  trans-93.7165-166.938.2-32.7000113.8
88P30Very low26.6Very low120 Ų120141.2 Ų141.278%0.77983%0.834SS**  trans-137.3131.9135.328.5-10.1000111.7
89A24.7Very low26.5Very low100 Ų100138.8 Ų138.883%0.82683%0.828SS**  88.6132.786.500000113.6
90A29.3Very low26.8Very low92 Ų92141.8 Ų141.876%0.7684%0.836SS**  trans-58.4152.4-175.300000114.1
91N25.4Very low26.7Very low173 Ų173144.7 Ų144.793%0.92584%0.839SS**  trans-157.2143.5136.4-95.3-19.4000112.5
92N26.3Very low26.6Very low156 Ų156143.9 Ų143.983%0.83484%0.835SS**  trans-94.1126.4-174.7-172.917.5000109.2
93S24.7Very low26.4Very low111 Ų111141.9 Ų141.978%0.77683%0.827SS**  trans-169.8125.1154.3520000112.7
94T26.6Very low26.8Very low120 Ų120143 Ų14374%0.73682%0.816SS**  trans-36136163.447.30000116.3
95H24.4Very low26.8Very low186 Ų186137.3 Ų137.386%0.86181%0.805SS**  trans-172.7122.6140.8-100.2-69000112.3
96R21.1Very low27.2Very low220 Ų220138.5 Ų138.583%0.8380%0.801SS**  trans36.7127.2140.6-148.2175-168.3149.71.6119.8Q98R96-Q98 PolarHBondContact O-N 2.84Å
97P25.6Very low27.5Very low130 Ų130144.4 Ų144.484%0.84480%0.803SS**PPolyproline II helixtrans-74.2119.6178.330.5-30.9000110.8
98Q24.7Very low27.2Very low184 Ų184143.1 Ų143.186%0.8680%0.803SS**PPolyproline II helixtrans-96.3136.1162.9-72-178.5-900108.4R96R96-Q98 PolarHBondContact O-N 2.84Å
99N25.3Very low27.3Very low155 Ų155140.7 Ų140.783%0.82980%0.8SS**PPolyproline II helixtrans-49137.2167.9-89.2-19.5000110.9E101N99-E101 PolarHBondContact O-N 2.92Å
100P30.2Very low27.4Very low127 Ų127144.5 Ų144.583%0.82580%0.803SS**  trans-83.1114.2161.731.1-25.1000108.8
101E24.9Very low27.4Very low189 Ų189146.2 Ų146.288%0.88381%0.806SS**  trans-58.3143.8165-72.9177.9134.100111.1N99 S103N99-E101 PolarHBondContact O-N 2.92Å; E101-S103 PolarHBondContact O-N 3.44Å
102L28.6Very low27.8Very low159 Ų159146.8 Ų146.883%0.83281%0.808SS**  trans-66.5105.4179-147.189.9000109.8V104L102-V104 HydrophobicContact CD2-CG2 3.88Å; L102-V104 HydrophobicContact CG-CG2 4.46Å; L102-V104 PolarHBondContact O-N 3.4Å; L102-V104 VanDerWaalsContact O-N 3.16Å
103S24Very low27.8Very low101 Ų101142.8 Ų142.871%0.70680%0.804SS**  trans-8097.5171.573.40000110.2E101 D105E101-S103 PolarHBondContact O-N 3.44Å; S103-D105 VanDerWaalsContact C-N 3.27Å; S103-D105 PolarHBondContact O-N 3.03Å; S103-D105 VanDerWaalsContact O-N 3.14Å
104V34.2Very low28.5Very low107 Ų107143.3 Ų143.365%0.64881%0.805SS**  trans-82.867.8172.3-172.90000108.9L102L102-V104 HydrophobicContact CD2-CG2 3.88Å; L102-V104 HydrophobicContact CG-CG2 4.46Å; L102-V104 PolarHBondContact O-N 3.4Å; L102-V104 VanDerWaalsContact O-N 3.16Å
105D27.2Very low28.8Very low135 Ų135143.7 Ų143.772%0.72281%0.812SS**  trans-142.536.4-178.6-77.4-47000113.6S103S103-D105 VanDerWaalsContact C-N 3.27Å; S103-D105 PolarHBondContact O-N 3.03Å; S103-D105 VanDerWaalsContact O-N 3.14Å
106V34.5Very low29Very low127 Ų127137.7 Ų137.777%0.7780%0.8SS**SBendtrans-103.8-7.9170.91790000112.4
107W31.3Very low29.3Very low218 Ų218139.6 Ų139.683%0.82681%0.808SS**SBendtrans-103.7-1-172.8-66.496000115.4
108A28.2Very low29.2Very low95 Ų95136.3 Ų136.379%0.78580%0.798SS**SBendtrans-104.219.8-173.400000115
109G32.6Very low29.4Very low70 Ų70135.2 Ų135.272%0.72280%0.798SS**  trans-123.157.5-169.700000115.7
110M26.1Very low29.5Very low180 Ų180136 Ų13689%0.88780%0.801SS**SBendtrans-141.9133.4156.3-85.9-124.4-170.800111.1
111P28.8Very low29.3Very low128 Ų128138.4 Ų138.483%0.83180%0.801SS**  trans-75.1131.7-169.729.9-33.6000112.1
112L34.1Very low29.4Very low185 Ų185138.6 Ų138.697%0.96980%0.802SS**  trans-79.7121.3165.1-71.3160.2000109.1
113G26.1Very low29.2Very low71 Ų71136.6 Ų136.673%0.73280%0.801SS**  trans-175.3137.7170.900000112.5
114P41Very low29.3Very low123 Ų123141.6 Ų141.680%0.79981%0.81SS**  trans-92.7164.8-160.637.2-34.7000113.7
115S32.2Very low28.9Very low127 Ų127140.4 Ų140.489%0.88881%0.812SS**  trans81.9131.7163.5760000118.7
116G28.4Very low29Very low60 Ų60140.2 Ų140.262%0.61982%0.817SS**  trans117.672.7146.100000116.1
117W27.2Very low28.8Very low261 Ų261142.9 Ų142.999%0.98982%0.821SS**  trans-149.496136.4-78.6101.3000107.7
118G24.2Very low28.5Very low61 Ų61140.3 Ų140.363%0.62982%0.823SS**  trans-77.5160.4161.600000110.5
119D29Very low28.6Very low161 Ų161141.2 Ų141.286%0.86182%0.821SS**  trans51.2102.8156.8-55.3-29.6000117.7
120L26.1Very low28.7Very low170 Ų170150.3 Ų150.389%0.8983%0.833SS**  trans-149.3109.8130.6-13483.5000111.5
121E26.9Very low28.8Very low179 Ų179144.8 Ų144.884%0.83682%0.822SS**  trans59.9108.1149.7-67.4-134107.100121.8
122E27.2Very low28.9Very low193 Ų193145 Ų14590%0.90282%0.824SS**  trans-67.4110.9158.2-174.1169138.900111.5
123S24.6Very low28.6Very low116 Ų116140.2 Ų140.281%0.81181%0.811SS**  trans-114.283.916659.20000111.4
124K26Very low28.7Very low207 Ų207142.5 Ų142.590%0.981%0.813SS**  trans16.3103.9144.4-156.2169.9-170172.70117.9
125A26.3Very low28.6Very low82 Ų82142.6 Ų142.668%0.67882%0.816SS**  trans-115.4147.7157.800000110.2
126P28.5Very low28.9Very low130 Ų130140.2 Ų140.284%0.84481%0.812SS**  trans-75.5140.7-16829.7-32.7000113.1
127H29.5Very low29.1Very low184 Ų184143.6 Ų143.685%0.85282%0.815SS**  trans-70.5132.7174.6-68.7-76.3000113
128L25.6Very low29.7Very low164 Ų164136.9 Ų136.986%0.85980%0.799SS**  trans-158157.8152.8-103.8130.5000109.4
129P29.8Very low30.6Very low114 Ų114140.2 Ų140.274%0.7480%0.802SS**  -97.7154.1-116.626.2-10.7000114.4G131P129-G131 PolarHBondContact O-N 3.05Å
130R34.8Very low31.2Very low260 Ų260139.5 Ų139.598%0.98179%0.791SS**  trans-61114.5167.2-82.4179.5168.5112.3-2.2110.6
131G28.1Very low31.7Very low64 Ų64136.8 Ų136.866%0.6677%0.774SS**  trans-114.5150.2157.300000110P129P129-G131 PolarHBondContact O-N 3.05Å
132P30.9Very low32.2Very low132 Ų132136.9 Ų136.986%0.85777%0.766SS**PPolyproline II helixtrans-71143.5-179.630.5-31.8000110.7
133A28.3Very low33.1Very low86 Ų86132.8 Ų132.871%0.71175%0.75SS**PPolyproline II helixtrans-63.9138.1-177.400000112.5S135A133-S135 PolarHBondContact O-N 3.29Å
134P28Very low33.8Very low118 Ų118133.5 Ų133.577%0.76674%0.744SS**PPolyproline II helixtrans-77.1121.4160.630.4-28000108.8G136P134-G136 PolarHBondContact O-N 2.9Å
135S39.9Very low34.4Very low125 Ų125130.8 Ų130.887%0.87474%0.738SS**SBendtrans-71.6114.9171.242.50000110.2A133A133-S135 PolarHBondContact O-N 3.29Å
136G38Very low35Very low77 Ų77132.6 Ų132.679%0.79474%0.736SS**  trans14040.716700000117.4P134P134-G136 PolarHBondContact O-N 2.9Å
137L32.3Very low35.3Very low131 Ų131134 Ų13469%0.68674%0.737SS**  trans-125.4128.4170.2-81.8165.2000110.9
138D39.1Very low35.5Very low120 Ų120132.5 Ų132.564%0.64273%0.73SS**  trans-61144.5-173.6-166.924.4000112.2F140 H141D138-F140 PolarHBondContact O-N 3.22Å; D138-H141 PolarHBondContact O-N 2.99Å
139L44.6Very low35.8Very low132 Ų132129.5 Ų129.569%0.69172%0.722SS**Hα-helixtrans-56.5-27.8-176.3-164.7101.4000111.6H141 R142 L143L139-H141 VanDerWaalsContact C-N 3.34Å; L139-H141 PolarHBondContact O-N 3.08Å; L139-R142 PolarHBondContact O-N 2.96Å; L139-L143 PolarHBondContact O-N 3.43Å
140F40.4Very low36.3Very low146 Ų146131.4 Ų131.464%0.6473%0.725SS**Hα-helixtrans-65.3-33176.8-144.3-92.8000113.2D138 L143D138-F140 PolarHBondContact O-N 3.22Å; F140-L143 WeakPolarHBondContact O-CB 3.25Å; F140-L143 PolarHBondContact O-N 3.11Å
141H36.6Very low36.2Very low113 Ų113122.7 Ų122.752%0.52371%0.709SS.*Hα-helixtrans-81.5-22.2176.4-115.424.2000113.1D138 L139 L143D138-H141 PolarHBondContact O-N 2.99Å; L139-H141 VanDerWaalsContact C-N 3.34Å; L139-H141 PolarHBondContact O-N 3.08Å; H141-L143 VanDerWaalsContact C-N 3.3Å
142R38.9Very low36.4Very low181 Ų181126 Ų12668%0.68371%0.712SS**Hα-helixtrans-70.5-28.2166.9-78.9-174.5176.9-152-1.4112.2L139 L145 L146L139-R142 PolarHBondContact O-N 2.96Å; R142-L145 PolarHBondContact O-N 3.42Å; R142-L146 VanDerWaalsContact O-CD1 3.29Å; R142-L146 WeakPolarHBondContact O-CD1 3.38Å
143L45Very low36.9Very low106 Ų106128 Ų12856%0.55571%0.709SS**Hα-helixtrans-73-27.2177.1-104.5140.7000113.7L139 F140 H141 L145L139-L143 PolarHBondContact O-N 3.43Å; F140-L143 WeakPolarHBondContact O-CB 3.25Å; F140-L143 PolarHBondContact O-N 3.11Å; H141-L143 VanDerWaalsContact C-N 3.3Å; L143-L145 VanDerWaalsContact C-N 3.29Å; L143-L145 PolarHBondContact O-N 2.82Å
144L40.5Very low37.6Very low132 Ų132129.9 Ų129.969%0.69171%0.707SS**THydrogen-bonded Turntrans-80.4-5.4174.2-77.5168.2000114.1
145L36.9Very low38.5Very low149 Ų149130 Ų13078%0.7870%0.701SS**SBendtrans-117.11-176.9-96.3161.3000114R142 L143 D147R142-L145 PolarHBondContact O-N 3.42Å; L143-L145 VanDerWaalsContact C-N 3.29Å; L143-L145 PolarHBondContact O-N 2.82Å; L145-D147 VanDerWaalsContact C-N 3.3Å; L145-D147 PolarHBondContact O-N 3.39Å; L145-D147 VanDerWaalsContact O-N 3.07Å
146L38.9Very low39.1Very low121 Ų121131.6 Ų131.663%0.63470%0.695SS**  trans-79.288.2164.9-92.995.8000108.9R142 H148R142-L146 VanDerWaalsContact O-CD1 3.29Å; R142-L146 WeakPolarHBondContact O-CD1 3.38Å; L146-H148 PolarHBondContact O-N 3.18Å
147D34.8Very low40Very low159 Ų159132.6 Ų132.685%0.8568%0.682SS**  trans-65.779156.8-146.62.2000107.3L145L145-D147 VanDerWaalsContact C-N 3.3Å; L145-D147 PolarHBondContact O-N 3.39Å; L145-D147 VanDerWaalsContact O-N 3.07Å
148H33.3Very low41.7Very low152 Ų152128.4 Ų128.470%0.70466%0.663SS**  trans-120.186.3165.9-94.939.5000106.7L146 L150L146-H148 PolarHBondContact O-N 3.18Å; H148-L150 PolarHBondContact O-N 3.5Å
149S32Very low43.2Very low101 Ų101124.6 Ų124.671%0.70664%0.643SS**  trans32.554.9139.7-165.70000115.1A151S149-A151 PolarHBondContact O-N 3.18Å
150L40.3Very low44.4Very low154 Ų154121.7 Ų121.781%0.80663%0.627SS**THydrogen-bonded Turntrans-8136.7170.4-153.7126.5000109.3H148 L154H148-L150 PolarHBondContact O-N 3.5Å; L150-L154 HydrophobicContact CD2-CD1 4.1Å
151A32.8Very low45.9Very low78 Ų78115.1 Ų115.165%0.64560%0.601SS**THydrogen-bonded Turntrans-109.2-9.3-170.200000113.5S149S149-A151 PolarHBondContact O-N 3.18Å
152D33.4Very low47.5Very low133 Ų133111.7 Ų111.771%0.71159%0.59SS**SBendtrans-140.13-170.6-85.8-39.6000117.7
153H40.8Very low49.1Very low174 Ų174107.7 Ų107.781%0.80658%0.579SS**  trans-135.543.9-174.3-77.1-19.5000117
154L42.8Very low50.6Low126 Ų126102.7 Ų102.766%0.6655%0.553SS**  trans-121.572.5167.6-73.9164.9000110.3L150L150-L154 HydrophobicContact CD2-CD1 4.1Å
155N48.4Very low52.3Low121 Ų12196.6 Ų96.665%0.64752%0.521SS*.  trans-74.9133.3165.7-85.20.2000109D157N155-D157 WeakPolarHBondContact CB-OD2 3.45Å; N155-D157 PolarHBondContact O-N 3.48Å
156E50.8Low54.2Low157 Ų15793.8 Ų93.873%0.73451%0.51SS*.SBend17.70124.1-61.7-80.313400121.4V196E156-V196 WeakPolarHBondContact O-CG1 3.31Å
157D57.8Low55.8Low99 Ų9992.4 Ų92.453%0.52950%0.503SS..  trans-110.1134-168.1-67.3-44.4000110.5N155 L159N155-D157 WeakPolarHBondContact CB-OD2 3.45Å; N155-D157 PolarHBondContact O-N 3.48Å; D157-L159 PolarHBondContact O-N 3.48Å
158C67.5Low57.9Low42 Ų4289.1 Ų89.128%0.28448%0.481SS..PPolyproline II helixtrans-61.8118.2170.6177.70000110.7C197C158-C197 WeakPolarHBondContact CA-SG 3.26Å; C158-C197 HydrophobicContact CB-CB 3.86Å; C158-C197 WeakPolarHBondContact CB-SG 3.37Å; C158-C197 WeakPolarHBondContact SG-CA 3.36Å; C158-C197 WeakPolarHBondContact SG-CB 3.41Å; C158-C197 CovalentContact SG-SG 2.04Å; C158-C197 PolarHBondContact SG-SG 2.89Å
159L70.1Confident59.8Low41 Ų4185.3 Ų85.322%0.21548%0.483CS..PPolyproline II helixtrans-83.3122.8-179.8-60.5175.2000110D157 Q163 L164 Q191D157-L159 PolarHBondContact O-N 3.48Å; L159-Q163 HydrophobicContact CB-CB 4.42Å; L159-Q163 HydrophobicContact CD2-CB 4.26Å; L159-L164 HydrophobicContact CD1-CD1 4.2Å; L159-Q191 PolarHBondContact O-OE1 3.08Å
160N70.7Confident62.1Low70 Ų7081.7 Ų81.737%0.37446%0.456SS..PPolyproline II helixtrans-69155.5169.6-168.3-0.2000110.2V70 S162 Q163 L164V70-N160 HydrophobicContact CG2-CB 4.3Å; N160-S162 PolarHBondContact O-N 3.5Å; N160-Q163 WeakPolarHBondContact O-CA 3.48Å; N160-Q163 WeakPolarHBondContact O-CB 3.46Å; N160-Q163 PolarHBondContact O-N 3.35Å; N160-L164 PolarHBondContact O-N 2.9Å
161G72.4Confident63.7Low8 Ų877.5 Ų77.58%0.08244%0.439CS..Hα-helixtrans-53.8-31.6-176.100000114.5L165G161-L165 WeakPolarHBondContact O-CG 3.21Å; G161-L165 PolarHBondContact O-N 3.47Å; G161-L165 VanDerWaalsContact O-N 3.12Å
162S69.7Low65.6Low42 Ų4276 Ų7629%0.29442%0.423SS..Hα-helixtrans-72.1-39.9173.6520000113.3N160 L165 V166N160-S162 PolarHBondContact O-N 3.5Å; S162-L165 PolarHBondContact O-N 3.04Å; S162-V166 VanDerWaalsContact O-CG2 3.27Å; S162-V166 WeakPolarHBondContact O-CG2 3.4Å; S162-V166 PolarHBondContact O-N 3.48Å
163Q71.4Confident67.4Low96 Ų9674.3 Ų74.345%0.44943%0.427SS..Hα-helixtrans-67.4-40.6176-67.6168.9-44.400110.5L159 N160 L165 V166 N167L159-Q163 HydrophobicContact CB-CB 4.42Å; L159-Q163 HydrophobicContact CD2-CB 4.26Å; N160-Q163 WeakPolarHBondContact O-CA 3.48Å; N160-Q163 WeakPolarHBondContact O-CB 3.46Å; N160-Q163 PolarHBondContact O-N 3.35Å; Q163-L165 VanDerWaalsContact C-N 3.35Å; Q163-L165 PolarHBondContact O-N 3Å; Q163-V166 PolarHBondContact O-N 3.37Å; Q163-N167 WeakPolarHBondContact O-CB 3.27Å; Q163-N167 VanDerWaalsContact O-CG 3.23Å; Q163-N167 PolarHBondContact O-N 3.07Å; Q163-N167 PolarHBondContact O-OD1 3.31Å
164L76.9Confident69.2Low1 Ų168.3 Ų68.31%0.00541%0.407CS..Hα-helixtrans-59.5-45.7174.8-169.671.9000111.2L159 N160 F168 L184 A187 L188L159-L164 HydrophobicContact CD1-CD1 4.2Å; N160-L164 PolarHBondContact O-N 2.9Å; L164-F168 HydrophobicContact CD1-CD2 4.43Å; L164-F168 HydrophobicContact CD1-CE2 4.1Å; L164-F168 VanDerWaalsContact O-CD2 3.29Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; L164-F168 PolarHBondContact O-N 2.93Å; L164-L184 HydrophobicContact CD2-CB 4.44Å; L164-L184 HydrophobicContact CG-CD2 4.28Å; L164-A187 HydrophobicContact CD1-CB 3.82Å; L164-L188 HydrophobicContact CD2-CD2 3.52Å; L164-L188 HydrophobicContact CD2-CG 4.05Å
165L77.1Confident71.2Confident5 Ų565.7 Ų65.73%0.02640%0.398CS..Hα-helixtrans-64.4-45.8178.1-72.1174.8000112.6L58 G161 S162 Q163 N167 F168 G169 L170 P172 L176 L184L58-L165 HydrophobicContact CD2-CD1 3.78Å; L58-L165 HydrophobicContact CD2-CD2 4.26Å; L58-L165 HydrophobicContact CD2-CG 4.05Å; G161-L165 WeakPolarHBondContact O-CG 3.21Å; G161-L165 PolarHBondContact O-N 3.47Å; G161-L165 VanDerWaalsContact O-N 3.12Å; S162-L165 PolarHBondContact O-N 3.04Å; Q163-L165 VanDerWaalsContact C-N 3.35Å; Q163-L165 PolarHBondContact O-N 3Å; L165-N167 VanDerWaalsContact C-N 3.34Å; L165-N167 PolarHBondContact O-N 3.08Å; L165-F168 CarbonylContact O-C 3.5Å; L165-F168 PolarHBondContact O-N 2.95Å; L165-G169 PolarHBondContact O-N 2.85Å; L165-L170 CarbonylContact C-O 3.58Å; L165-L170 VanDerWaalsContact C-O 3.31Å; L165-L170 HydrophobicContact CB-CB 4.25Å; L165-L170 HydrophobicContact CD2-CB 3.85Å; L165-L170 HydrophobicContact CD2-CD1 3.92Å; L165-L170 WeakPolarHBondContact O-CA 3.44Å; L165-L170 WeakPolarHBondContact O-CB 3.48Å; L165-L170 PolarHBondContact O-N 3.19Å; L165-L170 VanDerWaalsContact O-O 3.12Å; L165-P172 HydrophobicContact CD1-CB 4.42Å; L165-L176 HydrophobicContact CD2-CD1 3.8Å; L165-L176 HydrophobicContact CD2-CD2 3.66Å; L165-L176 HydrophobicContact CD2-CG 4.26Å; L165-L184 HydrophobicContact CD2-CD1 3.76Å
166V76.3Confident73Confident89 Ų8960.1 Ų60.154%0.53937%0.368SS..Hα-helixtrans-64.4-39.3-179.5171.90000111.5S162 Q163 F168 G169 P172S162-V166 VanDerWaalsContact O-CG2 3.27Å; S162-V166 WeakPolarHBondContact O-CG2 3.4Å; S162-V166 PolarHBondContact O-N 3.48Å; Q163-V166 PolarHBondContact O-N 3.37Å; V166-F168 PolarHBondContact O-N 3.1Å; V166-G169 PolarHBondContact O-N 3.15Å; V166-P172 HydrophobicContact CG2-CG 4.02Å
167N72.9Confident74.8Confident93 Ų9355.3 Ų55.350%0.49735%0.35SS..Hα-helixtrans-63.7-29.7178.2-76.45.9000112.9Q163 L165 G169Q163-N167 WeakPolarHBondContact O-CB 3.27Å; Q163-N167 VanDerWaalsContact O-CG 3.23Å; Q163-N167 PolarHBondContact O-N 3.07Å; Q163-N167 PolarHBondContact O-OD1 3.31Å; L165-N167 VanDerWaalsContact C-N 3.34Å; L165-N167 PolarHBondContact O-N 3.08Å; N167-G169 VanDerWaalsContact C-N 3.34Å
168F79Confident76Confident90 Ų9052.9 Ų52.940%0.39534%0.339SS..THydrogen-bonded Turntrans-93.311.5175-76.6-95.6000113.1L164 L165 V166 L170 L183 L184 A187L164-F168 HydrophobicContact CD1-CD2 4.43Å; L164-F168 HydrophobicContact CD1-CE2 4.1Å; L164-F168 VanDerWaalsContact O-CD2 3.29Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; L164-F168 PolarHBondContact O-N 2.93Å; L165-F168 CarbonylContact O-C 3.5Å; L165-F168 PolarHBondContact O-N 2.95Å; V166-F168 PolarHBondContact O-N 3.1Å; F168-L170 HydrophobicContact CB-CD1 4.36Å; F168-L170 HydrophobicContact CB-CG 4.34Å; F168-L170 PolarHBondContact O-N 3.44Å; F168-L183 VanDerWaalsContact CE1-O 3.23Å; F168-L183 WeakPolarHBondContact CE1-O 3.42Å; F168-L184 HydrophobicContact CB-CD2 3.75Å; F168-L184 HydrophobicContact CD1-CD2 4.19Å; F168-L184 HydrophobicContact CD2-CD2 3.64Å; F168-L184 HydrophobicContact CE2-CD2 4.27Å; F168-L184 HydrophobicContact CG-CD2 3.58Å; F168-A187 HydrophobicContact CE2-CB 3.69Å; F168-A187 HydrophobicContact CZ-CB 3.69Å
169G72.1Confident76.7Confident71 Ų7161.1 Ų61.173%0.73236%0.364SS*.THydrogen-bonded Turntrans68.620.5179.500000114.1L165 V166 N167L165-G169 PolarHBondContact O-N 2.85Å; V166-G169 PolarHBondContact O-N 3.15Å; N167-G169 VanDerWaalsContact C-N 3.34Å
170L80.8Confident77.3Confident26 Ų2662.4 Ų62.414%0.13637%0.369CS..  trans-97.7139.7179.6-58.7176.3000110.4L165 F168 P172 L176 Q180 L184L165-L170 CarbonylContact C-O 3.58Å; L165-L170 VanDerWaalsContact C-O 3.31Å; L165-L170 HydrophobicContact CB-CB 4.25Å; L165-L170 HydrophobicContact CD2-CB 3.85Å; L165-L170 HydrophobicContact CD2-CD1 3.92Å; L165-L170 WeakPolarHBondContact O-CA 3.44Å; L165-L170 WeakPolarHBondContact O-CB 3.48Å; L165-L170 PolarHBondContact O-N 3.19Å; L165-L170 VanDerWaalsContact O-O 3.12Å; F168-L170 HydrophobicContact CB-CD1 4.36Å; F168-L170 HydrophobicContact CB-CG 4.34Å; F168-L170 PolarHBondContact O-N 3.44Å; L170-P172 WeakPolarHBondContact O-CD 3.31Å; L170-L176 HydrophobicContact CB-CD2 4.42Å; L170-L176 HydrophobicContact CD1-CD2 3.78Å; L170-Q180 HydrophobicContact CD1-CB 4.32Å; L170-Q180 HydrophobicContact CD2-CB 4.4Å; L170-Q180 HydrophobicContact CD2-CG 4.17Å; L170-L184 HydrophobicContact CD1-CD1 4.32Å; L170-L184 HydrophobicContact CD1-CD2 4.02Å; L170-L184 HydrophobicContact CD1-CG 4.3Å
171S75.1Confident78.1Confident66 Ų6659.4 Ų59.446%0.46235%0.353SS..  trans-78.8126.9178.8179.10000111A173 A174S171-A173 PolarHBondContact O-N 3.39Å; S171-A173 VanDerWaalsContact O-N 3.14Å; S171-A173 PolarHBondContact OG-N 3.42Å; S171-A174 PolarHBondContact O-N 3.41Å; S171-A174 VanDerWaalsContact O-N 3.15Å
172P71.9Confident78.6Confident46 Ų4660.2 Ų60.230%0.29936%0.359SS..THydrogen-bonded Turntrans-61.8-19.1174.5-2232.9000114.3L165 V166 L170L165-P172 HydrophobicContact CD1-CB 4.42Å; V166-P172 HydrophobicContact CG2-CG 4.02Å; L170-P172 WeakPolarHBondContact O-CD 3.31Å
173A70.2Confident79.2Confident98 Ų9862.1 Ų62.181%0.8137%0.365SS*.THydrogen-bonded Turntrans-89-10.9-179.600000113.4S171S171-A173 PolarHBondContact O-N 3.39Å; S171-A173 VanDerWaalsContact O-N 3.14Å; S171-A173 PolarHBondContact OG-N 3.42Å
174A79.8Confident79.8Confident47 Ų4757.6 Ų57.639%0.38834%0.344SS..SBendtrans-100.8139.9-177.900000111.3S171S171-A174 PolarHBondContact O-N 3.41Å; S171-A174 VanDerWaalsContact O-N 3.15Å
175P84.3Confident80.1Confident71 Ų7159 Ų5946%0.46135%0.354SS..PPolyproline II helixtrans-69.7138.6173.630.3-34.1000110.7
176L87Confident80.3Confident5 Ų562.8 Ų62.83%0.02638%0.379CS..BIsolated β-bridgetrans-85.1138.7-175.5-60.9162.7000111.1F44 T52 L53 L58 L165 L170 Q180 L184F44-L176 WeakPolarHBondContact CE1-O 3.29Å; T52-L176 CarbonylContact C-O 3.25Å; T52-L176 VanDerWaalsContact CA-O 3.28Å; T52-L176 WeakPolarHBondContact CA-O 3.37Å; T52-L176 WeakPolarHBondContact CB-O 3.45Å; L53-L176 HydrophobicContact CB-CB 4.19Å; L53-L176 HydrophobicContact CD2-CD1 4.4Å; L53-L176 PolarHBondContact N-O 2.95Å; L53-L176 PolarHBondContact O-N 3.4Å; L58-L176 HydrophobicContact CD1-CD1 4.43Å; L58-L176 HydrophobicContact CD2-CD1 3.98Å; L165-L176 HydrophobicContact CD2-CD1 3.8Å; L165-L176 HydrophobicContact CD2-CD2 3.66Å; L165-L176 HydrophobicContact CD2-CG 4.26Å; L170-L176 HydrophobicContact CB-CD2 4.42Å; L170-L176 HydrophobicContact CD1-CD2 3.78Å; L176-Q180 HydrophobicContact CD2-CB 4.37Å; L176-L184 HydrophobicContact CD1-CD1 4.25Å
177T87.4Confident80.4Confident56 Ų5659.4 Ų59.434%0.34436%0.36SS..PPolyproline II helixtrans-85159.2169.360.60000111.2R179 Q180 F181T177-R179 PolarHBondContact O-N 3.39Å; T177-Q180 PolarHBondContact O-N 3.09Å; T177-Q180 VanDerWaalsContact OG1-CD 3.24Å; T177-Q180 VanDerWaalsContact OG1-CG 3.31Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.27Å; T177-Q180 PolarHBondContact OG1-N 3.36Å; T177-Q180 PolarHBondContact OG1-OE1 2.9Å; T177-F181 PolarHBondContact O-N 3.49Å
178P83.6Confident80.7Confident47 Ų4755.4 Ų55.431%0.30534%0.339SS..Hα-helixtrans-53.6-37.6176.4-28.535.3000113.7F44 F181 A182F44-P178 HydrophobicContact CD1-CG 3.89Å; F44-P178 HydrophobicContact CE1-CB 4.39Å; F44-P178 HydrophobicContact CE1-CG 3.76Å; F44-P178 HydrophobicContact CE2-CB 4.49Å; F44-P178 HydrophobicContact CG-CG 4.36Å; F44-P178 VanDerWaalsContact CZ-CA 3.49Å; F44-P178 HydrophobicContact CZ-CB 4.27Å; F44-P178 HydrophobicContact CZ-CG 4.14Å; P178-F181 PolarHBondContact O-N 3.32Å; P178-A182 WeakPolarHBondContact O-CB 3.3Å; P178-A182 PolarHBondContact O-N 2.86Å
179R81.5Confident80.7Confident215 Ų21556.6 Ų56.681%0.81135%0.349SS*.Hα-helixtrans-68.4-38.6177.3-68.6-174.6175.9-180-2.9112.7T177 A182T177-R179 PolarHBondContact O-N 3.39Å; R179-A182 PolarHBondContact O-N 2.93Å
180Q83.7Confident80.8Confident69 Ų6959.9 Ų59.932%0.32234%0.34SS..Hα-helixtrans-71.6-37176.1-72.9164.1-33.400111.7L170 L176 T177 A182 L183L170-Q180 HydrophobicContact CD1-CB 4.32Å; L170-Q180 HydrophobicContact CD2-CB 4.4Å; L170-Q180 HydrophobicContact CD2-CG 4.17Å; L176-Q180 HydrophobicContact CD2-CB 4.37Å; T177-Q180 PolarHBondContact O-N 3.09Å; T177-Q180 VanDerWaalsContact OG1-CD 3.24Å; T177-Q180 VanDerWaalsContact OG1-CG 3.31Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.27Å; T177-Q180 PolarHBondContact OG1-N 3.36Å; T177-Q180 PolarHBondContact OG1-OE1 2.9Å; Q180-A182 VanDerWaalsContact C-N 3.34Å; Q180-L183 WeakPolarHBondContact O-CB 3.42Å; Q180-L183 PolarHBondContact O-N 3.41Å
181F86.6Confident80.4Confident6 Ų659.1 Ų59.13%0.02634%0.336CS..Hα-helixtrans-65.7-37.5174-179.2-97.3000111.9L40 L43 F44 L53 L58 L61 T177 P178 L183 L184 C185 L188L40-F181 HydrophobicContact CD2-CD1 3.67Å; L40-F181 HydrophobicContact CD2-CE1 4.15Å; L43-F181 HydrophobicContact CD1-CE1 3.94Å; L43-F181 HydrophobicContact CD1-CZ 4.16Å; L43-F181 HydrophobicContact CD2-CD1 4.45Å; L43-F181 HydrophobicContact CD2-CE1 3.97Å; L43-F181 HydrophobicContact CD2-CZ 4.14Å; F44-F181 HydrophobicContact CE2-CB 3.82Å; F44-F181 AromaticContact CE2-CD1 3.87Å; F44-F181 HydrophobicContact CE2-CD1 3.87Å; F44-F181 AromaticContact CE2-CG 3.85Å; F44-F181 HydrophobicContact CE2-CG 3.85Å; F44-F181 HydrophobicContact CZ-CB 3.64Å; F44-F181 HydrophobicContact CZ-CG 4.12Å; L53-F181 HydrophobicContact CD2-CD2 3.74Å; L53-F181 HydrophobicContact CD2-CE2 3.99Å; L58-F181 HydrophobicContact CD1-CD2 4.33Å; L58-F181 HydrophobicContact CD1-CE2 4Å; L61-F181 HydrophobicContact CD2-CE1 4.5Å; L61-F181 HydrophobicContact CD2-CE2 3.48Å; L61-F181 VanDerWaalsContact CD2-CE2 3.48Å; L61-F181 HydrophobicContact CD2-CZ 3.43Å; L61-F181 VanDerWaalsContact CD2-CZ 3.43Å; T177-F181 PolarHBondContact O-N 3.49Å; P178-F181 PolarHBondContact O-N 3.32Å; F181-L183 PolarHBondContact O-N 2.97Å; F181-L184 HydrophobicContact CD2-CD1 4.44Å; F181-L184 WeakPolarHBondContact O-CA 3.34Å; F181-L184 WeakPolarHBondContact O-CB 3.23Å; F181-L184 PolarHBondContact O-N 2.93Å; F181-C185 PolarHBondContact O-N 2.88Å; F181-L188 HydrophobicContact CE2-CD1 3.88Å; F181-L188 HydrophobicContact CZ-CD1 3.89Å
182A83.8Confident80.2Confident25 Ų2559 Ų5921%0.20733%0.329CS..Hα-helixtrans-58.7-28.8174.600000113.3L40 P178 R179 Q180 L184 C185 P186L40-A182 HydrophobicContact CD1-CB 4.25Å; P178-A182 WeakPolarHBondContact O-CB 3.3Å; P178-A182 PolarHBondContact O-N 2.86Å; R179-A182 PolarHBondContact O-N 2.93Å; Q180-A182 VanDerWaalsContact C-N 3.34Å; A182-L184 VanDerWaalsContact C-N 3.28Å; A182-L184 PolarHBondContact O-N 3.32Å; A182-C185 WeakPolarHBondContact O-CB 3.47Å; A182-C185 PolarHBondContact O-N 3.48Å; A182-P186 WeakPolarHBondContact O-CD 3.28Å
183L82.3Confident79.8Confident83 Ų8363.5 Ų63.544%0.43535%0.351SS..Hα-helixtrans-69.1-26.8173.6-62171.2000112.6F168 Q180 F181F168-L183 VanDerWaalsContact CE1-O 3.23Å; F168-L183 WeakPolarHBondContact CE1-O 3.42Å; Q180-L183 WeakPolarHBondContact O-CB 3.42Å; Q180-L183 PolarHBondContact O-N 3.41Å; F181-L183 PolarHBondContact O-N 2.97Å
184L83.3Confident79.4Confident0 Ų060.8 Ų60.80%033%0.326CS..Hα-helixtrans-82.9-22.7177.6-54.1178.3000112L164 L165 F168 L170 L176 F181 A182 A187 L188L164-L184 HydrophobicContact CD2-CB 4.44Å; L164-L184 HydrophobicContact CG-CD2 4.28Å; L165-L184 HydrophobicContact CD2-CD1 3.76Å; F168-L184 HydrophobicContact CB-CD2 3.75Å; F168-L184 HydrophobicContact CD1-CD2 4.19Å; F168-L184 HydrophobicContact CD2-CD2 3.64Å; F168-L184 HydrophobicContact CE2-CD2 4.27Å; F168-L184 HydrophobicContact CG-CD2 3.58Å; L170-L184 HydrophobicContact CD1-CD1 4.32Å; L170-L184 HydrophobicContact CD1-CD2 4.02Å; L170-L184 HydrophobicContact CD1-CG 4.3Å; L176-L184 HydrophobicContact CD1-CD1 4.25Å; F181-L184 HydrophobicContact CD2-CD1 4.44Å; F181-L184 WeakPolarHBondContact O-CA 3.34Å; F181-L184 WeakPolarHBondContact O-CB 3.23Å; F181-L184 PolarHBondContact O-N 2.93Å; A182-L184 VanDerWaalsContact C-N 3.28Å; A182-L184 PolarHBondContact O-N 3.32Å; L184-A187 PolarHBondContact O-N 3.05Å; L184-A187 VanDerWaalsContact O-N 3.07Å; L184-L188 HydrophobicContact CB-CD1 4.33Å; L184-L188 WeakPolarHBondContact O-CG 3.35Å; L184-L188 PolarHBondContact O-N 3.07Å
185C83.7Confident78.6Confident32 Ų3266.8 Ų66.822%0.21634%0.339CS..Hα-helixtrans-54.1-44.2-175.7-69.90000114F181 A182 A187 L188 L189F181-C185 PolarHBondContact O-N 2.88Å; A182-C185 WeakPolarHBondContact O-CB 3.47Å; A182-C185 PolarHBondContact O-N 3.48Å; C185-A187 VanDerWaalsContact C-N 3.33Å; C185-A187 PolarHBondContact O-N 3.48Å; C185-L188 PolarHBondContact O-N 2.93Å; C185-L189 WeakPolarHBondContact O-CB 3.49Å; C185-L189 VanDerWaalsContact O-CG 3.29Å; C185-L189 WeakPolarHBondContact O-CG 3.29Å; C185-L189 PolarHBondContact O-N 3.34Å
186P81.3Confident77.6Confident83 Ų8365.6 Ų65.654%0.53933%0.33SS..Hα-helixtrans-60.2-40176.4-25.135.5000113.2A182 Y190A182-P186 WeakPolarHBondContact O-CD 3.28Å; P186-Y190 VanDerWaalsContact O-CB 3.31Å; P186-Y190 WeakPolarHBondContact O-CB 3.45Å; P186-Y190 PolarHBondContact O-N 3.06Å
187A77.6Confident76.3Confident19 Ų1966 Ų6616%0.15733%0.333CS..Hα-helixtrans-73.7-30.8177.700000112.9L164 F168 L184 C185 Q191L164-A187 HydrophobicContact CD1-CB 3.82Å; F168-A187 HydrophobicContact CE2-CB 3.69Å; F168-A187 HydrophobicContact CZ-CB 3.69Å; L184-A187 PolarHBondContact O-N 3.05Å; L184-A187 VanDerWaalsContact O-N 3.07Å; C185-A187 VanDerWaalsContact C-N 3.33Å; C185-A187 PolarHBondContact O-N 3.48Å; A187-Q191 VanDerWaalsContact O-CG 3.31Å; A187-Q191 WeakPolarHBondContact O-CG 3.38Å; A187-Q191 PolarHBondContact O-N 3.44Å; A187-Q191 VanDerWaalsContact O-N 3.1Å; A187-Q191 PolarHBondContact O-NE2 3.48Å; A187-Q191 VanDerWaalsContact O-NE2 3.16Å
188L80.4Confident74.9Confident8 Ų867.1 Ų67.14%0.04234%0.336CS..Hα-helixtrans-70.9-44172.4-67.9175.7000111.6L62 L67 L164 F181 L184 C185 Y190 Q191 I192L62-L188 HydrophobicContact CD2-CD1 4.4Å; L62-L188 HydrophobicContact CD2-CD2 3.34Å; L67-L188 HydrophobicContact CD1-CD2 3.85Å; L164-L188 HydrophobicContact CD2-CD2 3.52Å; L164-L188 HydrophobicContact CD2-CG 4.05Å; F181-L188 HydrophobicContact CE2-CD1 3.88Å; F181-L188 HydrophobicContact CZ-CD1 3.89Å; L184-L188 HydrophobicContact CB-CD1 4.33Å; L184-L188 WeakPolarHBondContact O-CG 3.35Å; L184-L188 PolarHBondContact O-N 3.07Å; C185-L188 PolarHBondContact O-N 2.93Å; L188-Y190 VanDerWaalsContact C-N 3.34Å; L188-Q191 PolarHBondContact O-N 2.9Å; L188-I192 WeakPolarHBondContact O-CD1 3.32Å; L188-I192 VanDerWaalsContact O-CG1 3.26Å; L188-I192 WeakPolarHBondContact O-CG1 3.26Å; L188-I192 PolarHBondContact O-N 3.18Å
189L78.9Confident73.2Confident115 Ų11567.7 Ų67.760%0.60235%0.351SS*.Hα-helixtrans-60.8-45.3174.4-75.1169.9000110.7C185 Q191 I192 D193C185-L189 WeakPolarHBondContact O-CB 3.49Å; C185-L189 VanDerWaalsContact O-CG 3.29Å; C185-L189 WeakPolarHBondContact O-CG 3.29Å; C185-L189 PolarHBondContact O-N 3.34Å; L189-Q191 PolarHBondContact O-N 3.33Å; L189-I192 PolarHBondContact O-N 3.43Å; L189-D193 VanDerWaalsContact O-CB 3.26Å; L189-D193 WeakPolarHBondContact O-CB 3.26Å; L189-D193 PolarHBondContact O-N 3.36Å
190Y73Confident71.2Confident141 Ų14161.5 Ų61.555%0.55335%0.345SS*.Hα-helixtrans-56.3-48.5174.3179-99.5000111.7P186 L188 I192 D193 S194P186-Y190 VanDerWaalsContact O-CB 3.31Å; P186-Y190 WeakPolarHBondContact O-CB 3.45Å; P186-Y190 PolarHBondContact O-N 3.06Å; L188-Y190 VanDerWaalsContact C-N 3.34Å; Y190-I192 VanDerWaalsContact C-N 3.3Å; Y190-I192 PolarHBondContact O-N 3.2Å; Y190-D193 PolarHBondContact O-N 3.43Å; Y190-S194 WeakPolarHBondContact O-CB 3.3Å; Y190-S194 PolarHBondContact O-N 3.35Å; Y190-S194 PolarHBondContact O-OG 3.13Å
191Q72.1Confident69.1Low9 Ų963.7 Ų63.74%0.04237%0.365CS..Hα-helixtrans-67.4-25.5179.9-73.9176.3105.800114.3L67 L159 A187 L188 L189 C197L67-Q191 HydrophobicContact CD2-CB 4.13Å; L159-Q191 PolarHBondContact O-OE1 3.08Å; A187-Q191 VanDerWaalsContact O-CG 3.31Å; A187-Q191 WeakPolarHBondContact O-CG 3.38Å; A187-Q191 PolarHBondContact O-N 3.44Å; A187-Q191 VanDerWaalsContact O-N 3.1Å; A187-Q191 PolarHBondContact O-NE2 3.48Å; A187-Q191 VanDerWaalsContact O-NE2 3.16Å; L188-Q191 PolarHBondContact O-N 2.9Å; L189-Q191 PolarHBondContact O-N 3.33Å; Q191-C197 PolarHBondContact OE1-SG 3.04Å
192I71.8Confident66.7Low63 Ų6367 Ų6732%0.32339%0.394SS..Hα-helixtrans-77.4-49.2174.3-68.6165.1000110.3L65 L67 L188 L189 Y190 R195L65-I192 HydrophobicContact CD2-CD1 4.46Å; L67-I192 HydrophobicContact CD1-CD1 4.35Å; L67-I192 HydrophobicContact CD1-CG1 4.06Å; L67-I192 HydrophobicContact CD2-CG1 4.05Å; L67-I192 HydrophobicContact CG-CG1 4.33Å; L188-I192 WeakPolarHBondContact O-CD1 3.32Å; L188-I192 VanDerWaalsContact O-CG1 3.26Å; L188-I192 WeakPolarHBondContact O-CG1 3.26Å; L188-I192 PolarHBondContact O-N 3.18Å; L189-I192 PolarHBondContact O-N 3.43Å; Y190-I192 VanDerWaalsContact C-N 3.3Å; Y190-I192 PolarHBondContact O-N 3.2Å; I192-R195 PolarHBondContact O-N 3.09Å
193D64.6Low64.7Low142 Ų14271.9 Ų71.976%0.75942%0.423SS*.Hα-helixtrans-68.4-46.7-175.4-168.258.7000111.7L189 Y190 R195L189-D193 VanDerWaalsContact O-CB 3.26Å; L189-D193 WeakPolarHBondContact O-CB 3.26Å; L189-D193 PolarHBondContact O-N 3.36Å; Y190-D193 PolarHBondContact O-N 3.43Å; D193-R195 PolarHBondContact O-N 3.38Å
194S61.3Low62.7Low41 Ų4170.4 Ų70.429%0.28742%0.423SS..THydrogen-bonded Turntrans-72-7.8176.864.10000114.1Y190 V196Y190-S194 WeakPolarHBondContact O-CB 3.3Å; Y190-S194 PolarHBondContact O-N 3.35Å; Y190-S194 PolarHBondContact O-OG 3.13Å; S194-V196 PolarHBondContact O-N 3.41Å; S194-V196 WeakPolarHBondContact OG-CG2 3.21Å
195R62.8Low60.6Low173 Ų17374.4 Ų74.465%0.65345%0.449SS*.  trans52.218.3-174.7-56.3-174-178.5173.23.2114.6I192 D193 C197 I198I192-R195 PolarHBondContact O-N 3.09Å; D193-R195 PolarHBondContact O-N 3.38Å; R195-C197 PolarHBondContact O-N 3.29Å; R195-C197 VanDerWaalsContact O-N 3.15Å; R195-I198 HydrophobicContact CB-CB 4.39Å; R195-I198 CarbonylContact O-C 3.55Å; R195-I198 VanDerWaalsContact O-C 3.25Å; R195-I198 PolarHBondContact O-N 3.47Å
196V62.5Low58.6Low46 Ų4679.2 Ų79.228%0.27948%0.48SS..THydrogen-bonded Turntrans-60.4-30.3-176.9172.30000112.5E156 S194E156-V196 WeakPolarHBondContact O-CG1 3.31Å; S194-V196 PolarHBondContact O-N 3.41Å; S194-V196 WeakPolarHBondContact OG-CG2 3.21Å
197C60.4Low57.1Low12 Ų1277.4 Ų77.48%0.08148%0.477CS..THydrogen-bonded Turntrans-91.3-16.7175.3-78.50000115.3L67 C158 Q191 R195 G199L67-C197 HydrophobicContact CD2-CB 3.52Å; C158-C197 WeakPolarHBondContact CA-SG 3.26Å; C158-C197 HydrophobicContact CB-CB 3.86Å; C158-C197 WeakPolarHBondContact CB-SG 3.37Å; C158-C197 WeakPolarHBondContact SG-CA 3.36Å; C158-C197 WeakPolarHBondContact SG-CB 3.41Å; C158-C197 CovalentContact SG-SG 2.04Å; C158-C197 PolarHBondContact SG-SG 2.89Å; Q191-C197 PolarHBondContact OE1-SG 3.04Å; R195-C197 PolarHBondContact O-N 3.29Å; R195-C197 VanDerWaalsContact O-N 3.15Å; C197-G199 PolarHBondContact O-N 3.24Å
198I57.6Low56.7Low80 Ų8080.2 Ų80.241%0.4149%0.489SS..SBendtrans-100.478.1176.6-54.7169.7000103.9R195 A200R195-I198 HydrophobicContact CB-CB 4.39Å; R195-I198 CarbonylContact O-C 3.55Å; R195-I198 VanDerWaalsContact O-C 3.25Å; R195-I198 PolarHBondContact O-N 3.47Å; I198-A200 PolarHBondContact O-N 3.46Å
199G47.3Very low56.8Low60 Ų6083.2 Ų83.262%0.61950%0.504SS*.  trans-37.3128.6-172.100000111C197C197-G199 PolarHBondContact O-N 3.24Å
200A40.7Very low57.2Low84 Ų8482.9 Ų82.969%0.69450%0.503SS*.  trans-32.4130178.300000108.7I198 A202I198-A200 PolarHBondContact O-N 3.46Å; A200-A202 PolarHBondContact O-N 2.58Å
201P39Very low57.8Low115 Ų11578 Ų7875%0.74749%0.489SS*.  trans-44.7118-177.217.7-29.5000106.7
202A36.7Very low58.6Low76 Ų7677.8 Ų77.863%0.62849%0.489SS*.  trans-45135.9-179.700000106.5A200 A204A200-A202 PolarHBondContact O-N 2.58Å; A202-A204 WeakPolarHBondContact O-CA 3.43Å; A202-A204 PolarHBondContact O-N 3.28Å
203P40.5Very low59.6Low127 Ų12777.4 Ų77.483%0.82549%0.488SS*.SBendtrans-44.9117.3179.518.4-31.1000106.2
204A41.4Very low61Low52 Ų5276 Ų7643%0.4348%0.479SS..  trans-33.1129.1-169.500000110.3A202 D208A202-A204 WeakPolarHBondContact O-CA 3.43Å; A202-A204 PolarHBondContact O-N 3.28Å; A204-D208 VanDerWaalsContact CA-OD2 3.3Å; A204-D208 WeakPolarHBondContact CA-OD2 3.32Å; A204-D208 HydrophobicContact CB-CB 3.38Å; A204-D208 WeakPolarHBondContact CB-OD2 3.5Å
205P39.1Very low62.6Low85 Ų8576.9 Ų76.955%0.55248%0.479SS*.  trans-47.6151.816722.8-33.8000108.4G207 D208P205-G207 PolarHBondContact O-N 3.1Å; P205-D208 WeakPolarHBondContact CD-OD2 3.3Å; P205-D208 PolarHBondContact O-N 3.47Å
206P41.8Very low64.1Low133 Ų13368.7 Ų68.786%0.86445%0.448SS*.THydrogen-bonded Turntrans-57.78.2-175.418.7-30.4000115.9
207G48.4Very low65.7Low45 Ų4568.2 Ų68.246%0.46445%0.449SS..THydrogen-bonded Turntrans-86.4-20.4163.400000117P205 S211P205-G207 PolarHBondContact O-N 3.1Å; G207-S211 PolarHBondContact O-N 3.24Å
208D70.3Confident67.5Low78 Ų7873.4 Ų73.442%0.41748%0.475SS..Hα-helixtrans-90.3-24.6-176.2-39.6-43.2000114.7A204 P205 L210 S211 A212A204-D208 VanDerWaalsContact CA-OD2 3.3Å; A204-D208 WeakPolarHBondContact CA-OD2 3.32Å; A204-D208 HydrophobicContact CB-CB 3.38Å; A204-D208 WeakPolarHBondContact CB-OD2 3.5Å; P205-D208 WeakPolarHBondContact CD-OD2 3.3Å; P205-D208 PolarHBondContact O-N 3.47Å; D208-L210 VanDerWaalsContact C-N 3.34Å; D208-L210 PolarHBondContact O-N 3.16Å; D208-S211 VanDerWaalsContact CA-OG 3.27Å; D208-S211 WeakPolarHBondContact CA-OG 3.45Å; D208-S211 PolarHBondContact O-N 3.24Å; D208-S211 PolarHBondContact O-OG 3.4Å; D208-A212 VanDerWaalsContact O-CB 3.3Å; D208-A212 WeakPolarHBondContact O-CB 3.42Å; D208-A212 PolarHBondContact O-N 2.83Å
209L81.9Confident69.3Low70 Ų7069.9 Ų69.937%0.36646%0.458SS..Hα-helixtrans-63.5-44.8171.7174.760.3000110.7S211 A212 L213 V464 L468L209-S211 VanDerWaalsContact C-N 3.33Å; L209-A212 PolarHBondContact O-N 3.39Å; L209-L213 HydrophobicContact CD1-CD1 4.17Å; L209-L213 HydrophobicContact CD1-CG 4.26Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 VanDerWaalsContact O-CG 3.25Å; L209-L213 WeakPolarHBondContact O-CG 3.18Å; L209-L213 PolarHBondContact O-N 2.92Å; L209-V464 HydrophobicContact CD1-CG1 3.18Å; L209-L468 HydrophobicContact CD1-CD1 3.95Å; L209-L468 HydrophobicContact CD1-CD2 4.19Å; L209-L468 HydrophobicContact CD1-CG 4.4Å; L209-L468 HydrophobicContact CD2-CD1 4.04Å
210L87.1Confident71.7Confident108 Ų10867.4 Ų67.457%0.56543%0.431SS*.Hα-helixtrans-66.1-38.8177.9-175.368.2000110.8D208 L214D208-L210 VanDerWaalsContact C-N 3.34Å; D208-L210 PolarHBondContact O-N 3.16Å; L210-L214 HydrophobicContact CD1-CD1 4.42Å; L210-L214 HydrophobicContact CD1-CG 4.45Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.41Å; L210-L214 WeakPolarHBondContact O-CB 3.41Å; L210-L214 WeakPolarHBondContact O-CG 3.5Å; L210-L214 PolarHBondContact O-N 3.14Å
211S86.9Confident74.2Confident39 Ų3968.6 Ų68.627%0.27343%0.425SS..Hα-helixtrans-67-44.4177.172.90000111.4G207 D208 L209 L213 L214 Q215G207-S211 PolarHBondContact O-N 3.24Å; D208-S211 VanDerWaalsContact CA-OG 3.27Å; D208-S211 WeakPolarHBondContact CA-OG 3.45Å; D208-S211 PolarHBondContact O-N 3.24Å; D208-S211 PolarHBondContact O-OG 3.4Å; L209-S211 VanDerWaalsContact C-N 3.33Å; S211-L213 PolarHBondContact O-N 2.94Å; S211-L214 PolarHBondContact O-N 3.44Å; S211-Q215 VanDerWaalsContact O-CB 3.28Å; S211-Q215 WeakPolarHBondContact O-CB 3.29Å; S211-Q215 WeakPolarHBondContact O-CG 3.47Å; S211-Q215 PolarHBondContact O-N 2.91Å
212A88.9Confident76.8Confident5 Ų567.3 Ų67.34%0.04141%0.412CS..Hα-helixtrans-60.8-43.3175.400000111.6D208 L209 S216 F406 V464D208-A212 VanDerWaalsContact O-CB 3.3Å; D208-A212 WeakPolarHBondContact O-CB 3.42Å; D208-A212 PolarHBondContact O-N 2.83Å; L209-A212 PolarHBondContact O-N 3.39Å; A212-S216 WeakPolarHBondContact O-CB 3.45Å; A212-S216 PolarHBondContact O-N 3.03Å; A212-S216 PolarHBondContact O-OG 2.86Å; A212-F406 HydrophobicContact CB-CB 4.46Å; A212-V464 HydrophobicContact CB-CG1 4.48Å; A212-V464 HydrophobicContact CB-CG2 4.4Å
213L92.9Very high79.5Confident55 Ų5564.2 Ų64.229%0.28839%0.385SS..Hα-helixtrans-63.4-44.1174.9-73.8172000112.2L209 S211 A217 V461 V464L209-L213 HydrophobicContact CD1-CD1 4.17Å; L209-L213 HydrophobicContact CD1-CG 4.26Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 VanDerWaalsContact O-CG 3.25Å; L209-L213 WeakPolarHBondContact O-CG 3.18Å; L209-L213 PolarHBondContact O-N 2.92Å; S211-L213 PolarHBondContact O-N 2.94Å; L213-A217 WeakPolarHBondContact O-CB 3.3Å; L213-A217 PolarHBondContact O-N 3.4Å; L213-V461 HydrophobicContact CD2-CG2 4.18Å; L213-V464 HydrophobicContact CD2-CB 3.93Å; L213-V464 HydrophobicContact CD2-CG1 3.95Å; L213-V464 HydrophobicContact CD2-CG2 4Å; L213-V464 HydrophobicContact CG-CG1 4.08Å
214L93.8Very high82Confident112 Ų11259.8 Ų59.859%0.58636%0.357SS*.Hα-helixtrans-67.2-42.7179-74.1172.3000111.9L210 S211 A217 L218L210-L214 HydrophobicContact CD1-CD1 4.42Å; L210-L214 HydrophobicContact CD1-CG 4.45Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.41Å; L210-L214 WeakPolarHBondContact O-CB 3.41Å; L210-L214 WeakPolarHBondContact O-CG 3.5Å; L210-L214 PolarHBondContact O-N 3.14Å; S211-L214 PolarHBondContact O-N 3.44Å; L214-A217 PolarHBondContact O-N 3.09Å; L214-L218 VanDerWaalsContact O-CB 3.28Å; L214-L218 WeakPolarHBondContact O-CB 3.37Å; L214-L218 PolarHBondContact O-N 3.3Å
215Q93.9Very high84.4Confident60 Ų6062.1 Ų62.128%0.2836%0.361SS..Hα-helixtrans-65.6-45.7177.5-72.8171.3-8.900111.1S211 L218 A219 F406S211-Q215 VanDerWaalsContact O-CB 3.28Å; S211-Q215 WeakPolarHBondContact O-CB 3.29Å; S211-Q215 WeakPolarHBondContact O-CG 3.47Å; S211-Q215 PolarHBondContact O-N 2.91Å; Q215-L218 PolarHBondContact O-N 2.98Å; Q215-A219 WeakPolarHBondContact O-CB 3.4Å; Q215-A219 PolarHBondContact O-N 3.45Å; Q215-F406 HydrophobicContact CB-CD1 3.71Å; Q215-F406 HydrophobicContact CB-CD2 4.4Å; Q215-F406 HydrophobicContact CB-CE1 3.86Å; Q215-F406 HydrophobicContact CB-CG 4.02Å; Q215-F406 HydrophobicContact CB-CZ 4.26Å; Q215-F406 HydrophobicContact CG-CD1 4.46Å
216S95.8Very high86.8Confident0 Ų058.1 Ų58.10%034%0.335CS..Hα-helixtrans-64.5-42.1176.3-53.40000111.6A212 L218 A219 V220 F406A212-S216 WeakPolarHBondContact O-CB 3.45Å; A212-S216 PolarHBondContact O-N 3.03Å; A212-S216 PolarHBondContact O-OG 2.86Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 3.38Å; S216-A219 PolarHBondContact O-N 3.13Å; S216-V220 WeakPolarHBondContact O-CG2 3.36Å; S216-V220 PolarHBondContact O-N 3.49Å; S216-F406 WeakPolarHBondContact OG-CB 3.21Å; S216-F406 WeakPolarHBondContact OG-CD2 3.4Å
217A96.1Very high89.2Confident36 Ų3651.9 Ų51.930%0.29830%0.295SS..Hα-helixtrans-64.5-39.8176.400000112.1L213 L214 L221 L457L213-A217 WeakPolarHBondContact O-CB 3.3Å; L213-A217 PolarHBondContact O-N 3.4Å; L214-A217 PolarHBondContact O-N 3.09Å; A217-L221 WeakPolarHBondContact O-CB 3.39Å; A217-L221 PolarHBondContact O-N 3.36Å; A217-L457 HydrophobicContact CB-CD2 3.79Å
218L96.4Very high91.2Very high121 Ų12152.4 Ų52.463%0.63429%0.29SS*.Hα-helixtrans-64.8-42.4174.7-179.863.1000111.5L214 Q215 S216 L221 L222L214-L218 VanDerWaalsContact O-CB 3.28Å; L214-L218 WeakPolarHBondContact O-CB 3.37Å; L214-L218 PolarHBondContact O-N 3.3Å; Q215-L218 PolarHBondContact O-N 2.98Å; S216-L218 VanDerWaalsContact C-N 3.35Å; S216-L218 PolarHBondContact O-N 3.38Å; L218-L221 PolarHBondContact O-N 2.88Å; L218-L222 WeakPolarHBondContact O-CB 3.37Å; L218-L222 PolarHBondContact O-N 3.34Å
219A96.6Very high92.1Very high6 Ų653 Ų535%0.0529%0.292CS..Hα-helixtrans-60.8-50.1175.600000111.8Q215 S216 L221 L222 L223 I402 F406 T417Q215-A219 WeakPolarHBondContact O-CB 3.4Å; Q215-A219 PolarHBondContact O-N 3.45Å; S216-A219 PolarHBondContact O-N 3.13Å; A219-L221 VanDerWaalsContact C-N 3.29Å; A219-L221 PolarHBondContact O-N 3.22Å; A219-L222 WeakPolarHBondContact O-CA 3.49Å; A219-L222 WeakPolarHBondContact O-CB 3.42Å; A219-L222 PolarHBondContact O-N 3.32Å; A219-L223 WeakPolarHBondContact O-CG 3.43Å; A219-L223 PolarHBondContact O-N 3.14Å; A219-I402 HydrophobicContact CB-CG2 3.87Å; A219-F406 HydrophobicContact CB-CE2 3.77Å; A219-F406 HydrophobicContact CB-CZ 4.42Å; A219-T417 HydrophobicContact CB-CG2 3.64Å; A219-T417 WeakPolarHBondContact CB-OG1 3.42Å
220V96.3Very high92.5Very high8 Ų849.6 Ų49.65%0.04828%0.275CS..Hα-helixtrans-61.8-37.8177.2174.80000111.8S216 L222 L223 S224 I402 L457 A460S216-V220 WeakPolarHBondContact O-CG2 3.36Å; S216-V220 PolarHBondContact O-N 3.49Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.48Å; V220-L223 CarbonylContact O-C 3.6Å; V220-L223 PolarHBondContact O-N 2.83Å; V220-S224 PolarHBondContact O-N 3.19Å; V220-S224 PolarHBondContact O-OG 3.35Å; V220-I402 HydrophobicContact CG2-CD1 4.39Å; V220-L457 HydrophobicContact CB-CD2 4.41Å; V220-L457 HydrophobicContact CB-CG 4.45Å; V220-L457 HydrophobicContact CG1-CD2 4.44Å; V220-L457 HydrophobicContact CG1-CG 3.94Å; V220-A460 HydrophobicContact CG2-CB 4.09Å
221L94.3Very high92.7Very high110 Ų11044.5 Ų44.558%0.57625%0.248SC*.Hα-helixtrans-64.4-38.8174.5-177.963.4000112A217 L218 A219 L223 S224A217-L221 WeakPolarHBondContact O-CB 3.39Å; A217-L221 PolarHBondContact O-N 3.36Å; L218-L221 PolarHBondContact O-N 2.88Å; A219-L221 VanDerWaalsContact C-N 3.29Å; A219-L221 PolarHBondContact O-N 3.22Å; L221-L223 VanDerWaalsContact C-N 3.33Å; L221-S224 WeakPolarHBondContact O-CB 3.22Å; L221-S224 PolarHBondContact O-N 3.35Å
222L93.9Very high92.8Very high88 Ų8847.1 Ų47.146%0.46126%0.259SS..Hα-helixtrans-63.8-40.5174.3-17372.8000111.1L218 A219 V220 S224 L225 P226L218-L222 WeakPolarHBondContact O-CB 3.37Å; L218-L222 PolarHBondContact O-N 3.34Å; A219-L222 WeakPolarHBondContact O-CA 3.49Å; A219-L222 WeakPolarHBondContact O-CB 3.42Å; A219-L222 PolarHBondContact O-N 3.32Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.48Å; L222-S224 PolarHBondContact O-N 2.88Å; L222-L225 HydrophobicContact CD1-CD1 3.81Å; L222-L225 WeakPolarHBondContact O-CB 3.26Å; L222-L225 WeakPolarHBondContact O-CG 3.25Å; L222-L225 PolarHBondContact O-N 2.97Å; L222-L225 VanDerWaalsContact O-N 3.12Å; L222-P226 WeakPolarHBondContact O-CD 3.34Å
223L93.6Very high92.8Very high11 Ų1149.6 Ų49.66%0.05827%0.271CS..Hα-helixtrans-69.6-13.6175.4-66.5171.9000113.8A219 V220 L221 P226 I402 T417 V420 F421A219-L223 WeakPolarHBondContact O-CG 3.43Å; A219-L223 PolarHBondContact O-N 3.14Å; V220-L223 CarbonylContact O-C 3.6Å; V220-L223 PolarHBondContact O-N 2.83Å; L221-L223 VanDerWaalsContact C-N 3.33Å; L223-P226 VanDerWaalsContact O-CD 3.26Å; L223-P226 WeakPolarHBondContact O-CD 3.34Å; L223-I402 HydrophobicContact CD1-CD1 3.19Å; L223-T417 HydrophobicContact CG-CG2 4.47Å; L223-V420 HydrophobicContact CD1-CB 4.08Å; L223-V420 HydrophobicContact CD1-CG1 3.64Å; L223-V420 HydrophobicContact CD2-CB 4.24Å; L223-V420 HydrophobicContact CD2-CG1 3.94Å; L223-V420 HydrophobicContact CG-CG1 4.39Å; L223-F421 VanDerWaalsContact CD2-CA 3.42Å; L223-F421 HydrophobicContact CD2-CB 3.58Å; L223-F421 HydrophobicContact CD2-CD2 4.06Å; L223-F421 HydrophobicContact CD2-CG 4.33Å
224S92.2Very high92.5Very high34 Ų3448 Ų4824%0.23826%0.263CS..THydrogen-bonded Turntrans-83.1-8.7170.9-54.10000113.4V220 L221 L222 P228V220-S224 PolarHBondContact O-N 3.19Å; V220-S224 PolarHBondContact O-OG 3.35Å; L221-S224 WeakPolarHBondContact O-CB 3.22Å; L221-S224 PolarHBondContact O-N 3.35Å; L222-S224 PolarHBondContact O-N 2.88Å; S224-P228 WeakPolarHBondContact O-CD 3.44Å
225L91.3Very high92.2Very high100 Ų10050.3 Ų50.352%0.52426%0.264SS..SBendtrans-73.3-36.1176.9-61-179.6000114.7L222 S227 P228 L229L222-L225 HydrophobicContact CD1-CD1 3.81Å; L222-L225 WeakPolarHBondContact O-CB 3.26Å; L222-L225 WeakPolarHBondContact O-CG 3.25Å; L222-L225 PolarHBondContact O-N 2.97Å; L222-L225 VanDerWaalsContact O-N 3.12Å; L225-S227 PolarHBondContact O-N 3.42Å; L225-P228 WeakPolarHBondContact O-CD 3.11Å; L225-P228 VanDerWaalsContact O-CG 3.3Å; L225-P228 WeakPolarHBondContact O-CG 3.34Å; L225-L229 WeakPolarHBondContact O-CB 3.34Å; L225-L229 PolarHBondContact O-N 3.16Å
226P91Very high92Very high2 Ų253.3 Ų53.31%0.01328%0.281CS..Hα-helixtrans-47.3-41.2169.9-34.135.4000114.7L222 L223 L229 S230 F421 E424 L425L222-P226 WeakPolarHBondContact O-CD 3.34Å; L223-P226 VanDerWaalsContact O-CD 3.26Å; L223-P226 WeakPolarHBondContact O-CD 3.34Å; P226-L229 CarbonylContact O-C 3.59Å; P226-L229 WeakPolarHBondContact O-CB 3.36Å; P226-L229 PolarHBondContact O-N 2.99Å; P226-S230 WeakPolarHBondContact O-CB 3.3Å; P226-S230 PolarHBondContact O-N 2.92Å; P226-S230 PolarHBondContact O-OG 2.94Å; P226-S230 VanDerWaalsContact O-OG 3.11Å; P226-F421 HydrophobicContact CG-CD2 4.05Å; P226-F421 HydrophobicContact CG-CE2 3.79Å; P226-E424 HydrophobicContact CB-CG 4.19Å; P226-E424 HydrophobicContact CG-CB 4.43Å; P226-E424 HydrophobicContact CG-CG 4.27Å; P226-L425 HydrophobicContact CB-CB 4.04Å; P226-L425 HydrophobicContact CB-CD1 3.99Å; P226-L425 HydrophobicContact CG-CB 4.49Å
227S90.5Very high91.6Very high2 Ų255.1 Ų55.11%0.01429%0.29CS..Hα-helixtrans-63.1-53.7-174.3-29.90000114.3L225 L229 S230 L231 E428 F432 S449L225-S227 PolarHBondContact O-N 3.42Å; S227-L229 VanDerWaalsContact C-N 3.27Å; S227-L229 PolarHBondContact O-N 2.76Å; S227-S230 PolarHBondContact O-N 2.81Å; S227-L231 PolarHBondContact O-N 2.77Å; S227-L231 VanDerWaalsContact O-N 3.09Å; S227-E428 VanDerWaalsContact CB-OE1 3.23Å; S227-E428 WeakPolarHBondContact CB-OE1 3.4Å; S227-E428 PolarHBondContact OG-OE1 3.16Å; S227-F432 VanDerWaalsContact O-CE2 3.31Å; S227-F432 WeakPolarHBondContact O-CE2 3.5Å; S227-S449 WeakPolarHBondContact CB-OG 3.2Å; S227-S449 PolarHBondContact OG-OG 2.88Å; S227-S449 VanDerWaalsContact OG-OG 3.1Å
228P90.8Very high91.1Very high56 Ų5660 Ų6036%0.36431%0.307SS..Hα-helixtrans-65.1-30173.525.9-34.4000112.7S224 L225 L232 L446S224-P228 WeakPolarHBondContact O-CD 3.44Å; L225-P228 WeakPolarHBondContact O-CD 3.11Å; L225-P228 VanDerWaalsContact O-CG 3.3Å; L225-P228 WeakPolarHBondContact O-CG 3.34Å; P228-L232 WeakPolarHBondContact O-CB 3.37Å; P228-L232 PolarHBondContact O-N 3.21Å; P228-L446 HydrophobicContact CB-CD1 4.22Å
229L90.7Very high90.4Very high89 Ų8959 Ų5947%0.46631%0.308SS..Hα-helixtrans-65.9-43.9175-18061000111.6L225 P226 S227 L232 L233 L425L225-L229 WeakPolarHBondContact O-CB 3.34Å; L225-L229 PolarHBondContact O-N 3.16Å; P226-L229 CarbonylContact O-C 3.59Å; P226-L229 WeakPolarHBondContact O-CB 3.36Å; P226-L229 PolarHBondContact O-N 2.99Å; S227-L229 VanDerWaalsContact C-N 3.27Å; S227-L229 PolarHBondContact O-N 2.76Å; L229-L232 WeakPolarHBondContact O-CB 3.33Å; L229-L232 PolarHBondContact O-N 3.34Å; L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 PolarHBondContact O-N 3.46Å; L229-L425 HydrophobicContact CB-CD1 4.43Å; L229-L425 HydrophobicContact CD2-CD1 3.97Å; L229-L425 HydrophobicContact CG-CD1 4.21Å
230S89.9Confident89.8Confident0 Ų069.5 Ų69.50%035%0.346CS..Hα-helixtrans-60.7-45.1175.1-73.40000111.5P226 S227 L232 L233 L234 L425 L429P226-S230 WeakPolarHBondContact O-CB 3.3Å; P226-S230 PolarHBondContact O-N 2.92Å; P226-S230 PolarHBondContact O-OG 2.94Å; P226-S230 VanDerWaalsContact O-OG 3.11Å; S227-S230 PolarHBondContact O-N 2.81Å; S230-L232 VanDerWaalsContact C-N 3.33Å; S230-L232 PolarHBondContact O-N 3.14Å; S230-L233 PolarHBondContact O-N 3.47Å; S230-L234 WeakPolarHBondContact O-CG 3.42Å; S230-L234 PolarHBondContact O-N 3.11Å; S230-L425 WeakPolarHBondContact OG-CD1 3.34Å; S230-L425 PolarHBondContact OG-O 3.07Å; S230-L429 WeakPolarHBondContact O-CD1 3.28Å
231L89.9Confident89.2Confident1 Ų174.1 Ų74.11%0.00537%0.37CS..Hα-helixtrans-62.8-37.3174.6-77.9178.5000113.2S227 R235 F432 F442 L445 L446S227-L231 PolarHBondContact O-N 2.77Å; S227-L231 VanDerWaalsContact O-N 3.09Å; L231-R235 WeakPolarHBondContact O-CG 3.1Å; L231-F432 HydrophobicContact CD1-CD2 4.49Å; L231-F432 HydrophobicContact CD1-CE2 4.24Å; L231-F432 HydrophobicContact CD1-CZ 4.31Å; L231-F432 HydrophobicContact CD2-CB 3.83Å; L231-F432 HydrophobicContact CD2-CD1 3.99Å; L231-F432 HydrophobicContact CD2-CD2 3.7Å; L231-F432 HydrophobicContact CD2-CE2 4.25Å; L231-F432 HydrophobicContact CD2-CG 3.55Å; L231-F432 HydrophobicContact CG-CD1 4.44Å; L231-F432 HydrophobicContact CG-CD2 3.59Å; L231-F432 HydrophobicContact CG-CE2 3.74Å; L231-F432 HydrophobicContact CG-CG 3.98Å; L231-F432 HydrophobicContact CG-CZ 4.25Å; L231-F442 HydrophobicContact CB-CD2 4.38Å; L231-F442 HydrophobicContact CB-CE2 3.57Å; L231-F442 HydrophobicContact CB-CZ 3.92Å; L231-F442 HydrophobicContact CD1-CE2 4.17Å; L231-F442 HydrophobicContact CD1-CZ 4.17Å; L231-F442 HydrophobicContact CD2-CD2 4.27Å; L231-F442 HydrophobicContact CD2-CE2 4.28Å; L231-F442 HydrophobicContact CG-CE2 4.23Å; L231-L445 HydrophobicContact CD1-CB 4.46Å; L231-L445 HydrophobicContact CD2-CB 4.39Å; L231-L445 HydrophobicContact CD2-CD1 4.2Å; L231-L446 HydrophobicContact CD1-CB 4.28Å; L231-L446 HydrophobicContact CD1-CD1 4.37Å
232L89.5Confident88.7Confident93 Ų9370.3 Ų70.349%0.48735%0.35SS..Hα-helixtrans-67.4-45.7173.8-179.964.6000110.9P228 L229 S230 L234 R235 L236P228-L232 WeakPolarHBondContact O-CB 3.37Å; P228-L232 PolarHBondContact O-N 3.21Å; L229-L232 WeakPolarHBondContact O-CB 3.33Å; L229-L232 PolarHBondContact O-N 3.34Å; S230-L232 VanDerWaalsContact C-N 3.33Å; S230-L232 PolarHBondContact O-N 3.14Å; L232-L234 VanDerWaalsContact C-N 3.31Å; L232-L234 PolarHBondContact O-N 3.05Å; L232-R235 WeakPolarHBondContact O-CA 3.45Å; L232-R235 WeakPolarHBondContact O-CB 3.44Å; L232-R235 PolarHBondContact O-N 3.43Å; L232-L236 HydrophobicContact CD1-CD1 3.44Å; L232-L236 VanDerWaalsContact CD1-CD1 3.44Å; L232-L236 HydrophobicContact CG-CD1 3.87Å; L232-L236 VanDerWaalsContact O-CD1 3.24Å; L232-L236 WeakPolarHBondContact O-CD1 3.24Å; L232-L236 PolarHBondContact O-N 3.44Å
233L88.4Confident88.1Confident58 Ų5875.7 Ų75.730%0.30436%0.364SS..Hα-helixtrans-59.4-42.8178.8-167.170.7000111.3L229 S230 R235 L236 L237 L245 L429L229-L233 WeakPolarHBondContact O-CB 3.36Å; L229-L233 PolarHBondContact O-N 3.46Å; S230-L233 PolarHBondContact O-N 3.47Å; L233-R235 PolarHBondContact O-N 3.44Å; L233-R235 VanDerWaalsContact O-N 3.14Å; L233-L236 PolarHBondContact O-N 3.28Å; L233-L237 HydrophobicContact CD1-CD1 3.39Å; L233-L237 HydrophobicContact CD1-CD2 4.3Å; L233-L237 HydrophobicContact CD1-CG 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.84Å; L233-L237 HydrophobicContact CG-CD2 4.15Å; L233-L237 WeakPolarHBondContact O-CD1 3.39Å; L233-L237 PolarHBondContact O-N 3.03Å; L233-L245 HydrophobicContact CD2-CD2 4.4Å; L233-L429 HydrophobicContact CB-CD1 4.18Å; L233-L429 HydrophobicContact CD2-CD1 3.9Å; L233-L429 HydrophobicContact CD2-CD2 4.35Å; L233-L429 HydrophobicContact CG-CD1 4.45Å
234L88.6Confident87.7Confident21 Ų2176.8 Ų76.811%0.1137%0.372CS..Hα-helixtrans-59.7-22.9174.4-75.7166000113.7S230 L232 L242 L429 F432 A433 L436S230-L234 WeakPolarHBondContact O-CG 3.42Å; S230-L234 PolarHBondContact O-N 3.11Å; L232-L234 VanDerWaalsContact C-N 3.31Å; L232-L234 PolarHBondContact O-N 3.05Å; L234-L242 HydrophobicContact CD2-CD1 3.62Å; L234-L242 HydrophobicContact CD2-CD2 3.83Å; L234-L242 HydrophobicContact CD2-CG 4.31Å; L234-L429 HydrophobicContact CD1-CD1 4.25Å; L234-L429 HydrophobicContact CD2-CD1 4.29Å; L234-L429 HydrophobicContact CG-CD1 3.79Å; L234-L429 HydrophobicContact CG-CG 4.46Å; L234-F432 HydrophobicContact CD1-CB 3.54Å; L234-A433 HydrophobicContact CD2-CB 4.08Å; L234-L436 HydrophobicContact CD1-CD1 4.09Å
235R87.3Confident87.4Confident161 Ų16177.3 Ų77.361%0.60837%0.372SS*.Hα-helixtrans-89.7-32.8176.5-70.2-69.3175116-5.9113.6L231 L232 L233L231-R235 WeakPolarHBondContact O-CG 3.1Å; L232-R235 WeakPolarHBondContact O-CA 3.45Å; L232-R235 WeakPolarHBondContact O-CB 3.44Å; L232-R235 PolarHBondContact O-N 3.43Å; L233-R235 PolarHBondContact O-N 3.44Å; L233-R235 VanDerWaalsContact O-N 3.14Å
236L88.9Confident87.2Confident123 Ų12374.4 Ų74.464%0.64436%0.357SS*.Hα-helixtrans-82.3-28.9-177.3-89.770.2000112.3L232 L233L232-L236 HydrophobicContact CD1-CD1 3.44Å; L232-L236 VanDerWaalsContact CD1-CD1 3.44Å; L232-L236 HydrophobicContact CG-CD1 3.87Å; L232-L236 VanDerWaalsContact O-CD1 3.24Å; L232-L236 WeakPolarHBondContact O-CD1 3.24Å; L232-L236 PolarHBondContact O-N 3.44Å; L233-L236 PolarHBondContact O-N 3.28Å
237L87.2Confident87Confident37 Ų3775.1 Ų75.119%0.19436%0.364CS..SBendtrans-84.9136.2-174.4-89.961.7000112.7L233 L241 L245L233-L237 HydrophobicContact CD1-CD1 3.39Å; L233-L237 HydrophobicContact CD1-CD2 4.3Å; L233-L237 HydrophobicContact CD1-CG 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.84Å; L233-L237 HydrophobicContact CG-CD2 4.15Å; L233-L237 WeakPolarHBondContact O-CD1 3.39Å; L233-L237 PolarHBondContact O-N 3.03Å; L237-L241 HydrophobicContact CD2-CD2 4.41Å; L237-L241 HydrophobicContact CG-CD2 4.43Å; L237-L245 HydrophobicContact CD2-CD2 3.17Å
238E85.9Confident87Confident140 Ų14077 Ų7765%0.65437%0.372SS*.  trans-66.6145.6172.4-64.1-168.4132.700111.4R240 L241 L242E238-R240 PolarHBondContact O-N 3.34Å; E238-L241 PolarHBondContact O-N 2.93Å; E238-L242 PolarHBondContact O-N 3.47Å; E238-L242 VanDerWaalsContact O-N 3.09Å
239P81.8Confident87Confident99 Ų9975.3 Ų75.364%0.64336%0.36SS*.Hα-helixtrans-56.8-22.3-178.6-26.634.1000114.9
240R83.1Confident87Confident227 Ų22771.5 Ų71.586%0.85734%0.342SS*.Hα-helixtrans-72.8-38.6179.3-64.5-177.4178.4-174.80.9112.6E238 P244E238-R240 PolarHBondContact O-N 3.34Å; R240-P244 VanDerWaalsContact O-CD 3.32Å; R240-P244 WeakPolarHBondContact O-CD 3.26Å
241L83.6Confident87.1Confident105 Ų10571.5 Ų71.555%0.5534%0.342SS..Hα-helixtrans-85-29.4177.9-176.562.2000111.5L237 E238 R243 P244 L245L237-L241 HydrophobicContact CD2-CD2 4.41Å; L237-L241 HydrophobicContact CG-CD2 4.43Å; E238-L241 PolarHBondContact O-N 2.93Å; L241-R243 PolarHBondContact O-N 3.03Å; L241-P244 VanDerWaalsContact O-CD 3.26Å; L241-P244 WeakPolarHBondContact O-CD 3.31Å; L241-P244 VanDerWaalsContact O-CG 3.31Å; L241-P244 WeakPolarHBondContact O-CG 3.4Å; L241-L245 VanDerWaalsContact O-CB 3.26Å; L241-L245 WeakPolarHBondContact O-CB 3.33Å; L241-L245 PolarHBondContact O-N 2.8Å; L241-L245 VanDerWaalsContact O-N 3.16Å
242L84Confident87.3Confident30 Ų3072.4 Ų72.416%0.15735%0.347CS..Hα-helixtrans-62.1-41.3-175.4-177.460.8000113.2L234 E238 L245 L246L234-L242 HydrophobicContact CD2-CD1 3.62Å; L234-L242 HydrophobicContact CD2-CD2 3.83Å; L234-L242 HydrophobicContact CD2-CG 4.31Å; E238-L242 PolarHBondContact O-N 3.47Å; E238-L242 VanDerWaalsContact O-N 3.09Å; L242-L245 PolarHBondContact O-N 2.84Å; L242-L246 HydrophobicContact CD1-CD1 4Å; L242-L246 HydrophobicContact CD1-CD2 4.38Å; L242-L246 HydrophobicContact CD1-CG 3.91Å; L242-L246 HydrophobicContact CD2-CD1 4.41Å; L242-L246 HydrophobicContact CG-CD1 3.78Å; L242-L246 HydrophobicContact CG-CG 4.17Å; L242-L246 WeakPolarHBondContact O-CB 3.19Å; L242-L246 VanDerWaalsContact O-CG 3.24Å; L242-L246 WeakPolarHBondContact O-CG 3.47Å; L242-L246 PolarHBondContact O-N 3.36Å
243R83.2Confident87.5Confident201 Ų20168 Ų6876%0.75832%0.324SS*.Hα-helixtrans-62.4-54.4-179-65.8-177.7-174-171.30.2114L241 L245 L246 G247L241-R243 PolarHBondContact O-N 3.03Å; R243-L245 VanDerWaalsContact C-N 3.26Å; R243-L245 PolarHBondContact O-N 3.02Å; R243-L246 PolarHBondContact O-N 3.42Å; R243-G247 PolarHBondContact O-N 3.46Å
244P84.8Confident87.8Confident34 Ų3465.4 Ų65.422%0.22131%0.31CS..Hα-helixtrans-63.5-34.1176.322.4-31.3000112R240 L241 G247 F248 L511R240-P244 VanDerWaalsContact O-CD 3.32Å; R240-P244 WeakPolarHBondContact O-CD 3.26Å; L241-P244 VanDerWaalsContact O-CD 3.26Å; L241-P244 WeakPolarHBondContact O-CD 3.31Å; L241-P244 VanDerWaalsContact O-CG 3.31Å; L241-P244 WeakPolarHBondContact O-CG 3.4Å; P244-G247 PolarHBondContact O-N 3.48Å; P244-F248 PolarHBondContact O-N 3.35Å; P244-L511 HydrophobicContact CB-CD2 4.21Å
245L86.1Confident88.1Confident45 Ų4564.8 Ų64.824%0.23631%0.309CS..Hα-helixtrans-65.6-43.7176.9-177.866.2000112.4L233 L237 L241 L242 R243 G247 F248 L249L233-L245 HydrophobicContact CD2-CD2 4.4Å; L237-L245 HydrophobicContact CD2-CD2 3.17Å; L241-L245 VanDerWaalsContact O-CB 3.26Å; L241-L245 WeakPolarHBondContact O-CB 3.33Å; L241-L245 PolarHBondContact O-N 2.8Å; L241-L245 VanDerWaalsContact O-N 3.16Å; L242-L245 PolarHBondContact O-N 2.84Å; R243-L245 VanDerWaalsContact C-N 3.26Å; R243-L245 PolarHBondContact O-N 3.02Å; L245-G247 VanDerWaalsContact C-N 3.3Å; L245-G247 PolarHBondContact O-N 3.12Å; L245-F248 HydrophobicContact CD1-CD1 4.44Å; L245-F248 PolarHBondContact O-N 2.82Å; L245-L249 HydrophobicContact CD1-CD1 3.85Å; L245-L249 HydrophobicContact CD1-CG 4.01Å; L245-L249 HydrophobicContact CD2-CD1 4.22Å; L245-L249 HydrophobicContact CG-CD1 3.7Å; L245-L249 HydrophobicContact CG-CG 4.23Å; L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 WeakPolarHBondContact O-CG 3.47Å; L245-L249 PolarHBondContact O-N 3.42Å
246L86.3Confident88.5Confident39 Ų3957.1 Ų57.120%0.20428%0.28CS..Hα-helixtrans-61.8-39.1175.5-74.5168.9000111.7L242 R243 G250 L429 A433L242-L246 HydrophobicContact CD1-CD1 4Å; L242-L246 HydrophobicContact CD1-CD2 4.38Å; L242-L246 HydrophobicContact CD1-CG 3.91Å; L242-L246 HydrophobicContact CD2-CD1 4.41Å; L242-L246 HydrophobicContact CG-CD1 3.78Å; L242-L246 HydrophobicContact CG-CG 4.17Å; L242-L246 WeakPolarHBondContact O-CB 3.19Å; L242-L246 VanDerWaalsContact O-CG 3.24Å; L242-L246 WeakPolarHBondContact O-CG 3.47Å; L242-L246 PolarHBondContact O-N 3.36Å; R243-L246 PolarHBondContact O-N 3.42Å; L246-G250 PolarHBondContact O-N 3Å; L246-L429 HydrophobicContact CD2-CD2 3.59Å; L246-L429 HydrophobicContact CD2-CG 3.81Å; L246-L429 HydrophobicContact CG-CD2 4.49Å; L246-A433 HydrophobicContact CD1-CB 3.72Å; L246-A433 HydrophobicContact CD2-CB 3.77Å; L246-A433 HydrophobicContact CG-CB 4.44Å
247G86.6Confident88.8Confident17 Ų1751.5 Ų51.518%0.17525%0.25CS..Hα-helixtrans-64.7-42.4174.400000112.7R243 P244 L245 A251R243-G247 PolarHBondContact O-N 3.46Å; P244-G247 PolarHBondContact O-N 3.48Å; L245-G247 VanDerWaalsContact C-N 3.3Å; L245-G247 PolarHBondContact O-N 3.12Å; G247-A251 VanDerWaalsContact O-CB 3.28Å; G247-A251 WeakPolarHBondContact O-CB 3.36Å; G247-A251 PolarHBondContact O-N 3.4Å; G247-A251 VanDerWaalsContact O-N 3.15Å
248F90.8Very high89.2Confident40 Ų4051 Ų5118%0.17525%0.249CC..Hα-helixtrans-64.4-47.8174.6173.1-101.6000112.2P244 L245 A251 L252 L511 L518P244-F248 PolarHBondContact O-N 3.35Å; L245-F248 HydrophobicContact CD1-CD1 4.44Å; L245-F248 PolarHBondContact O-N 2.82Å; F248-A251 WeakPolarHBondContact O-CB 3.31Å; F248-A251 PolarHBondContact O-N 3.35Å; F248-L252 HydrophobicContact CE1-CD2 4.45Å; F248-L252 WeakPolarHBondContact O-CB 3.29Å; F248-L252 PolarHBondContact O-N 3.14Å; F248-L511 HydrophobicContact CB-CD1 4.45Å; F248-L511 HydrophobicContact CB-CD2 4.09Å; F248-L511 HydrophobicContact CB-CG 3.95Å; F248-L511 HydrophobicContact CD2-CD1 3.77Å; F248-L511 HydrophobicContact CD2-CG 3.97Å; F248-L511 WeakPolarHBondContact CD2-O 3.44Å; F248-L511 HydrophobicContact CE2-CD1 4.45Å; F248-L511 HydrophobicContact CG-CD1 4.35Å; F248-L511 HydrophobicContact CG-CG 4.34Å; F248-L518 HydrophobicContact CZ-CD2 3.89Å
249L90.4Very high89.7Confident22 Ų2244.6 Ų44.612%0.11522%0.221CC..Hα-helixtrans-69.9-39.8-177.5-75.8175.3000112.2L245 A251 L252 A253 P426 L429L245-L249 HydrophobicContact CD1-CD1 3.85Å; L245-L249 HydrophobicContact CD1-CG 4.01Å; L245-L249 HydrophobicContact CD2-CD1 4.22Å; L245-L249 HydrophobicContact CG-CD1 3.7Å; L245-L249 HydrophobicContact CG-CG 4.23Å; L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 WeakPolarHBondContact O-CG 3.47Å; L245-L249 PolarHBondContact O-N 3.42Å; L249-A251 VanDerWaalsContact C-N 3.28Å; L249-A251 PolarHBondContact O-N 3.19Å; L249-L252 HydrophobicContact CD2-CD2 3.98Å; L249-L252 WeakPolarHBondContact O-CB 3.21Å; L249-L252 PolarHBondContact O-N 2.99Å; L249-A253 PolarHBondContact O-N 3.07Å; L249-P426 HydrophobicContact CB-CB 3.93Å; L249-P426 HydrophobicContact CD2-CB 4.01Å; L249-P426 HydrophobicContact CD2-CG 4.2Å; L249-P426 WeakPolarHBondContact O-CB 3.43Å; L249-L429 HydrophobicContact CD1-CD2 3.22Å; L249-L429 HydrophobicContact CG-CD2 4.5Å
250G90.1Very high90.3Very high8 Ų839.9 Ų39.98%0.08219%0.19CC..Hα-helixtrans-62.7-38.617200000111.5L246 A253 V254L246-G250 PolarHBondContact O-N 3Å; G250-A253 PolarHBondContact O-N 2.88Å; G250-V254 WeakPolarHBondContact O-CG2 3.46Å; G250-V254 PolarHBondContact O-N 2.81Å
251A92.3Very high90.9Very high0 Ų029.1 Ų29.10%015%0.15CC..Hα-helixtrans-66.8-37173.900000112.8G247 F248 L249 V254 G255 L497 Q512 L516G247-A251 VanDerWaalsContact O-CB 3.28Å; G247-A251 WeakPolarHBondContact O-CB 3.36Å; G247-A251 PolarHBondContact O-N 3.4Å; G247-A251 VanDerWaalsContact O-N 3.15Å; F248-A251 WeakPolarHBondContact O-CB 3.31Å; F248-A251 PolarHBondContact O-N 3.35Å; L249-A251 VanDerWaalsContact C-N 3.28Å; L249-A251 PolarHBondContact O-N 3.19Å; A251-V254 PolarHBondContact O-N 3.44Å; A251-G255 PolarHBondContact O-N 2.8Å; A251-L497 HydrophobicContact CB-CD1 4.02Å; A251-Q512 HydrophobicContact CB-CB 3.98Å; A251-Q512 HydrophobicContact CB-CG 4.25Å; A251-Q512 VanDerWaalsContact CB-O 3.23Å; A251-Q512 WeakPolarHBondContact CB-O 3.42Å; A251-L516 HydrophobicContact CB-CG 4.14Å; A251-L516 WeakPolarHBondContact O-CA 3.45Å; A251-L516 WeakPolarHBondContact O-CD2 3.28Å; A251-L516 PolarHBondContact O-N 3.49Å
252L94.8Very high91.4Very high21 Ų2128.1 Ų28.111%0.1115%0.145CC..Hα-helixtrans-60.5-48.8171.3-173.670000111F248 L249 V254 G255 T256 P426 G515 L518F248-L252 HydrophobicContact CE1-CD2 4.45Å; F248-L252 WeakPolarHBondContact O-CB 3.29Å; F248-L252 PolarHBondContact O-N 3.14Å; L249-L252 HydrophobicContact CD2-CD2 3.98Å; L249-L252 WeakPolarHBondContact O-CB 3.21Å; L249-L252 PolarHBondContact O-N 2.99Å; L252-V254 PolarHBondContact O-N 3.28Å; L252-G255 PolarHBondContact O-N 3.24Å; L252-G255 VanDerWaalsContact O-N 3.14Å; L252-T256 PolarHBondContact O-N 2.85Å; L252-T256 PolarHBondContact O-OG1 3.16Å; L252-P426 HydrophobicContact CD2-CG 3.83Å; L252-P426 HydrophobicContact CG-CG 4.29Å; L252-G515 WeakPolarHBondContact CA-O 3.33Å; L252-G515 WeakPolarHBondContact CD1-O 3.41Å; L252-L518 HydrophobicContact CD1-CB 3.96Å; L252-L518 HydrophobicContact CD1-CD2 3.95Å; L252-L518 HydrophobicContact CD1-CG 3.92Å
253A93.6Very high91.8Very high0 Ų030.1 Ų30.10%016%0.156CC..Hα-helixtrans-56.2-46.6175.500000112.4L249 G250 G255 T256 L257 P426 H427 M493L249-A253 PolarHBondContact O-N 3.07Å; G250-A253 PolarHBondContact O-N 2.88Å; A253-G255 VanDerWaalsContact C-N 3.29Å; A253-G255 PolarHBondContact O-N 3.31Å; A253-T256 WeakPolarHBondContact CA-OG1 3.44Å; A253-T256 PolarHBondContact O-N 3.39Å; A253-T256 PolarHBondContact O-OG1 3.44Å; A253-T256 VanDerWaalsContact O-OG1 3.12Å; A253-L257 VanDerWaalsContact O-CB 3.28Å; A253-L257 WeakPolarHBondContact O-CB 3.41Å; A253-L257 WeakPolarHBondContact O-CG 3.43Å; A253-L257 PolarHBondContact O-N 3.09Å; A253-P426 HydrophobicContact CB-CB 3.96Å; A253-H427 HydrophobicContact CB-CB 4.49Å; A253-M493 HydrophobicContact CB-SD 4.37Å
254V94.8Very high92.1Very high4 Ų420.6 Ų20.62%0.02412%0.12CC..Hα-helixtrans-62-40.9177.6174.10000110.9G250 A251 L252 C258 A489 M493 L494 L497 L516G250-V254 WeakPolarHBondContact O-CG2 3.46Å; G250-V254 PolarHBondContact O-N 2.81Å; A251-V254 PolarHBondContact O-N 3.44Å; L252-V254 PolarHBondContact O-N 3.28Å; V254-C258 VanDerWaalsContact O-CB 3.3Å; V254-C258 WeakPolarHBondContact O-CB 3.26Å; V254-C258 PolarHBondContact O-N 3.01Å; V254-C258 PolarHBondContact O-SG 3.47Å; V254-A489 HydrophobicContact CG1-CB 4.43Å; V254-M493 HydrophobicContact CG2-CB 3.5Å; V254-M493 VanDerWaalsContact CG2-CB 3.5Å; V254-L494 HydrophobicContact CG1-CB 4.38Å; V254-L494 HydrophobicContact CG1-CD1 4.37Å; V254-L494 HydrophobicContact CG2-CB 4.39Å; V254-L497 HydrophobicContact CB-CD1 4.36Å; V254-L497 HydrophobicContact CG2-CD1 3.7Å; V254-L516 HydrophobicContact CB-CD2 3.73Å; V254-L516 HydrophobicContact CG1-CD2 3.57Å
255G95.5Very high92.5Very high7 Ų719 Ų197%0.07211%0.109CC..Hα-helixtrans-65.7-44.3177.700000112.6A251 L252 A253 G259 G520A251-G255 PolarHBondContact O-N 2.8Å; L252-G255 PolarHBondContact O-N 3.24Å; L252-G255 VanDerWaalsContact O-N 3.14Å; A253-G255 VanDerWaalsContact C-N 3.29Å; A253-G255 PolarHBondContact O-N 3.31Å; G255-G259 PolarHBondContact O-N 2.95Å; G255-G520 PolarHBondContact O-N 2.97Å
256T95.6Very high92.7Very high0 Ų018.7 Ų18.70%011%0.108CC..Hα-helixtrans-71.9-40.3178.546.50000112.4L252 A253 G259 D260 C422 H423 G519 L522 M523L252-T256 PolarHBondContact O-N 2.85Å; L252-T256 PolarHBondContact O-OG1 3.16Å; A253-T256 WeakPolarHBondContact CA-OG1 3.44Å; A253-T256 PolarHBondContact O-N 3.39Å; A253-T256 PolarHBondContact O-OG1 3.44Å; A253-T256 VanDerWaalsContact O-OG1 3.12Å; T256-G259 PolarHBondContact O-N 2.83Å; T256-D260 VanDerWaalsContact O-CB 3.27Å; T256-D260 WeakPolarHBondContact O-CB 3.38Å; T256-D260 PolarHBondContact O-N 3.37Å; T256-C422 HydrophobicContact CG2-CB 4.11Å; T256-H423 WeakPolarHBondContact OG1-CA 3.42Å; T256-H423 WeakPolarHBondContact OG1-CB 3.5Å; T256-G519 VanDerWaalsContact CG2-CA 3.41Å; T256-L522 HydrophobicContact CG2-CD2 4.41Å; T256-M523 HydrophobicContact CG2-CG 4.33Å; T256-M523 VanDerWaalsContact O-CG 3.3Å; T256-M523 WeakPolarHBondContact O-CG 3.4Å
257L94.6Very high92.8Very high6 Ų618.7 Ų18.73%0.03111%0.11CC..Hα-helixtrans-64.4-46.4175-76.7165.6000112.3A253 G259 D260 A261 H423 F485 V488 A489A253-L257 VanDerWaalsContact O-CB 3.28Å; A253-L257 WeakPolarHBondContact O-CB 3.41Å; A253-L257 WeakPolarHBondContact O-CG 3.43Å; A253-L257 PolarHBondContact O-N 3.09Å; L257-G259 VanDerWaalsContact C-N 3.3Å; L257-G259 PolarHBondContact O-N 2.9Å; L257-D260 PolarHBondContact O-N 3.05Å; L257-A261 WeakPolarHBondContact O-CB 3.4Å; L257-A261 PolarHBondContact O-N 3.45Å; L257-H423 HydrophobicContact CD2-CB 4.1Å; L257-H423 HydrophobicContact CG-CB 3.86Å; L257-F485 HydrophobicContact CD2-CB 4.3Å; L257-F485 HydrophobicContact CD2-CD1 4.37Å; L257-F485 HydrophobicContact CD2-CG 4.17Å; L257-V488 HydrophobicContact CD1-CG1 4.15Å; L257-A489 HydrophobicContact CB-CB 3.72Å; L257-A489 HydrophobicContact CD1-CB 4.22Å
258C96.3Very high92.6Very high25 Ų2518.8 Ų18.817%0.16911%0.105CC..Hα-helixtrans-62.9-40.5174.8-66.30000111.2V254 L262V254-C258 VanDerWaalsContact O-CB 3.3Å; V254-C258 WeakPolarHBondContact O-CB 3.26Å; V254-C258 PolarHBondContact O-N 3.01Å; V254-C258 PolarHBondContact O-SG 3.47Å; C258-L262 WeakPolarHBondContact O-CB 3.36Å; C258-L262 WeakPolarHBondContact O-CG 3.45Å; C258-L262 PolarHBondContact O-N 3.33Å
259G95.1Very high92.4Very high6 Ų616.9 Ų16.96%0.06210%0.098CC..Hα-helixtrans-64.8-43.1177.400000112.5G255 T256 L257 L262 L263G255-G259 PolarHBondContact O-N 2.95Å; T256-G259 PolarHBondContact O-N 2.83Å; L257-G259 VanDerWaalsContact C-N 3.3Å; L257-G259 PolarHBondContact O-N 2.9Å; G259-L262 PolarHBondContact O-N 3.22Å; G259-L263 WeakPolarHBondContact O-CA 3.05Å; G259-L263 VanDerWaalsContact O-CB 3.24Å; G259-L263 WeakPolarHBondContact O-CB 3.5Å; G259-L263 PolarHBondContact O-N 3.09Å
260D95.1Very high92Very high0 Ų019.7 Ų19.70%011%0.11CC..Iπ-helixtrans-63.7-46.6177.7-164.81.8000110.8T256 L257 L262 H264 L265 H423 F485 M523T256-D260 VanDerWaalsContact O-CB 3.27Å; T256-D260 WeakPolarHBondContact O-CB 3.38Å; T256-D260 PolarHBondContact O-N 3.37Å; L257-D260 PolarHBondContact O-N 3.05Å; D260-L262 PolarHBondContact O-N 2.85Å; D260-H264 WeakPolarHBondContact O-CB 3.41Å; D260-H264 PolarHBondContact O-N 3.45Å; D260-H264 IonicContact OD1-CE1 3.95Å; D260-H264 IonicContact OD1-CG 3.14Å; D260-H264 IonicContact OD1-ND1 3.87Å; D260-H264 PolarHBondContact OD1-ND1 3.25Å; D260-L265 PolarHBondContact O-N 2.98Å; D260-H423 IonicContact OD2-CE1 3.91Å; D260-H423 PolarHBondContact OD2-CE1 3.48Å; D260-H423 IonicContact OD2-ND1 3.64Å; D260-F485 HydrophobicContact CB-CD2 4.2Å; D260-F485 HydrophobicContact CB-CE2 4.44Å; D260-F485 WeakPolarHBondContact OD2-CE2 2.96Å; D260-M523 HydrophobicContact CB-CE 3.73Å; D260-M523 HydrophobicContact CB-SD 4.34Å
261A95.6Very high90.7Very high1 Ų126 Ų261%0.00814%0.137CC..Iπ-helixtrans-59.1-47.417600000113.2L257 L266 A482 F485 L486L257-A261 WeakPolarHBondContact O-CB 3.4Å; L257-A261 PolarHBondContact O-N 3.45Å; A261-L266 WeakPolarHBondContact O-CB 3.43Å; A261-L266 PolarHBondContact O-N 3.15Å; A261-A482 HydrophobicContact CB-CB 4.02Å; A261-A482 WeakPolarHBondContact CB-O 3.3Å; A261-F485 HydrophobicContact CB-CB 4.03Å; A261-L486 HydrophobicContact CB-CD1 4.35Å; A261-L486 HydrophobicContact CB-CD2 4.19Å; A261-L486 HydrophobicContact CB-CG 3.73Å
262L94.9Very high88.9Confident85 Ų8528.2 Ų28.245%0.44516%0.16SC..Iπ-helixtrans-93.3-36.1-168.3-65.4176.5000114.6C258 G259 D260 L266 P267 L486C258-L262 WeakPolarHBondContact O-CB 3.36Å; C258-L262 WeakPolarHBondContact O-CG 3.45Å; C258-L262 PolarHBondContact O-N 3.33Å; G259-L262 PolarHBondContact O-N 3.22Å; D260-L262 PolarHBondContact O-N 2.85Å; L262-L266 HydrophobicContact CD2-CD2 4.33Å; L262-P267 WeakPolarHBondContact O-CD 3.5Å; L262-L486 HydrophobicContact CD1-CD2 4.41Å; L262-L486 HydrophobicContact CD2-CD1 4.13Å; L262-L486 HydrophobicContact CD2-CD2 4.44Å; L262-L486 HydrophobicContact CG-CD2 4.25Å
263L91.3Very high87.1Confident72 Ų7230.6 Ų30.638%0.37717%0.168SC..Iπ-helixtrans-102.2-13-172.3-56178.3000112.8G259 L524 A527G259-L263 WeakPolarHBondContact O-CA 3.05Å; G259-L263 VanDerWaalsContact O-CB 3.24Å; G259-L263 WeakPolarHBondContact O-CB 3.5Å; G259-L263 PolarHBondContact O-N 3.09Å; L263-L524 HydrophobicContact CD1-CB 3.99Å; L263-L524 HydrophobicContact CD1-CD1 4.32Å; L263-A527 WeakPolarHBondContact O-CB 3.3Å
264H90.3Very high84.9Confident1 Ų137.2 Ų37.21%0.00520%0.199CC..Iπ-helixtrans-123.6-63.6-175.9176.5-106.5000111.3D260 P267 H268 S415 T416 M523 E530D260-H264 WeakPolarHBondContact O-CB 3.41Å; D260-H264 PolarHBondContact O-N 3.45Å; D260-H264 IonicContact OD1-CE1 3.95Å; D260-H264 IonicContact OD1-CG 3.14Å; D260-H264 IonicContact OD1-ND1 3.87Å; D260-H264 PolarHBondContact OD1-ND1 3.25Å; H264-P267 WeakPolarHBondContact O-CD 2.96Å; H264-H268 AromaticContact CD2-CE1 3.77Å; H264-H268 AromaticContact NE2-CE1 3.65Å; H264-H268 PolarHBondContact O-N 3.26Å; H264-H268 PolarHBondContact O-ND1 3.4Å; H264-S415 PolarHBondContact NE2-OG 2.81Å; H264-T416 VanDerWaalsContact CE1-CA 3.49Å; H264-T416 WeakPolarHBondContact CE1-CA 3.35Å; H264-T416 PolarHBondContact CE1-OG1 3.3Å; H264-M523 HydrophobicContact CB-CE 4.15Å; H264-E530 IonicContact CD2-OE2 3.6Å
265L92.1Very high82.4Confident1 Ų140 Ų401%0.00522%0.222CC..Iπ-helixtrans-71.2-39.8-177.1-65.9-176.2000114.6D260 H268 A269 F478 T481 A482 F485D260-L265 PolarHBondContact O-N 2.98Å; L265-H268 PolarHBondContact O-N 3.08Å; L265-A269 PolarHBondContact O-N 3.23Å; L265-F478 HydrophobicContact CD2-CD1 3.84Å; L265-F478 HydrophobicContact CD2-CE1 4.35Å; L265-F478 HydrophobicContact CD2-CG 4.45Å; L265-T481 HydrophobicContact CD1-CG2 3.79Å; L265-A482 HydrophobicContact CB-CB 3.9Å; L265-A482 HydrophobicContact CD1-CB 4.33Å; L265-F485 HydrophobicContact CD1-CD2 3.68Å; L265-F485 HydrophobicContact CD1-CE2 3.5Å; L265-F485 HydrophobicContact CD1-CZ 4.36Å
266L91.1Very high79.9Confident38 Ų3842.2 Ų42.220%0.19925%0.245CC..Hα-helixtrans-64.8-45.2179.8177.361.8000112.8A261 L262 H268 A269 Q270 P287 V291A261-L266 WeakPolarHBondContact O-CB 3.43Å; A261-L266 PolarHBondContact O-N 3.15Å; L262-L266 HydrophobicContact CD2-CD2 4.33Å; L266-H268 PolarHBondContact O-N 2.92Å; L266-A269 WeakPolarHBondContact O-CB 3.49Å; L266-A269 PolarHBondContact O-N 2.89Å; L266-A269 VanDerWaalsContact O-N 3.1Å; L266-Q270 WeakPolarHBondContact O-CG 3.34Å; L266-Q270 PolarHBondContact O-N 3.15Å; L266-P287 HydrophobicContact CD1-CB 4.22Å; L266-V291 HydrophobicContact CD1-CG2 3.93Å
267P87.6Confident77.2Confident38 Ų3848.3 Ų48.325%0.24728%0.284CS..Hα-helixtrans-55.8-45.6170.8-28.636.3000113.3L262 H264 A269 Q270 E271L262-P267 WeakPolarHBondContact O-CD 3.5Å; H264-P267 WeakPolarHBondContact O-CD 2.96Å; P267-A269 PolarHBondContact O-N 3.41Å; P267-Q270 WeakPolarHBondContact O-CA 3.35Å; P267-Q270 WeakPolarHBondContact O-CB 3.26Å; P267-Q270 PolarHBondContact O-N 2.98Å; P267-E271 PolarHBondContact O-N 2.91Å
268H83.5Confident74.8Confident19 Ų1950.5 Ų50.59%0.08831%0.308CS..Hα-helixtrans-60.5-31.6174.9-79.285.4000113.1H264 L265 L266 Q270 S412 F478 E530H264-H268 AromaticContact CD2-CE1 3.77Å; H264-H268 AromaticContact NE2-CE1 3.65Å; H264-H268 PolarHBondContact O-N 3.26Å; H264-H268 PolarHBondContact O-ND1 3.4Å; L265-H268 PolarHBondContact O-N 3.08Å; L266-H268 PolarHBondContact O-N 2.92Å; H268-Q270 VanDerWaalsContact C-N 3.3Å; H268-S412 PolarHBondContact NE2-OG 3.03Å; H268-F478 HydrophobicContact CB-CD2 3.61Å; H268-F478 HydrophobicContact CB-CE2 3.87Å; H268-F478 HydrophobicContact CB-CG 4.27Å; H268-E530 IonicContact CE1-OE1 3.75Å; H268-E530 PolarHBondContact CE1-OE1 3.11Å; H268-E530 IonicContact CE1-OE2 3.35Å; H268-E530 PolarHBondContact CE1-OE2 3.12Å; H268-E530 IonicContact NE2-OE1 3.9Å; H268-E530 PolarHBondContact NE2-OE1 3.48Å; H268-E530 VanDerWaalsContact NE2-OE1 3.14Å; H268-E530 IonicContact NE2-OE2 3.56Å
269A85.9Confident72.2Confident1 Ų153.8 Ų53.81%0.00835%0.346CS..Hα-helixtrans-72.5-21.9174.300000113.4L265 L266 P267 P287 P475 F478L265-A269 PolarHBondContact O-N 3.23Å; L266-A269 WeakPolarHBondContact O-CB 3.49Å; L266-A269 PolarHBondContact O-N 2.89Å; L266-A269 VanDerWaalsContact O-N 3.1Å; P267-A269 PolarHBondContact O-N 3.41Å; A269-P287 HydrophobicContact CB-CB 4.37Å; A269-P475 VanDerWaalsContact CB-O 3.26Å; A269-P475 WeakPolarHBondContact CB-O 3.31Å; A269-P475 WeakPolarHBondContact O-CB 3.29Å; A269-F478 HydrophobicContact CB-CB 4.12Å
270Q81.6Confident69.7Low80 Ų8060.4 Ų60.437%0.37438%0.38SS..Hα-helixtrans-90.6-40.2180-70.4176.3-37.200112.2L266 P267 H268 G272 R273 H274 P287L266-Q270 WeakPolarHBondContact O-CG 3.34Å; L266-Q270 PolarHBondContact O-N 3.15Å; P267-Q270 WeakPolarHBondContact O-CA 3.35Å; P267-Q270 WeakPolarHBondContact O-CB 3.26Å; P267-Q270 PolarHBondContact O-N 2.98Å; H268-Q270 VanDerWaalsContact C-N 3.3Å; Q270-G272 PolarHBondContact O-N 3.06Å; Q270-G272 VanDerWaalsContact O-N 3.17Å; Q270-R273 PolarHBondContact O-N 3.3Å; Q270-H274 PolarHBondContact O-CD2 2.92Å; Q270-H274 VanDerWaalsContact O-CD2 3.26Å; Q270-P287 HydrophobicContact CG-CB 3.82Å; Q270-P287 HydrophobicContact CG-CG 3.85Å
271E63.2Low67.2Low141 Ų14166 Ų6666%0.65942%0.416SS*.Hα-helixtrans-57.5-31.6-179-77.9172-179.300113.2P267 R273P267-E271 PolarHBondContact O-N 2.91Å; E271-R273 PolarHBondContact O-N 3Å
272G55.6Low65Low47 Ų4774.1 Ų74.149%0.48545%0.454SS..THydrogen-bonded Turntrans-73.82.1176.700000116.2Q270Q270-G272 PolarHBondContact O-N 3.06Å; Q270-G272 VanDerWaalsContact O-N 3.17Å
273R56.5Low63.1Low71 Ų7178.5 Ų78.527%0.26847%0.472SS..THydrogen-bonded Turntrans-133.6-8.7-168.7-55.7-164.5119.2168.1-8.9116.8Q270 E271 A275 W476Q270-R273 PolarHBondContact O-N 3.3Å; E271-R273 PolarHBondContact O-N 3Å; R273-A275 VanDerWaalsContact C-N 3.34Å; R273-A275 PolarHBondContact O-N 3.49Å; R273-W476 VanDerWaalsContact CZ-CZ2 3.44Å
274H46.4Very low62Low139 Ų13978.9 Ų78.964%0.64447%0.474SS*.  trans-80.374.9-179-68.1-54.5000113.1Q270Q270-H274 PolarHBondContact O-CD2 2.92Å; Q270-H274 VanDerWaalsContact O-CD2 3.26Å
275A43.1Very low61.4Low63 Ų6384 Ų8452%0.52150%0.501SS..  trans-158.563.1159.100000111.8R273R273-A275 VanDerWaalsContact C-N 3.34Å; R273-A275 PolarHBondContact O-N 3.49Å
276G41.8Very low60.9Low53 Ų5384.4 Ų84.455%0.54651%0.506SS..  trans-74.1135162.100000110.5G278G276-G278 PolarHBondContact O-N 2.83Å
277P39.8Very low60.6Low128 Ų12882.9 Ų82.983%0.83150%0.498SS*.SBendtrans-7692.9-179.129.9-31.7000110
278G43.3Very low60.6Low51 Ų5183.1 Ų83.153%0.52651%0.508SS..SBendtrans141.5114.417300000110.2G276 L280G276-G278 PolarHBondContact O-N 2.83Å; G278-L280 PolarHBondContact O-N 2.85Å
279G43.1Very low61Low95 Ų9586.6 Ų86.698%0.97953%0.527SS*.SBendtrans-6535-178.700000116.1
280L41.6Very low61.2Low145 Ų14586.8 Ų86.876%0.75953%0.528SS*.SBendtrans-83.3135154.8-80140000107.2G278 E282G278-L280 PolarHBondContact O-N 2.85Å; L280-E282 PolarHBondContact O-N 3.46Å
281P42.4Very low61.9Low118 Ų11884 Ų8477%0.76652%0.516SS*.  trans-6685.3167.128.4-30.7000107.6E283P281-E283 PolarHBondContact O-N 3.04Å; P281-E283 VanDerWaalsContact O-N 3.16Å
282E49.5Very low63.4Low170 Ų17082.5 Ų82.579%0.79451%0.512SS*.  trans-63.2112.7154.1-92.6-153.6122.500105.2L280 D284L280-E282 PolarHBondContact O-N 3.46Å; E282-D284 PolarHBondContact O-N 3.49Å
283E56.5Low65.2Low177 Ų17781.8 Ų81.883%0.82751%0.505SS*.  trans-64.194.7171.2-64.9-144.5139.500107.4P281 L285P281-E283 PolarHBondContact O-N 3.04Å; P281-E283 VanDerWaalsContact O-N 3.16Å; E283-L285 PolarHBondContact O-N 3.1Å
284D66.4Low67Low81 Ų8178.4 Ų78.443%0.43349%0.492SS..  trans-68.186.7178.8-128-17.5000107.8E282 G286 P287E282-D284 PolarHBondContact O-N 3.49Å; D284-G286 PolarHBondContact O-N 3.45Å; D284-G286 VanDerWaalsContact O-N 3.14Å; D284-P287 VanDerWaalsContact O-CD 3.25Å; D284-P287 WeakPolarHBondContact O-CD 2.99Å
285L78.6Confident69.3Low107 Ų10774.5 Ų74.556%0.5648%0.476SS*.  trans-72.5-4.7-175-154.172.1000111.7E283 G288 L289E283-L285 PolarHBondContact O-N 3.1Å; L285-G288 PolarHBondContact O-N 2.91Å; L285-L289 HydrophobicContact CB-CD1 4.22Å; L285-L289 HydrophobicContact CB-CG 4.45Å; L285-L289 HydrophobicContact CD2-CD1 4.18Å; L285-L289 HydrophobicContact CD2-CD2 4.32Å; L285-L289 HydrophobicContact CD2-CG 4.11Å; L285-L289 HydrophobicContact CG-CD1 4.3Å; L285-L289 HydrophobicContact CG-CG 4.08Å; L285-L289 WeakPolarHBondContact O-CB 2.98Å; L285-L289 VanDerWaalsContact O-CG 3.25Å; L285-L289 WeakPolarHBondContact O-CG 3.23Å; L285-L289 PolarHBondContact O-N 3.09Å
286G82.4Confident71.7Confident11 Ų1177.7 Ų77.711%0.11348%0.478CS..Hα-helixtrans-52.8-52.9-176.800000114.4D284 L289 S290D284-G286 PolarHBondContact O-N 3.45Å; D284-G286 VanDerWaalsContact O-N 3.14Å; G286-L289 PolarHBondContact O-N 2.99Å; G286-S290 PolarHBondContact O-N 3.42Å; G286-S290 PolarHBondContact O-OG 3Å
287P84.1Confident74.1Confident5 Ų579.7 Ų79.73%0.03248%0.476CS..Hα-helixtrans-63.8-38.6177.5-24.336.8000113L266 A269 Q270 D284 S290 V291L266-P287 HydrophobicContact CD1-CB 4.22Å; A269-P287 HydrophobicContact CB-CB 4.37Å; Q270-P287 HydrophobicContact CG-CB 3.82Å; Q270-P287 HydrophobicContact CG-CG 3.85Å; D284-P287 VanDerWaalsContact O-CD 3.25Å; D284-P287 WeakPolarHBondContact O-CD 2.99Å; P287-S290 WeakPolarHBondContact CA-OG 3.45Å; P287-S290 PolarHBondContact O-N 3.43Å; P287-S290 PolarHBondContact O-OG 3.14Å; P287-V291 WeakPolarHBondContact O-CG2 3.5Å; P287-V291 PolarHBondContact O-N 2.81Å; P287-V291 VanDerWaalsContact O-N 3.13Å
288G87.8Confident76.5Confident43 Ų4374.5 Ų74.544%0.44344%0.441SS..Hα-helixtrans-65.3-40174.400000112.6L285 V291 L292L285-G288 PolarHBondContact O-N 2.91Å; G288-V291 PolarHBondContact O-N 2.74Å; G288-L292 PolarHBondContact O-N 2.96Å
289L90.6Very high78.8Confident93 Ų9376.9 Ų76.949%0.48744%0.437SS..Hα-helixtrans-67.5-36.5176.9-74.5169.6000112.4L285 G286 L292 G293L285-L289 HydrophobicContact CB-CD1 4.22Å; L285-L289 HydrophobicContact CB-CG 4.45Å; L285-L289 HydrophobicContact CD2-CD1 4.18Å; L285-L289 HydrophobicContact CD2-CD2 4.32Å; L285-L289 HydrophobicContact CD2-CG 4.11Å; L285-L289 HydrophobicContact CG-CD1 4.3Å; L285-L289 HydrophobicContact CG-CG 4.08Å; L285-L289 WeakPolarHBondContact O-CB 2.98Å; L285-L289 VanDerWaalsContact O-CG 3.25Å; L285-L289 WeakPolarHBondContact O-CG 3.23Å; L285-L289 PolarHBondContact O-N 3.09Å; G286-L289 PolarHBondContact O-N 2.99Å; L289-L292 PolarHBondContact O-N 3.33Å; L289-G293 PolarHBondContact O-N 3.07Å
290S92.1Very high81.1Confident5 Ų574.8 Ų74.84%0.03541%0.405CS..Hα-helixtrans-68.6-40.8176.5620000111.7G286 P287 G293 G294 G479G286-S290 PolarHBondContact O-N 3.42Å; G286-S290 PolarHBondContact O-OG 3Å; P287-S290 WeakPolarHBondContact CA-OG 3.45Å; P287-S290 PolarHBondContact O-N 3.43Å; P287-S290 PolarHBondContact O-OG 3.14Å; S290-G293 WeakPolarHBondContact O-CA 3.31Å; S290-G293 PolarHBondContact O-N 3.3Å; S290-G294 PolarHBondContact O-N 3.09Å; S290-G479 WeakPolarHBondContact OG-CA 3.33Å
291V95.1Very high83.3Confident21 Ų2170.4 Ų70.413%0.12738%0.382CS..Hα-helixtrans-58.4-51.3170.6174.20000111L266 P287 G288 G293 G294 L295 G479 A482 G483 L486L266-V291 HydrophobicContact CD1-CG2 3.93Å; P287-V291 WeakPolarHBondContact O-CG2 3.5Å; P287-V291 PolarHBondContact O-N 2.81Å; P287-V291 VanDerWaalsContact O-N 3.13Å; G288-V291 PolarHBondContact O-N 2.74Å; V291-G293 PolarHBondContact O-N 2.56Å; V291-G294 PolarHBondContact O-N 2.71Å; V291-L295 HydrophobicContact CG1-CD1 3.84Å; V291-L295 VanDerWaalsContact O-CD1 3.26Å; V291-L295 WeakPolarHBondContact O-CD1 3.06Å; V291-L295 PolarHBondContact O-N 3.17Å; V291-G479 WeakPolarHBondContact CA-O 3.29Å; V291-G479 WeakPolarHBondContact CG2-O 3.35Å; V291-G479 PolarHBondContact N-O 3.19Å; V291-A482 HydrophobicContact CG2-CB 4.18Å; V291-G483 WeakPolarHBondContact O-CA 3.15Å; V291-L486 HydrophobicContact CG1-CD1 4.02Å
292L94.6Very high85.3Confident109 Ų10967.9 Ų67.957%0.57136%0.36SS*.Hα-helixtrans-59.8-37.7177.3-171.867.7000111.8G288 L289 L295 F296G288-L292 PolarHBondContact O-N 2.96Å; L289-L292 PolarHBondContact O-N 3.33Å; L292-L295 PolarHBondContact O-N 2.93Å; L292-F296 WeakPolarHBondContact O-CB 3.44Å; L292-F296 PolarHBondContact O-N 3.1Å
293G94.4Very high87.1Confident33 Ų3363.5 Ų63.534%0.3434%0.342SS..Hα-helixtrans-59.5-42.9173.300000112.6L289 S290 V291 F296 L297L289-G293 PolarHBondContact O-N 3.07Å; S290-G293 WeakPolarHBondContact O-CA 3.31Å; S290-G293 PolarHBondContact O-N 3.3Å; V291-G293 PolarHBondContact O-N 2.56Å; G293-F296 PolarHBondContact O-N 3.38Å; G293-L297 VanDerWaalsContact O-CB 3.24Å; G293-L297 WeakPolarHBondContact O-CB 3.16Å; G293-L297 PolarHBondContact O-N 3.34Å
294G94.5Very high88.5Confident0 Ų060 Ų600%033%0.327CS..Hα-helixtrans-62.8-46.4174.300000113.5S290 V291 F296 L297 L298 V480S290-G294 PolarHBondContact O-N 3.09Å; V291-G294 PolarHBondContact O-N 2.71Å; G294-F296 VanDerWaalsContact C-N 3.33Å; G294-F296 PolarHBondContact O-N 3.25Å; G294-L297 WeakPolarHBondContact O-CB 3.49Å; G294-L297 PolarHBondContact O-N 2.97Å; G294-L298 PolarHBondContact O-N 3.03Å; G294-V480 WeakPolarHBondContact CA-O 3.44Å
295L94.3Very high89.3Confident57 Ų5759 Ų5930%0.29832%0.321SS..Hα-helixtrans-58.4-47.1173.9-87.696.2000111.3V291 L292 L297 F299 G483 L486V291-L295 HydrophobicContact CG1-CD1 3.84Å; V291-L295 VanDerWaalsContact O-CD1 3.26Å; V291-L295 WeakPolarHBondContact O-CD1 3.06Å; V291-L295 PolarHBondContact O-N 3.17Å; L292-L295 PolarHBondContact O-N 2.93Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 PolarHBondContact O-N 3.47Å; L295-F299 WeakPolarHBondContact O-CB 3.38Å; L295-F299 PolarHBondContact O-N 3.38Å; L295-F299 VanDerWaalsContact O-N 3.08Å; L295-G483 WeakPolarHBondContact CD1-O 3.32Å; L295-G483 WeakPolarHBondContact CG-O 3.19Å; L295-L486 HydrophobicContact CD1-CB 4.32Å; L295-L486 HydrophobicContact CD1-CD1 4.46Å
296F93.9Very high89.3Confident130 Ų13054.9 Ų54.957%0.5731%0.305SS*.Hα-helixtrans-66.9-35.8-179.4-175.3-107.9000112L292 G293 G294 F299 V300L292-F296 WeakPolarHBondContact O-CB 3.44Å; L292-F296 PolarHBondContact O-N 3.1Å; G293-F296 PolarHBondContact O-N 3.38Å; G294-F296 VanDerWaalsContact C-N 3.33Å; G294-F296 PolarHBondContact O-N 3.25Å; F296-F299 HydrophobicContact CD2-CD1 4.3Å; F296-F299 HydrophobicContact CE2-CD1 4.33Å; F296-F299 PolarHBondContact O-N 2.8Å; F296-V300 HydrophobicContact CD1-CG2 3.98Å; F296-V300 HydrophobicContact CD2-CG2 4.19Å; F296-V300 HydrophobicContact CE1-CG2 3.53Å; F296-V300 HydrophobicContact CE2-CG2 3.75Å; F296-V300 HydrophobicContact CG-CG2 4.3Å; F296-V300 HydrophobicContact CZ-CG2 3.4Å; F296-V300 VanDerWaalsContact CZ-CG2 3.4Å; F296-V300 WeakPolarHBondContact O-CB 3.37Å; F296-V300 WeakPolarHBondContact O-CG2 3.28Å; F296-V300 PolarHBondContact O-N 2.82Å
297L92.2Very high89.3Confident95 Ų9558.2 Ų58.250%0.49732%0.32SS..Hα-helixtrans-59.2-52.6177.1177.767.4000111.1G293 G294 L295 V300 L301 V480G293-L297 VanDerWaalsContact O-CB 3.24Å; G293-L297 WeakPolarHBondContact O-CB 3.16Å; G293-L297 PolarHBondContact O-N 3.34Å; G294-L297 WeakPolarHBondContact O-CB 3.49Å; G294-L297 PolarHBondContact O-N 2.97Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 PolarHBondContact O-N 3.47Å; L297-V300 PolarHBondContact O-N 3.14Å; L297-L301 VanDerWaalsContact O-CB 3.24Å; L297-L301 WeakPolarHBondContact O-CB 3.37Å; L297-L301 PolarHBondContact O-N 3.38Å; L297-V480 HydrophobicContact CD2-CG1 4.29Å
298L89.6Confident89Confident19 Ų1963.9 Ų63.910%0.09935%0.349CS..Hα-helixtrans-64.3-43178-95-173.5000111.9G294 V300 L301 E302 L393 V484 Y487 V488G294-L298 PolarHBondContact O-N 3.03Å; L298-V300 PolarHBondContact O-N 2.95Å; L298-L301 HydrophobicContact CD2-CD2 4.5Å; L298-L301 PolarHBondContact O-N 3.11Å; L298-E302 WeakPolarHBondContact O-CB 3.36Å; L298-E302 PolarHBondContact O-N 3.28Å; L298-L393 HydrophobicContact CD2-CD1 4.33Å; L298-V484 HydrophobicContact CD1-CB 4.04Å; L298-V484 HydrophobicContact CD1-CG1 3.45Å; L298-V484 VanDerWaalsContact CD1-CG1 3.45Å; L298-V484 HydrophobicContact CD1-CG2 4.28Å; L298-V484 HydrophobicContact CG-CB 4.48Å; L298-V484 HydrophobicContact CG-CG1 4.04Å; L298-V484 HydrophobicContact CG-CG2 4.18Å; L298-Y487 HydrophobicContact CB-CD1 3.86Å; L298-Y487 HydrophobicContact CB-CD2 4.32Å; L298-Y487 HydrophobicContact CB-CE1 4.21Å; L298-Y487 HydrophobicContact CB-CG 3.91Å; L298-Y487 HydrophobicContact CD1-CD1 3.73Å; L298-Y487 HydrophobicContact CD1-CG 4.04Å; L298-Y487 HydrophobicContact CG-CD1 4.44Å; L298-V488 HydrophobicContact CD1-CG2 3.79Å
299F90.4Very high88.2Confident100 Ų10065.1 Ų65.144%0.43934%0.34SS..Hα-helixtrans-55.1-49.5175.3173.7-100.4000112.1L295 F296 L301 N303 Y487L295-F299 WeakPolarHBondContact O-CB 3.38Å; L295-F299 PolarHBondContact O-N 3.38Å; L295-F299 VanDerWaalsContact O-N 3.08Å; F296-F299 HydrophobicContact CD2-CD1 4.3Å; F296-F299 HydrophobicContact CE2-CD1 4.33Å; F296-F299 PolarHBondContact O-N 2.8Å; F299-L301 VanDerWaalsContact C-N 3.35Å; F299-N303 WeakPolarHBondContact CD2-ND2 3.4Å; F299-N303 WeakPolarHBondContact CE1-ND2 3.34Å; F299-N303 WeakPolarHBondContact CE2-ND2 3.4Å; F299-N303 WeakPolarHBondContact CZ-ND2 3.47Å; F299-N303 WeakPolarHBondContact O-CB 3.48Å; F299-N303 PolarHBondContact O-N 2.83Å; F299-N303 VanDerWaalsContact O-N 3.11Å; F299-N303 PolarHBondContact O-ND2 2.96Å; F299-Y487 HydrophobicContact CB-CE2 3.83Å; F299-Y487 HydrophobicContact CD2-CE2 4.49Å
300V91.3Very high87.1Confident51 Ų5167.3 Ų67.331%0.30935%0.348SS..Hα-helixtrans-64.5-43178.7169.70000110.6F296 L297 L298 N303 M304F296-V300 HydrophobicContact CD1-CG2 3.98Å; F296-V300 HydrophobicContact CD2-CG2 4.19Å; F296-V300 HydrophobicContact CE1-CG2 3.53Å; F296-V300 HydrophobicContact CE2-CG2 3.75Å; F296-V300 HydrophobicContact CG-CG2 4.3Å; F296-V300 HydrophobicContact CZ-CG2 3.4Å; F296-V300 VanDerWaalsContact CZ-CG2 3.4Å; F296-V300 WeakPolarHBondContact O-CB 3.37Å; F296-V300 WeakPolarHBondContact O-CG2 3.28Å; F296-V300 PolarHBondContact O-N 2.82Å; L297-V300 PolarHBondContact O-N 3.14Å; L298-V300 PolarHBondContact O-N 2.95Å; V300-N303 PolarHBondContact O-N 3.18Å; V300-M304 HydrophobicContact CG1-CG 3.97Å; V300-M304 VanDerWaalsContact O-CB 3.32Å; V300-M304 WeakPolarHBondContact O-CB 3.48Å; V300-M304 VanDerWaalsContact O-CG 3.22Å; V300-M304 WeakPolarHBondContact O-CG 3.24Å; V300-M304 PolarHBondContact O-N 2.94Å
301L87.7Confident85.9Confident54 Ų5476.3 Ų76.328%0.28338%0.381SS..Hα-helixtrans-62.9-46.6-177.9-174.156.3000111.7L297 L298 F299 N303 M304 L305 L393L297-L301 VanDerWaalsContact O-CB 3.24Å; L297-L301 WeakPolarHBondContact O-CB 3.37Å; L297-L301 PolarHBondContact O-N 3.38Å; L298-L301 HydrophobicContact CD2-CD2 4.5Å; L298-L301 PolarHBondContact O-N 3.11Å; F299-L301 VanDerWaalsContact C-N 3.35Å; L301-N303 PolarHBondContact O-N 2.77Å; L301-M304 PolarHBondContact O-N 2.96Å; L301-L305 HydrophobicContact CD1-CD1 3.65Å; L301-L305 HydrophobicContact CG-CD1 4.29Å; L301-L305 VanDerWaalsContact O-CD1 3.29Å; L301-L305 WeakPolarHBondContact O-CD1 3.44Å; L301-L305 PolarHBondContact O-N 3.06Å; L301-L393 HydrophobicContact CD2-CD1 3.29Å; L301-L393 HydrophobicContact CD2-CD2 3.66Å; L301-L393 HydrophobicContact CD2-CG 4.09Å; L301-L393 HydrophobicContact CG-CD1 3.96Å
302E85.3Confident84.1Confident65 Ų6578.5 Ų78.530%0.30441%0.408SS..Hα-helixtrans-60.3-46.4176.1-166.8-173.7158.400111.2L298 M304 L305 G306 Y487L298-E302 WeakPolarHBondContact O-CB 3.36Å; L298-E302 PolarHBondContact O-N 3.28Å; E302-M304 PolarHBondContact O-N 3.14Å; E302-L305 PolarHBondContact O-N 3.39Å; E302-G306 PolarHBondContact O-N 3.32Å; E302-Y487 WeakPolarHBondContact OE2-CE1 3.49Å; E302-Y487 PolarHBondContact OE2-OH 2.94Å
303N86.5Confident82.1Confident78 Ų7879.1 Ų79.142%0.41741%0.411SS..Hα-helixtrans-64.1-41.8177.3-80.3-63.8000113F299 V300 L301 G306 L307F299-N303 WeakPolarHBondContact CD2-ND2 3.4Å; F299-N303 WeakPolarHBondContact CE1-ND2 3.34Å; F299-N303 WeakPolarHBondContact CE2-ND2 3.4Å; F299-N303 WeakPolarHBondContact CZ-ND2 3.47Å; F299-N303 WeakPolarHBondContact O-CB 3.48Å; F299-N303 PolarHBondContact O-N 2.83Å; F299-N303 VanDerWaalsContact O-N 3.11Å; F299-N303 PolarHBondContact O-ND2 2.96Å; V300-N303 PolarHBondContact O-N 3.18Å; L301-N303 PolarHBondContact O-N 2.77Å; N303-G306 PolarHBondContact O-N 3.44Å; N303-L307 WeakPolarHBondContact O-CB 3.43Å; N303-L307 PolarHBondContact O-N 3.21Å
304M86.5Confident79.7Confident102 Ų10288.2 Ų88.250%0.50244%0.435SS..Hα-helixtrans-64.6-41.3178.3-76.4-60.4102.200111.4V300 L301 E302 L307 L308V300-M304 HydrophobicContact CG1-CG 3.97Å; V300-M304 VanDerWaalsContact O-CB 3.32Å; V300-M304 WeakPolarHBondContact O-CB 3.48Å; V300-M304 VanDerWaalsContact O-CG 3.22Å; V300-M304 WeakPolarHBondContact O-CG 3.24Å; V300-M304 PolarHBondContact O-N 2.94Å; L301-M304 PolarHBondContact O-N 2.96Å; E302-M304 PolarHBondContact O-N 3.14Å; M304-L307 HydrophobicContact CE-CD2 4.38Å; M304-L307 PolarHBondContact O-N 2.8Å; M304-L308 WeakPolarHBondContact O-CB 3.18Å; M304-L308 PolarHBondContact O-N 3.44Å
305L82.6Confident77.3Confident60 Ų6092.8 Ų92.831%0.31447%0.465SS..Hα-helixtrans-68.3-40.1175.2-95.579.6000112.7L301 E302 L307 L308 R309 L389L301-L305 HydrophobicContact CD1-CD1 3.65Å; L301-L305 HydrophobicContact CG-CD1 4.29Å; L301-L305 VanDerWaalsContact O-CD1 3.29Å; L301-L305 WeakPolarHBondContact O-CD1 3.44Å; L301-L305 PolarHBondContact O-N 3.06Å; E302-L305 PolarHBondContact O-N 3.39Å; L305-L307 VanDerWaalsContact C-N 3.26Å; L305-L307 PolarHBondContact O-N 2.76Å; L305-L308 PolarHBondContact O-N 2.94Å; L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 3.19Å; L305-L389 HydrophobicContact CD2-CD1 3.41Å; L305-L389 VanDerWaalsContact CD2-CD1 3.41Å; L305-L389 HydrophobicContact CD2-CD2 3.07Å; L305-L389 HydrophobicContact CD2-CG 3.77Å; L305-L389 HydrophobicContact CG-CD2 4.41Å
306G80.1Confident75Confident22 Ų22101.7 Ų101.723%0.22749%0.494CS..Hα-helixtrans-53.8-46.5170.800000111.3E302 N303 H310E302-G306 PolarHBondContact O-N 3.32Å; N303-G306 PolarHBondContact O-N 3.44Å; G306-H310 PolarHBondContact O-CD2 3.07Å; G306-H310 PolarHBondContact O-N 3.41Å; G306-H310 VanDerWaalsContact O-N 3.12Å
307L81.1Confident72.8Confident80 Ų80100.4 Ų100.442%0.41950%0.501SS..Hα-helixtrans-68.8-43.5179.6-173.465.2000113.3N303 M304 L305 R309 H310 R311N303-L307 WeakPolarHBondContact O-CB 3.43Å; N303-L307 PolarHBondContact O-N 3.21Å; M304-L307 HydrophobicContact CE-CD2 4.38Å; M304-L307 PolarHBondContact O-N 2.8Å; L305-L307 VanDerWaalsContact C-N 3.26Å; L305-L307 PolarHBondContact O-N 2.76Å; L307-R309 VanDerWaalsContact C-N 3.27Å; L307-R309 PolarHBondContact O-N 3.29Å; L307-H310 PolarHBondContact O-N 2.9Å; L307-R311 PolarHBondContact O-N 3.42Å
308L79.4Confident70.6Confident125 Ų125102 Ų10265%0.65452%0.518SS*.Hα-helixtrans-62-38.6179.3-174.960.4000110.9M304 L305 R311 G312M304-L308 WeakPolarHBondContact O-CB 3.18Å; M304-L308 PolarHBondContact O-N 3.44Å; L305-L308 PolarHBondContact O-N 2.94Å; L308-R311 PolarHBondContact O-N 2.84Å; L308-G312 PolarHBondContact O-N 3.04Å
309R69.9Low68.4Low68 Ų68112.5 Ų112.526%0.25756%0.556SS.*Hα-helixtrans-66.5-42.9175-173.1175.465.3-164.51.1112.4L305 L307 R311 G312 L313 D382L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 3.19Å; L307-R309 VanDerWaalsContact C-N 3.27Å; L307-R309 PolarHBondContact O-N 3.29Å; R309-R311 PolarHBondContact O-N 3.45Å; R309-G312 PolarHBondContact O-N 2.89Å; R309-G312 VanDerWaalsContact O-N 3.15Å; R309-L313 HydrophobicContact CG-CD1 4.11Å; R309-L313 PolarHBondContact O-N 3.43Å; R309-D382 IonicContact CZ-OD1 3.93Å; R309-D382 IonicContact CZ-OD2 3.84Å; R309-D382 IonicContact NE-OD1 3.75Å; R309-D382 IonicContact NE-OD2 3.7Å; R309-D382 VanDerWaalsContact NH1-C 3.35Å; R309-D382 VanDerWaalsContact NH1-CA 3.32Å; R309-D382 PolarHBondContact NH1-O 2.84Å; R309-D382 IonicContact NH1-OD1 3.57Å; R309-D382 IonicContact NH2-OD2 2.82Å
310H66.8Low66Low140 Ų140118.3 Ų118.365%0.64858%0.575SS**Hα-helixtrans-62.1-27.5174.8-81.9-59.6000113.1G306 L307G306-H310 PolarHBondContact O-CD2 3.07Å; G306-H310 PolarHBondContact O-N 3.41Å; G306-H310 VanDerWaalsContact O-N 3.12Å; L307-H310 PolarHBondContact O-N 2.9Å
311R67.3Low63.5Low193 Ų193125.7 Ų125.773%0.72860%0.603SS**Hα-helixtrans-81.5-34.1172.7-75.2-177.9168.4168.8-1.5113.4L307 L308 R309L307-R311 PolarHBondContact O-N 3.42Å; L308-R311 PolarHBondContact O-N 2.84Å; R309-R311 PolarHBondContact O-N 3.45Å
312G57.5Low61.2Low67 Ų67134.6 Ų134.669%0.69163%0.633SS**Hα-helixtrans-75.6-19.1-177.900000115.6L308 R309L308-G312 PolarHBondContact O-N 3.04Å; R309-G312 PolarHBondContact O-N 2.89Å; R309-G312 VanDerWaalsContact O-N 3.15Å
313L52.7Low59.2Low122 Ų122142.1 Ų142.164%0.63966%0.659SS**THydrogen-bonded Turntrans-120.546.9-178.1-79.2151.9000112.8R309 P315R309-L313 HydrophobicContact CG-CD1 4.11Å; R309-L313 PolarHBondContact O-N 3.43Å; L313-P315 VanDerWaalsContact C-CD 3.48Å; L313-P315 WeakPolarHBondContact O-CD 3.44Å
314R43.7Very low57Low225 Ų225145.6 Ų145.685%0.84968%0.678SS**  trans-81.698.3148.9-94.1-166.3-179.4-153.31.3107.8R316R314-R316 PolarHBondContact O-N 3.22Å
315P44.8Very low55Low95 Ų95149.2 Ų149.262%0.61770%0.698SS**  trans-56132.4164.223-30.4000107.8L313 C317L313-P315 VanDerWaalsContact C-CD 3.48Å; L313-P315 WeakPolarHBondContact O-CD 3.44Å; P315-C317 HydrophobicContact CB-CB 4.28Å; P315-C317 PolarHBondContact O-N 3.37Å
316R45.8Very low53Low244 Ų244154.7 Ų154.792%0.92172%0.722SS**G310 helixtrans-58.620.5169.6-99.5179.4172.8-169.6-0.3113.6R314 C318R314-R316 PolarHBondContact O-N 3.22Å; R316-C318 PolarHBondContact O-N 2.92Å
317C47.8Very low51.1Low104 Ų104160.2 Ų160.270%0.70375%0.751SS**G310 helixtrans-81-7.7-170.2-75.60000115.1P315P315-C317 HydrophobicContact CB-CB 4.28Å; P315-C317 PolarHBondContact O-N 3.37Å
318C45Very low48.9Very low127 Ų127167.1 Ų167.186%0.85877%0.772SS**G310 helixtrans-97.62.2179.2-61.60000115.1R316R316-C318 PolarHBondContact O-N 2.92Å
319R43.5Very low46.5Very low240 Ų240169 Ų16991%0.90678%0.782SS**SBendtrans-93.5-6-179.8-126.3-174.1-171.6-166.93.7115.5
320R40.4Very low44.9Very low222 Ų222173.7 Ų173.784%0.83881%0.812SS**SBendtrans-109.7-7.4-175.6-151.2172.5-179.5178.30115.7
321K38.3Very low43.2Very low206 Ų206174.6 Ų174.690%0.89682%0.821SS**SBendtrans-99.729.9179.7-144.3178-175.6-178.80114.2
322R40.7Very low42.1Very low242 Ų242170.5 Ų170.591%0.91382%0.82SS**SBendtrans-128.638.5171.6-159.4-173.7-177-116.11.1111.5
323R42.7Very low40.8Very low223 Ų223176.3 Ų176.384%0.84283%0.829SS**SBendtrans-139.9-4.2171.7-133.2178.6-172.4174.31.5116.1
324D40.6Very low39.7Very low151 Ų151178.3 Ų178.381%0.80784%0.84SS**SBendtrans-116.119.3-179.3-61-28000113.6
325L43.8Very low38.9Very low177 Ų177170.6 Ų170.693%0.92783%0.831SS**SBendtrans-124.443.5170.4-154.579.6000111
326E42.2Very low38.2Very low176 Ų176172.5 Ų172.582%0.82285%0.846SS**SBendtrans-149.453.3174.6-151173.9160.300110.5
327T39.3Very low37.3Very low137 Ų137163.9 Ų163.984%0.8483%0.834SS**SBendtrans-171.2136.6146.120000112.2
328R34.3Very low36.5Very low226 Ų226167.9 Ų167.985%0.85384%0.844SS**  trans7891.5166.1-66.4179.9154.5151.3-4.4117
329N30.4Very low35.6Very low163 Ų163166 Ų16687%0.87284%0.838SS**  -156.6111.697.9-84.5-41.1000109.2
330L36.1Very low34.8Very low167 Ų167162.6 Ų162.687%0.87484%0.837SS**  trans-92.5120.8155.6-79.4161.7000104.9
331D31.2Very low34.2Very low159 Ų159160.4 Ų160.485%0.8584%0.836SS**  trans-148.9146.8143.3-87.8-38.8000108.5
332P42.6Very low34Very low107 Ų107155.7 Ų155.770%0.69583%0.827SS**  trans-102.7158.2-155.731.6-17.9000113.8
333E31.8Very low33.2Very low189 Ų189150.6 Ų150.688%0.88382%0.817SS**  trans42.7122.6153.8-60.3-157.1108.800119.6
334N28.6Very low32.4Very low164 Ų164148.1 Ų148.188%0.87782%0.815SS**  -178.7137.999.3-148.1-6000111.4
335G27.3Very low31.6Very low63 Ų63145.5 Ų145.565%0.64981%0.814SS**  trans97.299142.200000119.3
336S29.5Very low30.9Very low135 Ų135141.5 Ų141.594%0.94481%0.806SS**  trans71.3124.2139.1-158.10000117.1
337G27.2Very low30.6Very low64 Ų64139.1 Ų139.166%0.6681%0.806SS**  cis159.9146.212.800000107.5
338M31Very low30Very low188 Ų188141 Ų14193%0.92681%0.805SS**  trans56.2108.1167.4-63.1-162-169.600117.7
339A27.1Very low29.5Very low88 Ų88138.3 Ų138.373%0.72781%0.807SS**  67120.354.600000115.2
340L26Very low29.3Very low168 Ų168133.9 Ų133.988%0.8880%0.8SS**  trans95.5115.2147.9-62.2167.6000120.2
341Q28.2Very low28.8Very low175 Ų175130.5 Ų130.582%0.81880%0.796SS**  trans-50.8-175.8144.7-68156.8-39.800111.5
342P33.5Very low28.5Very low108 Ų108132.4 Ų132.470%0.70180%0.8SS**  cis-139.4-171.3-12.317.411.4000113.6
343L23.9Very low27.7Very low134 Ų134130.6 Ų130.670%0.70280%0.801SS**  trans79.8122.2143.8-81.2153.6000122.2
344Q25.8Very low27.5Very low172 Ų172131.5 Ų131.580%0.80481%0.805SS**  82.8139.6129.3-94.1162.9-4.200123.4
345A24.7Very low27.3Very low96 Ų96134.2 Ų134.279%0.79380%0.803SS**  trans97.9114.5143.500000118.8
346A28.4Very low27.3Very low92 Ų92138.5 Ų138.576%0.7681%0.806SS**  trans-65.4165.3151.300000109.8
347P36.3Very low27.1Very low127 Ų127140.9 Ų140.983%0.82580%0.802SS**  -151.1-174.465.936-11.7000116.6
348E25.9Very low27Very low175 Ų175144.9 Ų144.982%0.81881%0.809SS**  trans-52.8162-171.4-45-16712500119.5
349L24.8Very low26.8Very low171 Ų171140.2 Ų140.290%0.89580%0.795SS**  169.1141.7108.5-143.977.7000112.2
350G25.1Very low26.8Very low69 Ų69144.8 Ų144.871%0.71180%0.801SS**  trans116.289.9138.100000121
351A25.5Very low26.9Very low97 Ų97145.8 Ų145.880%0.80280%0.801SS**  56.9135.7125.300000124.6
352Q25.9Very low27.3Very low198 Ų198142.6 Ų142.693%0.92580%0.795SS**  trans83.8117.2144-93.9180-38.600121.4
353G24.9Very low27.1Very low70 Ų70143.6 Ų143.672%0.72280%0.802SS**  121.5114123.300000119
354Q28.1Very low27.3Very low208 Ų208141.6 Ų141.697%0.97280%0.804SS**  trans85.4143144.3-66.5-179.4-23.400121.6
355R25.2Very low27.9Very low221 Ų221139.4 Ų139.483%0.83481%0.805SS**  trans-81147.4-167.8-101.1174.8163.2156.8-3.2113.6
356E25.8Very low28.1Very low152 Ų152139.3 Ų139.371%0.7180%0.804SS**  trans61.1104.1137.7-66.9177.8117.200120.2
357Q26.2Very low28.4Very low185 Ų185140.4 Ų140.486%0.86480%0.804SS**  167.7133.4102-93.51782000113.1
358N23.8Very low28.3Very low148 Ų148140.6 Ų140.679%0.79181%0.805SS**  trans68.5115.8145.4-152.128.4000120.6
359S28.1Very low28.4Very low91 Ų91135.4 Ų135.464%0.63680%0.798SS**  trans145.1109.7137.3-62.80000114.2
360Q27.4Very low28.7Very low183 Ų183136.6 Ų136.686%0.85580%0.799SS**  trans50.1106.5132.5-67.9162.44.300121.8
361H28.4Very low29Very low190 Ų190141.5 Ų141.588%0.8880%0.803SS**  trans56.1152.5154.4-94.7-44.1000120.8
362P34.8Very low29Very low108 Ų108140 Ų14070%0.70180%0.798SS**  cis-127.5-171.4-1240-22.3000112.5
363P30.6Very low29.4Very low128 Ų128138 Ų13883%0.83179%0.788SS**  trans-129.1138.5147.935.4-23.1000113.7
364A28.3Very low29.5Very low92 Ų92140.4 Ų140.476%0.7679%0.794SS**  trans-107179.5159.200000108.6
365P37.2Very low30Very low127 Ų127139.3 Ų139.383%0.82579%0.788SS**  -114.2161.1-62.734.3-21.2000111.3
366A30.4Very low30.1Very low93 Ų93131.9 Ų131.977%0.76978%0.78SS**  trans-106.3161.3170.900000110.3
367P34.6Very low30.6Very low116 Ų116134.2 Ų134.275%0.75379%0.791SS**  trans-72.4166.1-155.531.2-34.2000114.1G369P367-G369 PolarHBondContact O-N 3.45Å
368P34Very low30.9Very low131 Ų131134.1 Ų134.185%0.85179%0.79SS**  trans-66.5104.2-170.126.3-33.2000111.3
369G26.3Very low31.9Very low65 Ų65128.7 Ų128.767%0.6777%0.769SS**  trans-62.7136.7161.400000109.8P367 Q371P367-G369 PolarHBondContact O-N 3.45Å; G369-Q371 PolarHBondContact O-N 3.29Å
370H32Very low33.1Very low197 Ų197126.6 Ų126.691%0.91276%0.762SS**  trans-46.4125.9170.5-81.9-84000110.6G372H370-G372 PolarHBondContact O-N 2.77Å
371Q30.4Very low34.7Very low171 Ų171122.2 Ų122.280%0.79975%0.748SS**  trans-58.896.4177.9-70.1173.5-1.500110.2G369 H373G369-Q371 PolarHBondContact O-N 3.29Å; Q371-H373 PolarHBondContact O-N 2.84Å
372G26.9Very low36.6Very low67 Ų67115.5 Ų115.569%0.69172%0.718SS**  trans-67.2112.4155.800000107.9H370 S374H370-G372 PolarHBondContact O-N 2.77Å; G372-S374 PolarHBondContact O-N 3.28Å
373H34.7Very low38.3Very low156 Ų156114.8 Ų114.872%0.72271%0.707SS**  trans-59.1102.3178.1-62.8-67.4000110.3Q371 H375Q371-H373 PolarHBondContact O-N 2.84Å; H373-H375 PolarHBondContact O-N 3.09Å
374S26.8Very low40.6Very low120 Ų120109.7 Ų109.784%0.83967%0.674SS**  trans-71.9115.5166-73.80000109.3G372 G376G372-S374 PolarHBondContact O-N 3.28Å; S374-G376 PolarHBondContact O-N 3.15Å
375H37.8Very low43Very low185 Ų185113 Ų11386%0.85667%0.667SS**  trans-71.793.6174.1-71.4-78.8000110.5H373 H377H373-H375 PolarHBondContact O-N 3.09Å; H375-H377 PolarHBondContact O-N 3.43Å
376G27.1Very low44.9Very low64 Ų64110.8 Ų110.866%0.6665%0.647SS**  trans-70.1110.4165.800000111.5S374 Q378S374-G376 PolarHBondContact O-N 3.15Å; G376-Q378 VanDerWaalsContact C-N 3.28Å; G376-Q378 PolarHBondContact O-N 2.98Å
377H36.9Very low47.2Very low202 Ų202107.9 Ų107.994%0.93562%0.62SS**SBendtrans39.313143.9-95.4-65.9000123.4H375H375-H377 PolarHBondContact O-N 3.43Å
378Q32.6Very low49.5Very low182 Ų182103.7 Ų103.785%0.8559%0.591SS**SBendtrans-117.84.6170.5-69.1-167.724.400114.7G376G376-Q378 VanDerWaalsContact C-N 3.28Å; G376-Q378 PolarHBondContact O-N 2.98Å
379G43.6Very low51.9Low35 Ų35101 Ų10136%0.36157%0.568SS.*  trans-98.34-175.700000116.9D382 I383G379-D382 PolarHBondContact O-N 3.14Å; G379-I383 PolarHBondContact O-N 3.42Å
380G54.1Low54.7Low46 Ų4699.1 Ų99.147%0.47455%0.55SS..Hα-helixtrans-65.1-43.8-171.800000113.9D382 T384G380-D382 VanDerWaalsContact C-N 3.31Å; G380-D382 PolarHBondContact O-N 3.45Å; G380-T384 PolarHBondContact O-N 3.08Å; G380-T384 PolarHBondContact O-OG1 3.42Å
381T61.6Low57.3Low92 Ų9290.2 Ų90.256%0.56451%0.509SS*.Hα-helixtrans-68.4-31.5-178.951.40000112.7W385T381-W385 PolarHBondContact O-N 3.05Å; T381-W385 VanDerWaalsContact O-N 3.14Å
382D67.7Low60.1Low49 Ų4982.3 Ų82.326%0.26247%0.473SS..Hα-helixtrans-73.5-38.2-176.2-80.53.7000111.9R309 G379 G380 M386R309-D382 IonicContact CZ-OD1 3.93Å; R309-D382 IonicContact CZ-OD2 3.84Å; R309-D382 IonicContact NE-OD1 3.75Å; R309-D382 IonicContact NE-OD2 3.7Å; R309-D382 VanDerWaalsContact NH1-C 3.35Å; R309-D382 VanDerWaalsContact NH1-CA 3.32Å; R309-D382 PolarHBondContact NH1-O 2.84Å; R309-D382 IonicContact NH1-OD1 3.57Å; R309-D382 IonicContact NH2-OD2 2.82Å; G379-D382 PolarHBondContact O-N 3.14Å; G380-D382 VanDerWaalsContact C-N 3.31Å; G380-D382 PolarHBondContact O-N 3.45Å; D382-M386 PolarHBondContact O-N 3.29Å
383I71.3Confident63.1Low92 Ų9281 Ų8147%0.47245%0.451SS..Hα-helixtrans-70.9-42.4175.4-61.5164.9000109.7G379 W385 M386 V387G379-I383 PolarHBondContact O-N 3.42Å; I383-W385 PolarHBondContact O-N 3.08Å; I383-M386 PolarHBondContact O-N 3.38Å; I383-V387 HydrophobicContact CG2-CG2 4.36Å; I383-V387 WeakPolarHBondContact O-CG2 3.24Å; I383-V387 PolarHBondContact O-N 3.35Å
384T77.5Confident65.7Low22 Ų2274.1 Ų74.114%0.13542%0.419CS..Hα-helixtrans-55.9-44.4176.9-63.20000113.2G380 L388 L435 S438 L440G380-T384 PolarHBondContact O-N 3.08Å; G380-T384 PolarHBondContact O-OG1 3.42Å; T384-L388 WeakPolarHBondContact O-CB 3.17Å; T384-L388 PolarHBondContact O-N 3.14Å; T384-L388 VanDerWaalsContact O-N 3.13Å; T384-L435 HydrophobicContact CG2-CD2 3.66Å; T384-S438 VanDerWaalsContact OG1-CB 3.29Å; T384-S438 WeakPolarHBondContact OG1-CB 3.3Å; T384-S438 PolarHBondContact OG1-OG 3.38Å; T384-L440 HydrophobicContact CG2-CD1 3.39Å; T384-L440 HydrophobicContact CG2-CG 4.31Å
385W79.4Confident68.9Low161 Ų16169.1 Ų69.161%0.6138%0.382SS*.Hα-helixtrans-70.8-32.3178.4-80.2116.4000113.5T381 I383 L388 L389T381-W385 PolarHBondContact O-N 3.05Å; T381-W385 VanDerWaalsContact O-N 3.14Å; I383-W385 PolarHBondContact O-N 3.08Å; W385-L388 HydrophobicContact CE3-CD2 3.79Å; W385-L388 HydrophobicContact CZ3-CD2 3.64Å; W385-L389 WeakPolarHBondContact O-CB 3.45Å; W385-L389 PolarHBondContact O-N 2.87Å; W385-L389 VanDerWaalsContact O-N 3.12Å
386M76.6Confident71.6Confident81 Ų8163 Ų6340%0.39936%0.356SS..Hα-helixtrans-68.6-46.8177.9-171172.583.100110.7D382 I383 L388 L389 G390D382-M386 PolarHBondContact O-N 3.29Å; I383-M386 PolarHBondContact O-N 3.38Å; M386-L388 PolarHBondContact O-N 3.04Å; M386-L389 PolarHBondContact O-N 3.25Å; M386-G390 PolarHBondContact O-N 3.34Å
387V79.8Confident74.8Confident32 Ų3260.9 Ų60.919%0.19433%0.33CS..Hα-helixtrans-57.6-49.8174.71730000110.4I383 L389 G390 D391 D431 L435I383-V387 HydrophobicContact CG2-CG2 4.36Å; I383-V387 WeakPolarHBondContact O-CG2 3.24Å; I383-V387 PolarHBondContact O-N 3.35Å; V387-L389 VanDerWaalsContact C-N 3.3Å; V387-L389 PolarHBondContact O-N 3.36Å; V387-G390 PolarHBondContact O-N 2.86Å; V387-D391 WeakPolarHBondContact O-CB 3.27Å; V387-D391 PolarHBondContact O-N 3.03Å; V387-D431 HydrophobicContact CG1-CB 4.14Å; V387-L435 HydrophobicContact CB-CD2 4.36Å; V387-L435 HydrophobicContact CG1-CD1 4.33Å; V387-L435 HydrophobicContact CG1-CD2 4.22Å; V387-L435 HydrophobicContact CG1-CG 4.26Å
388L82.6Confident77.6Confident28 Ų2851.5 Ų51.515%0.14729%0.286CS..Hα-helixtrans-62-35.5-178.5176.563.6000113.9T384 W385 M386 G392 L448T384-L388 WeakPolarHBondContact O-CB 3.17Å; T384-L388 PolarHBondContact O-N 3.14Å; T384-L388 VanDerWaalsContact O-N 3.13Å; W385-L388 HydrophobicContact CE3-CD2 3.79Å; W385-L388 HydrophobicContact CZ3-CD2 3.64Å; M386-L388 PolarHBondContact O-N 3.04Å; L388-G392 PolarHBondContact O-N 3.32Å; L388-G392 VanDerWaalsContact O-N 3.13Å; L388-L448 HydrophobicContact CD1-CB 3.68Å; L388-L448 HydrophobicContact CD1-CD1 3.99Å; L388-L448 HydrophobicContact CD1-CD2 4.01Å; L388-L448 HydrophobicContact CD1-CG 4.08Å; L388-L448 HydrophobicContact CD2-CD1 3.79Å; L388-L448 HydrophobicContact CD2-CD2 3.58Å; L388-L448 HydrophobicContact CD2-CG 4.18Å; L388-L448 HydrophobicContact CG-CD2 4.39Å
389L84.1Confident80.6Confident73 Ų7342.9 Ų42.938%0.38225%0.246SC..Hα-helixtrans-83.9-33.3-179.7178.9132000112.1L305 W385 M386 V387 D391 G392 L393L305-L389 HydrophobicContact CD2-CD1 3.41Å; L305-L389 VanDerWaalsContact CD2-CD1 3.41Å; L305-L389 HydrophobicContact CD2-CD2 3.07Å; L305-L389 HydrophobicContact CD2-CG 3.77Å; L305-L389 HydrophobicContact CG-CD2 4.41Å; W385-L389 WeakPolarHBondContact O-CB 3.45Å; W385-L389 PolarHBondContact O-N 2.87Å; W385-L389 VanDerWaalsContact O-N 3.12Å; M386-L389 PolarHBondContact O-N 3.25Å; V387-L389 VanDerWaalsContact C-N 3.3Å; V387-L389 PolarHBondContact O-N 3.36Å; L389-D391 PolarHBondContact O-N 3.31Å; L389-G392 PolarHBondContact O-N 3.21Å; L389-L393 HydrophobicContact CD2-CD1 3.56Å; L389-L393 HydrophobicContact CD2-CG 4.38Å; L389-L393 HydrophobicContact CG-CD1 4.26Å; L389-L393 VanDerWaalsContact O-CG 3.3Å; L389-L393 WeakPolarHBondContact O-CG 3.29Å; L389-L393 PolarHBondContact O-N 2.78Å
390G84.8Confident83.1Confident27 Ų2742.3 Ų42.328%0.27824%0.235SC..Hα-helixtrans-53.8-47.2164.800000110.3M386 V387 G392 L393 H394M386-G390 PolarHBondContact O-N 3.34Å; V387-G390 PolarHBondContact O-N 2.86Å; G390-G392 PolarHBondContact O-N 3.03Å; G390-L393 PolarHBondContact O-N 2.99Å; G390-L393 VanDerWaalsContact O-N 3.08Å; G390-H394 PolarHBondContact O-N 3.26Å
391D86.8Confident85.1Confident9 Ų940.1 Ų40.15%0.04821%0.212CC..Hα-helixtrans-56.5-48.7177.2-178.680000113.1V387 L389 L393 H394 N395 S452V387-D391 WeakPolarHBondContact O-CB 3.27Å; V387-D391 PolarHBondContact O-N 3.03Å; L389-D391 PolarHBondContact O-N 3.31Å; D391-L393 VanDerWaalsContact C-N 3.29Å; D391-L393 PolarHBondContact O-N 2.93Å; D391-H394 VanDerWaalsContact CA-CE1 3.42Å; D391-H394 WeakPolarHBondContact CA-CE1 3.43Å; D391-H394 VanDerWaalsContact CA-ND1 3.3Å; D391-H394 WeakPolarHBondContact CA-ND1 3.49Å; D391-H394 PolarHBondContact O-CD2 3.44Å; D391-H394 VanDerWaalsContact O-CD2 3.29Å; D391-H394 PolarHBondContact O-CE1 3.22Å; D391-H394 VanDerWaalsContact O-CG 3.22Å; D391-H394 PolarHBondContact O-N 2.96Å; D391-H394 PolarHBondContact O-ND1 2.98Å; D391-H394 PolarHBondContact O-NE2 2.95Å; D391-H394 IonicContact OD1-CE1 3.97Å; D391-H394 PolarHBondContact OD1-CE1 3.4Å; D391-H394 IonicContact OD1-ND1 3.19Å; D391-H394 IonicContact OD1-NE2 3.51Å; D391-H394 PolarHBondContact OD1-NE2 3.23Å; D391-N395 WeakPolarHBondContact O-CB 3.41Å; D391-N395 PolarHBondContact O-N 2.89Å; D391-N395 VanDerWaalsContact O-N 3.09Å; D391-S452 PolarHBondContact O-OG 2.83Å; D391-S452 WeakPolarHBondContact OD2-CB 3.32Å; D391-S452 PolarHBondContact OD2-OG 3.12Å
392G89.9Confident86.7Confident6 Ų635.7 Ų35.76%0.06219%0.186CC..Hα-helixtrans-62.7-32.917600000114.5L388 L389 G390 L396 S452L388-G392 PolarHBondContact O-N 3.32Å; L388-G392 VanDerWaalsContact O-N 3.13Å; L389-G392 PolarHBondContact O-N 3.21Å; G390-G392 PolarHBondContact O-N 3.03Å; G392-L396 WeakPolarHBondContact O-CB 3.44Å; G392-L396 PolarHBondContact O-N 3.02Å; G392-S452 VanDerWaalsContact CA-OG 3.29Å; G392-S452 WeakPolarHBondContact CA-OG 3.42Å; G392-S452 PolarHBondContact N-OG 3.28Å
393L89.6Confident88Confident40 Ų4033.4 Ų33.421%0.20917%0.173CC..Hα-helixtrans-78.8-38.2179.6-72.1166.3000112.4L298 L301 L389 G390 D391 N395 L396 T397L298-L393 HydrophobicContact CD2-CD1 4.33Å; L301-L393 HydrophobicContact CD2-CD1 3.29Å; L301-L393 HydrophobicContact CD2-CD2 3.66Å; L301-L393 HydrophobicContact CD2-CG 4.09Å; L301-L393 HydrophobicContact CG-CD1 3.96Å; L389-L393 HydrophobicContact CD2-CD1 3.56Å; L389-L393 HydrophobicContact CD2-CG 4.38Å; L389-L393 HydrophobicContact CG-CD1 4.26Å; L389-L393 VanDerWaalsContact O-CG 3.3Å; L389-L393 WeakPolarHBondContact O-CG 3.29Å; L389-L393 PolarHBondContact O-N 2.78Å; G390-L393 PolarHBondContact O-N 2.99Å; G390-L393 VanDerWaalsContact O-N 3.08Å; D391-L393 VanDerWaalsContact C-N 3.29Å; D391-L393 PolarHBondContact O-N 2.93Å; L393-N395 VanDerWaalsContact C-N 3.3Å; L393-L396 HydrophobicContact CD2-CD2 4.48Å; L393-L396 WeakPolarHBondContact O-CB 3.49Å; L393-L396 PolarHBondContact O-N 3.19Å; L393-T397 WeakPolarHBondContact O-CG2 3.46Å; L393-T397 PolarHBondContact O-N 3.03Å; L393-T397 PolarHBondContact O-OG1 3.17Å
394H90.4Very high88.9Confident11 Ų1129 Ų295%0.05115%0.151CC..Hα-helixtrans-62.5-43.8173.476.9-135.3000109.8G390 D391 L396 T397 D398 E424 H427G390-H394 PolarHBondContact O-N 3.26Å; D391-H394 VanDerWaalsContact CA-CE1 3.42Å; D391-H394 WeakPolarHBondContact CA-CE1 3.43Å; D391-H394 VanDerWaalsContact CA-ND1 3.3Å; D391-H394 WeakPolarHBondContact CA-ND1 3.49Å; D391-H394 PolarHBondContact O-CD2 3.44Å; D391-H394 VanDerWaalsContact O-CD2 3.29Å; D391-H394 PolarHBondContact O-CE1 3.22Å; D391-H394 VanDerWaalsContact O-CG 3.22Å; D391-H394 PolarHBondContact O-N 2.96Å; D391-H394 PolarHBondContact O-ND1 2.98Å; D391-H394 PolarHBondContact O-NE2 2.95Å; D391-H394 IonicContact OD1-CE1 3.97Å; D391-H394 PolarHBondContact OD1-CE1 3.4Å; D391-H394 IonicContact OD1-ND1 3.19Å; D391-H394 IonicContact OD1-NE2 3.51Å; D391-H394 PolarHBondContact OD1-NE2 3.23Å; H394-L396 VanDerWaalsContact C-N 3.27Å; H394-L396 PolarHBondContact O-N 2.77Å; H394-T397 WeakPolarHBondContact CA-OG1 3.46Å; H394-T397 CarbonylContact O-C 3.58Å; H394-T397 WeakPolarHBondContact O-CA 3.47Å; H394-T397 PolarHBondContact O-N 3.46Å; H394-T397 PolarHBondContact O-OG1 3Å; H394-D398 IonicContact CD2-OD2 3.19Å; H394-D398 PolarHBondContact O-N 3.46Å; H394-E424 IonicContact NE2-OE1 2.88Å; H394-E424 IonicContact NE2-OE2 3.19Å; H394-H427 AromaticContact CE1-CE1 3.22Å; H394-H427 PolarHBondContact CE1-CE1 3.46Å; H394-H427 AromaticContact CE1-ND1 3.35Å; H394-H427 PolarHBondContact CE1-ND1 3.19Å; H394-H427 VanDerWaalsContact CE1-ND1 3.35Å; H394-H427 AromaticContact ND1-CE1 3.34Å; H394-H427 PolarHBondContact ND1-CE1 2.83Å; H394-H427 VanDerWaalsContact ND1-CE1 3.34Å; H394-H427 AromaticContact ND1-ND1 3.88Å
395N93.1Very high89.5Confident15 Ų1528 Ų288%0.0814%0.144CC..Hα-helixtrans-66.7-36.3-176.3-91.6-32000110.6D391 L393 D398 G399 E424 S452 G456D391-N395 WeakPolarHBondContact O-CB 3.41Å; D391-N395 PolarHBondContact O-N 2.89Å; D391-N395 VanDerWaalsContact O-N 3.09Å; L393-N395 VanDerWaalsContact C-N 3.3Å; N395-D398 PolarHBondContact O-N 3.19Å; N395-G399 PolarHBondContact O-N 2.76Å; N395-E424 PolarHBondContact OD1-OE1 3.38Å; N395-S452 WeakPolarHBondContact ND2-CB 3.36Å; N395-S452 PolarHBondContact ND2-OG 3.1Å; N395-G456 WeakPolarHBondContact O-CA 3.39Å
396L94.8Very high90.1Very high57 Ų5721.1 Ų21.130%0.29812%0.119SC..Hα-helixtrans-58.7-46170178.470.5000111.6G392 L393 H394 L400 L455 G459G392-L396 WeakPolarHBondContact O-CB 3.44Å; G392-L396 PolarHBondContact O-N 3.02Å; L393-L396 HydrophobicContact CD2-CD2 4.48Å; L393-L396 WeakPolarHBondContact O-CB 3.49Å; L393-L396 PolarHBondContact O-N 3.19Å; H394-L396 VanDerWaalsContact C-N 3.27Å; H394-L396 PolarHBondContact O-N 2.77Å; L396-L400 WeakPolarHBondContact O-CB 3.48Å; L396-L400 PolarHBondContact O-N 3Å; L396-L455 HydrophobicContact CB-CB 4.38Å; L396-L455 VanDerWaalsContact CD1-O 3.31Å; L396-L455 WeakPolarHBondContact CD1-O 3.4Å; L396-G459 WeakPolarHBondContact O-CA 3.38Å
397T94.3Very high90.6Very high18 Ų1819.3 Ų19.311%0.1111%0.114CC..Hα-helixtrans-73.1-30.6-179.251.40000113.5L393 H394 L400 A401 V484L393-T397 WeakPolarHBondContact O-CG2 3.46Å; L393-T397 PolarHBondContact O-N 3.03Å; L393-T397 PolarHBondContact O-OG1 3.17Å; H394-T397 WeakPolarHBondContact CA-OG1 3.46Å; H394-T397 CarbonylContact O-C 3.58Å; H394-T397 WeakPolarHBondContact O-CA 3.47Å; H394-T397 PolarHBondContact O-N 3.46Å; H394-T397 PolarHBondContact O-OG1 3Å; T397-L400 WeakPolarHBondContact O-CB 3.06Å; T397-L400 PolarHBondContact O-N 3.22Å; T397-A401 PolarHBondContact O-N 3.36Å; T397-V484 HydrophobicContact CG2-CG1 4.04Å; T397-V484 HydrophobicContact CG2-CG2 4.3Å
398D94.9Very high90.7Very high5 Ų523.1 Ų23.13%0.02713%0.134CC..Hα-helixtrans-64.1-50.7172-63.4-16000109.9H394 N395 L400 A401 I402 V420 F485H394-D398 IonicContact CD2-OD2 3.19Å; H394-D398 PolarHBondContact O-N 3.46Å; N395-D398 PolarHBondContact O-N 3.19Å; D398-L400 VanDerWaalsContact C-N 3.28Å; D398-L400 PolarHBondContact O-N 3.3Å; D398-A401 PolarHBondContact O-N 3.24Å; D398-I402 WeakPolarHBondContact O-CB 3.37Å; D398-I402 WeakPolarHBondContact O-CD1 3.3Å; D398-I402 WeakPolarHBondContact O-CG1 3.48Å; D398-I402 PolarHBondContact O-N 2.86Å; D398-V420 HydrophobicContact CB-CG1 3.93Å; D398-V420 HydrophobicContact CB-CG2 4.41Å; D398-F485 WeakPolarHBondContact OD1-CE1 3.34Å; D398-F485 WeakPolarHBondContact OD1-CZ 3.03Å
399G96.7Very high90.7Very high1 Ų123 Ų231%0.0114%0.139CC..Hα-helixtrans-54.6-46.717300000111.5N395 A401 I402 G403 G456 A460N395-G399 PolarHBondContact O-N 2.76Å; G399-A401 PolarHBondContact O-N 3.37Å; G399-I402 PolarHBondContact O-N 3.1Å; G399-G403 PolarHBondContact O-N 3.02Å; G399-G456 WeakPolarHBondContact CA-O 3.25Å; G399-A460 WeakPolarHBondContact O-CA 3.14Å; G399-A460 PolarHBondContact O-N 3.46Å
400L95.9Very high90.7Very high23 Ų2324 Ų2412%0.1214%0.14CC..Hα-helixtrans-56.2-48.5178-173.875.2000112.3L396 T397 D398 A404 G459 L462 G463 L466 V477L396-L400 WeakPolarHBondContact O-CB 3.48Å; L396-L400 PolarHBondContact O-N 3Å; T397-L400 WeakPolarHBondContact O-CB 3.06Å; T397-L400 PolarHBondContact O-N 3.22Å; D398-L400 VanDerWaalsContact C-N 3.28Å; D398-L400 PolarHBondContact O-N 3.3Å; L400-A404 WeakPolarHBondContact O-CB 3.42Å; L400-A404 PolarHBondContact O-N 2.86Å; L400-G459 VanDerWaalsContact CA-O 3.29Å; L400-G459 WeakPolarHBondContact CA-O 3.28Å; L400-G459 VanDerWaalsContact N-C 3.33Å; L400-L462 HydrophobicContact CD1-CB 4Å; L400-L462 HydrophobicContact CD1-CD2 3.88Å; L400-L462 HydrophobicContact CD1-CG 3.73Å; L400-G463 WeakPolarHBondContact O-CA 3.45Å; L400-L466 HydrophobicContact CD1-CD1 4.1Å; L400-V477 HydrophobicContact CD2-CG1 3.84Å; L400-V477 HydrophobicContact CG-CG1 3.65Å
401A94.9Very high90.6Very high0 Ų024.3 Ų24.30%014%0.139CC..Hα-helixtrans-66.3-43.517800000112.1T397 D398 G399 G403 A404 A405 T416 F478 T481T397-A401 PolarHBondContact O-N 3.36Å; D398-A401 PolarHBondContact O-N 3.24Å; G399-A401 PolarHBondContact O-N 3.37Å; A401-G403 PolarHBondContact O-N 3.11Å; A401-A404 PolarHBondContact O-N 3.16Å; A401-A405 VanDerWaalsContact O-CB 3.3Å; A401-A405 WeakPolarHBondContact O-CB 3.33Å; A401-A405 PolarHBondContact O-N 3.2Å; A401-T416 HydrophobicContact CB-CG2 4.35Å; A401-F478 HydrophobicContact CB-CD1 4.35Å; A401-F478 HydrophobicContact CB-CE1 4.42Å; A401-T481 HydrophobicContact CB-CG2 3.96Å
402I95.7Very high90.5Very high0 Ų024.3 Ų24.30%014%0.139CC..Hα-helixtrans-60.9-45177.7-69.3164.1000111.1A219 V220 L223 D398 G399 A404 A405 F406 T416 V420A219-I402 HydrophobicContact CB-CG2 3.87Å; V220-I402 HydrophobicContact CG2-CD1 4.39Å; L223-I402 HydrophobicContact CD1-CD1 3.19Å; D398-I402 WeakPolarHBondContact O-CB 3.37Å; D398-I402 WeakPolarHBondContact O-CD1 3.3Å; D398-I402 WeakPolarHBondContact O-CG1 3.48Å; D398-I402 PolarHBondContact O-N 2.86Å; G399-I402 PolarHBondContact O-N 3.1Å; I402-A404 VanDerWaalsContact C-N 3.34Å; I402-A404 PolarHBondContact O-N 3.07Å; I402-A405 PolarHBondContact O-N 3.48Å; I402-F406 HydrophobicContact CG2-CD2 3.65Å; I402-F406 HydrophobicContact CG2-CE2 3.74Å; I402-F406 WeakPolarHBondContact O-CD2 3.44Å; I402-F406 PolarHBondContact O-N 2.96Å; I402-T416 HydrophobicContact CG1-CG2 3.99Å; I402-V420 HydrophobicContact CD1-CG2 4.4Å
403G94.4Very high90.5Very high0 Ų024 Ų240%014%0.137CC..Hα-helixtrans-62.2-42.2176.800000112.5G399 A401 S407 V464G399-G403 PolarHBondContact O-N 3.02Å; A401-G403 PolarHBondContact O-N 3.11Å; G403-S407 WeakPolarHBondContact O-CB 3.26Å; G403-S407 PolarHBondContact O-N 3.26Å; G403-S407 PolarHBondContact O-OG 2.93Å; G403-V464 VanDerWaalsContact O-CG2 3.28Å; G403-V464 WeakPolarHBondContact O-CG2 3.31Å
404A91.3Very high90.5Very high0 Ų024.6 Ų24.60%014%0.14CC..Hα-helixtrans-63.7-43.6175.200000111.5L400 A401 I402 S407 D408 T474 V477 F478L400-A404 WeakPolarHBondContact O-CB 3.42Å; L400-A404 PolarHBondContact O-N 2.86Å; A401-A404 PolarHBondContact O-N 3.16Å; I402-A404 VanDerWaalsContact C-N 3.34Å; I402-A404 PolarHBondContact O-N 3.07Å; A404-S407 WeakPolarHBondContact O-CB 3.12Å; A404-S407 PolarHBondContact O-N 2.95Å; A404-D408 PolarHBondContact O-N 3.21Å; A404-T474 HydrophobicContact CB-CG2 3.86Å; A404-V477 HydrophobicContact CB-CB 4.38Å; A404-V477 HydrophobicContact CB-CG1 3.87Å; A404-F478 HydrophobicContact CB-CE1 4.2Å; A404-F478 HydrophobicContact CB-CZ 4.45Å
405A90.5Very high90.4Very high0 Ų024.1 Ų24.10%014%0.137CC..Hα-helixtrans-67.8-45.3-178.900000113.8A401 I402 S407 D408 G409 T416 F478A401-A405 VanDerWaalsContact O-CB 3.3Å; A401-A405 WeakPolarHBondContact O-CB 3.33Å; A401-A405 PolarHBondContact O-N 3.2Å; I402-A405 PolarHBondContact O-N 3.48Å; A405-S407 PolarHBondContact O-N 3.41Å; A405-D408 WeakPolarHBondContact O-CB 3.21Å; A405-D408 PolarHBondContact O-N 2.99Å; A405-G409 PolarHBondContact O-N 3.47Å; A405-G409 VanDerWaalsContact O-O 3.07Å; A405-T416 HydrophobicContact CB-CG2 4.26Å; A405-T416 WeakPolarHBondContact CB-OG1 3.21Å; A405-F478 HydrophobicContact CB-CE1 4Å; A405-F478 HydrophobicContact CB-CZ 3.8Å
406F90.8Very high90.4Very high17 Ų1723.4 Ų23.48%0.07513%0.134CC..Hα-helixtrans-66.9-21.5174.7-84.3-66.4000113.3A212 Q215 S216 A219 I402 D408 F410 G413 T417A212-F406 HydrophobicContact CB-CB 4.46Å; Q215-F406 HydrophobicContact CB-CD1 3.71Å; Q215-F406 HydrophobicContact CB-CD2 4.4Å; Q215-F406 HydrophobicContact CB-CE1 3.86Å; Q215-F406 HydrophobicContact CB-CG 4.02Å; Q215-F406 HydrophobicContact CB-CZ 4.26Å; Q215-F406 HydrophobicContact CG-CD1 4.46Å; S216-F406 WeakPolarHBondContact OG-CB 3.21Å; S216-F406 WeakPolarHBondContact OG-CD2 3.4Å; A219-F406 HydrophobicContact CB-CE2 3.77Å; A219-F406 HydrophobicContact CB-CZ 4.42Å; I402-F406 HydrophobicContact CG2-CD2 3.65Å; I402-F406 HydrophobicContact CG2-CE2 3.74Å; I402-F406 WeakPolarHBondContact O-CD2 3.44Å; I402-F406 PolarHBondContact O-N 2.96Å; F406-D408 VanDerWaalsContact C-N 3.32Å; F406-F410 HydrophobicContact CE1-CD2 4Å; F406-F410 HydrophobicContact CE1-CE2 4.33Å; F406-G413 WeakPolarHBondContact CE2-O 3.44Å; F406-G413 WeakPolarHBondContact CZ-O 3.41Å; F406-T417 WeakPolarHBondContact CE2-OG1 3.34Å
407S87.5Confident90.4Very high44 Ų4421 Ų2131%0.30812%0.121SC..Hα-helixtrans-75.8-24.3171.9-55.70000112.5G403 A404 A405 V464 S467G403-S407 WeakPolarHBondContact O-CB 3.26Å; G403-S407 PolarHBondContact O-N 3.26Å; G403-S407 PolarHBondContact O-OG 2.93Å; A404-S407 WeakPolarHBondContact O-CB 3.12Å; A404-S407 PolarHBondContact O-N 2.95Å; A405-S407 PolarHBondContact O-N 3.41Å; S407-V464 WeakPolarHBondContact OG-CA 3.35Å; S407-S467 VanDerWaalsContact CB-CB 3.48Å
408D81.6Confident90.3Very high112 Ų11223.4 Ų23.460%0.59913%0.133SC*.Hα-helixtrans-84.4-39.4175.3-164.960.1000111.5A404 A405 F406A404-D408 PolarHBondContact O-N 3.21Å; A405-D408 WeakPolarHBondContact O-CB 3.21Å; A405-D408 PolarHBondContact O-N 2.99Å; F406-D408 VanDerWaalsContact C-N 3.32Å
409G82.1Confident90.1Very high26 Ų2623.1 Ų23.127%0.26813%0.132SC..  trans174.8164170.500000114.2A405 S411 S412 G413A405-G409 PolarHBondContact O-N 3.47Å; A405-G409 VanDerWaalsContact O-O 3.07Å; G409-S411 PolarHBondContact O-N 3.48Å; G409-S412 PolarHBondContact O-N 3.27Å; G409-G413 PolarHBondContact O-N 3.41Å
410F84.2Confident90Very high92 Ų9223.1 Ų23.140%0.40413%0.131SC..Hα-helixtrans-61.5-39.8179.7-179.2-99.5000113.6F406 L414F406-F410 HydrophobicContact CE1-CD2 4Å; F406-F410 HydrophobicContact CE1-CE2 4.33Å; F410-L414 HydrophobicContact CE1-CD2 4.19Å; F410-L414 HydrophobicContact CZ-CD2 4.49Å; F410-L414 VanDerWaalsContact O-CB 3.31Å; F410-L414 WeakPolarHBondContact O-CB 3.3Å; F410-L414 PolarHBondContact O-N 3.24Å
411S82.3Confident89.8Confident35 Ų3526 Ų2625%0.24514%0.143CC..Hα-helixtrans-64.9-49.5179.4-159.30000111.7G409 G413 L414 S415 E530G409-S411 PolarHBondContact O-N 3.48Å; S411-G413 PolarHBondContact O-N 3.35Å; S411-L414 PolarHBondContact O-N 3.19Å; S411-S415 WeakPolarHBondContact O-CB 3.29Å; S411-S415 PolarHBondContact O-N 2.94Å; S411-E530 PolarHBondContact OG-O 2.97Å
412S84.8Confident89.6Confident9 Ų927.2 Ų27.26%0.06315%0.151CC..Hα-helixtrans-62.1-43.3177.9-178.40000111.4H268 G409 L414 S415 T416H268-S412 PolarHBondContact NE2-OG 3.03Å; G409-S412 PolarHBondContact O-N 3.27Å; S412-L414 PolarHBondContact O-N 3.11Å; S412-S415 PolarHBondContact O-N 3.41Å; S412-T416 VanDerWaalsContact O-CB 3.29Å; S412-T416 WeakPolarHBondContact O-CB 3.46Å; S412-T416 PolarHBondContact O-N 2.99Å; S412-T416 PolarHBondContact O-OG1 3.28Å
413G90Very high89.5Confident0 Ų027.3 Ų27.30%015%0.152CC..Hα-helixtrans-61-42173.800000113.9F406 G409 S411 T417F406-G413 WeakPolarHBondContact CE2-O 3.44Å; F406-G413 WeakPolarHBondContact CZ-O 3.41Å; G409-G413 PolarHBondContact O-N 3.41Å; S411-G413 PolarHBondContact O-N 3.35Å; G413-T417 WeakPolarHBondContact O-CB 3.44Å; G413-T417 PolarHBondContact O-N 3.5Å; G413-T417 PolarHBondContact O-OG1 3.5Å
414L89.7Confident89.3Confident52 Ų5227.5 Ų27.527%0.27215%0.152SC..Hα-helixtrans-68-45.2176.9-178.863000111.8F410 S411 S412 T417 L418 L533F410-L414 HydrophobicContact CE1-CD2 4.19Å; F410-L414 HydrophobicContact CZ-CD2 4.49Å; F410-L414 VanDerWaalsContact O-CB 3.31Å; F410-L414 WeakPolarHBondContact O-CB 3.3Å; F410-L414 PolarHBondContact O-N 3.24Å; S411-L414 PolarHBondContact O-N 3.19Å; S412-L414 PolarHBondContact O-N 3.11Å; L414-T417 PolarHBondContact O-N 3.25Å; L414-L418 HydrophobicContact CG-CD1 4.28Å; L414-L418 WeakPolarHBondContact O-CG 3.49Å; L414-L418 PolarHBondContact O-N 2.87Å; L414-L533 HydrophobicContact CD2-CD2 4.44Å
415S89.4Confident89.1Confident0 Ų030 Ų300%017%0.165CC..Hα-helixtrans-56.7-50175.5-172.40000110.7H264 S411 S412 T417 L418 A419 E530H264-S415 PolarHBondContact NE2-OG 2.81Å; S411-S415 WeakPolarHBondContact O-CB 3.29Å; S411-S415 PolarHBondContact O-N 2.94Å; S412-S415 PolarHBondContact O-N 3.41Å; S415-T417 PolarHBondContact O-N 3.45Å; S415-L418 PolarHBondContact O-N 2.66Å; S415-L418 VanDerWaalsContact O-N 3.16Å; S415-A419 WeakPolarHBondContact O-CB 3.43Å; S415-A419 PolarHBondContact O-N 2.9Å; S415-E530 VanDerWaalsContact CB-OE1 3.27Å; S415-E530 WeakPolarHBondContact CB-OE1 3.14Å; S415-E530 PolarHBondContact OG-OE1 3.44Å
416T92.1Very high88.9Confident1 Ų130.2 Ų30.21%0.00617%0.167CC..Hα-helixtrans-60.4-41.8176.1-55.10000112.4H264 A401 I402 A405 S412 L418 A419 V420H264-T416 VanDerWaalsContact CE1-CA 3.49Å; H264-T416 WeakPolarHBondContact CE1-CA 3.35Å; H264-T416 PolarHBondContact CE1-OG1 3.3Å; A401-T416 HydrophobicContact CB-CG2 4.35Å; I402-T416 HydrophobicContact CG1-CG2 3.99Å; A405-T416 HydrophobicContact CB-CG2 4.26Å; A405-T416 WeakPolarHBondContact CB-OG1 3.21Å; S412-T416 VanDerWaalsContact O-CB 3.29Å; S412-T416 WeakPolarHBondContact O-CB 3.46Å; S412-T416 PolarHBondContact O-N 2.99Å; S412-T416 PolarHBondContact O-OG1 3.28Å; T416-L418 VanDerWaalsContact C-N 3.34Å; T416-L418 PolarHBondContact O-N 2.72Å; T416-A419 WeakPolarHBondContact O-CB 3.36Å; T416-A419 PolarHBondContact O-N 3.27Å; T416-V420 WeakPolarHBondContact O-CG2 3.39Å; T416-V420 PolarHBondContact O-N 3.38Å
417T94.6Very high88.8Confident7 Ų729.9 Ų29.94%0.04317%0.166CC..Hα-helixtrans-63.5-41.5176.9-580000111.6A219 L223 F406 G413 L414 S415 F421A219-T417 HydrophobicContact CB-CG2 3.64Å; A219-T417 WeakPolarHBondContact CB-OG1 3.42Å; L223-T417 HydrophobicContact CG-CG2 4.47Å; F406-T417 WeakPolarHBondContact CE2-OG1 3.34Å; G413-T417 WeakPolarHBondContact O-CB 3.44Å; G413-T417 PolarHBondContact O-N 3.5Å; G413-T417 PolarHBondContact O-OG1 3.5Å; L414-T417 PolarHBondContact O-N 3.25Å; S415-T417 PolarHBondContact O-N 3.45Å; T417-F421 WeakPolarHBondContact O-CB 3.41Å; T417-F421 PolarHBondContact O-N 3.25Å
418L92.2Very high88.8Confident67 Ų6727.8 Ų27.835%0.35115%0.151SC..Hα-helixtrans-67.7-40.8177.4-70.3172.1000111.6L414 S415 T416 F421 C422 L533L414-L418 HydrophobicContact CG-CD1 4.28Å; L414-L418 WeakPolarHBondContact O-CG 3.49Å; L414-L418 PolarHBondContact O-N 2.87Å; S415-L418 PolarHBondContact O-N 2.66Å; S415-L418 VanDerWaalsContact O-N 3.16Å; T416-L418 VanDerWaalsContact C-N 3.34Å; T416-L418 PolarHBondContact O-N 2.72Å; L418-F421 PolarHBondContact O-N 2.94Å; L418-C422 PolarHBondContact O-N 3.49Å; L418-C422 VanDerWaalsContact O-N 3.16Å; L418-C422 PolarHBondContact O-SG 3.31Å; L418-L533 HydrophobicContact CD1-CD1 4.37Å; L418-L533 HydrophobicContact CD1-CD2 4.21Å
419A91.7Very high89.1Confident0 Ų022.5 Ų22.50%012%0.123CC..Hα-helixtrans-56.2-52.6174.900000111.5S415 T416 F421 C422 M523S415-A419 WeakPolarHBondContact O-CB 3.43Å; S415-A419 PolarHBondContact O-N 2.9Å; T416-A419 WeakPolarHBondContact O-CB 3.36Å; T416-A419 PolarHBondContact O-N 3.27Å; A419-F421 PolarHBondContact O-N 2.93Å; A419-C422 WeakPolarHBondContact O-CB 3.45Å; A419-C422 PolarHBondContact O-N 2.99Å; A419-M523 HydrophobicContact CB-CE 3.36Å; A419-M523 HydrophobicContact CB-SD 4.3Å
420V94.1Very high89.2Confident1 Ų122.2 Ų22.21%0.00612%0.12CC..Hα-helixtrans-61.8-44.6177.61760000111.4L223 D398 I402 T416 C422 H423 E424L223-V420 HydrophobicContact CD1-CB 4.08Å; L223-V420 HydrophobicContact CD1-CG1 3.64Å; L223-V420 HydrophobicContact CD2-CB 4.24Å; L223-V420 HydrophobicContact CD2-CG1 3.94Å; L223-V420 HydrophobicContact CG-CG1 4.39Å; D398-V420 HydrophobicContact CB-CG1 3.93Å; D398-V420 HydrophobicContact CB-CG2 4.41Å; I402-V420 HydrophobicContact CD1-CG2 4.4Å; T416-V420 WeakPolarHBondContact O-CG2 3.39Å; T416-V420 PolarHBondContact O-N 3.38Å; V420-C422 PolarHBondContact O-N 3.35Å; V420-C422 VanDerWaalsContact O-N 3.1Å; V420-H423 PolarHBondContact O-CD2 3.26Å; V420-H423 PolarHBondContact O-N 3.02Å; V420-E424 WeakPolarHBondContact O-CB 3.47Å; V420-E424 PolarHBondContact O-N 2.91Å
421F92.9Very high89.3Confident83 Ų8318.8 Ų18.836%0.36411%0.105SC..Hα-helixtrans-56.1-34.4178.8-177.2-92.8000112.8L223 P226 T417 L418 A419 H423L223-F421 VanDerWaalsContact CD2-CA 3.42Å; L223-F421 HydrophobicContact CD2-CB 3.58Å; L223-F421 HydrophobicContact CD2-CD2 4.06Å; L223-F421 HydrophobicContact CD2-CG 4.33Å; P226-F421 HydrophobicContact CG-CD2 4.05Å; P226-F421 HydrophobicContact CG-CE2 3.79Å; T417-F421 WeakPolarHBondContact O-CB 3.41Å; T417-F421 PolarHBondContact O-N 3.25Å; L418-F421 PolarHBondContact O-N 2.94Å; A419-F421 PolarHBondContact O-N 2.93Å; F421-H423 VanDerWaalsContact C-N 3.31Å; F421-H423 PolarHBondContact O-N 3.3Å
422C90.6Very high89.6Confident25 Ų2517.4 Ų17.417%0.16910%0.095CC..Hα-helixtrans-69-26.9-179.3-68.30000113.4T256 L418 A419 V420 P426 L522 M523T256-C422 HydrophobicContact CG2-CB 4.11Å; L418-C422 PolarHBondContact O-N 3.49Å; L418-C422 VanDerWaalsContact O-N 3.16Å; L418-C422 PolarHBondContact O-SG 3.31Å; A419-C422 WeakPolarHBondContact O-CB 3.45Å; A419-C422 PolarHBondContact O-N 2.99Å; V420-C422 PolarHBondContact O-N 3.35Å; V420-C422 VanDerWaalsContact O-N 3.1Å; C422-P426 WeakPolarHBondContact O-CD 3.35Å; C422-L522 HydrophobicContact CB-CD2 3.77Å; C422-L522 HydrophobicContact CB-CG 4.47Å; C422-L522 WeakPolarHBondContact SG-CD2 3.41Å; C422-M523 HydrophobicContact CB-SD 4.49Å
423H91.9Very high89.6Confident3 Ų317.3 Ų17.31%0.01410%0.095CC..Hα-helixtrans-100.5-18175.662.1-130.2000114.5T256 L257 D260 V420 F421 P426 H427 F485T256-H423 WeakPolarHBondContact OG1-CA 3.42Å; T256-H423 WeakPolarHBondContact OG1-CB 3.5Å; L257-H423 HydrophobicContact CD2-CB 4.1Å; L257-H423 HydrophobicContact CG-CB 3.86Å; D260-H423 IonicContact OD2-CE1 3.91Å; D260-H423 PolarHBondContact OD2-CE1 3.48Å; D260-H423 IonicContact OD2-ND1 3.64Å; V420-H423 PolarHBondContact O-CD2 3.26Å; V420-H423 PolarHBondContact O-N 3.02Å; F421-H423 VanDerWaalsContact C-N 3.31Å; F421-H423 PolarHBondContact O-N 3.3Å; H423-P426 WeakPolarHBondContact O-CD 3.5Å; H423-H427 WeakPolarHBondContact O-CB 3.25Å; H423-H427 PolarHBondContact O-N 2.94Å; H423-H427 VanDerWaalsContact O-N 3.14Å; H423-F485 AromaticContact CE1-CE2 3.7Å; H423-F485 AromaticContact CE1-CZ 3.97Å
424E91.1Very high89.2Confident3 Ų322.2 Ų22.21%0.01412%0.119CC..Hα-helixtrans-70.7-46.9-176.3-167.359.7-164.700113P226 H394 N395 V420 H427 E428P226-E424 HydrophobicContact CB-CG 4.19Å; P226-E424 HydrophobicContact CG-CB 4.43Å; P226-E424 HydrophobicContact CG-CG 4.27Å; H394-E424 IonicContact NE2-OE1 2.88Å; H394-E424 IonicContact NE2-OE2 3.19Å; N395-E424 PolarHBondContact OD1-OE1 3.38Å; V420-E424 WeakPolarHBondContact O-CB 3.47Å; V420-E424 PolarHBondContact O-N 2.91Å; E424-H427 PolarHBondContact O-N 3.2Å; E424-E428 HydrophobicContact CG-CG 4.23Å; E424-E428 VanDerWaalsContact O-CB 3.28Å; E424-E428 WeakPolarHBondContact O-CB 3.46Å; E424-E428 WeakPolarHBondContact O-CG 3.26Å; E424-E428 PolarHBondContact O-N 2.95Å; E424-E428 WeakPolarHBondContact OE1-CG 3.44Å
425L86.6Confident89Confident52 Ų5220.3 Ų20.327%0.27211%0.109SC..Hα-helixtrans-60.8-48.5179.5-179.974.4000112.9P226 L229 S230 H427 L429P226-L425 HydrophobicContact CB-CB 4.04Å; P226-L425 HydrophobicContact CB-CD1 3.99Å; P226-L425 HydrophobicContact CG-CB 4.49Å; L229-L425 HydrophobicContact CB-CD1 4.43Å; L229-L425 HydrophobicContact CD2-CD1 3.97Å; L229-L425 HydrophobicContact CG-CD1 4.21Å; S230-L425 WeakPolarHBondContact OG-CD1 3.34Å; S230-L425 PolarHBondContact OG-O 3.07Å; L425-H427 VanDerWaalsContact C-N 3.35Å; L425-L429 PolarHBondContact O-N 2.72Å
426P87.5Confident88.7Confident5 Ų522.8 Ų22.83%0.03212%0.122CC..Hα-helixtrans-68.5-33179.2-1530.2000112.9L249 L252 A253 C422 H423 G430L249-P426 HydrophobicContact CB-CB 3.93Å; L249-P426 HydrophobicContact CD2-CB 4.01Å; L249-P426 HydrophobicContact CD2-CG 4.2Å; L249-P426 WeakPolarHBondContact O-CB 3.43Å; L252-P426 HydrophobicContact CD2-CG 3.83Å; L252-P426 HydrophobicContact CG-CG 4.29Å; A253-P426 HydrophobicContact CB-CB 3.96Å; C422-P426 WeakPolarHBondContact O-CD 3.35Å; H423-P426 WeakPolarHBondContact O-CD 3.5Å; P426-G430 PolarHBondContact O-N 3.25Å
427H87.9Confident88.2Confident10 Ų1030 Ų305%0.04616%0.156CC..Hα-helixtrans-66.3-55.1176.6-173.9-87.2000111.9A253 H394 H423 E424 L425 L429 G430 D431 M493A253-H427 HydrophobicContact CB-CB 4.49Å; H394-H427 AromaticContact CE1-CE1 3.22Å; H394-H427 PolarHBondContact CE1-CE1 3.46Å; H394-H427 AromaticContact CE1-ND1 3.35Å; H394-H427 PolarHBondContact CE1-ND1 3.19Å; H394-H427 VanDerWaalsContact CE1-ND1 3.35Å; H394-H427 AromaticContact ND1-CE1 3.34Å; H394-H427 PolarHBondContact ND1-CE1 2.83Å; H394-H427 VanDerWaalsContact ND1-CE1 3.34Å; H394-H427 AromaticContact ND1-ND1 3.88Å; H423-H427 WeakPolarHBondContact O-CB 3.25Å; H423-H427 PolarHBondContact O-N 2.94Å; H423-H427 VanDerWaalsContact O-N 3.14Å; E424-H427 PolarHBondContact O-N 3.2Å; L425-H427 VanDerWaalsContact C-N 3.35Å; H427-L429 VanDerWaalsContact C-N 3.26Å; H427-L429 PolarHBondContact O-N 3.14Å; H427-G430 WeakPolarHBondContact O-CA 3.4Å; H427-G430 PolarHBondContact O-N 2.88Å; H427-D431 IonicContact CE1-OD2 3.98Å; H427-D431 PolarHBondContact CE1-OD2 3.47Å; H427-D431 IonicContact ND1-OD2 3.14Å; H427-D431 PolarHBondContact O-N 3.43Å; H427-D431 VanDerWaalsContact O-N 3.11Å; H427-M493 VanDerWaalsContact CD2-CE 3.45Å; H427-M493 WeakPolarHBondContact CD2-CE 3.31Å
428E88.4Confident87.6Confident1 Ų132.3 Ų32.31%0.00517%0.172CC..Hα-helixtrans-56.9-37.3179.8-79.7-84-140.800112.9S227 E424 G430 D431 F432S227-E428 VanDerWaalsContact CB-OE1 3.23Å; S227-E428 WeakPolarHBondContact CB-OE1 3.4Å; S227-E428 PolarHBondContact OG-OE1 3.16Å; E424-E428 HydrophobicContact CG-CG 4.23Å; E424-E428 VanDerWaalsContact O-CB 3.28Å; E424-E428 WeakPolarHBondContact O-CB 3.46Å; E424-E428 WeakPolarHBondContact O-CG 3.26Å; E424-E428 PolarHBondContact O-N 2.95Å; E424-E428 WeakPolarHBondContact OE1-CG 3.44Å; E428-G430 VanDerWaalsContact C-N 3.32Å; E428-G430 PolarHBondContact O-N 2.94Å; E428-D431 PolarHBondContact O-N 3.3Å; E428-F432 HydrophobicContact CB-CE2 4.27Å; E428-F432 WeakPolarHBondContact O-CD2 3.4Å; E428-F432 WeakPolarHBondContact O-CG 3.32Å; E428-F432 PolarHBondContact O-N 2.97Å; E428-F432 WeakPolarHBondContact OE2-CE2 3.28Å; E428-F432 WeakPolarHBondContact OE2-CZ 3.5Å
429L87.8Confident87.1Confident1 Ų132.2 Ų32.21%0.00519%0.188CC..Hα-helixtrans-63-40.6175.8-165.785.3000111.9S230 L233 L234 L246 L249 L425 H427 A433S230-L429 WeakPolarHBondContact O-CD1 3.28Å; L233-L429 HydrophobicContact CB-CD1 4.18Å; L233-L429 HydrophobicContact CD2-CD1 3.9Å; L233-L429 HydrophobicContact CD2-CD2 4.35Å; L233-L429 HydrophobicContact CG-CD1 4.45Å; L234-L429 HydrophobicContact CD1-CD1 4.25Å; L234-L429 HydrophobicContact CD2-CD1 4.29Å; L234-L429 HydrophobicContact CG-CD1 3.79Å; L234-L429 HydrophobicContact CG-CG 4.46Å; L246-L429 HydrophobicContact CD2-CD2 3.59Å; L246-L429 HydrophobicContact CD2-CG 3.81Å; L246-L429 HydrophobicContact CG-CD2 4.49Å; L249-L429 HydrophobicContact CD1-CD2 3.22Å; L249-L429 HydrophobicContact CG-CD2 4.5Å; L425-L429 PolarHBondContact O-N 2.72Å; H427-L429 VanDerWaalsContact C-N 3.26Å; H427-L429 PolarHBondContact O-N 3.14Å; L429-A433 VanDerWaalsContact O-CB 3.27Å; L429-A433 WeakPolarHBondContact O-CB 3.46Å; L429-A433 PolarHBondContact O-N 3.32Å
430G84.2Confident86.9Confident20 Ų2033.8 Ų33.821%0.20620%0.196CC..Hα-helixtrans-63.2-47.217700000111.9P426 H427 E428 A433 M434P426-G430 PolarHBondContact O-N 3.25Å; H427-G430 WeakPolarHBondContact O-CA 3.4Å; H427-G430 PolarHBondContact O-N 2.88Å; E428-G430 VanDerWaalsContact C-N 3.32Å; E428-G430 PolarHBondContact O-N 2.94Å; G430-A433 PolarHBondContact O-N 3.39Å; G430-M434 PolarHBondContact O-N 3.38Å; G430-M434 VanDerWaalsContact O-N 3.08Å
431D85.8Confident86.6Confident19 Ų1936.5 Ų36.510%0.10222%0.215CC..Hα-helixtrans-65.9-46.5-178.6-77.7-0.9000111.8V387 H427 E428 A433 M434 L435V387-D431 HydrophobicContact CG1-CB 4.14Å; H427-D431 IonicContact CE1-OD2 3.98Å; H427-D431 PolarHBondContact CE1-OD2 3.47Å; H427-D431 IonicContact ND1-OD2 3.14Å; H427-D431 PolarHBondContact O-N 3.43Å; H427-D431 VanDerWaalsContact O-N 3.11Å; E428-D431 PolarHBondContact O-N 3.3Å; D431-A433 VanDerWaalsContact C-N 3.33Å; D431-A433 PolarHBondContact O-N 3.03Å; D431-M434 PolarHBondContact O-N 3.1Å; D431-L435 WeakPolarHBondContact O-CB 3.2Å; D431-L435 WeakPolarHBondContact O-CG 3.35Å; D431-L435 PolarHBondContact O-N 3.24Å
432F88.6Confident86.4Confident6 Ų635.9 Ų35.93%0.02621%0.212CC..Hα-helixtrans-65.4-35.3175.5-66.8-38.4000113.3S227 L231 L234 E428 M434 L435 L436 L445S227-F432 VanDerWaalsContact O-CE2 3.31Å; S227-F432 WeakPolarHBondContact O-CE2 3.5Å; L231-F432 HydrophobicContact CD1-CD2 4.49Å; L231-F432 HydrophobicContact CD1-CE2 4.24Å; L231-F432 HydrophobicContact CD1-CZ 4.31Å; L231-F432 HydrophobicContact CD2-CB 3.83Å; L231-F432 HydrophobicContact CD2-CD1 3.99Å; L231-F432 HydrophobicContact CD2-CD2 3.7Å; L231-F432 HydrophobicContact CD2-CE2 4.25Å; L231-F432 HydrophobicContact CD2-CG 3.55Å; L231-F432 HydrophobicContact CG-CD1 4.44Å; L231-F432 HydrophobicContact CG-CD2 3.59Å; L231-F432 HydrophobicContact CG-CE2 3.74Å; L231-F432 HydrophobicContact CG-CG 3.98Å; L231-F432 HydrophobicContact CG-CZ 4.25Å; L234-F432 HydrophobicContact CD1-CB 3.54Å; E428-F432 HydrophobicContact CB-CE2 4.27Å; E428-F432 WeakPolarHBondContact O-CD2 3.4Å; E428-F432 WeakPolarHBondContact O-CG 3.32Å; E428-F432 PolarHBondContact O-N 2.97Å; E428-F432 WeakPolarHBondContact OE2-CE2 3.28Å; E428-F432 WeakPolarHBondContact OE2-CZ 3.5Å; F432-M434 VanDerWaalsContact C-N 3.27Å; F432-M434 PolarHBondContact O-N 3.32Å; F432-L435 HydrophobicContact CD1-CD1 4.45Å; F432-L435 PolarHBondContact O-N 3.29Å; F432-L436 VanDerWaalsContact O-CB 3.27Å; F432-L436 WeakPolarHBondContact O-CB 3.45Å; F432-L436 VanDerWaalsContact O-CG 3.26Å; F432-L436 WeakPolarHBondContact O-CG 3.34Å; F432-L436 PolarHBondContact O-N 2.93Å; F432-L445 HydrophobicContact CD1-CB 4.08Å; F432-L445 HydrophobicContact CD1-CD1 4.26Å; F432-L445 HydrophobicContact CD1-CD2 4.29Å; F432-L445 HydrophobicContact CD1-CG 4.44Å; F432-L445 HydrophobicContact CE1-CB 4.08Å
433A84.9Confident86.4Confident8 Ų844.4 Ų44.47%0.06624%0.24CC..Hα-helixtrans-61.3-39.3174.800000111.4L234 L246 L429 G430 D431 Q437L234-A433 HydrophobicContact CD2-CB 4.08Å; L246-A433 HydrophobicContact CD1-CB 3.72Å; L246-A433 HydrophobicContact CD2-CB 3.77Å; L246-A433 HydrophobicContact CG-CB 4.44Å; L429-A433 VanDerWaalsContact O-CB 3.27Å; L429-A433 WeakPolarHBondContact O-CB 3.46Å; L429-A433 PolarHBondContact O-N 3.32Å; G430-A433 PolarHBondContact O-N 3.39Å; D431-A433 VanDerWaalsContact C-N 3.33Å; D431-A433 PolarHBondContact O-N 3.03Å; A433-Q437 VanDerWaalsContact O-CG 3.3Å; A433-Q437 WeakPolarHBondContact O-CG 3.41Å; A433-Q437 PolarHBondContact O-N 3.49Å; A433-Q437 PolarHBondContact O-NE2 3.24Å
434M82Confident86.3Confident103 Ų10351.7 Ų51.751%0.50727%0.268SS..Hα-helixtrans-71.1-46.7175.3-78.9-64.7-6300112.4G430 D431 F432 L436 Q437 S438G430-M434 PolarHBondContact O-N 3.38Å; G430-M434 VanDerWaalsContact O-N 3.08Å; D431-M434 PolarHBondContact O-N 3.1Å; F432-M434 VanDerWaalsContact C-N 3.27Å; F432-M434 PolarHBondContact O-N 3.32Å; M434-L436 PolarHBondContact O-N 3.05Å; M434-Q437 WeakPolarHBondContact O-CB 3.34Å; M434-Q437 PolarHBondContact O-N 3.45Å; M434-S438 PolarHBondContact O-N 2.94Å; M434-S438 VanDerWaalsContact O-N 3.16Å
435L84.1Confident86.2Confident11 Ų1151.6 Ų51.66%0.05827%0.267CS..Hα-helixtrans-68.8-35-176.8-66.1169.8000112.5T384 V387 D431 F432 Q437 S438 G439 L440 L445T384-L435 HydrophobicContact CG2-CD2 3.66Å; V387-L435 HydrophobicContact CB-CD2 4.36Å; V387-L435 HydrophobicContact CG1-CD1 4.33Å; V387-L435 HydrophobicContact CG1-CD2 4.22Å; V387-L435 HydrophobicContact CG1-CG 4.26Å; D431-L435 WeakPolarHBondContact O-CB 3.2Å; D431-L435 WeakPolarHBondContact O-CG 3.35Å; D431-L435 PolarHBondContact O-N 3.24Å; F432-L435 HydrophobicContact CD1-CD1 4.45Å; F432-L435 PolarHBondContact O-N 3.29Å; L435-Q437 VanDerWaalsContact C-N 3.33Å; L435-Q437 PolarHBondContact O-N 3.03Å; L435-S438 WeakPolarHBondContact O-CB 3.42Å; L435-S438 PolarHBondContact O-N 3.49Å; L435-S438 PolarHBondContact O-OG 2.85Å; L435-G439 PolarHBondContact O-N 3.49Å; L435-L440 HydrophobicContact CB-CD1 4.02Å; L435-L440 HydrophobicContact CD2-CD1 3.9Å; L435-L440 HydrophobicContact CG-CD1 4.47Å; L435-L440 PolarHBondContact O-N 2.8Å; L435-L445 HydrophobicContact CB-CD1 4.49Å; L435-L445 HydrophobicContact CB-CD2 3.52Å; L435-L445 HydrophobicContact CD1-CD2 3.78Å; L435-L445 HydrophobicContact CG-CD2 4.25Å
436L84.3Confident86.4Confident52 Ų5251.9 Ų51.927%0.27227%0.269SS..Hα-helixtrans-63.8-37.9171.8-76.6171.5000112L234 F432 M434 S438 G439 L445L234-L436 HydrophobicContact CD1-CD1 4.09Å; F432-L436 VanDerWaalsContact O-CB 3.27Å; F432-L436 WeakPolarHBondContact O-CB 3.45Å; F432-L436 VanDerWaalsContact O-CG 3.26Å; F432-L436 WeakPolarHBondContact O-CG 3.34Å; F432-L436 PolarHBondContact O-N 2.93Å; M434-L436 PolarHBondContact O-N 3.05Å; L436-S438 PolarHBondContact O-N 3.46Å; L436-G439 PolarHBondContact O-N 2.86Å; L436-L445 HydrophobicContact CD2-CD1 3.46Å; L436-L445 VanDerWaalsContact CD2-CD1 3.46Å; L436-L445 HydrophobicContact CG-CD1 3.56Å
437Q80.9Confident86.6Confident154 Ų15457 Ų5772%0.7230%0.295SS*.Hα-helixtrans-65.8-28.1174.9-73.1173.465.200112.2A433 M434 L435 G439A433-Q437 VanDerWaalsContact O-CG 3.3Å; A433-Q437 WeakPolarHBondContact O-CG 3.41Å; A433-Q437 PolarHBondContact O-N 3.49Å; A433-Q437 PolarHBondContact O-NE2 3.24Å; M434-Q437 WeakPolarHBondContact O-CB 3.34Å; M434-Q437 PolarHBondContact O-N 3.45Å; L435-Q437 VanDerWaalsContact C-N 3.33Å; L435-Q437 PolarHBondContact O-N 3.03Å; Q437-G439 PolarHBondContact O-N 3.44Å
438S81.2Confident86.7Confident55 Ų5558.8 Ų58.839%0.38531%0.305SS..THydrogen-bonded Turntrans-73.8-6172.380.30000114.2T384 M434 L435 L436T384-S438 VanDerWaalsContact OG1-CB 3.29Å; T384-S438 WeakPolarHBondContact OG1-CB 3.3Å; T384-S438 PolarHBondContact OG1-OG 3.38Å; M434-S438 PolarHBondContact O-N 2.94Å; M434-S438 VanDerWaalsContact O-N 3.16Å; L435-S438 WeakPolarHBondContact O-CB 3.42Å; L435-S438 PolarHBondContact O-N 3.49Å; L435-S438 PolarHBondContact O-OG 2.85Å; L436-S438 PolarHBondContact O-N 3.46Å
439G83.1Confident86.7Confident65 Ų6559.1 Ų59.167%0.6731%0.308SS*.THydrogen-bonded Turntrans91.311.8176.200000115.1L435 L436 Q437L435-G439 PolarHBondContact O-N 3.49Å; L436-G439 PolarHBondContact O-N 2.86Å; Q437-G439 PolarHBondContact O-N 3.44Å
440L86.3Confident86.9Confident33 Ų3364.2 Ų64.217%0.17333%0.334CS..  trans-66.8137.8172.4-79.5163.7000110.9T384 L435 R444 L445T384-L440 HydrophobicContact CG2-CD1 3.39Å; T384-L440 HydrophobicContact CG2-CG 4.31Å; L435-L440 HydrophobicContact CB-CD1 4.02Å; L435-L440 HydrophobicContact CD2-CD1 3.9Å; L435-L440 HydrophobicContact CG-CD1 4.47Å; L435-L440 PolarHBondContact O-N 2.8Å; L440-R444 HydrophobicContact CD2-CB 4.38Å; L440-L445 HydrophobicContact CB-CD1 4.49Å; L440-L445 HydrophobicContact CB-CD2 3.8Å; L440-L445 HydrophobicContact CB-CG 4.08Å; L440-L445 HydrophobicContact CD1-CD2 3.78Å; L440-L445 HydrophobicContact CG-CD2 4.4Å
441S89.3Confident87.3Confident57 Ų5767.6 Ų67.640%0.39935%0.351SS..  trans-77.3148.3177.366.30000111R443 R444 L445S441-R443 PolarHBondContact O-N 2.91Å; S441-R443 VanDerWaalsContact O-N 3.16Å; S441-R444 WeakPolarHBondContact O-CA 3.42Å; S441-R444 WeakPolarHBondContact O-CB 3.36Å; S441-R444 PolarHBondContact O-N 3.24Å; S441-R444 WeakPolarHBondContact OG-CG 3.33Å; S441-L445 PolarHBondContact O-N 2.98Å; S441-L445 VanDerWaalsContact O-N 3.1Å
442F88Confident87.7Confident70 Ų7066.9 Ų66.931%0.30735%0.347SS..Hα-helixtrans-48.9-44.3179.2-176.5-82.9000113.4L231 R444 L445 L446L231-F442 HydrophobicContact CB-CD2 4.38Å; L231-F442 HydrophobicContact CB-CE2 3.57Å; L231-F442 HydrophobicContact CB-CZ 3.92Å; L231-F442 HydrophobicContact CD1-CE2 4.17Å; L231-F442 HydrophobicContact CD1-CZ 4.17Å; L231-F442 HydrophobicContact CD2-CD2 4.27Å; L231-F442 HydrophobicContact CD2-CE2 4.28Å; L231-F442 HydrophobicContact CG-CE2 4.23Å; F442-R444 VanDerWaalsContact C-N 3.3Å; F442-R444 PolarHBondContact O-N 3.31Å; F442-L445 PolarHBondContact O-N 3.15Å; F442-L446 PolarHBondContact O-N 3.42Å
443R90.3Very high87.9Confident204 Ų20467 Ų6777%0.7735%0.35SS*.Hα-helixtrans-63.9-35.6179.7-64.4-176.3-176.1178.10.6112.3S441 L447S441-R443 PolarHBondContact O-N 2.91Å; S441-R443 VanDerWaalsContact O-N 3.16Å; R443-L447 WeakPolarHBondContact O-CB 3.49Å; R443-L447 VanDerWaalsContact O-CG 3.26Å; R443-L447 WeakPolarHBondContact O-CG 3.49Å; R443-L447 PolarHBondContact O-N 2.99Å; R443-L447 VanDerWaalsContact O-N 3.09Å
444R90.8Very high88.3Confident156 Ų15669.2 Ų69.259%0.58937%0.369SS*.Hα-helixtrans-69.2-44176.7-71.2177-177.3178.31.4110.5L440 S441 F442 L446 L447 L448L440-R444 HydrophobicContact CD2-CB 4.38Å; S441-R444 WeakPolarHBondContact O-CA 3.42Å; S441-R444 WeakPolarHBondContact O-CB 3.36Å; S441-R444 PolarHBondContact O-N 3.24Å; S441-R444 WeakPolarHBondContact OG-CG 3.33Å; F442-R444 VanDerWaalsContact C-N 3.3Å; F442-R444 PolarHBondContact O-N 3.31Å; R444-L446 VanDerWaalsContact C-N 3.35Å; R444-L446 PolarHBondContact O-N 3.18Å; R444-L447 PolarHBondContact O-N 2.66Å; R444-L448 WeakPolarHBondContact O-CB 3.43Å; R444-L448 WeakPolarHBondContact O-CG 3.32Å; R444-L448 PolarHBondContact O-N 3.36Å
445L88.9Confident89Confident1 Ų168.1 Ų68.11%0.00536%0.364CS..Hα-helixtrans-59.8-45.2177-63.9175.6000112L231 F432 L435 L436 L440 S441 F442 L447 L448 S449L231-L445 HydrophobicContact CD1-CB 4.46Å; L231-L445 HydrophobicContact CD2-CB 4.39Å; L231-L445 HydrophobicContact CD2-CD1 4.2Å; F432-L445 HydrophobicContact CD1-CB 4.08Å; F432-L445 HydrophobicContact CD1-CD1 4.26Å; F432-L445 HydrophobicContact CD1-CD2 4.29Å; F432-L445 HydrophobicContact CD1-CG 4.44Å; F432-L445 HydrophobicContact CE1-CB 4.08Å; L435-L445 HydrophobicContact CB-CD1 4.49Å; L435-L445 HydrophobicContact CB-CD2 3.52Å; L435-L445 HydrophobicContact CD1-CD2 3.78Å; L435-L445 HydrophobicContact CG-CD2 4.25Å; L436-L445 HydrophobicContact CD2-CD1 3.46Å; L436-L445 VanDerWaalsContact CD2-CD1 3.46Å; L436-L445 HydrophobicContact CG-CD1 3.56Å; L440-L445 HydrophobicContact CB-CD1 4.49Å; L440-L445 HydrophobicContact CB-CD2 3.8Å; L440-L445 HydrophobicContact CB-CG 4.08Å; L440-L445 HydrophobicContact CD1-CD2 3.78Å; L440-L445 HydrophobicContact CG-CD2 4.4Å; S441-L445 PolarHBondContact O-N 2.98Å; S441-L445 VanDerWaalsContact O-N 3.1Å; F442-L445 PolarHBondContact O-N 3.15Å; L445-L447 PolarHBondContact O-N 3.49Å; L445-L448 PolarHBondContact O-N 2.56Å; L445-S449 WeakPolarHBondContact O-CB 3.43Å; L445-S449 PolarHBondContact O-N 3.2Å
446L89.7Confident89.6Confident59 Ų5967.7 Ų67.731%0.30936%0.362SS..Hα-helixtrans-61.7-43176.1-174.566000112.3P228 L231 F442 R444 L448 S449 L450P228-L446 HydrophobicContact CB-CD1 4.22Å; L231-L446 HydrophobicContact CD1-CB 4.28Å; L231-L446 HydrophobicContact CD1-CD1 4.37Å; F442-L446 PolarHBondContact O-N 3.42Å; R444-L446 VanDerWaalsContact C-N 3.35Å; R444-L446 PolarHBondContact O-N 3.18Å; L446-L448 VanDerWaalsContact C-N 3.32Å; L446-L448 PolarHBondContact O-N 2.96Å; L446-S449 PolarHBondContact O-N 3.33Å; L446-L450 WeakPolarHBondContact O-CG 3.32Å; L446-L450 PolarHBondContact O-N 3.22Å
447L91.8Very high90.2Very high112 Ų11268.6 Ų68.659%0.58637%0.367SS*.Hα-helixtrans-63.9-38.2176.2-74.8169.5000112.4R443 R444 L445 L450 V451R443-L447 WeakPolarHBondContact O-CB 3.49Å; R443-L447 VanDerWaalsContact O-CG 3.26Å; R443-L447 WeakPolarHBondContact O-CG 3.49Å; R443-L447 PolarHBondContact O-N 2.99Å; R443-L447 VanDerWaalsContact O-N 3.09Å; R444-L447 PolarHBondContact O-N 2.66Å; L445-L447 PolarHBondContact O-N 3.49Å; L447-L450 PolarHBondContact O-N 2.86Å; L447-V451 WeakPolarHBondContact O-CG2 3.27Å; L447-V451 PolarHBondContact O-N 2.99Å; L447-V451 VanDerWaalsContact O-N 3.12Å
448L90.3Very high91Very high47 Ų4763.1 Ų63.125%0.24635%0.352CS..Hα-helixtrans-68.7-42.3179.2-75.9174.7000111.8L388 R444 L445 L446 L450 V451 S452L388-L448 HydrophobicContact CD1-CB 3.68Å; L388-L448 HydrophobicContact CD1-CD1 3.99Å; L388-L448 HydrophobicContact CD1-CD2 4.01Å; L388-L448 HydrophobicContact CD1-CG 4.08Å; L388-L448 HydrophobicContact CD2-CD1 3.79Å; L388-L448 HydrophobicContact CD2-CD2 3.58Å; L388-L448 HydrophobicContact CD2-CG 4.18Å; L388-L448 HydrophobicContact CG-CD2 4.39Å; R444-L448 WeakPolarHBondContact O-CB 3.43Å; R444-L448 WeakPolarHBondContact O-CG 3.32Å; R444-L448 PolarHBondContact O-N 3.36Å; L445-L448 PolarHBondContact O-N 2.56Å; L446-L448 VanDerWaalsContact C-N 3.32Å; L446-L448 PolarHBondContact O-N 2.96Å; L448-L450 VanDerWaalsContact C-N 3.32Å; L448-L450 PolarHBondContact O-N 2.92Å; L448-V451 WeakPolarHBondContact O-CB 3.4Å; L448-V451 PolarHBondContact O-N 3.28Å; L448-V451 VanDerWaalsContact O-N 3.11Å; L448-S452 PolarHBondContact O-N 3.35Å
449S89.6Confident91.7Very high9 Ų960.5 Ų60.56%0.06333%0.334CS..Hα-helixtrans-62.4-37.4172.3162.50000112.2S227 L445 L446 V451 S452 G453S227-S449 WeakPolarHBondContact CB-OG 3.2Å; S227-S449 PolarHBondContact OG-OG 2.88Å; S227-S449 VanDerWaalsContact OG-OG 3.1Å; L445-S449 WeakPolarHBondContact O-CB 3.43Å; L445-S449 PolarHBondContact O-N 3.2Å; L446-S449 PolarHBondContact O-N 3.33Å; S449-V451 VanDerWaalsContact C-N 3.31Å; S449-V451 PolarHBondContact O-N 3.3Å; S449-S452 WeakPolarHBondContact O-CA 3.29Å; S449-S452 VanDerWaalsContact O-CB 3.3Å; S449-S452 WeakPolarHBondContact O-CB 3.12Å; S449-S452 PolarHBondContact O-N 2.92Å; S449-S452 VanDerWaalsContact O-N 3.15Å; S449-G453 PolarHBondContact O-N 3.28Å
450L91.3Very high92.4Very high107 Ų10757.6 Ų57.656%0.5630%0.303SS*.Hα-helixtrans-63.1-36.3172-72.8170.4000113L446 L447 L448 A454L446-L450 WeakPolarHBondContact O-CG 3.32Å; L446-L450 PolarHBondContact O-N 3.22Å; L447-L450 PolarHBondContact O-N 2.86Å; L448-L450 VanDerWaalsContact C-N 3.32Å; L448-L450 PolarHBondContact O-N 2.92Å; L450-A454 WeakPolarHBondContact O-CB 3.49Å; L450-A454 PolarHBondContact O-N 3.43Å
451V92.9Very high92.8Very high91 Ų9160.4 Ų60.455%0.55232%0.322SS*.Hα-helixtrans-66.9-41.1173.6172.30000110.3L447 L448 S449 A454 L455L447-V451 WeakPolarHBondContact O-CG2 3.27Å; L447-V451 PolarHBondContact O-N 2.99Å; L447-V451 VanDerWaalsContact O-N 3.12Å; L448-V451 WeakPolarHBondContact O-CB 3.4Å; L448-V451 PolarHBondContact O-N 3.28Å; L448-V451 VanDerWaalsContact O-N 3.11Å; S449-V451 VanDerWaalsContact C-N 3.31Å; S449-V451 PolarHBondContact O-N 3.3Å; V451-A454 WeakPolarHBondContact O-CB 3.34Å; V451-A454 PolarHBondContact O-N 3.24Å; V451-L455 PolarHBondContact O-N 2.89Å; V451-L455 VanDerWaalsContact O-N 3.08Å
452S92.7Very high93Very high4 Ų462.1 Ų62.13%0.02833%0.326CS..Hα-helixtrans-59.7-49.5175.2-150.10000111.9D391 G392 N395 L448 S449 A454 L455 G456D391-S452 PolarHBondContact O-OG 2.83Å; D391-S452 WeakPolarHBondContact OD2-CB 3.32Å; D391-S452 PolarHBondContact OD2-OG 3.12Å; G392-S452 VanDerWaalsContact CA-OG 3.29Å; G392-S452 WeakPolarHBondContact CA-OG 3.42Å; G392-S452 PolarHBondContact N-OG 3.28Å; N395-S452 WeakPolarHBondContact ND2-CB 3.36Å; N395-S452 PolarHBondContact ND2-OG 3.1Å; L448-S452 PolarHBondContact O-N 3.35Å; S449-S452 WeakPolarHBondContact O-CA 3.29Å; S449-S452 VanDerWaalsContact O-CB 3.3Å; S449-S452 WeakPolarHBondContact O-CB 3.12Å; S449-S452 PolarHBondContact O-N 2.92Å; S449-S452 VanDerWaalsContact O-N 3.15Å; S452-A454 VanDerWaalsContact C-N 3.28Å; S452-A454 PolarHBondContact O-N 3.4Å; S452-L455 WeakPolarHBondContact O-CA 3.42Å; S452-L455 VanDerWaalsContact O-CB 3.29Å; S452-L455 WeakPolarHBondContact O-CB 3.18Å; S452-L455 PolarHBondContact O-N 3.16Å; S452-G456 PolarHBondContact O-N 3.25Å
453G92.9Very high93.3Very high8 Ų858.8 Ų58.88%0.08231%0.311CS..Hα-helixtrans-62.5-31.6174.800000113.7S449 L455 G456 L457S449-G453 PolarHBondContact O-N 3.28Å; G453-L455 VanDerWaalsContact C-N 3.34Å; G453-G456 PolarHBondContact O-N 3.12Å; G453-L457 PolarHBondContact O-N 3.12Å
454A95Very high93.3Very high56 Ų5649.2 Ų49.246%0.46328%0.275SS..Hα-helixtrans-67.7-33.217200000112.6L450 V451 S452 G456 L457 G458L450-A454 WeakPolarHBondContact O-CB 3.49Å; L450-A454 PolarHBondContact O-N 3.43Å; V451-A454 WeakPolarHBondContact O-CB 3.34Å; V451-A454 PolarHBondContact O-N 3.24Å; S452-A454 VanDerWaalsContact C-N 3.28Å; S452-A454 PolarHBondContact O-N 3.4Å; A454-G456 VanDerWaalsContact C-N 3.34Å; A454-L457 PolarHBondContact O-N 3.35Å; A454-G458 PolarHBondContact O-N 3.4Å; A454-G458 VanDerWaalsContact O-N 3.08Å
455L95.8Very high93.3Very high79 Ų7943.6 Ų43.641%0.41427%0.266SS..Hα-helixtrans-65.3-39.7170.1-65.5172.2000110.7L396 V451 S452 G453 L457 G458 G459L396-L455 HydrophobicContact CB-CB 4.38Å; L396-L455 VanDerWaalsContact CD1-O 3.31Å; L396-L455 WeakPolarHBondContact CD1-O 3.4Å; V451-L455 PolarHBondContact O-N 2.89Å; V451-L455 VanDerWaalsContact O-N 3.08Å; S452-L455 WeakPolarHBondContact O-CA 3.42Å; S452-L455 VanDerWaalsContact O-CB 3.29Å; S452-L455 WeakPolarHBondContact O-CB 3.18Å; S452-L455 PolarHBondContact O-N 3.16Å; G453-L455 VanDerWaalsContact C-N 3.34Å; L455-L457 VanDerWaalsContact C-N 3.35Å; L455-L457 PolarHBondContact O-N 2.87Å; L455-G458 CarbonylContact O-C 3.54Å; L455-G458 WeakPolarHBondContact O-CA 3.31Å; L455-G458 PolarHBondContact O-N 3.21Å; L455-G458 VanDerWaalsContact O-N 3.09Å; L455-G459 PolarHBondContact O-N 3.02Å
456G96.5Very high93.2Very high2 Ų246.2 Ų46.22%0.02128%0.28CS..Hα-helixtrans-60.5-39.8172.500000113.7N395 G399 S452 G453 A454 G458 G459 A460N395-G456 WeakPolarHBondContact O-CA 3.39Å; G399-G456 WeakPolarHBondContact CA-O 3.25Å; S452-G456 PolarHBondContact O-N 3.25Å; G453-G456 PolarHBondContact O-N 3.12Å; A454-G456 VanDerWaalsContact C-N 3.34Å; G456-G458 VanDerWaalsContact C-N 3.31Å; G456-G458 PolarHBondContact O-N 2.82Å; G456-G459 WeakPolarHBondContact O-CA 3.3Å; G456-G459 PolarHBondContact O-N 3.28Å; G456-G459 VanDerWaalsContact O-N 3.14Å; G456-A460 PolarHBondContact O-N 3.29Å
457L97.1Very high92.9Very high72 Ų7245 Ų4538%0.37728%0.276SS..Hα-helixtrans-61.1-41.4171.6-82.7161.6000111.7A217 V220 G453 A454 L455 G459 A460 V461A217-L457 HydrophobicContact CB-CD2 3.79Å; V220-L457 HydrophobicContact CB-CD2 4.41Å; V220-L457 HydrophobicContact CB-CG 4.45Å; V220-L457 HydrophobicContact CG1-CD2 4.44Å; V220-L457 HydrophobicContact CG1-CG 3.94Å; G453-L457 PolarHBondContact O-N 3.12Å; A454-L457 PolarHBondContact O-N 3.35Å; L455-L457 VanDerWaalsContact C-N 3.35Å; L455-L457 PolarHBondContact O-N 2.87Å; L457-G459 VanDerWaalsContact C-N 3.32Å; L457-A460 PolarHBondContact O-N 3.28Å; L457-V461 WeakPolarHBondContact O-CG2 3.39Å; L457-V461 PolarHBondContact O-N 3.07Å; L457-V461 VanDerWaalsContact O-N 3.08Å
458G97.1Very high92.2Very high39 Ų3945.1 Ų45.140%0.40228%0.277SS..Hα-helixtrans-61.7-40.1173.100000112.6A454 L455 G456 V461 L462A454-G458 PolarHBondContact O-N 3.4Å; A454-G458 VanDerWaalsContact O-N 3.08Å; L455-G458 CarbonylContact O-C 3.54Å; L455-G458 WeakPolarHBondContact O-CA 3.31Å; L455-G458 PolarHBondContact O-N 3.21Å; L455-G458 VanDerWaalsContact O-N 3.09Å; G456-G458 VanDerWaalsContact C-N 3.31Å; G456-G458 PolarHBondContact O-N 2.82Å; G458-V461 PolarHBondContact O-N 2.86Å; G458-L462 WeakPolarHBondContact O-CB 3.16Å; G458-L462 PolarHBondContact O-N 3.17Å
459G96.8Very high91.2Very high0 Ų044.6 Ų44.60%028%0.283CS..Hα-helixtrans-58.9-49.3173.100000111.8L396 L400 L455 G456 L457 V461 L462 G463L396-G459 WeakPolarHBondContact O-CA 3.38Å; L400-G459 VanDerWaalsContact CA-O 3.29Å; L400-G459 WeakPolarHBondContact CA-O 3.28Å; L400-G459 VanDerWaalsContact N-C 3.33Å; L455-G459 PolarHBondContact O-N 3.02Å; G456-G459 WeakPolarHBondContact O-CA 3.3Å; G456-G459 PolarHBondContact O-N 3.28Å; G456-G459 VanDerWaalsContact O-N 3.14Å; L457-G459 VanDerWaalsContact C-N 3.32Å; G459-V461 PolarHBondContact O-N 3.26Å; G459-L462 CarbonylContact O-C 3.52Å; G459-L462 WeakPolarHBondContact O-CA 3.28Å; G459-L462 WeakPolarHBondContact O-CB 3.5Å; G459-L462 PolarHBondContact O-N 2.91Å; G459-L462 VanDerWaalsContact O-N 3.09Å; G459-G463 PolarHBondContact O-N 2.82Å
460A96.6Very high89.9Confident3 Ų350.9 Ų50.93%0.02532%0.323CS..Hα-helixtrans-59-45.1177.700000112.9V220 G399 G456 L457 L462 G463 V464V220-A460 HydrophobicContact CG2-CB 4.09Å; G399-A460 WeakPolarHBondContact O-CA 3.14Å; G399-A460 PolarHBondContact O-N 3.46Å; G456-A460 PolarHBondContact O-N 3.29Å; L457-A460 PolarHBondContact O-N 3.28Å; A460-L462 VanDerWaalsContact C-N 3.3Å; A460-L462 PolarHBondContact O-N 3.42Å; A460-G463 PolarHBondContact O-N 2.9Å; A460-V464 WeakPolarHBondContact O-CG2 3.2Å; A460-V464 PolarHBondContact O-N 3.5Å
461V95.6Very high89Confident92 Ų9249.8 Ų49.856%0.55832%0.321SS*.Hα-helixtrans-60.9-41.9174.8173.70000111.1L213 L457 G458 G459 G465L213-V461 HydrophobicContact CD2-CG2 4.18Å; L457-V461 WeakPolarHBondContact O-CG2 3.39Å; L457-V461 PolarHBondContact O-N 3.07Å; L457-V461 VanDerWaalsContact O-N 3.08Å; G458-V461 PolarHBondContact O-N 2.86Å; G459-V461 PolarHBondContact O-N 3.26Å; V461-G465 PolarHBondContact O-N 3.31Å
462L94.4Very high88Confident94 Ų9449.6 Ų49.649%0.49232%0.322SS..Hα-helixtrans-65.5-43.1176.9-17960.8000111.7L400 G458 G459 A460 G465 L466L400-L462 HydrophobicContact CD1-CB 4Å; L400-L462 HydrophobicContact CD1-CD2 3.88Å; L400-L462 HydrophobicContact CD1-CG 3.73Å; G458-L462 WeakPolarHBondContact O-CB 3.16Å; G458-L462 PolarHBondContact O-N 3.17Å; G459-L462 CarbonylContact O-C 3.52Å; G459-L462 WeakPolarHBondContact O-CA 3.28Å; G459-L462 WeakPolarHBondContact O-CB 3.5Å; G459-L462 PolarHBondContact O-N 2.91Å; G459-L462 VanDerWaalsContact O-N 3.09Å; A460-L462 VanDerWaalsContact C-N 3.3Å; A460-L462 PolarHBondContact O-N 3.42Å; L462-G465 CarbonylContact O-C 3.53Å; L462-G465 PolarHBondContact O-N 2.98Å; L462-G465 VanDerWaalsContact O-N 3.15Å; L462-L466 HydrophobicContact CD1-CD1 4.4Å; L462-L466 HydrophobicContact CD1-CD2 4.5Å; L462-L466 HydrophobicContact CD1-CG 4.17Å; L462-L466 HydrophobicContact CG-CD1 4.19Å; L462-L466 HydrophobicContact CG-CG 4.38Å; L462-L466 VanDerWaalsContact O-CG 3.32Å; L462-L466 WeakPolarHBondContact O-CG 3.35Å; L462-L466 PolarHBondContact O-N 2.85Å
463G92.9Very high87.5Confident0 Ų052.3 Ų52.30%034%0.336CS..Hα-helixtrans-61.4-49.2-179.600000111.2L400 G459 A460 G465 L466 S467L400-G463 WeakPolarHBondContact O-CA 3.45Å; G459-G463 PolarHBondContact O-N 2.82Å; A460-G463 PolarHBondContact O-N 2.9Å; G463-G465 VanDerWaalsContact C-N 3.31Å; G463-G465 PolarHBondContact O-N 2.9Å; G463-L466 PolarHBondContact O-N 2.91Å; G463-S467 PolarHBondContact O-N 3.2Å; G463-S467 PolarHBondContact O-OG 2.6Å
464V91.5Very high87.1Confident2 Ų252.8 Ų52.81%0.01234%0.337CS..Hα-helixtrans-59.5-43.1173.1176.50000111.3L209 A212 L213 G403 S407 A460 L466 S467L209-V464 HydrophobicContact CD1-CG1 3.18Å; A212-V464 HydrophobicContact CB-CG1 4.48Å; A212-V464 HydrophobicContact CB-CG2 4.4Å; L213-V464 HydrophobicContact CD2-CB 3.93Å; L213-V464 HydrophobicContact CD2-CG1 3.95Å; L213-V464 HydrophobicContact CD2-CG2 4Å; L213-V464 HydrophobicContact CG-CG1 4.08Å; G403-V464 VanDerWaalsContact O-CG2 3.28Å; G403-V464 WeakPolarHBondContact O-CG2 3.31Å; S407-V464 WeakPolarHBondContact OG-CA 3.35Å; A460-V464 WeakPolarHBondContact O-CG2 3.2Å; A460-V464 PolarHBondContact O-N 3.5Å; V464-L466 PolarHBondContact O-N 3.35Å; V464-S467 PolarHBondContact O-N 3.4Å
465G89Confident86.8Confident39 Ų3950.6 Ų50.640%0.40232%0.318SS..Hα-helixtrans-62.9-38178.800000113.9V461 L462 G463 S467 L468V461-G465 PolarHBondContact O-N 3.31Å; L462-G465 CarbonylContact O-C 3.53Å; L462-G465 PolarHBondContact O-N 2.98Å; L462-G465 VanDerWaalsContact O-N 3.15Å; G463-G465 VanDerWaalsContact C-N 3.31Å; G463-G465 PolarHBondContact O-N 2.9Å; G465-S467 VanDerWaalsContact C-N 3.3Å; G465-L468 PolarHBondContact O-N 3.45Å
466L87.3Confident86.4Confident56 Ų5651.4 Ų51.429%0.29332%0.315SS..Hα-helixtrans-69.5-29.4176.8-69.7176000112.1L400 L462 G463 V464 L468 L473 V477L400-L466 HydrophobicContact CD1-CD1 4.1Å; L462-L466 HydrophobicContact CD1-CD1 4.4Å; L462-L466 HydrophobicContact CD1-CD2 4.5Å; L462-L466 HydrophobicContact CD1-CG 4.17Å; L462-L466 HydrophobicContact CG-CD1 4.19Å; L462-L466 HydrophobicContact CG-CG 4.38Å; L462-L466 VanDerWaalsContact O-CG 3.32Å; L462-L466 WeakPolarHBondContact O-CG 3.35Å; L462-L466 PolarHBondContact O-N 2.85Å; G463-L466 PolarHBondContact O-N 2.91Å; V464-L466 PolarHBondContact O-N 3.35Å; L466-L468 PolarHBondContact O-N 2.04Å; L466-L473 HydrophobicContact CB-CB 4.47Å; L466-L473 HydrophobicContact CB-CD1 4.45Å; L466-L473 HydrophobicContact CD2-CD1 4.05Å; L466-V477 HydrophobicContact CD1-CG2 3.85Å
467S82.9Confident86.2Confident33 Ų3351.8 Ų51.823%0.23132%0.317CS..THydrogen-bonded Turntrans-73.4-9.9176.3-58.30000114.1S407 G463 V464 G465 T474S407-S467 VanDerWaalsContact CB-CB 3.48Å; G463-S467 PolarHBondContact O-N 3.2Å; G463-S467 PolarHBondContact O-OG 2.6Å; V464-S467 PolarHBondContact O-N 3.4Å; G465-S467 VanDerWaalsContact C-N 3.3Å; S467-T474 PolarHBondContact OG-OG1 3.37Å
468L79Confident86Confident115 Ų11548.5 Ų48.560%0.60230%0.3SS*.THydrogen-bonded Turntrans-84.6-8177.7-65.4174.4000114.2L209 G465 L466L209-L468 HydrophobicContact CD1-CD1 3.95Å; L209-L468 HydrophobicContact CD1-CD2 4.19Å; L209-L468 HydrophobicContact CD1-CG 4.4Å; L209-L468 HydrophobicContact CD2-CD1 4.04Å; G465-L468 PolarHBondContact O-N 3.45Å; L466-L468 PolarHBondContact O-N 2.04Å
469G68.3Low85.8Confident35 Ų3546.7 Ų46.736%0.36128%0.281SS..SBendtrans-70.8159-176.500000113.4V471G469-V471 PolarHBondContact O-N 2.92Å
470P61.5Low85.7Confident141 Ų14148.6 Ų48.692%0.91629%0.293SS*.SBendtrans-68.3-12.3173.429.1-34.9000113.2
471V72.6Confident85.6Confident84 Ų8448.4 Ų48.451%0.50929%0.291SS..SBendtrans-106.7131.2175.7-179.60000107.9G469 L473G469-V471 PolarHBondContact O-N 2.92Å; V471-L473 HydrophobicContact CG1-CD2 4.16Å; V471-L473 PolarHBondContact O-N 2.9Å
472P72.1Confident85.7Confident88 Ų8844.1 Ų44.157%0.57127%0.265SS*.  trans-69.496.3177.428.1-33.5000110P475P472-P475 WeakPolarHBondContact O-CD 3.31Å
473L83.5Confident85.7Confident61 Ų6139.6 Ų39.632%0.31924%0.242SC..  trans-86.9-16.4178.5-65.8-178.7000113L466 V471 P475 W476 V477L466-L473 HydrophobicContact CB-CB 4.47Å; L466-L473 HydrophobicContact CB-CD1 4.45Å; L466-L473 HydrophobicContact CD2-CD1 4.05Å; V471-L473 HydrophobicContact CG1-CD2 4.16Å; V471-L473 PolarHBondContact O-N 2.9Å; L473-P475 VanDerWaalsContact C-CD 3.48Å; L473-W476 WeakPolarHBondContact O-CB 3.26Å; L473-W476 PolarHBondContact O-N 3.46Å; L473-V477 PolarHBondContact O-N 3.4Å
474T84.6Confident85.8Confident17 Ų1739.7 Ų39.710%0.10424%0.242CC..Hα-helixtrans-48.7-47.6178.8-400000113.1A404 S467 W476 V477 F478A404-T474 HydrophobicContact CB-CG2 3.86Å; S467-T474 PolarHBondContact OG-OG1 3.37Å; T474-W476 VanDerWaalsContact C-N 3.31Å; T474-W476 PolarHBondContact O-N 3.03Å; T474-V477 WeakPolarHBondContact O-CB 3.49Å; T474-V477 PolarHBondContact O-N 3.26Å; T474-V477 VanDerWaalsContact O-N 3.15Å; T474-F478 HydrophobicContact CG2-CD2 4.15Å; T474-F478 HydrophobicContact CG2-CE2 3.55Å; T474-F478 HydrophobicContact CG2-CZ 3.86Å; T474-F478 WeakPolarHBondContact O-CD2 3.47Å; T474-F478 PolarHBondContact O-N 3.34Å
475P86.6Confident85.9Confident10 Ų1039.8 Ų39.87%0.06524%0.242CC..Hα-helixtrans-66.8-31.9-179.7-19.934.3000113.1A269 P472 L473 G479A269-P475 VanDerWaalsContact CB-O 3.26Å; A269-P475 WeakPolarHBondContact CB-O 3.31Å; A269-P475 WeakPolarHBondContact O-CB 3.29Å; P472-P475 WeakPolarHBondContact O-CD 3.31Å; L473-P475 VanDerWaalsContact C-CD 3.48Å; P475-G479 PolarHBondContact O-N 2.89Å
476W89Confident86.2Confident96 Ų9639 Ų3936%0.36423%0.229SC..Hα-helixtrans-69.6-39.9174.2-66.295.3000111.7R273 L473 T474 G479 V480R273-W476 VanDerWaalsContact CZ-CZ2 3.44Å; L473-W476 WeakPolarHBondContact O-CB 3.26Å; L473-W476 PolarHBondContact O-N 3.46Å; T474-W476 VanDerWaalsContact C-N 3.31Å; T474-W476 PolarHBondContact O-N 3.03Å; W476-G479 PolarHBondContact O-N 3.12Å; W476-V480 WeakPolarHBondContact O-CB 3.37Å; W476-V480 WeakPolarHBondContact O-CG2 3.38Å; W476-V480 PolarHBondContact O-N 3.25Å
477V91.9Very high86.5Confident10 Ų1037.3 Ų37.36%0.06122%0.219CC..Hα-helixtrans-59.2-50.7175.3168.50000109.9L400 A404 L466 L473 T474 G479 V480 T481L400-V477 HydrophobicContact CD2-CG1 3.84Å; L400-V477 HydrophobicContact CG-CG1 3.65Å; A404-V477 HydrophobicContact CB-CB 4.38Å; A404-V477 HydrophobicContact CB-CG1 3.87Å; L466-V477 HydrophobicContact CD1-CG2 3.85Å; L473-V477 PolarHBondContact O-N 3.4Å; T474-V477 WeakPolarHBondContact O-CB 3.49Å; T474-V477 PolarHBondContact O-N 3.26Å; T474-V477 VanDerWaalsContact O-N 3.15Å; V477-G479 PolarHBondContact O-N 3.28Å; V477-V480 PolarHBondContact O-N 3.23Å; V477-T481 WeakPolarHBondContact O-CB 3.23Å; V477-T481 PolarHBondContact O-N 3.39Å; V477-T481 PolarHBondContact O-OG1 2.82Å
478F92.7Very high86.8Confident4 Ų436.2 Ų36.22%0.01821%0.211CC..Hα-helixtrans-59.8-44.3178-67.2-38.2000113L265 H268 A269 A401 A404 A405 T474 T481 A482L265-F478 HydrophobicContact CD2-CD1 3.84Å; L265-F478 HydrophobicContact CD2-CE1 4.35Å; L265-F478 HydrophobicContact CD2-CG 4.45Å; H268-F478 HydrophobicContact CB-CD2 3.61Å; H268-F478 HydrophobicContact CB-CE2 3.87Å; H268-F478 HydrophobicContact CB-CG 4.27Å; A269-F478 HydrophobicContact CB-CB 4.12Å; A401-F478 HydrophobicContact CB-CD1 4.35Å; A401-F478 HydrophobicContact CB-CE1 4.42Å; A404-F478 HydrophobicContact CB-CE1 4.2Å; A404-F478 HydrophobicContact CB-CZ 4.45Å; A405-F478 HydrophobicContact CB-CE1 4Å; A405-F478 HydrophobicContact CB-CZ 3.8Å; T474-F478 HydrophobicContact CG2-CD2 4.15Å; T474-F478 HydrophobicContact CG2-CE2 3.55Å; T474-F478 HydrophobicContact CG2-CZ 3.86Å; T474-F478 WeakPolarHBondContact O-CD2 3.47Å; T474-F478 PolarHBondContact O-N 3.34Å; F478-T481 PolarHBondContact O-N 3.19Å; F478-A482 WeakPolarHBondContact O-CB 3.38Å; F478-A482 PolarHBondContact O-N 3.46Å
479G93.8Very high87.5Confident0 Ų030.7 Ų30.70%018%0.182CC..Hα-helixtrans-65-42.5177.600000113S290 V291 P475 W476 V477 A482 G483S290-G479 WeakPolarHBondContact OG-CA 3.33Å; V291-G479 WeakPolarHBondContact CA-O 3.29Å; V291-G479 WeakPolarHBondContact CG2-O 3.35Å; V291-G479 PolarHBondContact N-O 3.19Å; P475-G479 PolarHBondContact O-N 2.89Å; W476-G479 PolarHBondContact O-N 3.12Å; V477-G479 PolarHBondContact O-N 3.28Å; G479-A482 PolarHBondContact O-N 3.48Å; G479-G483 PolarHBondContact O-N 2.9Å
480V94.2Very high88.6Confident40 Ų4033 Ų3324%0.24219%0.186CC..Hα-helixtrans-61.2-46.8174.2168.70000110.8G294 L297 W476 V477 A482 G483 V484G294-V480 WeakPolarHBondContact CA-O 3.44Å; L297-V480 HydrophobicContact CD2-CG1 4.29Å; W476-V480 WeakPolarHBondContact O-CB 3.37Å; W476-V480 WeakPolarHBondContact O-CG2 3.38Å; W476-V480 PolarHBondContact O-N 3.25Å; V477-V480 PolarHBondContact O-N 3.23Å; V480-A482 PolarHBondContact O-N 2.9Å; V480-G483 PolarHBondContact O-N 3.04Å; V480-G483 VanDerWaalsContact O-N 3.14Å; V480-V484 WeakPolarHBondContact O-CG2 3.33Å; V480-V484 PolarHBondContact O-N 2.96Å
481T94.9Very high89.9Confident0 Ų029.7 Ų29.70%016%0.163CC..Hα-helixtrans-62.8-41.1178-60.50000112L265 A401 V477 F478 G483 V484 F485L265-T481 HydrophobicContact CD1-CG2 3.79Å; A401-T481 HydrophobicContact CB-CG2 3.96Å; V477-T481 WeakPolarHBondContact O-CB 3.23Å; V477-T481 PolarHBondContact O-N 3.39Å; V477-T481 PolarHBondContact O-OG1 2.82Å; F478-T481 PolarHBondContact O-N 3.19Å; T481-G483 VanDerWaalsContact C-N 3.26Å; T481-G483 PolarHBondContact O-N 3.41Å; T481-V484 WeakPolarHBondContact O-CB 2.97Å; T481-V484 PolarHBondContact O-N 2.95Å; T481-V484 VanDerWaalsContact O-N 3.09Å; T481-F485 HydrophobicContact CG2-CD1 4Å; T481-F485 HydrophobicContact CG2-CD2 4.34Å; T481-F485 HydrophobicContact CG2-CE1 3.47Å; T481-F485 VanDerWaalsContact CG2-CE1 3.47Å; T481-F485 HydrophobicContact CG2-CE2 3.87Å; T481-F485 HydrophobicContact CG2-CG 4.41Å; T481-F485 HydrophobicContact CG2-CZ 3.4Å; T481-F485 WeakPolarHBondContact O-CD1 3.48Å; T481-F485 WeakPolarHBondContact O-CG 3.42Å; T481-F485 PolarHBondContact O-N 3.01Å
482A95.9Very high90.4Very high1 Ų128.9 Ų28.91%0.00816%0.155CC..Hα-helixtrans-58.2-40.3173.500000111.9A261 L265 V291 F478 G479 V480 F485 L486A261-A482 HydrophobicContact CB-CB 4.02Å; A261-A482 WeakPolarHBondContact CB-O 3.3Å; L265-A482 HydrophobicContact CB-CB 3.9Å; L265-A482 HydrophobicContact CD1-CB 4.33Å; V291-A482 HydrophobicContact CG2-CB 4.18Å; F478-A482 WeakPolarHBondContact O-CB 3.38Å; F478-A482 PolarHBondContact O-N 3.46Å; G479-A482 PolarHBondContact O-N 3.48Å; V480-A482 PolarHBondContact O-N 2.9Å; A482-F485 PolarHBondContact O-N 3.05Å; A482-L486 WeakPolarHBondContact O-CG 3.44Å; A482-L486 PolarHBondContact O-N 3.06Å
483G95.6Very high91Very high0 Ų025.8 Ų25.80%013%0.133CC..Hα-helixtrans-64.7-39.8174.300000113.7V291 L295 G479 V480 T481 Y487V291-G483 WeakPolarHBondContact O-CA 3.15Å; L295-G483 WeakPolarHBondContact CD1-O 3.32Å; L295-G483 WeakPolarHBondContact CG-O 3.19Å; G479-G483 PolarHBondContact O-N 2.9Å; V480-G483 PolarHBondContact O-N 3.04Å; V480-G483 VanDerWaalsContact O-N 3.14Å; T481-G483 VanDerWaalsContact C-N 3.26Å; T481-G483 PolarHBondContact O-N 3.41Å; G483-Y487 PolarHBondContact O-N 3.49Å; G483-Y487 VanDerWaalsContact O-N 3.08Å
484V94.1Very high91.2Very high2 Ų225 Ų251%0.01213%0.129CC..Hα-helixtrans-62.1-47.3173.7170.10000110.4L298 T397 V480 T481 L486 Y487 V488L298-V484 HydrophobicContact CD1-CB 4.04Å; L298-V484 HydrophobicContact CD1-CG1 3.45Å; L298-V484 VanDerWaalsContact CD1-CG1 3.45Å; L298-V484 HydrophobicContact CD1-CG2 4.28Å; L298-V484 HydrophobicContact CG-CB 4.48Å; L298-V484 HydrophobicContact CG-CG1 4.04Å; L298-V484 HydrophobicContact CG-CG2 4.18Å; T397-V484 HydrophobicContact CG2-CG1 4.04Å; T397-V484 HydrophobicContact CG2-CG2 4.3Å; V480-V484 WeakPolarHBondContact O-CG2 3.33Å; V480-V484 PolarHBondContact O-N 2.96Å; T481-V484 WeakPolarHBondContact O-CB 2.97Å; T481-V484 PolarHBondContact O-N 2.95Å; T481-V484 VanDerWaalsContact O-N 3.09Å; V484-L486 PolarHBondContact O-N 3.35Å; V484-Y487 WeakPolarHBondContact O-CB 3.47Å; V484-Y487 PolarHBondContact O-N 3.43Å; V484-Y487 VanDerWaalsContact O-N 3.11Å; V484-V488 WeakPolarHBondContact O-CG2 3.44Å; V484-V488 PolarHBondContact O-N 2.91Å
485F94.1Very high91.2Very high3 Ų326.6 Ų26.61%0.01314%0.14CC..Hα-helixtrans-62.3-40.7179.2-710.7000112.6L257 D260 A261 L265 D398 H423 T481 A482 Y487 V488 A489L257-F485 HydrophobicContact CD2-CB 4.3Å; L257-F485 HydrophobicContact CD2-CD1 4.37Å; L257-F485 HydrophobicContact CD2-CG 4.17Å; D260-F485 HydrophobicContact CB-CD2 4.2Å; D260-F485 HydrophobicContact CB-CE2 4.44Å; D260-F485 WeakPolarHBondContact OD2-CE2 2.96Å; A261-F485 HydrophobicContact CB-CB 4.03Å; L265-F485 HydrophobicContact CD1-CD2 3.68Å; L265-F485 HydrophobicContact CD1-CE2 3.5Å; L265-F485 HydrophobicContact CD1-CZ 4.36Å; D398-F485 WeakPolarHBondContact OD1-CE1 3.34Å; D398-F485 WeakPolarHBondContact OD1-CZ 3.03Å; H423-F485 AromaticContact CE1-CE2 3.7Å; H423-F485 AromaticContact CE1-CZ 3.97Å; T481-F485 HydrophobicContact CG2-CD1 4Å; T481-F485 HydrophobicContact CG2-CD2 4.34Å; T481-F485 HydrophobicContact CG2-CE1 3.47Å; T481-F485 VanDerWaalsContact CG2-CE1 3.47Å; T481-F485 HydrophobicContact CG2-CE2 3.87Å; T481-F485 HydrophobicContact CG2-CG 4.41Å; T481-F485 HydrophobicContact CG2-CZ 3.4Å; T481-F485 WeakPolarHBondContact O-CD1 3.48Å; T481-F485 WeakPolarHBondContact O-CG 3.42Å; T481-F485 PolarHBondContact O-N 3.01Å; A482-F485 PolarHBondContact O-N 3.05Å; F485-Y487 VanDerWaalsContact C-N 3.33Å; F485-Y487 PolarHBondContact O-N 3.35Å; F485-V488 PolarHBondContact O-N 2.9Å; F485-A489 VanDerWaalsContact O-CB 3.22Å; F485-A489 WeakPolarHBondContact O-CB 3.27Å; F485-A489 PolarHBondContact O-N 3.34Å
486L95.4Very high90.8Very high23 Ų2328.9 Ų28.912%0.1216%0.16CC..Hα-helixtrans-62-40.6173.2-77.4170.1000112.2A261 L262 V291 L295 A482 V484 L490A261-L486 HydrophobicContact CB-CD1 4.35Å; A261-L486 HydrophobicContact CB-CD2 4.19Å; A261-L486 HydrophobicContact CB-CG 3.73Å; L262-L486 HydrophobicContact CD1-CD2 4.41Å; L262-L486 HydrophobicContact CD2-CD1 4.13Å; L262-L486 HydrophobicContact CD2-CD2 4.44Å; L262-L486 HydrophobicContact CG-CD2 4.25Å; V291-L486 HydrophobicContact CG1-CD1 4.02Å; L295-L486 HydrophobicContact CD1-CB 4.32Å; L295-L486 HydrophobicContact CD1-CD1 4.46Å; A482-L486 WeakPolarHBondContact O-CG 3.44Å; A482-L486 PolarHBondContact O-N 3.06Å; V484-L486 PolarHBondContact O-N 3.35Å; L486-L490 HydrophobicContact CD2-CD1 4.39Å; L486-L490 VanDerWaalsContact O-CB 3.29Å; L486-L490 WeakPolarHBondContact O-CB 3.38Å; L486-L490 VanDerWaalsContact O-CG 3.31Å; L486-L490 WeakPolarHBondContact O-CG 3.27Å; L486-L490 PolarHBondContact O-N 3.43Å
487Y93.1Very high90.2Very high20 Ų2025.3 Ų25.38%0.07815%0.148CC..Hα-helixtrans-62.6-52.9176.5-171.8-81000110.9L298 F299 E302 G483 V484 F485 A489 L490 V491L298-Y487 HydrophobicContact CB-CD1 3.86Å; L298-Y487 HydrophobicContact CB-CD2 4.32Å; L298-Y487 HydrophobicContact CB-CE1 4.21Å; L298-Y487 HydrophobicContact CB-CG 3.91Å; L298-Y487 HydrophobicContact CD1-CD1 3.73Å; L298-Y487 HydrophobicContact CD1-CG 4.04Å; L298-Y487 HydrophobicContact CG-CD1 4.44Å; F299-Y487 HydrophobicContact CB-CE2 3.83Å; F299-Y487 HydrophobicContact CD2-CE2 4.49Å; E302-Y487 WeakPolarHBondContact OE2-CE1 3.49Å; E302-Y487 PolarHBondContact OE2-OH 2.94Å; G483-Y487 PolarHBondContact O-N 3.49Å; G483-Y487 VanDerWaalsContact O-N 3.08Å; V484-Y487 WeakPolarHBondContact O-CB 3.47Å; V484-Y487 PolarHBondContact O-N 3.43Å; V484-Y487 VanDerWaalsContact O-N 3.11Å; F485-Y487 VanDerWaalsContact C-N 3.33Å; F485-Y487 PolarHBondContact O-N 3.35Å; Y487-A489 VanDerWaalsContact C-N 3.33Å; Y487-A489 PolarHBondContact O-N 3.42Å; Y487-L490 PolarHBondContact O-N 2.85Å; Y487-V491 HydrophobicContact CD1-CB 4.13Å; Y487-V491 HydrophobicContact CD1-CG2 4.36Å; Y487-V491 HydrophobicContact CD2-CG2 3.95Å; Y487-V491 HydrophobicContact CE1-CB 3.99Å; Y487-V491 HydrophobicContact CE1-CG1 3.98Å; Y487-V491 HydrophobicContact CE1-CG2 4.38Å; Y487-V491 HydrophobicContact CE2-CB 4.4Å; Y487-V491 HydrophobicContact CE2-CG1 4.4Å; Y487-V491 HydrophobicContact CE2-CG2 3.94Å; Y487-V491 HydrophobicContact CG-CB 4.43Å; Y487-V491 HydrophobicContact CG-CG2 4.16Å; Y487-V491 WeakPolarHBondContact O-CA 3.42Å; Y487-V491 WeakPolarHBondContact O-CB 3.5Å; Y487-V491 PolarHBondContact O-N 3.39Å
488V90.4Very high89.6Confident10 Ų1030.6 Ų30.66%0.06118%0.175CC..Iπ-helixtrans-58.2-45.6179.4174.80000110.9L257 L298 V484 F485 D492 M493L257-V488 HydrophobicContact CD1-CG1 4.15Å; L298-V488 HydrophobicContact CD1-CG2 3.79Å; V484-V488 WeakPolarHBondContact O-CG2 3.44Å; V484-V488 PolarHBondContact O-N 2.91Å; F485-V488 PolarHBondContact O-N 2.9Å; V488-D492 WeakPolarHBondContact O-CB 3.35Å; V488-D492 PolarHBondContact O-N 3.38Å; V488-M493 PolarHBondContact O-N 3.14Å
489A92.5Very high88.6Confident0 Ų039 Ų390%021%0.207CC..Iπ-helixtrans-63-47.4-179.700000112.9V254 L257 F485 Y487 L494V254-A489 HydrophobicContact CG1-CB 4.43Å; L257-A489 HydrophobicContact CB-CB 3.72Å; L257-A489 HydrophobicContact CD1-CB 4.22Å; F485-A489 VanDerWaalsContact O-CB 3.22Å; F485-A489 WeakPolarHBondContact O-CB 3.27Å; F485-A489 PolarHBondContact O-N 3.34Å; Y487-A489 VanDerWaalsContact C-N 3.33Å; Y487-A489 PolarHBondContact O-N 3.42Å; A489-L494 VanDerWaalsContact O-CB 3.29Å; A489-L494 WeakPolarHBondContact O-CB 3.46Å; A489-L494 PolarHBondContact O-N 3.05Å
490L92.6Very high86.9Confident84 Ų8443.6 Ų43.644%0.4424%0.237SC..Iπ-helixtrans-91.2-30.8-169.5-61.5178.7000113.8L486 Y487 L494 P495L486-L490 HydrophobicContact CD2-CD1 4.39Å; L486-L490 VanDerWaalsContact O-CB 3.29Å; L486-L490 WeakPolarHBondContact O-CB 3.38Å; L486-L490 VanDerWaalsContact O-CG 3.31Å; L486-L490 WeakPolarHBondContact O-CG 3.27Å; L486-L490 PolarHBondContact O-N 3.43Å; Y487-L490 PolarHBondContact O-N 2.85Å; L490-L494 HydrophobicContact CD2-CD2 3.92Å; L490-P495 WeakPolarHBondContact O-CD 3.44Å
491V88.6Confident85.2Confident71 Ų7146.2 Ų46.243%0.4325%0.254SS..Iπ-helixtrans-95.8-42-176.4-176.50000111.3Y487 P495Y487-V491 HydrophobicContact CD1-CB 4.13Å; Y487-V491 HydrophobicContact CD1-CG2 4.36Å; Y487-V491 HydrophobicContact CD2-CG2 3.95Å; Y487-V491 HydrophobicContact CE1-CB 3.99Å; Y487-V491 HydrophobicContact CE1-CG1 3.98Å; Y487-V491 HydrophobicContact CE1-CG2 4.38Å; Y487-V491 HydrophobicContact CE2-CB 4.4Å; Y487-V491 HydrophobicContact CE2-CG1 4.4Å; Y487-V491 HydrophobicContact CE2-CG2 3.94Å; Y487-V491 HydrophobicContact CG-CB 4.43Å; Y487-V491 HydrophobicContact CG-CG2 4.16Å; Y487-V491 WeakPolarHBondContact O-CA 3.42Å; Y487-V491 WeakPolarHBondContact O-CB 3.5Å; Y487-V491 PolarHBondContact O-N 3.39Å; V491-P495 WeakPolarHBondContact O-CD 3.48Å; V491-P495 VanDerWaalsContact O-CG 3.28Å; V491-P495 WeakPolarHBondContact O-CG 3.26Å
492D82.6Confident83.2Confident66 Ų6654.2 Ų54.235%0.35329%0.292SS..Iπ-helixtrans-91.4-53.3-175.1-60.9-29.9000111.8V488V488-D492 WeakPolarHBondContact O-CB 3.35Å; V488-D492 PolarHBondContact O-N 3.38Å
493M84.6Confident81.5Confident23 Ų2359 Ų5911%0.11332%0.323CS..Iπ-helixtrans-83.3-50.5-170.5-76-99.5138.100113.4A253 V254 H427 V488 A496 L497A253-M493 HydrophobicContact CB-SD 4.37Å; V254-M493 HydrophobicContact CG2-CB 3.5Å; V254-M493 VanDerWaalsContact CG2-CB 3.5Å; H427-M493 VanDerWaalsContact CD2-CE 3.45Å; H427-M493 WeakPolarHBondContact CD2-CE 3.31Å; V488-M493 PolarHBondContact O-N 3.14Å; M493-A496 WeakPolarHBondContact O-CB 3.46Å; M493-A496 PolarHBondContact O-N 3.15Å; M493-A496 VanDerWaalsContact O-N 3.09Å; M493-L497 PolarHBondContact O-N 3.27Å
494L88.2Confident79.6Confident44 Ų4467.4 Ų67.423%0.2336%0.359CS..Hα-helixtrans-58.3-42.6-174.5-178.263.1000113.8V254 A489 L490 A496 L497 L498V254-L494 HydrophobicContact CG1-CB 4.38Å; V254-L494 HydrophobicContact CG1-CD1 4.37Å; V254-L494 HydrophobicContact CG2-CB 4.39Å; A489-L494 VanDerWaalsContact O-CB 3.29Å; A489-L494 WeakPolarHBondContact O-CB 3.46Å; A489-L494 PolarHBondContact O-N 3.05Å; L490-L494 HydrophobicContact CD2-CD2 3.92Å; L494-A496 PolarHBondContact O-N 3.24Å; L494-L497 WeakPolarHBondContact O-CB 3.32Å; L494-L497 PolarHBondContact O-N 2.87Å; L494-L498 HydrophobicContact CD1-CD1 4.26Å; L494-L498 HydrophobicContact CD1-CG 4.16Å; L494-L498 HydrophobicContact CG-CD1 3.97Å; L494-L498 HydrophobicContact CG-CG 4.31Å; L494-L498 WeakPolarHBondContact O-CG 3.46Å; L494-L498 PolarHBondContact O-N 3.33Å; L494-L498 VanDerWaalsContact O-N 3.09Å
495P84.9Confident78.3Confident52 Ų5271 Ų7134%0.33838%0.383SS..Hα-helixtrans-67.6-22178.8-2438.3000113.8L490 V491 R499L490-P495 WeakPolarHBondContact O-CD 3.44Å; V491-P495 WeakPolarHBondContact O-CD 3.48Å; V491-P495 VanDerWaalsContact O-CG 3.28Å; V491-P495 WeakPolarHBondContact O-CG 3.26Å; P495-R499 PolarHBondContact O-NE 2.72Å; P495-R499 VanDerWaalsContact O-NE 3.15Å
496A78.4Confident77.3Confident58 Ų5875.9 Ų75.948%0.47941%0.413SS..Hα-helixtrans-71.7-35171.900000111.4M493 L494M493-A496 WeakPolarHBondContact O-CB 3.46Å; M493-A496 PolarHBondContact O-N 3.15Å; M493-A496 VanDerWaalsContact O-N 3.09Å; L494-A496 PolarHBondContact O-N 3.24Å
497L76.9Confident76.6Confident20 Ų2078.5 Ų78.511%0.10543%0.431CS..Hα-helixtrans-73.3-35.6177.6-62.4173.2000113.4A251 V254 M493 L494 R499 Q512A251-L497 HydrophobicContact CB-CD1 4.02Å; V254-L497 HydrophobicContact CB-CD1 4.36Å; V254-L497 HydrophobicContact CG2-CD1 3.7Å; M493-L497 PolarHBondContact O-N 3.27Å; L494-L497 WeakPolarHBondContact O-CB 3.32Å; L494-L497 PolarHBondContact O-N 2.87Å; L497-R499 VanDerWaalsContact C-N 3.28Å; L497-R499 PolarHBondContact O-N 3.08Å; L497-Q512 PolarHBondContact O-NE2 3.11Å; L497-Q512 VanDerWaalsContact O-NE2 3.09Å
498L78.8Confident76Confident122 Ų12281.2 Ų81.264%0.63945%0.445SS*.SBendtrans-76.5-10.1-177-66.8176.3000113.7L494 P500L494-L498 HydrophobicContact CD1-CD1 4.26Å; L494-L498 HydrophobicContact CD1-CG 4.16Å; L494-L498 HydrophobicContact CG-CD1 3.97Å; L494-L498 HydrophobicContact CG-CG 4.31Å; L494-L498 WeakPolarHBondContact O-CG 3.46Å; L494-L498 PolarHBondContact O-N 3.33Å; L494-L498 VanDerWaalsContact O-N 3.09Å; L498-P500 WeakPolarHBondContact O-CD 3.36Å
499R71.8Confident75.7Confident179 Ų17985 Ų8568%0.67547%0.468SS*.SBendtrans-77.4109.5176.9-81.7-179.4-106171.1-7.4110.2P495 L497P495-R499 PolarHBondContact O-NE 2.72Å; P495-R499 VanDerWaalsContact O-NE 3.15Å; L497-R499 VanDerWaalsContact C-N 3.28Å; L497-R499 PolarHBondContact O-N 3.08Å
500P58Low75.5Confident97 Ų9791.4 Ų91.463%0.6350%0.501SS*.  trans-74.4134-172.428.6-32.7000111.9L498 E502L498-P500 WeakPolarHBondContact O-CD 3.36Å; P500-E502 PolarHBondContact O-N 2.98Å
501P57.3Low75.3Confident95 Ų9590.2 Ų90.262%0.61750%0.495SS*.  trans-74.9111.7158.727.6-28.3000109.6
502E54.4Low75.3Confident169 Ų16988.9 Ų88.979%0.7948%0.484SS*.THydrogen-bonded Turntrans-56.5144.7169.7-78.8-77.7161.100112.6P500P500-E502 PolarHBondContact O-N 2.98Å
503P59.2Low75.7Confident101 Ų10187.2 Ų87.266%0.65648%0.482SS*.THydrogen-bonded Turncis-121.2115.6-38.429.1-11.3000111.2
504K56.6Low76.1Confident177 Ų17790.9 Ų90.977%0.7750%0.502SS*.  trans-178.880.4150.8-99.6165.7-169.8-177.80108.5
505P66.9Low76.4Confident77 Ų7788.8 Ų88.850%0.549%0.491SS..  trans-88.3-13.4-156.131.5-34.9000116.3V509P505-V509 VanDerWaalsContact O-CG2 3.28Å; P505-V509 WeakPolarHBondContact O-CG2 3.36Å; P505-V509 PolarHBondContact O-N 2.85Å
506T72.8Confident76.8Confident105 Ų10589.4 Ų89.464%0.64449%0.491SS*.Hα-helixtrans-67.4-46.5-168.3460000116.2H508 L510T506-H508 VanDerWaalsContact C-N 3.35Å; T506-H508 PolarHBondContact O-N 3.04Å; T506-L510 WeakPolarHBondContact O-CG 3.09Å; T506-L510 PolarHBondContact O-N 3.33Å
507P80.4Confident77.7Confident79 Ų7993.1 Ų93.151%0.51350%0.502SS..Hα-helixtrans-72-30.4-178.928.9-35000112.5L511P507-L511 VanDerWaalsContact O-CB 3.29Å; P507-L511 WeakPolarHBondContact O-CB 3.49Å; P507-L511 PolarHBondContact O-N 2.83Å
508H80.7Confident78.6Confident77 Ų7796.5 Ų96.536%0.35652%0.519SS..Hα-helixtrans-68.3-43.3178.2-75.5-71.4000112T506 L511 Q512T506-H508 VanDerWaalsContact C-N 3.35Å; T506-H508 PolarHBondContact O-N 3.04Å; H508-L511 PolarHBondContact O-N 2.76Å; H508-Q512 WeakPolarHBondContact O-CB 3.46Å; H508-Q512 WeakPolarHBondContact O-CG 3.22Å; H508-Q512 PolarHBondContact O-N 3.42Å
509V83.8Confident79.3Confident90 Ų9090.7 Ų90.755%0.54549%0.489SS..Hα-helixtrans-65.8-40.9176.8173.30000111.2P505 L511 Q512 G513P505-V509 VanDerWaalsContact O-CG2 3.28Å; P505-V509 WeakPolarHBondContact O-CG2 3.36Å; P505-V509 PolarHBondContact O-N 2.85Å; V509-L511 VanDerWaalsContact C-N 3.34Å; V509-L511 PolarHBondContact O-N 3.18Å; V509-Q512 PolarHBondContact O-N 3.32Å; V509-G513 PolarHBondContact O-N 2.88Å
510L87.4Confident80.4Confident133 Ų13383.2 Ų83.270%0.69647%0.468SS*.Hα-helixtrans-61.8-42.6174.4-76.9164.1000111.9T506 G513 L514T506-L510 WeakPolarHBondContact O-CG 3.09Å; T506-L510 PolarHBondContact O-N 3.33Å; L510-G513 PolarHBondContact O-N 3.33Å; L510-L514 WeakPolarHBondContact O-CB 3.31Å; L510-L514 PolarHBondContact O-N 3.22Å
511L87.9Confident82.2Confident60 Ų6080.3 Ų80.331%0.31446%0.456SS..Hα-helixtrans-66.5-41.3178.5-173.365.5000111.7P244 F248 P507 H508 V509 L514 G515P244-L511 HydrophobicContact CB-CD2 4.21Å; F248-L511 HydrophobicContact CB-CD1 4.45Å; F248-L511 HydrophobicContact CB-CD2 4.09Å; F248-L511 HydrophobicContact CB-CG 3.95Å; F248-L511 HydrophobicContact CD2-CD1 3.77Å; F248-L511 HydrophobicContact CD2-CG 3.97Å; F248-L511 WeakPolarHBondContact CD2-O 3.44Å; F248-L511 HydrophobicContact CE2-CD1 4.45Å; F248-L511 HydrophobicContact CG-CD1 4.35Å; F248-L511 HydrophobicContact CG-CG 4.34Å; P507-L511 VanDerWaalsContact O-CB 3.29Å; P507-L511 WeakPolarHBondContact O-CB 3.49Å; P507-L511 PolarHBondContact O-N 2.83Å; H508-L511 PolarHBondContact O-N 2.76Å; V509-L511 VanDerWaalsContact C-N 3.34Å; V509-L511 PolarHBondContact O-N 3.18Å; L511-L514 PolarHBondContact O-N 3.19Å; L511-G515 PolarHBondContact O-N 3.01Å
512Q89.4Confident83.9Confident43 Ų4379 Ų7920%0.20144%0.443CS..Hα-helixtrans-63.5-45173.1-74.4173.9-22.400111.5A251 L497 H508 V509 L514 G515 L516A251-Q512 HydrophobicContact CB-CB 3.98Å; A251-Q512 HydrophobicContact CB-CG 4.25Å; A251-Q512 VanDerWaalsContact CB-O 3.23Å; A251-Q512 WeakPolarHBondContact CB-O 3.42Å; L497-Q512 PolarHBondContact O-NE2 3.11Å; L497-Q512 VanDerWaalsContact O-NE2 3.09Å; H508-Q512 WeakPolarHBondContact O-CB 3.46Å; H508-Q512 WeakPolarHBondContact O-CG 3.22Å; H508-Q512 PolarHBondContact O-N 3.42Å; V509-Q512 PolarHBondContact O-N 3.32Å; Q512-L514 VanDerWaalsContact C-N 3.28Å; Q512-L514 PolarHBondContact O-N 3.01Å; Q512-G515 PolarHBondContact O-N 3.29Å; Q512-G515 VanDerWaalsContact O-N 3.09Å; Q512-L516 PolarHBondContact O-N 3.01Å
513G91.1Very high85.8Confident30 Ų3071 Ų7131%0.30941%0.406SS..Hα-helixtrans-58.8-40.1175.100000112.4V509 L510 L516 L517V509-G513 PolarHBondContact O-N 2.88Å; L510-G513 PolarHBondContact O-N 3.33Å; G513-L516 PolarHBondContact O-N 3.11Å; G513-L517 WeakPolarHBondContact O-CB 3.25Å; G513-L517 WeakPolarHBondContact O-CG 3.37Å; G513-L517 PolarHBondContact O-N 3.16Å
514L93.5Very high87.4Confident101 Ų10170.1 Ų70.153%0.52940%0.395SS..Hα-helixtrans-64.3-41.2173.4-177.564.5000112L510 L511 Q512 L517 L518L510-L514 WeakPolarHBondContact O-CB 3.31Å; L510-L514 PolarHBondContact O-N 3.22Å; L511-L514 PolarHBondContact O-N 3.19Å; Q512-L514 VanDerWaalsContact C-N 3.28Å; Q512-L514 PolarHBondContact O-N 3.01Å; L514-L517 PolarHBondContact O-N 3.45Å; L514-L518 WeakPolarHBondContact O-CB 3.29Å; L514-L518 PolarHBondContact O-N 2.98Å
515G93.8Very high89Confident0 Ų063.7 Ų63.70%038%0.375CS..Hα-helixtrans-58.8-50.2174.500000112L252 L511 Q512 L517 L518 G519L252-G515 WeakPolarHBondContact CA-O 3.33Å; L252-G515 WeakPolarHBondContact CD1-O 3.41Å; L511-G515 PolarHBondContact O-N 3.01Å; Q512-G515 PolarHBondContact O-N 3.29Å; Q512-G515 VanDerWaalsContact O-N 3.09Å; G515-L517 PolarHBondContact O-N 3.16Å; G515-L518 PolarHBondContact O-N 2.95Å; G515-G519 PolarHBondContact O-N 3.37Å
516L94.3Very high90Very high64 Ų6460.9 Ų60.934%0.33536%0.356SS..Hα-helixtrans-56.9-48.7176.5-77163.8000112.1A251 V254 Q512 G513 G519 G520A251-L516 HydrophobicContact CB-CG 4.14Å; A251-L516 WeakPolarHBondContact O-CA 3.45Å; A251-L516 WeakPolarHBondContact O-CD2 3.28Å; A251-L516 PolarHBondContact O-N 3.49Å; V254-L516 HydrophobicContact CB-CD2 3.73Å; V254-L516 HydrophobicContact CG1-CD2 3.57Å; Q512-L516 PolarHBondContact O-N 3.01Å; G513-L516 PolarHBondContact O-N 3.11Å; L516-G519 PolarHBondContact O-N 3.32Å; L516-G520 PolarHBondContact O-N 3.46Å
517L95.7Very high90.7Very high136 Ų13657.2 Ų57.271%0.71234%0.336SS*.Hα-helixtrans-65.8-40.7179.6-72.8173000112.3G513 L514 G515 G519 G521G513-L517 WeakPolarHBondContact O-CB 3.25Å; G513-L517 WeakPolarHBondContact O-CG 3.37Å; G513-L517 PolarHBondContact O-N 3.16Å; L514-L517 PolarHBondContact O-N 3.45Å; G515-L517 PolarHBondContact O-N 3.16Å; L517-G519 VanDerWaalsContact C-N 3.31Å; L517-G521 PolarHBondContact O-N 2.81Å
518L95.9Very high90.9Very high91 Ų9159.4 Ų59.448%0.47634%0.343SS..Hα-helixtrans-64.4-40.1176.5-177.366000110.7F248 L252 L514 G515 G521 L522F248-L518 HydrophobicContact CZ-CD2 3.89Å; L252-L518 HydrophobicContact CD1-CB 3.96Å; L252-L518 HydrophobicContact CD1-CD2 3.95Å; L252-L518 HydrophobicContact CD1-CG 3.92Å; L514-L518 WeakPolarHBondContact O-CB 3.29Å; L514-L518 PolarHBondContact O-N 2.98Å; G515-L518 PolarHBondContact O-N 2.95Å; L518-G521 PolarHBondContact O-N 2.99Å; L518-L522 VanDerWaalsContact O-CB 3.26Å; L518-L522 WeakPolarHBondContact O-CB 3.34Å; L518-L522 PolarHBondContact O-N 2.83Å
519G95.1Very high91.1Very high0 Ų060.6 Ų60.60%035%0.351CS..Hα-helixtrans-66.2-50.1179.100000112.2T256 G515 L516 L517 G521 L522 M523T256-G519 VanDerWaalsContact CG2-CA 3.41Å; G515-G519 PolarHBondContact O-N 3.37Å; L516-G519 PolarHBondContact O-N 3.32Å; L517-G519 VanDerWaalsContact C-N 3.31Å; G519-G521 VanDerWaalsContact C-N 3.31Å; G519-G521 PolarHBondContact O-N 2.94Å; G519-L522 PolarHBondContact O-N 2.85Å; G519-M523 PolarHBondContact O-N 3.01Å
520G94.9Very high90.9Very high22 Ų2257.7 Ų57.723%0.22733%0.332CS..Hα-helixtrans-62.4-38.5174.600000112.7G255 L516 M523 L524G255-G520 PolarHBondContact O-N 2.97Å; L516-G520 PolarHBondContact O-N 3.46Å; G520-M523 PolarHBondContact O-N 3.38Å; G520-L524 WeakPolarHBondContact O-CB 3.39Å; G520-L524 PolarHBondContact O-N 2.93Å
521G95.3Very high89.9Confident37 Ų3759.1 Ų59.138%0.38134%0.335SS..Hα-helixtrans-66.9-36.8176.300000113.5L517 L518 G519 L524 A525L517-G521 PolarHBondContact O-N 2.81Å; L518-G521 PolarHBondContact O-N 2.99Å; G519-G521 VanDerWaalsContact C-N 3.31Å; G519-G521 PolarHBondContact O-N 2.94Å; G521-L524 PolarHBondContact O-N 2.99Å; G521-A525 WeakPolarHBondContact O-CB 3.45Å; G521-A525 PolarHBondContact O-N 3.02Å
522L93.3Very high89Confident68 Ų6866.3 Ų66.336%0.35636%0.358SS..Hα-helixtrans-65.2-44174.2-179.159.2000110.9T256 C422 L518 G519 A525 I526T256-L522 HydrophobicContact CG2-CD2 4.41Å; C422-L522 HydrophobicContact CB-CD2 3.77Å; C422-L522 HydrophobicContact CB-CG 4.47Å; C422-L522 WeakPolarHBondContact SG-CD2 3.41Å; L518-L522 VanDerWaalsContact O-CB 3.26Å; L518-L522 WeakPolarHBondContact O-CB 3.34Å; L518-L522 PolarHBondContact O-N 2.83Å; G519-L522 PolarHBondContact O-N 2.85Å; L522-A525 WeakPolarHBondContact O-CB 3.29Å; L522-A525 PolarHBondContact O-N 3.36Å; L522-I526 HydrophobicContact CG-CD1 4.42Å; L522-I526 WeakPolarHBondContact O-CG1 3.45Å; L522-I526 PolarHBondContact O-N 2.94Å
523M93.9Very high87.8Confident0 Ų066.5 Ų66.50%036%0.36CS..Hα-helixtrans-65.2-41175.5-69.7-45.7-52.600112.8T256 D260 H264 A419 C422 G519 G520 A525 I526 A527T256-M523 HydrophobicContact CG2-CG 4.33Å; T256-M523 VanDerWaalsContact O-CG 3.3Å; T256-M523 WeakPolarHBondContact O-CG 3.4Å; D260-M523 HydrophobicContact CB-CE 3.73Å; D260-M523 HydrophobicContact CB-SD 4.34Å; H264-M523 HydrophobicContact CB-CE 4.15Å; A419-M523 HydrophobicContact CB-CE 3.36Å; A419-M523 HydrophobicContact CB-SD 4.3Å; C422-M523 HydrophobicContact CB-SD 4.49Å; G519-M523 PolarHBondContact O-N 3.01Å; G520-M523 PolarHBondContact O-N 3.38Å; M523-A525 VanDerWaalsContact C-N 3.28Å; M523-A525 PolarHBondContact O-N 2.96Å; M523-I526 HydrophobicContact CE-CD1 4.29Å; M523-I526 PolarHBondContact O-N 3.45Å; M523-I526 HydrophobicContact SD-CD1 4.01Å; M523-A527 WeakPolarHBondContact O-CB 3.49Å; M523-A527 PolarHBondContact O-N 2.95Å
524L91.9Very high86.1Confident82 Ų8271.1 Ų71.143%0.42938%0.377SS..Hα-helixtrans-60.2-40.7172.6-179.862.3000111.4L263 G520 G521 A527 L528L263-L524 HydrophobicContact CD1-CB 3.99Å; L263-L524 HydrophobicContact CD1-CD1 4.32Å; G520-L524 WeakPolarHBondContact O-CB 3.39Å; G520-L524 PolarHBondContact O-N 2.93Å; G521-L524 PolarHBondContact O-N 2.99Å; L524-A527 PolarHBondContact O-N 3.24Å; L524-L528 HydrophobicContact CD1-CD1 4.16Å; L524-L528 HydrophobicContact CD1-CG 4.24Å; L524-L528 HydrophobicContact CG-CD1 4.05Å; L524-L528 WeakPolarHBondContact O-CB 3.43Å; L524-L528 VanDerWaalsContact O-CG 3.25Å; L524-L528 WeakPolarHBondContact O-CG 3.36Å; L524-L528 PolarHBondContact O-N 2.83Å
525A90.8Very high84Confident43 Ų4369.7 Ų69.736%0.35537%0.373SS..Hα-helixtrans-64.3-43.6176.600000111.7G521 L522 M523 L528 L529G521-A525 WeakPolarHBondContact O-CB 3.45Å; G521-A525 PolarHBondContact O-N 3.02Å; L522-A525 WeakPolarHBondContact O-CB 3.29Å; L522-A525 PolarHBondContact O-N 3.36Å; M523-A525 VanDerWaalsContact C-N 3.28Å; M523-A525 PolarHBondContact O-N 2.96Å; A525-L528 PolarHBondContact O-N 3.03Å; A525-L529 WeakPolarHBondContact O-CB 3.48Å; A525-L529 WeakPolarHBondContact O-CD1 3.2Å; A525-L529 PolarHBondContact O-N 2.94Å
526I88.4Confident81.6Confident18 Ų1876.9 Ų76.99%0.09242%0.417CS..Hα-helixtrans-58.7-50.1175.9-68168.1000110.2L522 M523 L528 L529 E530L522-I526 HydrophobicContact CG-CD1 4.42Å; L522-I526 WeakPolarHBondContact O-CG1 3.45Å; L522-I526 PolarHBondContact O-N 2.94Å; M523-I526 HydrophobicContact CE-CD1 4.29Å; M523-I526 PolarHBondContact O-N 3.45Å; M523-I526 HydrophobicContact SD-CD1 4.01Å; I526-L528 VanDerWaalsContact C-N 3.31Å; I526-L528 PolarHBondContact O-N 3.46Å; I526-L529 PolarHBondContact O-N 3.42Å; I526-L529 VanDerWaalsContact O-N 3.1Å; I526-E530 PolarHBondContact O-N 3.12Å
527A86.2Confident79.1Confident27 Ų2778.6 Ų78.622%0.22343%0.43CS..Hα-helixtrans-58.8-39.7178.600000112.8L263 M523 L524L263-A527 WeakPolarHBondContact O-CB 3.3Å; M523-A527 WeakPolarHBondContact O-CB 3.49Å; M523-A527 PolarHBondContact O-N 2.95Å; L524-A527 PolarHBondContact O-N 3.24Å
528L86.1Confident76.5Confident126 Ų12678.5 Ų78.566%0.6644%0.435SS*.Hα-helixtrans-75.3-24.4177.9-68.3174.8000113.8L524 A525 I526L524-L528 HydrophobicContact CD1-CD1 4.16Å; L524-L528 HydrophobicContact CD1-CG 4.24Å; L524-L528 HydrophobicContact CG-CD1 4.05Å; L524-L528 WeakPolarHBondContact O-CB 3.43Å; L524-L528 VanDerWaalsContact O-CG 3.25Å; L524-L528 WeakPolarHBondContact O-CG 3.36Å; L524-L528 PolarHBondContact O-N 2.83Å; A525-L528 PolarHBondContact O-N 3.03Å; I526-L528 VanDerWaalsContact C-N 3.31Å; I526-L528 PolarHBondContact O-N 3.46Å
529L85.1Confident73.6Confident101 Ų10184 Ų8453%0.52946%0.459SS..Hα-helixtrans-95.3-3.8-179.1-88.479.4000113.2A525 I526 E531 R532 L533A525-L529 WeakPolarHBondContact O-CB 3.48Å; A525-L529 WeakPolarHBondContact O-CD1 3.2Å; A525-L529 PolarHBondContact O-N 2.94Å; I526-L529 PolarHBondContact O-N 3.42Å; I526-L529 VanDerWaalsContact O-N 3.1Å; L529-E531 VanDerWaalsContact C-N 3.31Å; L529-E531 PolarHBondContact O-N 3.19Å; L529-R532 CarbonylContact O-C 3.53Å; L529-R532 WeakPolarHBondContact O-CA 3.47Å; L529-R532 WeakPolarHBondContact O-CB 3.44Å; L529-R532 PolarHBondContact O-N 3.14Å; L529-L533 PolarHBondContact O-N 3.26Å
530E77.9Confident70.7Confident30 Ų3091.2 Ų91.214%0.1453%0.534CS..G310 helixtrans-53.8-44.9-176.6179.6153-145.800113.3H264 H268 S411 S415 I526 R532 L533H264-E530 IonicContact CD2-OE2 3.6Å; H268-E530 IonicContact CE1-OE1 3.75Å; H268-E530 PolarHBondContact CE1-OE1 3.11Å; H268-E530 IonicContact CE1-OE2 3.35Å; H268-E530 PolarHBondContact CE1-OE2 3.12Å; H268-E530 IonicContact NE2-OE1 3.9Å; H268-E530 PolarHBondContact NE2-OE1 3.48Å; H268-E530 VanDerWaalsContact NE2-OE1 3.14Å; H268-E530 IonicContact NE2-OE2 3.56Å; S411-E530 PolarHBondContact OG-O 2.97Å; S415-E530 VanDerWaalsContact CB-OE1 3.27Å; S415-E530 WeakPolarHBondContact CB-OE1 3.14Å; S415-E530 PolarHBondContact OG-OE1 3.44Å; I526-E530 PolarHBondContact O-N 3.12Å; E530-R532 PolarHBondContact O-N 3.23Å; E530-R532 VanDerWaalsContact O-N 3.12Å; E530-L533 WeakPolarHBondContact O-CB 3.21Å; E530-L533 PolarHBondContact O-N 3.13Å; E530-L533 VanDerWaalsContact O-N 3.12Å
531E67.4Low69.5Low162 Ų16294.7 Ų94.776%0.75755%0.549SS*.G310 helixtrans-66.9-14.2177.2-64.1-63.317000113.8L529L529-E531 VanDerWaalsContact C-N 3.31Å; L529-E531 PolarHBondContact O-N 3.19Å
532R69.8Low68.2Low212 Ų21297.7 Ų97.780%0.856%0.558SS**G310 helixtrans-100.7-5.3178.8-59-63.6-165.5-1770.2112.8L529 E530 L534L529-R532 CarbonylContact O-C 3.53Å; L529-R532 WeakPolarHBondContact O-CA 3.47Å; L529-R532 WeakPolarHBondContact O-CB 3.44Å; L529-R532 PolarHBondContact O-N 3.14Å; E530-R532 PolarHBondContact O-N 3.23Å; E530-R532 VanDerWaalsContact O-N 3.12Å; R532-L534 PolarHBondContact O-N 3.16Å
533L63.6Low66.8Low47 Ų4799.4 Ų99.425%0.24657%0.569CS.*  trans-76.38.3-179.3-77.3168.2000114.2L414 L418 L529 E530L414-L533 HydrophobicContact CD2-CD2 4.44Å; L418-L533 HydrophobicContact CD1-CD1 4.37Å; L418-L533 HydrophobicContact CD1-CD2 4.21Å; L529-L533 PolarHBondContact O-N 3.26Å; E530-L533 WeakPolarHBondContact O-CB 3.21Å; E530-L533 PolarHBondContact O-N 3.13Å; E530-L533 VanDerWaalsContact O-N 3.12Å
534L54.6Low65.2Low126 Ų126105.2 Ų105.266%0.6660%0.603SS**  trans-53.6136.7170.5-79163.5000111.3R532 V536R532-L534 PolarHBondContact O-N 3.16Å; L534-V536 PolarHBondContact O-N 3.46Å
535P49.2Very low63.5Low71 Ų71106.7 Ų106.746%0.46161%0.613SS.*  trans-67.1128.4176.429-32.4000109.2T537P535-T537 PolarHBondContact O-N 3.29Å
536V43.5Very low61.7Low151 Ų151110.9 Ų110.992%0.91563%0.631SS**SBendtrans-68.454.4167-175.20000109.4L534L534-V536 PolarHBondContact O-N 3.46Å
537T42.5Very low59.8Low101 Ų101117.6 Ų117.662%0.6267%0.669SS**  trans-141.367.6179.7610000109.8P535P535-T537 PolarHBondContact O-N 3.29Å
538T40.2Very low57.7Low133 Ų133124.5 Ų124.582%0.81670%0.703SS**  trans-179.373.3143.3450000109
539E36.5Very low55.4Low206 Ų206124.4 Ų124.496%0.96371%0.707SS**  trans-125.392.5151.1-77.2-82.4134.600104.1
540G34.1Very low52.7Low153 Ų153126.5 Ų126.5100%1.57772%0.723SS**  trans-1410179.600000109.9

Retrieved 540 of 540 residues in 100.7 ms (Link to these results)