A0A096MUI0_PAPAN Loading...

Retrotransposon Gag like 6

AlphaFold DB , UniProt , Accession A0A096MUI0, Species PAPAN (Papio anubis, Olive baboon), Gene RTL6, Length 239 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
1M36.3Very low42Very low240 Ų240149.4 Ų149.4100%1.18283%0.826SS**  0124.70-78.5157.577.700106.1
2V37Very low42.7Very low123 Ų123147.1 Ų147.175%0.74582%0.823SS**  cis-161.71345.9148.30000102.5
3Q39.4Very low42.9Very low160 Ų160142 Ų14275%0.74881%0.811SS**  trans-86.7156.6156.3-82.6-163.419.600108.4
4P50.3Low43.4Very low117 Ų117140.6 Ų140.676%0.7682%0.815SS**  -142.4146.9111.130.4-12.7000115.2
5Q42.9Very low43.8Very low158 Ų158137.5 Ų137.574%0.73881%0.812SS**  trans-62143.8165.1-70.6-90.532.500112.1
6T42Very low44.7Very low139 Ų139133.1 Ų133.185%0.85380%0.795SS**  trans-142.4124.3149.855.30000110.9
7S47Very low45.6Very low117 Ų117129.5 Ų129.582%0.81878%0.779SS**  trans-71.6146.5175-46.80000112.3
8K38.8Very low46.7Very low207 Ų207127.8 Ų127.890%0.977%0.771SS**  trans-164.2127148.9-143.8161.6179.8172.50115.4
9A41.7Very low47.6Very low86 Ų86127.4 Ų127.471%0.71176%0.764SS**  trans58.4111.1151.600000118
10E34.3Very low48.8Very low191 Ų191123.9 Ų123.989%0.89375%0.749SS**  51.894.266.6-159.6160.8115.500113.7
11S52.1Low50.3Low105 Ų105124.2 Ų124.273%0.73474%0.743SS**  trans27.4150.6147.1-130.70000121.1A13S11-A13 PolarHBondContact OG-N 3.16Å
12P50.3Low52.6Low122 Ų122118.2 Ų118.279%0.79271%0.713SS**  -142.1142.281.631.5-12.3000116.1
13A45.5Very low55.1Low81 Ų81116.7 Ų116.767%0.66970%0.701SS**  trans24.8112.8133.200000117.3S11 A15S11-A13 PolarHBondContact OG-N 3.16Å; A13-A15 PolarHBondContact O-N 3.03Å
14S50.1Low57.5Low123 Ų123113.9 Ų113.986%0.8669%0.691SS**  trans-47.8110.7155.7-169.90000109.2A16S14-A16 VanDerWaalsContact C-N 3.33Å; S14-A16 PolarHBondContact O-N 2.85Å
15A48.9Very low59.5Low94 Ų94112.1 Ų112.178%0.77768%0.678SS**  trans-65.994.4174.800000108.4A13 S17A13-A15 PolarHBondContact O-N 3.03Å; A15-S17 PolarHBondContact O-N 3.42Å; A15-S17 VanDerWaalsContact O-N 3.16Å
16A59.4Low61.9Low66 Ų66108.2 Ų108.255%0.54566%0.661SS.*  trans-57.6119.2164.400000107.3S14S14-A16 VanDerWaalsContact C-N 3.33Å; S14-A16 PolarHBondContact O-N 2.85Å
17S59.4Low64.4Low73 Ų73106.5 Ų106.551%0.5165%0.647SS.*  trans-57.3133.3-179.4-146.40000109A15 N19 A20 Q21A15-S17 PolarHBondContact O-N 3.42Å; A15-S17 VanDerWaalsContact O-N 3.16Å; S17-N19 PolarHBondContact O-N 2.9Å; S17-A20 WeakPolarHBondContact O-CB 3.4Å; S17-A20 PolarHBondContact O-N 3.46Å; S17-Q21 PolarHBondContact O-N 3.46Å
18P65Low66.7Low99 Ų99104.5 Ų104.564%0.64363%0.63SS**Hα-helixtrans-57.5-25.5-177.119.8-30.8000113.1M22P18-M22 PolarHBondContact O-N 3.24Å
19N63.6Low69.5Low120 Ų12098.5 Ų98.564%0.64261%0.607SS**Hα-helixtrans-65.6-39.8172.3-72.3-1.1000112.6S17 Q21 M22 D23S17-N19 PolarHBondContact O-N 2.9Å; N19-Q21 VanDerWaalsContact C-N 3.33Å; N19-Q21 PolarHBondContact O-N 3.04Å; N19-M22 PolarHBondContact O-N 3.41Å; N19-M22 VanDerWaalsContact O-N 3.16Å; N19-D23 PolarHBondContact O-N 2.95Å
20A71.6Confident72Confident56 Ų5697.3 Ų97.346%0.46359%0.591SS.*Hα-helixtrans-68.1-31.5-18000000112.6S17 D24S17-A20 WeakPolarHBondContact O-CB 3.4Å; S17-A20 PolarHBondContact O-N 3.46Å; A20-D24 PolarHBondContact O-N 3.3Å
21Q80.8Confident74.9Confident131 Ų13191.4 Ų91.461%0.61257%0.571SS**Hα-helixtrans-69.9-38.4171.2-87.6-172.23.700112.2S17 N19 D24 V25S17-Q21 PolarHBondContact O-N 3.46Å; N19-Q21 VanDerWaalsContact C-N 3.33Å; N19-Q21 PolarHBondContact O-N 3.04Å; Q21-D24 PolarHBondContact O-N 2.97Å; Q21-V25 VanDerWaalsContact O-CG2 3.29Å; Q21-V25 WeakPolarHBondContact O-CG2 3.24Å; Q21-V25 PolarHBondContact O-N 3.16Å
22M85.3Confident77Confident114 Ų11491.6 Ų91.656%0.56256%0.563SS**Hα-helixtrans-68-39178.6-170.565.9-177.700111.6P18 N19 V25 I26P18-M22 PolarHBondContact O-N 3.24Å; N19-M22 PolarHBondContact O-N 3.41Å; N19-M22 VanDerWaalsContact O-N 3.16Å; M22-V25 PolarHBondContact O-N 3.21Å; M22-I26 HydrophobicContact CE-CD1 4.47Å; M22-I26 HydrophobicContact CG-CD1 4.2Å; M22-I26 VanDerWaalsContact O-CG1 3.26Å; M22-I26 WeakPolarHBondContact O-CG1 3.29Å; M22-I26 PolarHBondContact O-N 3.32Å
23D88.6Confident79.3Confident92 Ų9293.8 Ų93.849%0.49256%0.556SS.*Hα-helixtrans-63.7-42.3175.2-68.3-36.6000111.5N19 V25 I26 D27N19-D23 PolarHBondContact O-N 2.95Å; D23-V25 VanDerWaalsContact C-N 3.34Å; D23-V25 PolarHBondContact O-N 3.46Å; D23-I26 PolarHBondContact O-N 3.16Å; D23-I26 VanDerWaalsContact O-N 3.14Å; D23-D27 PolarHBondContact O-N 2.87Å
24D89.8Confident81.7Confident101 Ų10195.5 Ų95.554%0.5455%0.553SS.*Hα-helixtrans-62.2-39173.8-176.570.6000112.4A20 Q21 I26 D27 T28A20-D24 PolarHBondContact O-N 3.3Å; Q21-D24 PolarHBondContact O-N 2.97Å; D24-I26 VanDerWaalsContact C-N 3.33Å; D24-I26 PolarHBondContact O-N 3.31Å; D24-D27 PolarHBondContact O-N 3.48Å; D24-T28 WeakPolarHBondContact O-CB 3.26Å; D24-T28 VanDerWaalsContact O-CG2 3.27Å; D24-T28 WeakPolarHBondContact O-CG2 3.27Å; D24-T28 PolarHBondContact O-N 3.05Å; D24-T28 PolarHBondContact O-OG1 3.43Å
25V92.6Very high83.8Confident80 Ų8093.2 Ų93.249%0.48553%0.534SS..Hα-helixtrans-65.6-37.1174172.60000111.5Q21 M22 D23 T28 L29Q21-V25 VanDerWaalsContact O-CG2 3.29Å; Q21-V25 WeakPolarHBondContact O-CG2 3.24Å; Q21-V25 PolarHBondContact O-N 3.16Å; M22-V25 PolarHBondContact O-N 3.21Å; D23-V25 VanDerWaalsContact C-N 3.34Å; D23-V25 PolarHBondContact O-N 3.46Å; V25-T28 VanDerWaalsContact CA-OG1 3.29Å; V25-T28 WeakPolarHBondContact CA-OG1 3.3Å; V25-T28 PolarHBondContact O-OG1 2.87Å; V25-L29 VanDerWaalsContact O-CB 3.24Å; V25-L29 WeakPolarHBondContact O-CB 3.29Å; V25-L29 PolarHBondContact O-N 2.88Å
26I94.1Very high86.1Confident75 Ų7592.1 Ų92.139%0.38552%0.515SS..Hα-helixtrans-68.4-43.1176.1-68.9164.4000110.4M22 D23 D24 L29 T30M22-I26 HydrophobicContact CE-CD1 4.47Å; M22-I26 HydrophobicContact CG-CD1 4.2Å; M22-I26 VanDerWaalsContact O-CG1 3.26Å; M22-I26 WeakPolarHBondContact O-CG1 3.29Å; M22-I26 PolarHBondContact O-N 3.32Å; D23-I26 PolarHBondContact O-N 3.16Å; D23-I26 VanDerWaalsContact O-N 3.14Å; D24-I26 VanDerWaalsContact C-N 3.33Å; D24-I26 PolarHBondContact O-N 3.31Å; I26-L29 PolarHBondContact O-N 2.93Å; I26-T30 HydrophobicContact CG2-CG2 4.41Å; I26-T30 VanDerWaalsContact O-CG2 3.27Å; I26-T30 WeakPolarHBondContact O-CG2 3.43Å; I26-T30 PolarHBondContact O-N 2.89Å; I26-T30 PolarHBondContact O-OG1 3.38Å
27D93.9Very high87.8Confident103 Ų10391.2 Ų91.255%0.55151%0.505SS*.Hα-helixtrans-65.4-41.5178.2-76.4-16.3000112.1D23 D24 T30 S31D23-D27 PolarHBondContact O-N 2.87Å; D24-D27 PolarHBondContact O-N 3.48Å; D27-T30 WeakPolarHBondContact CA-OG1 3.33Å; D27-T30 PolarHBondContact O-N 3.14Å; D27-T30 PolarHBondContact O-OG1 3.22Å; D27-S31 VanDerWaalsContact O-CB 3.3Å; D27-S31 WeakPolarHBondContact O-CB 3.27Å; D27-S31 PolarHBondContact O-N 3Å
28T95.1Very high89.6Confident76 Ų7689.9 Ų89.947%0.46650%0.498SS..Hα-helixtrans-65.4-40.9174.351.70000111.8D24 V25 S31 L32D24-T28 WeakPolarHBondContact O-CB 3.26Å; D24-T28 VanDerWaalsContact O-CG2 3.27Å; D24-T28 WeakPolarHBondContact O-CG2 3.27Å; D24-T28 PolarHBondContact O-N 3.05Å; D24-T28 PolarHBondContact O-OG1 3.43Å; V25-T28 VanDerWaalsContact CA-OG1 3.29Å; V25-T28 WeakPolarHBondContact CA-OG1 3.3Å; V25-T28 PolarHBondContact O-OG1 2.87Å; T28-S31 PolarHBondContact O-N 3.44Å; T28-L32 WeakPolarHBondContact O-CB 3.4Å; T28-L32 PolarHBondContact O-N 2.98Å
29L96.5Very high91Very high81 Ų8190.4 Ų90.442%0.42450%0.495SS..Hα-helixtrans-66-39.7176.9-169.9106.2000112.2V25 I26 L32 R33V25-L29 VanDerWaalsContact O-CB 3.24Å; V25-L29 WeakPolarHBondContact O-CB 3.29Å; V25-L29 PolarHBondContact O-N 2.88Å; I26-L29 PolarHBondContact O-N 2.93Å; L29-L32 PolarHBondContact O-N 3.08Å; L29-R33 VanDerWaalsContact CD2-CZ 3.42Å; L29-R33 WeakPolarHBondContact O-CB 3.35Å; L29-R33 VanDerWaalsContact O-CG 3.31Å; L29-R33 WeakPolarHBondContact O-CG 3.31Å; L29-R33 PolarHBondContact O-N 2.86Å
30T95.9Very high92.6Very high60 Ų6093 Ų9337%0.36850%0.496SS..Hα-helixtrans-68-44.1176.756.40000111.2I26 D27 L32 R33 L34I26-T30 HydrophobicContact CG2-CG2 4.41Å; I26-T30 VanDerWaalsContact O-CG2 3.27Å; I26-T30 WeakPolarHBondContact O-CG2 3.43Å; I26-T30 PolarHBondContact O-N 2.89Å; I26-T30 PolarHBondContact O-OG1 3.38Å; D27-T30 WeakPolarHBondContact CA-OG1 3.33Å; D27-T30 PolarHBondContact O-N 3.14Å; D27-T30 PolarHBondContact O-OG1 3.22Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 2.93Å; T30-R33 PolarHBondContact O-N 3.43Å; T30-L34 WeakPolarHBondContact O-CG 3.49Å; T30-L34 PolarHBondContact O-N 2.95Å
31S95.2Very high93.8Very high67 Ų6798.9 Ų98.947%0.46951%0.506SS..Hα-helixtrans-58.7-44.2173.3-177.40000112D27 T28 R33 L34 T35D27-S31 VanDerWaalsContact O-CB 3.3Å; D27-S31 WeakPolarHBondContact O-CB 3.27Å; D27-S31 PolarHBondContact O-N 3Å; T28-S31 PolarHBondContact O-N 3.44Å; S31-R33 PolarHBondContact O-N 2.93Å; S31-L34 PolarHBondContact O-N 3.49Å; S31-T35 WeakPolarHBondContact O-CG2 3.49Å; S31-T35 PolarHBondContact O-N 2.89Å; S31-T35 PolarHBondContact O-OG1 3.48Å; S31-T35 VanDerWaalsContact O-OG1 3.08Å
32L96.2Very high94.4Very high109 Ų10998.4 Ų98.457%0.57150%0.503SS*.Hα-helixtrans-64.9-38.5177.4-171.462.7000112.1T28 L29 T30 T35 N36T28-L32 WeakPolarHBondContact O-CB 3.4Å; T28-L32 PolarHBondContact O-N 2.98Å; L29-L32 PolarHBondContact O-N 3.08Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 2.93Å; L32-T35 WeakPolarHBondContact CA-OG1 3.39Å; L32-T35 PolarHBondContact O-OG1 2.95Å; L32-N36 WeakPolarHBondContact O-CB 3.33Å; L32-N36 PolarHBondContact O-N 3.4Å
33R96.8Very high94.8Very high168 Ų16894.4 Ų94.463%0.63449%0.488SS*.Hα-helixtrans-64.3-42.8174.8-78174.3173.5166.3-0.5112L29 T30 S31 N36 S37L29-R33 VanDerWaalsContact CD2-CZ 3.42Å; L29-R33 WeakPolarHBondContact O-CB 3.35Å; L29-R33 VanDerWaalsContact O-CG 3.31Å; L29-R33 WeakPolarHBondContact O-CG 3.31Å; L29-R33 PolarHBondContact O-N 2.86Å; T30-R33 PolarHBondContact O-N 3.43Å; S31-R33 PolarHBondContact O-N 2.93Å; R33-N36 PolarHBondContact O-N 3.27Å; R33-S37 WeakPolarHBondContact O-CB 3.24Å; R33-S37 PolarHBondContact O-N 3.47Å
34L96.3Very high95.2Very high118 Ų11893.1 Ų93.162%0.61849%0.487SS*.Hα-helixtrans-62.3-48.2177.3-71.4170.5000110.9T30 S31 N36 S37 A38T30-L34 WeakPolarHBondContact O-CG 3.49Å; T30-L34 PolarHBondContact O-N 2.95Å; S31-L34 PolarHBondContact O-N 3.49Å; L34-N36 PolarHBondContact O-N 3.37Å; L34-S37 PolarHBondContact O-N 3.44Å; L34-S37 PolarHBondContact O-OG 2.95Å; L34-A38 PolarHBondContact O-N 3.44Å
35T95.5Very high95.5Very high74 Ų7492.5 Ų92.545%0.45449%0.487SS..Hα-helixtrans-63-41.4177.453.50000112.3S31 L32 S37 A38 L39S31-T35 WeakPolarHBondContact O-CG2 3.49Å; S31-T35 PolarHBondContact O-N 2.89Å; S31-T35 PolarHBondContact O-OG1 3.48Å; S31-T35 VanDerWaalsContact O-OG1 3.08Å; L32-T35 WeakPolarHBondContact CA-OG1 3.39Å; L32-T35 PolarHBondContact O-OG1 2.95Å; T35-S37 VanDerWaalsContact C-N 3.3Å; T35-S37 PolarHBondContact O-N 2.92Å; T35-A38 PolarHBondContact O-N 2.68Å; T35-L39 WeakPolarHBondContact O-CB 3.43Å; T35-L39 PolarHBondContact O-N 3.17Å
36N95.6Very high95.6Very high72 Ų7294 Ų9439%0.38549%0.492SS..Hα-helixtrans-61.1-40.9174.4-132.6-82.8000111.6L32 R33 L34 R40L32-N36 WeakPolarHBondContact O-CB 3.33Å; L32-N36 PolarHBondContact O-N 3.4Å; R33-N36 PolarHBondContact O-N 3.27Å; L34-N36 PolarHBondContact O-N 3.37Å; N36-R40 WeakPolarHBondContact O-CB 3.36Å; N36-R40 VanDerWaalsContact O-CG 3.24Å; N36-R40 WeakPolarHBondContact O-CG 3.39Å; N36-R40 PolarHBondContact O-N 2.94Å; N36-R40 PolarHBondContact OD1-NE 3.04Å
37S96.6Very high95.8Very high47 Ų4798.6 Ų98.633%0.32950%0.504SS..Hα-helixtrans-66.3-38.5177.779.20000112.3R33 L34 T35 R40 R41R33-S37 WeakPolarHBondContact O-CB 3.24Å; R33-S37 PolarHBondContact O-N 3.47Å; L34-S37 PolarHBondContact O-N 3.44Å; L34-S37 PolarHBondContact O-OG 2.95Å; T35-S37 VanDerWaalsContact C-N 3.3Å; T35-S37 PolarHBondContact O-N 2.92Å; S37-R40 PolarHBondContact O-N 2.88Å; S37-R41 WeakPolarHBondContact O-CG 3.47Å; S37-R41 PolarHBondContact O-N 3.45Å; S37-R41 VanDerWaalsContact O-N 3.11Å
38A95.6Very high95.9Very high44 Ų4496.7 Ų96.736%0.36450%0.502SS..Hα-helixtrans-65.2-47.7175.800000111.3L34 T35 R40 R41 E42L34-A38 PolarHBondContact O-N 3.44Å; T35-A38 PolarHBondContact O-N 2.68Å; A38-R40 VanDerWaalsContact C-N 3.28Å; A38-R40 PolarHBondContact O-N 3.38Å; A38-R41 WeakPolarHBondContact O-CB 3.3Å; A38-R41 PolarHBondContact O-N 3.32Å; A38-E42 PolarHBondContact O-N 3.26Å
39L95.5Very high95.8Very high110 Ų11098.2 Ų98.258%0.57650%0.504SS*.Hα-helixtrans-61.7-37178.1-172.164.7000112.1T35 E42 A43T35-L39 WeakPolarHBondContact O-CB 3.43Å; T35-L39 PolarHBondContact O-N 3.17Å; L39-E42 PolarHBondContact O-N 3.32Å; L39-A43 VanDerWaalsContact O-CB 3.3Å; L39-A43 WeakPolarHBondContact O-CB 3.49Å; L39-A43 PolarHBondContact O-N 3.34Å
40R96.5Very high95.6Very high176 Ų176101.5 Ų101.566%0.66452%0.515SS*.Hα-helixtrans-64.2-39.3173.9-74.8173.9-171.7-155.80.2112.2N36 S37 A38 A43 S44N36-R40 WeakPolarHBondContact O-CB 3.36Å; N36-R40 VanDerWaalsContact O-CG 3.24Å; N36-R40 WeakPolarHBondContact O-CG 3.39Å; N36-R40 PolarHBondContact O-N 2.94Å; N36-R40 PolarHBondContact OD1-NE 3.04Å; S37-R40 PolarHBondContact O-N 2.88Å; A38-R40 VanDerWaalsContact C-N 3.28Å; A38-R40 PolarHBondContact O-N 3.38Å; R40-A43 PolarHBondContact O-N 3.02Å; R40-S44 WeakPolarHBondContact O-CB 3.4Å; R40-S44 PolarHBondContact O-N 3.11Å
41R96.4Very high95.5Very high179 Ų179100.9 Ų100.968%0.67552%0.516SS*.Hα-helixtrans-63.7-49.4175.3-72174.6-179.3176.21.1110.7S37 A38 A43 S44 T45S37-R41 WeakPolarHBondContact O-CG 3.47Å; S37-R41 PolarHBondContact O-N 3.45Å; S37-R41 VanDerWaalsContact O-N 3.11Å; A38-R41 WeakPolarHBondContact O-CB 3.3Å; A38-R41 PolarHBondContact O-N 3.32Å; R41-A43 VanDerWaalsContact C-N 3.32Å; R41-A43 PolarHBondContact O-N 2.92Å; R41-S44 WeakPolarHBondContact O-CA 3.46Å; R41-S44 WeakPolarHBondContact O-CB 3.48Å; R41-S44 PolarHBondContact O-N 3.46Å; R41-S44 PolarHBondContact O-OG 2.98Å; R41-T45 PolarHBondContact O-N 3.09Å; R41-T45 PolarHBondContact O-OG1 3.3Å; R41-T45 VanDerWaalsContact O-OG1 3.09Å
42E94.7Very high95.6Very high120 Ų120102.2 Ų102.256%0.56152%0.518SS*.Hα-helixtrans-57.5-45.6176.4-70.4-179.4-176.400112.1A38 L39 S44 T45 L46A38-E42 PolarHBondContact O-N 3.26Å; L39-E42 PolarHBondContact O-N 3.32Å; E42-S44 PolarHBondContact O-N 2.62Å; E42-T45 PolarHBondContact O-N 3.32Å; E42-T45 VanDerWaalsContact O-N 3.17Å; E42-L46 PolarHBondContact O-N 2.94Å
43A93.9Very high95.6Very high30 Ų30101.6 Ų101.625%0.24852%0.515CS..Hα-helixtrans-65.7-27.1177.400000112.6L39 R40 R41 R47L39-A43 VanDerWaalsContact O-CB 3.3Å; L39-A43 WeakPolarHBondContact O-CB 3.49Å; L39-A43 PolarHBondContact O-N 3.34Å; R40-A43 PolarHBondContact O-N 3.02Å; R41-A43 VanDerWaalsContact C-N 3.32Å; R41-A43 PolarHBondContact O-N 2.92Å; A43-R47 VanDerWaalsContact C-NH1 3.33Å; A43-R47 VanDerWaalsContact CB-NH1 3.29Å; A43-R47 WeakPolarHBondContact O-CB 3.23Å; A43-R47 VanDerWaalsContact O-CG 3.23Å; A43-R47 WeakPolarHBondContact O-CG 3.42Å; A43-R47 PolarHBondContact O-N 2.93Å; A43-R47 PolarHBondContact O-NH1 3.29Å
44S95.4Very high95.4Very high65 Ų6597 Ų9746%0.45551%0.506SS..Hα-helixtrans-73.8-40.9172.673.80000111.7R40 R41 E42 R47 A48R40-S44 WeakPolarHBondContact O-CB 3.4Å; R40-S44 PolarHBondContact O-N 3.11Å; R41-S44 WeakPolarHBondContact O-CA 3.46Å; R41-S44 WeakPolarHBondContact O-CB 3.48Å; R41-S44 PolarHBondContact O-N 3.46Å; R41-S44 PolarHBondContact O-OG 2.98Å; E42-S44 PolarHBondContact O-N 2.62Å; S44-R47 PolarHBondContact O-N 3.01Å; S44-A48 PolarHBondContact O-N 3.37Å
45T96.8Very high95.4Very high89 Ų8996.1 Ų96.155%0.54650%0.501SS..Hα-helixtrans-62.3-48.6176.3-53.10000111.2R41 E42 R47 A48 E49R41-T45 PolarHBondContact O-N 3.09Å; R41-T45 PolarHBondContact O-OG1 3.3Å; R41-T45 VanDerWaalsContact O-OG1 3.09Å; E42-T45 PolarHBondContact O-N 3.32Å; E42-T45 VanDerWaalsContact O-N 3.17Å; T45-R47 VanDerWaalsContact C-N 3.29Å; T45-R47 PolarHBondContact O-N 3.49Å; T45-A48 WeakPolarHBondContact O-CB 3.47Å; T45-A48 PolarHBondContact O-N 3.3Å; T45-A48 VanDerWaalsContact O-N 3.11Å; T45-E49 PolarHBondContact O-N 3.46Å
46L95.4Very high95.4Very high112 Ų11297.7 Ų97.759%0.58651%0.505SS*.Hα-helixtrans-62.3-36.2177.4-73.9170.2000112.3E42 K50E42-L46 PolarHBondContact O-N 2.94Å; L46-K50 WeakPolarHBondContact O-CB 3.09Å; L46-K50 PolarHBondContact O-N 3.3Å
47R96.9Very high95.3Very high171 Ų17199.3 Ų99.365%0.64551%0.513SS*.Hα-helixtrans-66.5-40.8173.9-79.9-177.1-169.391.5-5.9111.9A43 S44 T45 K50 A51A43-R47 VanDerWaalsContact C-NH1 3.33Å; A43-R47 VanDerWaalsContact CB-NH1 3.29Å; A43-R47 WeakPolarHBondContact O-CB 3.23Å; A43-R47 VanDerWaalsContact O-CG 3.23Å; A43-R47 WeakPolarHBondContact O-CG 3.42Å; A43-R47 PolarHBondContact O-N 2.93Å; A43-R47 PolarHBondContact O-NH1 3.29Å; S44-R47 PolarHBondContact O-N 3.01Å; T45-R47 VanDerWaalsContact C-N 3.29Å; T45-R47 PolarHBondContact O-N 3.49Å; R47-K50 PolarHBondContact O-N 3.17Å; R47-A51 WeakPolarHBondContact O-CB 3.48Å; R47-A51 PolarHBondContact O-N 2.93Å
48A96Very high95Very high62 Ų62102.8 Ų102.851%0.51252%0.524SS..Hα-helixtrans-65-42.4176.500000111.5S44 T45 A51 N52S44-A48 PolarHBondContact O-N 3.37Å; T45-A48 WeakPolarHBondContact O-CB 3.47Å; T45-A48 PolarHBondContact O-N 3.3Å; T45-A48 VanDerWaalsContact O-N 3.11Å; A48-A51 PolarHBondContact O-N 2.92Å; A48-N52 WeakPolarHBondContact O-CB 2.94Å; A48-N52 PolarHBondContact O-N 3.24Å
49E94.1Very high95Very high108 Ų108104.2 Ų104.251%0.50553%0.531SS..Hα-helixtrans-63.2-45.4175.4-171.9-177173.100111.5T45 A51 N52 L53T45-E49 PolarHBondContact O-N 3.46Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 2.89Å; E49-N52 WeakPolarHBondContact O-CB 3.31Å; E49-N52 PolarHBondContact O-N 3.24Å; E49-L53 WeakPolarHBondContact O-CG 3.34Å; E49-L53 PolarHBondContact O-N 3.39Å
50K92.8Very high94.9Very high151 Ų151102.6 Ų102.666%0.65753%0.526SS*.Hα-helixtrans-58.6-44.7173.9-178.9-179174179.30111.5L46 R47 N52 L53 T54L46-K50 WeakPolarHBondContact O-CB 3.09Å; L46-K50 PolarHBondContact O-N 3.3Å; R47-K50 PolarHBondContact O-N 3.17Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.27Å; K50-L53 PolarHBondContact O-N 2.86Å; K50-T54 WeakPolarHBondContact O-CB 3.19Å; K50-T54 PolarHBondContact O-N 3.43Å; K50-T54 PolarHBondContact O-OG1 3.37Å
51A94.3Very high94.5Very high47 Ų4799 Ų9939%0.38852%0.518SS..Hα-helixtrans-61.9-42.3177.100000111.1R47 A48 E49 T54 N55R47-A51 WeakPolarHBondContact O-CB 3.48Å; R47-A51 PolarHBondContact O-N 2.93Å; A48-A51 PolarHBondContact O-N 2.92Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 2.89Å; A51-T54 PolarHBondContact O-N 3.45Å; A51-N55 WeakPolarHBondContact O-CB 3.46Å; A51-N55 PolarHBondContact O-N 3.19Å; A51-N55 PolarHBondContact O-ND2 2.78Å; A51-N55 PolarHBondContact O-OD1 2.85Å
52N96.2Very high94.3Very high95 Ų9593.4 Ų93.451%0.50851%0.509SS..Hα-helixtrans-60.6-46.9175.9-173.640.8000112.3A48 E49 K50 T54 N55 M56A48-N52 WeakPolarHBondContact O-CB 2.94Å; A48-N52 PolarHBondContact O-N 3.24Å; E49-N52 WeakPolarHBondContact O-CB 3.31Å; E49-N52 PolarHBondContact O-N 3.24Å; K50-N52 VanDerWaalsContact C-N 3.32Å; K50-N52 PolarHBondContact O-N 3.27Å; N52-T54 VanDerWaalsContact C-N 3.3Å; N52-T54 PolarHBondContact O-N 3.29Å; N52-N55 PolarHBondContact O-N 3.34Å; N52-M56 WeakPolarHBondContact O-CB 3.41Å; N52-M56 PolarHBondContact O-N 2.89Å
53L96.1Very high94.1Very high96 Ų9692.6 Ų92.650%0.50351%0.506SS..Hα-helixtrans-62.7-38.3175.4-69.7175.2000112.2E49 K50 M56 L57E49-L53 WeakPolarHBondContact O-CG 3.34Å; E49-L53 PolarHBondContact O-N 3.39Å; K50-L53 PolarHBondContact O-N 2.86Å; L53-M56 PolarHBondContact O-N 3.05Å; L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 PolarHBondContact O-N 2.84Å
54T93.6Very high93.6Very high72 Ų7296.6 Ų96.644%0.44252%0.522SS..Hα-helixtrans-64.8-45.3177.8-50.80000110.6K50 A51 N52 M56 L57 E58K50-T54 WeakPolarHBondContact O-CB 3.19Å; K50-T54 PolarHBondContact O-N 3.43Å; K50-T54 PolarHBondContact O-OG1 3.37Å; A51-T54 PolarHBondContact O-N 3.45Å; N52-T54 VanDerWaalsContact C-N 3.3Å; N52-T54 PolarHBondContact O-N 3.29Å; T54-M56 VanDerWaalsContact C-N 3.33Å; T54-M56 PolarHBondContact O-N 2.83Å; T54-L57 PolarHBondContact O-N 3.4Å; T54-E58 PolarHBondContact O-N 3.11Å
55N95.4Very high93.2Very high98 Ų9897.5 Ų97.552%0.52453%0.525SS..Hα-helixtrans-63.6-38.8176.3-65.4-15000111.8A51 N52 E58 S59A51-N55 WeakPolarHBondContact O-CB 3.46Å; A51-N55 PolarHBondContact O-N 3.19Å; A51-N55 PolarHBondContact O-ND2 2.78Å; A51-N55 PolarHBondContact O-OD1 2.85Å; N52-N55 PolarHBondContact O-N 3.34Å; N55-E58 PolarHBondContact O-N 2.82Å; N55-S59 WeakPolarHBondContact O-CB 3.32Å; N55-S59 PolarHBondContact O-N 2.79Å
56M94.9Very high92.7Very high107 Ų10798.1 Ų98.153%0.52753%0.525SS..Hα-helixtrans-64-43.3175.5-172.6-174.4-62.600111.5N52 L53 T54 S59 V60N52-M56 WeakPolarHBondContact O-CB 3.41Å; N52-M56 PolarHBondContact O-N 2.89Å; L53-M56 PolarHBondContact O-N 3.05Å; T54-M56 VanDerWaalsContact C-N 3.33Å; T54-M56 PolarHBondContact O-N 2.83Å; M56-S59 PolarHBondContact O-N 2.9Å; M56-V60 WeakPolarHBondContact O-CG2 3.26Å; M56-V60 PolarHBondContact O-N 2.9Å
57L93.5Very high92.1Very high106 Ų10698 Ų9856%0.55552%0.524SS*.Hα-helixtrans-62.2-44.9175.8179.661.9000111.3L53 T54 S59 V60 M61L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 PolarHBondContact O-N 2.84Å; T54-L57 PolarHBondContact O-N 3.4Å; L57-S59 VanDerWaalsContact C-N 3.34Å; L57-S59 PolarHBondContact O-N 3.11Å; L57-V60 PolarHBondContact O-N 3.49Å; L57-M61 HydrophobicContact CD1-CG 4.44Å; L57-M61 HydrophobicContact CG-CE 4.27Å; L57-M61 WeakPolarHBondContact O-CG 3.27Å; L57-M61 PolarHBondContact O-N 3.5Å
58E92Very high91.4Very high121 Ų12198.9 Ų98.957%0.56553%0.527SS*.Hα-helixtrans-61.8-41.5177.1-170169.7-16800111.9T54 N55 M61 A62T54-E58 PolarHBondContact O-N 3.11Å; N55-E58 PolarHBondContact O-N 2.82Å; E58-M61 PolarHBondContact O-N 3.47Å; E58-A62 WeakPolarHBondContact O-CB 3.34Å; E58-A62 PolarHBondContact O-N 2.87Å
59S93.7Very high90.4Very high73 Ų73100 Ų10051%0.5153%0.528SS..Hα-helixtrans-60.9-46.1174.5175.20000112.5N55 M56 L57 M61 A62 E63N55-S59 WeakPolarHBondContact O-CB 3.32Å; N55-S59 PolarHBondContact O-N 2.79Å; M56-S59 PolarHBondContact O-N 2.9Å; L57-S59 VanDerWaalsContact C-N 3.34Å; L57-S59 PolarHBondContact O-N 3.11Å; S59-M61 VanDerWaalsContact C-N 3.34Å; S59-M61 PolarHBondContact O-N 3.35Å; S59-A62 PolarHBondContact O-N 3.28Å; S59-E63 PolarHBondContact O-N 2.93Å
60V93.9Very high89.2Confident77 Ų77105.7 Ų105.747%0.46755%0.545SS..Hα-helixtrans-65.4-38.5177.3173.10000111.3M56 L57 E63 L64M56-V60 WeakPolarHBondContact O-CG2 3.26Å; M56-V60 PolarHBondContact O-N 2.9Å; L57-V60 PolarHBondContact O-N 3.49Å; V60-E63 PolarHBondContact O-N 3.18Å; V60-L64 HydrophobicContact CG1-CD1 4.22Å; V60-L64 WeakPolarHBondContact O-CG 3.19Å; V60-L64 PolarHBondContact O-N 3.46Å
61M89.6Confident87.8Confident101 Ų101102.5 Ų102.550%0.49855%0.547SS..Hα-helixtrans-65.3-39.3174.9-72.6-168-57.800112.3L57 E58 S59 L64 T65L57-M61 HydrophobicContact CD1-CG 4.44Å; L57-M61 HydrophobicContact CG-CE 4.27Å; L57-M61 WeakPolarHBondContact O-CG 3.27Å; L57-M61 PolarHBondContact O-N 3.5Å; E58-M61 PolarHBondContact O-N 3.47Å; S59-M61 VanDerWaalsContact C-N 3.34Å; S59-M61 PolarHBondContact O-N 3.35Å; M61-L64 PolarHBondContact O-N 2.87Å; M61-T65 WeakPolarHBondContact O-CB 3.39Å; M61-T65 PolarHBondContact O-N 2.9Å; M61-T65 PolarHBondContact O-OG1 2.86Å
62A90.9Very high86.2Confident60 Ų60109.7 Ų109.750%0.49656%0.564SS.*Hα-helixtrans-64.3-43.4175.800000111.6E58 S59 T65 L66E58-A62 WeakPolarHBondContact O-CB 3.34Å; E58-A62 PolarHBondContact O-N 2.87Å; S59-A62 PolarHBondContact O-N 3.28Å; A62-T65 WeakPolarHBondContact O-CB 3.44Å; A62-T65 PolarHBondContact O-N 2.62Å; A62-L66 PolarHBondContact O-N 3.35Å
63E89.9Confident84Confident104 Ų104112.5 Ų112.549%0.48658%0.577SS.*Hα-helixtrans-60.4-49.6174-84.5-65164.300112S59 V60 T65 L66 L67S59-E63 PolarHBondContact O-N 2.93Å; V60-E63 PolarHBondContact O-N 3.18Å; E63-T65 PolarHBondContact O-N 2.79Å; E63-L66 PolarHBondContact O-N 2.97Å; E63-L66 VanDerWaalsContact O-N 3.09Å; E63-L67 WeakPolarHBondContact O-CD1 3.31Å; E63-L67 PolarHBondContact O-N 3.4Å
64L84.3Confident81.7Confident114 Ų114114.1 Ų114.160%0.59759%0.593SS**Hα-helixtrans-59.8-35.3176.1-72.3175000112.3V60 M61 R68V60-L64 HydrophobicContact CG1-CD1 4.22Å; V60-L64 WeakPolarHBondContact O-CG 3.19Å; V60-L64 PolarHBondContact O-N 3.46Å; M61-L64 PolarHBondContact O-N 2.87Å; L64-R68 VanDerWaalsContact O-CB 3.27Å; L64-R68 WeakPolarHBondContact O-CB 3.25Å; L64-R68 PolarHBondContact O-N 3.41Å
65T86.1Confident79.4Confident84 Ų84113.9 Ų113.952%0.51561%0.605SS.*Hα-helixtrans-67.9-41.1175.8-57.70000111.2M61 A62 E63 R68 T69M61-T65 WeakPolarHBondContact O-CB 3.39Å; M61-T65 PolarHBondContact O-N 2.9Å; M61-T65 PolarHBondContact O-OG1 2.86Å; A62-T65 WeakPolarHBondContact O-CB 3.44Å; A62-T65 PolarHBondContact O-N 2.62Å; E63-T65 PolarHBondContact O-N 2.79Å; T65-R68 PolarHBondContact O-N 3.1Å; T65-T69 WeakPolarHBondContact O-CG2 3.48Å; T65-T69 PolarHBondContact O-N 3.29Å; T65-T69 PolarHBondContact O-OG1 2.97Å
66L87.1Confident76.6Confident102 Ų102114.2 Ų114.253%0.53462%0.622SS.*Hα-helixtrans-65.9-43176.3-175.167.5000112.2A62 E63 R68 T69 R70A62-L66 PolarHBondContact O-N 3.35Å; E63-L66 PolarHBondContact O-N 2.97Å; E63-L66 VanDerWaalsContact O-N 3.09Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 2.96Å; L66-T69 WeakPolarHBondContact CA-OG1 3.33Å; L66-T69 PolarHBondContact O-N 3.47Å; L66-T69 PolarHBondContact O-OG1 2.91Å; L66-R70 WeakPolarHBondContact O-CB 3.46Å; L66-R70 PolarHBondContact O-N 3.47Å
67L83.4Confident74.1Confident108 Ų108116.4 Ų116.457%0.56564%0.635SS**Hα-helixtrans-62.6-38.2174-85.890.3000111.3E63 A71E63-L67 WeakPolarHBondContact O-CD1 3.31Å; E63-L67 PolarHBondContact O-N 3.4Å; L67-A71 WeakPolarHBondContact O-CB 3.42Å; L67-A71 PolarHBondContact O-N 3.07Å
68R80.9Confident71.9Confident190 Ų190119.2 Ų119.272%0.71765%0.645SS**Hα-helixtrans-68-39.2177.7-173179.3-176.591.3-0.1112.8L64 T65 L66 R72L64-R68 VanDerWaalsContact O-CB 3.27Å; L64-R68 WeakPolarHBondContact O-CB 3.25Å; L64-R68 PolarHBondContact O-N 3.41Å; T65-R68 PolarHBondContact O-N 3.1Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 2.96Å; R68-R72 PolarHBondContact O-N 3.34Å
69T75.1Confident69.1Low87 Ų87121.2 Ų121.253%0.53466%0.658SS.*Hα-helixtrans-70.9-38.6176.653.40000111.4T65 L66 A71 R72T65-T69 WeakPolarHBondContact O-CG2 3.48Å; T65-T69 PolarHBondContact O-N 3.29Å; T65-T69 PolarHBondContact O-OG1 2.97Å; L66-T69 WeakPolarHBondContact CA-OG1 3.33Å; L66-T69 PolarHBondContact O-N 3.47Å; L66-T69 PolarHBondContact O-OG1 2.91Å; T69-A71 VanDerWaalsContact C-N 3.3Å; T69-A71 PolarHBondContact O-N 2.97Å; T69-R72 PolarHBondContact O-N 2.93Å; T69-R72 VanDerWaalsContact O-N 3.09Å
70R70.3Confident66.6Low226 Ų226123.6 Ų123.685%0.85367%0.67SS**Hα-helixtrans-67.8-28176.4-165.3161.2-179.5113.8-2.8113.4L66 R72L66-R70 WeakPolarHBondContact O-CB 3.46Å; L66-R70 PolarHBondContact O-N 3.47Å; R70-R72 VanDerWaalsContact C-N 3.3Å
71A62.1Low64.8Low84 Ų84125.5 Ų125.569%0.69468%0.683SS**THydrogen-bonded Turntrans-79.6-6.6172.600000114L67 T69L67-A71 WeakPolarHBondContact O-CB 3.42Å; L67-A71 PolarHBondContact O-N 3.07Å; T69-A71 VanDerWaalsContact C-N 3.3Å; T69-A71 PolarHBondContact O-N 2.97Å
72R61Low62.9Low199 Ų199126.4 Ų126.475%0.75170%0.697SS**  trans-97.7103.9-179.7-162169.4-168.1159.72.1110R68 T69 R70 P74R68-R72 PolarHBondContact O-N 3.34Å; T69-R72 PolarHBondContact O-N 2.93Å; T69-R72 VanDerWaalsContact O-N 3.09Å; R70-R72 VanDerWaalsContact C-N 3.3Å; R72-P74 WeakPolarHBondContact O-CD 3.48Å
73I49.6Very low61.1Low153 Ų153131.1 Ų131.179%0.78571%0.712SS**  trans-62.8122.3171.6-55.1171000108.6G75I73-G75 PolarHBondContact O-N 3.27Å
74P49.4Very low58.9Low130 Ų130131.4 Ų131.484%0.84473%0.726SS**  trans-86.5104.2169.117.2-2.5000108.8R72R72-P74 WeakPolarHBondContact O-CD 3.48Å
75G44.3Very low56.7Low67 Ų67130.3 Ų130.369%0.69173%0.733SS**  trans159.196.3170.100000114I73I73-G75 PolarHBondContact O-N 3.27Å
76A37.5Very low55Low105 Ų105134.4 Ų134.487%0.86875%0.75SS**  trans-173.6105.4134.300000108.9
77L41Very low52.7Low153 Ų153135.9 Ų135.980%0.80176%0.763SS**  trans-62.7140.1164.9-87.8166.7000110.7
78Q47.2Very low51.1Low166 Ų166136 Ų13678%0.77677%0.773SS**  trans65.7133.9155-43.4-80.216.800114.8
79I34.8Very low49.5Very low162 Ų162134.6 Ų134.683%0.83178%0.78SS**  -177.6133.771.4-72.6156.7000106.6
80T39.6Very low47.8Very low124 Ų124134 Ų13476%0.76179%0.792SS**  trans-87.3167.3155.544.50000110.3
81P57.1Low46.6Very low116 Ų116129.9 Ų129.975%0.75379%0.792SS**  cis-124.8-154.1-3739-18.5000109
82P49.6Very low45.7Very low120 Ų120134.9 Ų134.978%0.77979%0.792SS**  cis-131-179.1-2.641.4-20.8000116.8
83I52.3Low45Very low159 Ų159130.9 Ų130.982%0.81579%0.792SS**  trans-40.1126.8-178.7-56.1156.7000115.6
84S45Very low44.6Very low111 Ų111132.5 Ų132.578%0.77680%0.799SS**  165.6150.7121.2-76.70000112.8
85A36.5Very low44.3Very low90 Ų90130.4 Ų130.474%0.74478%0.783SS**  trans81.393.3163.600000118.2T87A85-T87 PolarHBondContact O-N 3.21Å
86I50.8Low44.6Very low170 Ų170130.9 Ų130.987%0.87277%0.773SS**  11.8102129-48.5165.9000114.2
87T39.9Very low45.3Very low134 Ų134129.9 Ų129.982%0.82276%0.758SS**  trans-147.1127.3133.840.80000108.2A85 N89A85-T87 PolarHBondContact O-N 3.21Å; T87-N89 PolarHBondContact O-N 3.37Å
88S48.1Very low45.9Very low109 Ų109128 Ų12876%0.76276%0.755SS**  trans-46.4130.5169.5-167.40000109.9
89N48.2Very low46.7Very low161 Ų161121.4 Ų121.486%0.86173%0.726SS**  trans179.769.6151.1-84.6-12.5000109.1T87T87-N89 PolarHBondContact O-N 3.37Å
90G39.3Very low48.7Very low76 Ų76118.5 Ų118.578%0.78472%0.72SS**  trans-86.4107.7168.900000109.9R92G90-R92 PolarHBondContact O-N 3.35Å
91T44.5Very low51Low139 Ų139116.9 Ų116.985%0.85371%0.706SS**  trans-45.3111.9170.8-42.70000110.2P93T91-P93 VanDerWaalsContact O-CD 3.28Å; T91-P93 WeakPolarHBondContact O-CD 3.38Å
92R44.3Very low52.7Low188 Ų188111.5 Ų111.571%0.70967%0.671SS**  trans-64.3116.6-178.9-171.6179.2-167.4-169.61.9109.5G90 T95G90-R92 PolarHBondContact O-N 3.35Å; R92-T95 VanDerWaalsContact NE-CG2 3.32Å; R92-T95 VanDerWaalsContact NH1-CG2 3.26Å
93P45.5Very low54.7Low115 Ų115112 Ų11275%0.74766%0.663SS**  trans-68.2138.2168.1-7.223000108.8T91 T95T91-P93 VanDerWaalsContact O-CD 3.28Å; T91-P93 WeakPolarHBondContact O-CD 3.38Å; P93-T95 PolarHBondContact O-N 3.17Å
94M40.8Very low56.7Low188 Ų188107.9 Ų107.993%0.92665%0.647SS**  trans0.6110.1171.5-103.7-179.4163.400115.7T96M94-T96 PolarHBondContact O-N 2.94Å
95T43.3Very low59.1Low85 Ų85102.6 Ų102.652%0.52161%0.61SS.*  trans-62.295.5171.642.50000111R92 P93R92-T95 VanDerWaalsContact NE-CG2 3.32Å; R92-T95 VanDerWaalsContact NH1-CG2 3.26Å; P93-T95 PolarHBondContact O-N 3.17Å
96T51.1Low61.8Low77 Ų77100.8 Ų100.847%0.47259%0.592SS.*  trans-51.8130142.852.70000106.4M94M94-T96 PolarHBondContact O-N 2.94Å
97P51.7Low63.7Low84 Ų8493.2 Ų93.255%0.54556%0.555SS.*  trans-50.6136.4173.119.4-29.1000107.9T99P97-T99 VanDerWaalsContact C-N 3.33Å; P97-T99 PolarHBondContact O-N 3.2Å
98P54.5Low66.1Low115 Ų11590.3 Ų90.375%0.74754%0.535SS*.  trans-60.7101.5-178.923-30.1000107.6S100P98-S100 VanDerWaalsContact C-N 3.31Å; P98-S100 PolarHBondContact O-N 3.41Å
99T63.9Low68Low26 Ų2686.9 Ų86.916%0.1651%0.51CS..  trans-60.7105.5160.923.60000105.2P97 L101 R121 F125P97-T99 VanDerWaalsContact C-N 3.33Å; P97-T99 PolarHBondContact O-N 3.2Å; T99-L101 PolarHBondContact O-N 3.49Å; T99-R121 HydrophobicContact CG2-CG 4.21Å; T99-F125 HydrophobicContact CG2-CB 3.65Å; T99-F125 HydrophobicContact CG2-CD2 3.22Å; T99-F125 HydrophobicContact CG2-CE2 3.99Å; T99-F125 HydrophobicContact CG2-CG 3.58Å
100S77.9Confident69.9Low101 Ų10182.4 Ų82.471%0.70650%0.501SS*.PPolyproline II helixtrans-48.6135.6170.751.70000108.2P98P98-S100 VanDerWaalsContact C-N 3.31Å; P98-S100 PolarHBondContact O-N 3.41Å
101L87.4Confident72.3Confident90 Ų9083.3 Ų83.347%0.47149%0.485SS..PPolyproline II helixtrans-54.8133.5175.9-170.867.3000108.3T99 F122 F139T99-L101 PolarHBondContact O-N 3.49Å; L101-F122 HydrophobicContact CD1-CE2 4.16Å; L101-F122 HydrophobicContact CD1-CZ 4.17Å; L101-F139 HydrophobicContact CD1-CE2 3.74Å; L101-F139 HydrophobicContact CD1-CZ 3.65Å
102P91.4Very high74.7Confident4 Ų477 Ų773%0.02645%0.446CS..PPolyproline II helixtrans-58.2143.4179.9-30.741.1000111.8Q118 M119 F122P102-Q118 HydrophobicContact CB-CB 3.84Å; P102-Q118 HydrophobicContact CG-CB 4.23Å; P102-M119 HydrophobicContact CB-CE 3.03Å; P102-M119 HydrophobicContact CG-CE 3.24Å; P102-F122 HydrophobicContact CG-CB 3.71Å; P102-F122 HydrophobicContact CG-CD2 4.2Å; P102-F122 HydrophobicContact CG-CG 4Å
103E92.4Very high77Confident130 Ų13071.7 Ų71.761%0.60744%0.443SS*.PPolyproline II helixtrans-64.4143.5179.7-69.3-174.2159.800110.6F115E103-F115 WeakPolarHBondContact O-CD2 2.97Å
104P94.6Very high79.1Confident72 Ų7267.8 Ų67.847%0.46842%0.424SS..PPolyproline II helixtrans-65.1139179-18.130.4000112.3R143 T145P104-R143 CarbonylContact C-O 3.55Å; P104-R143 WeakPolarHBondContact CA-O 3.43Å; P104-T145 HydrophobicContact CB-CG2 3.6Å
105F95.4Very high81.7Confident1 Ų159.2 Ų59.20%0.00438%0.381CS..BIsolated β-bridgetrans-102.9116.8178.6178.4-110.6000111.4G107 D108 Q111 L112 F115 R143 L144 T145 A148 L173 Y177F105-G107 VanDerWaalsContact CE1-CA 3.49Å; F105-G107 VanDerWaalsContact CZ-CA 3.46Å; F105-D108 WeakPolarHBondContact CE2-O 3.45Å; F105-Q111 HydrophobicContact CD2-CB 4.32Å; F105-Q111 HydrophobicContact CE2-CB 4.36Å; F105-L112 HydrophobicContact CE1-CD1 4.16Å; F105-L112 HydrophobicContact CE2-CB 4.03Å; F105-L112 HydrophobicContact CE2-CD1 4.15Å; F105-L112 HydrophobicContact CZ-CB 4.18Å; F105-L112 HydrophobicContact CZ-CD1 3.76Å; F105-F115 HydrophobicContact CB-CB 4.31Å; F105-F115 HydrophobicContact CB-CD1 3.92Å; F105-F115 HydrophobicContact CB-CD2 3.58Å; F105-F115 HydrophobicContact CB-CE1 4.08Å; F105-F115 HydrophobicContact CB-CE2 3.73Å; F105-F115 HydrophobicContact CB-CG 3.65Å; F105-F115 HydrophobicContact CB-CZ 3.99Å; F105-F115 HydrophobicContact CD1-CD1 4.47Å; F105-F115 HydrophobicContact CD2-CB 4.13Å; F105-F115 HydrophobicContact CD2-CD1 4.44Å; F105-F115 HydrophobicContact CD2-CG 4.25Å; F105-F115 HydrophobicContact CG-CB 4.45Å; F105-F115 HydrophobicContact CG-CD1 4.05Å; F105-F115 HydrophobicContact CG-CD2 4.47Å; F105-F115 HydrophobicContact CG-CE1 4.43Å; F105-F115 HydrophobicContact CG-CG 4.06Å; F105-R143 PolarHBondContact N-O 2.94Å; F105-L144 HydrophobicContact CB-CD2 4.19Å; F105-L144 HydrophobicContact CD1-CD2 3.88Å; F105-L144 WeakPolarHBondContact O-CA 3.43Å; F105-T145 PolarHBondContact O-N 3.45Å; F105-A148 HydrophobicContact CD1-CB 3.75Å; F105-A148 HydrophobicContact CE1-CB 4.01Å; F105-A148 WeakPolarHBondContact O-CB 3.47Å; F105-L173 HydrophobicContact CD1-CD1 4.47Å; F105-L173 HydrophobicContact CE1-CD1 4.17Å; F105-Y177 HydrophobicContact CE1-CD1 4.08Å; F105-Y177 AromaticContact CE1-CD2 3.92Å; F105-Y177 HydrophobicContact CE1-CD2 3.92Å; F105-Y177 HydrophobicContact CE1-CE1 4.36Å; F105-Y177 HydrophobicContact CE1-CE2 4.23Å; F105-Y177 AromaticContact CE1-CG 3.86Å; F105-Y177 HydrophobicContact CE1-CG 3.86Å; F105-Y177 AromaticContact CZ-CD1 3.96Å; F105-Y177 HydrophobicContact CZ-CD1 3.96Å; F105-Y177 HydrophobicContact CZ-CD2 4.35Å; F105-Y177 AromaticContact CZ-CG 3.84Å; F105-Y177 HydrophobicContact CZ-CG 3.84Å
106S93.1Very high84.2Confident52 Ų5256.3 Ų56.336%0.36436%0.362SS..  trans-84.6-14.3-177.563.10000114.2T145 E147 A148S106-T145 CarbonylContact C-O 3.47Å; S106-T145 WeakPolarHBondContact CA-O 3.38Å; S106-T145 WeakPolarHBondContact CA-OG1 3.44Å; S106-E147 PolarHBondContact O-N 3.48Å; S106-A148 PolarHBondContact O-N 3.01Å
107G91.1Very high86.3Confident10 Ų1057.7 Ų57.710%0.10336%0.364CS..SBendtrans108.98.6-17100000115F105 P109 Y177F105-G107 VanDerWaalsContact CE1-CA 3.49Å; F105-G107 VanDerWaalsContact CZ-CA 3.46Å; G107-P109 VanDerWaalsContact O-CD 3.31Å; G107-P109 WeakPolarHBondContact O-CD 3.42Å; G107-Y177 WeakPolarHBondContact O-CD1 3.49Å; G107-Y177 WeakPolarHBondContact O-CE1 3.25Å
108D89.3Confident88.3Confident73 Ų7356.2 Ų56.239%0.3935%0.351SS..  trans-72.9117.1174.8177.512.9000111.6F105 G110 Q111 L112F105-D108 WeakPolarHBondContact CE2-O 3.45Å; D108-G110 PolarHBondContact O-N 3.44Å; D108-G110 VanDerWaalsContact O-N 3.09Å; D108-G110 PolarHBondContact OD1-N 2.91Å; D108-Q111 HydrophobicContact CB-CB 4.38Å; D108-Q111 HydrophobicContact CB-CG 4.24Å; D108-Q111 PolarHBondContact O-N 3.46Å; D108-L112 PolarHBondContact O-N 3.38Å
109P89.3Confident90.2Very high38 Ų3850.8 Ų50.825%0.24732%0.315CS..THydrogen-bonded Turntrans-51.8-32.4175.7-2938.3000114.7G107 Q111 L112 Y177 H183G107-P109 VanDerWaalsContact O-CD 3.31Å; G107-P109 WeakPolarHBondContact O-CD 3.42Å; P109-Q111 VanDerWaalsContact C-N 3.29Å; P109-Q111 PolarHBondContact O-N 2.88Å; P109-L112 PolarHBondContact O-N 3.28Å; P109-Y177 VanDerWaalsContact CB-O 3.23Å; P109-Y177 WeakPolarHBondContact CB-O 3.45Å; P109-Y177 WeakPolarHBondContact CG-O 3.46Å; P109-H183 HydrophobicContact CG-CB 4.42Å
110G88.1Confident91.6Very high66 Ų6654.1 Ų54.168%0.6833%0.332SS*.THydrogen-bonded Turntrans-66.4-29179.200000113.5D108D108-G110 PolarHBondContact O-N 3.44Å; D108-G110 VanDerWaalsContact O-N 3.09Å; D108-G110 PolarHBondContact OD1-N 2.91Å
111Q90.1Very high92.3Very high95 Ų9555.7 Ų55.744%0.44432%0.322SS..THydrogen-bonded Turntrans-91.3-13.3-179.1-66.2-175.9-22.100113.5F105 D108 P109 A113 G114 F115F105-Q111 HydrophobicContact CD2-CB 4.32Å; F105-Q111 HydrophobicContact CE2-CB 4.36Å; D108-Q111 HydrophobicContact CB-CB 4.38Å; D108-Q111 HydrophobicContact CB-CG 4.24Å; D108-Q111 PolarHBondContact O-N 3.46Å; P109-Q111 VanDerWaalsContact C-N 3.29Å; P109-Q111 PolarHBondContact O-N 2.88Å; Q111-A113 VanDerWaalsContact C-N 3.33Å; Q111-A113 PolarHBondContact O-N 3Å; Q111-G114 PolarHBondContact O-N 3.25Å; Q111-F115 WeakPolarHBondContact O-CB 3.47Å; Q111-F115 PolarHBondContact O-N 2.88Å
112L93.3Very high92.5Very high7 Ų752.4 Ų52.44%0.03730%0.304CS..Hα-helixtrans-58-42.8-171.4-178.864.9000112.9F105 D108 P109 L116 L173 K178F105-L112 HydrophobicContact CE1-CD1 4.16Å; F105-L112 HydrophobicContact CE2-CB 4.03Å; F105-L112 HydrophobicContact CE2-CD1 4.15Å; F105-L112 HydrophobicContact CZ-CB 4.18Å; F105-L112 HydrophobicContact CZ-CD1 3.76Å; D108-L112 PolarHBondContact O-N 3.38Å; P109-L112 PolarHBondContact O-N 3.28Å; L112-L116 HydrophobicContact CD1-CD1 4.04Å; L112-L116 HydrophobicContact CD1-CG 4.16Å; L112-L116 HydrophobicContact CG-CD1 3.93Å; L112-L116 HydrophobicContact CG-CG 4.43Å; L112-L116 WeakPolarHBondContact O-CB 3.28Å; L112-L116 WeakPolarHBondContact O-CG 3.48Å; L112-L116 PolarHBondContact O-N 2.98Å; L112-L173 HydrophobicContact CD1-CD2 4.23Å; L112-L173 HydrophobicContact CD1-CG 4.17Å; L112-K178 HydrophobicContact CD2-CB 4.1Å
113A92.3Very high92.5Very high77 Ų7753 Ų5364%0.63631%0.307SS*.Hα-helixtrans-64.6-45.2-178.800000111.9Q111 L116 M117Q111-A113 VanDerWaalsContact C-N 3.33Å; Q111-A113 PolarHBondContact O-N 3Å; A113-L116 PolarHBondContact O-N 3.28Å; A113-M117 PolarHBondContact O-N 3.48Å; A113-M117 VanDerWaalsContact O-N 3.08Å
114G91.5Very high92.3Very high33 Ų3352.1 Ų52.134%0.3431%0.305SS..Hα-helixtrans-63.7-45.1177.300000112Q111 L116 M117 Q118Q111-G114 PolarHBondContact O-N 3.25Å; G114-L116 PolarHBondContact O-N 3.06Å; G114-M117 PolarHBondContact O-N 2.97Å; G114-Q118 WeakPolarHBondContact O-CG 3.47Å; G114-Q118 PolarHBondContact O-N 2.9Å
115F95.3Very high91.9Very high8 Ų853.2 Ų53.24%0.03530%0.303CS..Hα-helixtrans-56.9-48.9175.6173.2-108.3000112.3E103 F105 Q111 M117 Q118 M119 L140 R143 L144 L173E103-F115 WeakPolarHBondContact O-CD2 2.97Å; F105-F115 HydrophobicContact CB-CB 4.31Å; F105-F115 HydrophobicContact CB-CD1 3.92Å; F105-F115 HydrophobicContact CB-CD2 3.58Å; F105-F115 HydrophobicContact CB-CE1 4.08Å; F105-F115 HydrophobicContact CB-CE2 3.73Å; F105-F115 HydrophobicContact CB-CG 3.65Å; F105-F115 HydrophobicContact CB-CZ 3.99Å; F105-F115 HydrophobicContact CD1-CD1 4.47Å; F105-F115 HydrophobicContact CD2-CB 4.13Å; F105-F115 HydrophobicContact CD2-CD1 4.44Å; F105-F115 HydrophobicContact CD2-CG 4.25Å; F105-F115 HydrophobicContact CG-CB 4.45Å; F105-F115 HydrophobicContact CG-CD1 4.05Å; F105-F115 HydrophobicContact CG-CD2 4.47Å; F105-F115 HydrophobicContact CG-CE1 4.43Å; F105-F115 HydrophobicContact CG-CG 4.06Å; Q111-F115 WeakPolarHBondContact O-CB 3.47Å; Q111-F115 PolarHBondContact O-N 2.88Å; F115-M117 VanDerWaalsContact C-N 3.34Å; F115-M117 PolarHBondContact O-N 2.79Å; F115-Q118 PolarHBondContact O-N 2.94Å; F115-M119 HydrophobicContact CD1-CG 4.25Å; F115-M119 HydrophobicContact CD2-CE 4.45Å; F115-M119 HydrophobicContact CD2-CG 4.41Å; F115-M119 HydrophobicContact CE1-CG 3.79Å; F115-M119 HydrophobicContact CE1-SD 4.5Å; F115-M119 HydrophobicContact CE2-CE 3.72Å; F115-M119 HydrophobicContact CE2-CG 3.99Å; F115-M119 HydrophobicContact CE2-SD 4.19Å; F115-M119 HydrophobicContact CZ-CE 4.01Å; F115-M119 HydrophobicContact CZ-CG 3.65Å; F115-M119 HydrophobicContact CZ-SD 3.86Å; F115-M119 WeakPolarHBondContact O-CG 3.35Å; F115-M119 PolarHBondContact O-N 2.89Å; F115-L140 HydrophobicContact CZ-CG 4.45Å; F115-R143 HydrophobicContact CE2-CB 3.81Å; F115-R143 HydrophobicContact CZ-CB 4.14Å; F115-L144 HydrophobicContact CE1-CD2 4.19Å; F115-L144 HydrophobicContact CZ-CD2 4Å; F115-L173 HydrophobicContact CD1-CD2 4.3Å; F115-L173 HydrophobicContact CE1-CD2 3.86Å
116L95.3Very high91.5Very high24 Ų2454.9 Ų54.913%0.12631%0.311CS..Hα-helixtrans-63.4-38.8-180-72173.1000112.6L112 A113 G114 M119 D120 L170 L173 R174L112-L116 HydrophobicContact CD1-CD1 4.04Å; L112-L116 HydrophobicContact CD1-CG 4.16Å; L112-L116 HydrophobicContact CG-CD1 3.93Å; L112-L116 HydrophobicContact CG-CG 4.43Å; L112-L116 WeakPolarHBondContact O-CB 3.28Å; L112-L116 WeakPolarHBondContact O-CG 3.48Å; L112-L116 PolarHBondContact O-N 2.98Å; A113-L116 PolarHBondContact O-N 3.28Å; G114-L116 PolarHBondContact O-N 3.06Å; L116-M119 WeakPolarHBondContact O-CB 3.45Å; L116-M119 PolarHBondContact O-N 2.81Å; L116-D120 WeakPolarHBondContact O-CB 3.41Å; L116-D120 PolarHBondContact O-N 3.46Å; L116-L170 HydrophobicContact CD2-CD2 3.59Å; L116-L173 HydrophobicContact CD2-CD2 4.06Å; L116-R174 HydrophobicContact CD1-CG 3.66Å
117M94.5Very high91.1Very high105 Ų10554.8 Ų54.852%0.51731%0.313SS..Hα-helixtrans-63.2-42.9174.7-178.8-165.568.700111.4A113 G114 F115 D120 R121A113-M117 PolarHBondContact O-N 3.48Å; A113-M117 VanDerWaalsContact O-N 3.08Å; G114-M117 PolarHBondContact O-N 2.97Å; F115-M117 VanDerWaalsContact C-N 3.34Å; F115-M117 PolarHBondContact O-N 2.79Å; M117-D120 PolarHBondContact O-N 3.31Å; M117-R121 WeakPolarHBondContact O-CB 3.26Å; M117-R121 PolarHBondContact O-N 3.24Å
118Q94.4Very high90.9Very high54 Ų5459.5 Ų59.525%0.25235%0.345SS..Hα-helixtrans-66.3-40.3177.2-68.7175.14.400111.8P102 G114 F115 F122P102-Q118 HydrophobicContact CB-CB 3.84Å; P102-Q118 HydrophobicContact CG-CB 4.23Å; G114-Q118 WeakPolarHBondContact O-CG 3.47Å; G114-Q118 PolarHBondContact O-N 2.9Å; F115-Q118 PolarHBondContact O-N 2.94Å; Q118-F122 WeakPolarHBondContact O-CB 3.18Å; Q118-F122 PolarHBondContact O-N 3.35Å
119M94.9Very high90.7Very high0 Ų064.6 Ų64.60%036%0.358CS..Hα-helixtrans-55.9-53.3172.5-77.3-66.5101.200111.5P102 F115 L116 R121 F122 M123 F139 L140 R143P102-M119 HydrophobicContact CB-CE 3.03Å; P102-M119 HydrophobicContact CG-CE 3.24Å; F115-M119 HydrophobicContact CD1-CG 4.25Å; F115-M119 HydrophobicContact CD2-CE 4.45Å; F115-M119 HydrophobicContact CD2-CG 4.41Å; F115-M119 HydrophobicContact CE1-CG 3.79Å; F115-M119 HydrophobicContact CE1-SD 4.5Å; F115-M119 HydrophobicContact CE2-CE 3.72Å; F115-M119 HydrophobicContact CE2-CG 3.99Å; F115-M119 HydrophobicContact CE2-SD 4.19Å; F115-M119 HydrophobicContact CZ-CE 4.01Å; F115-M119 HydrophobicContact CZ-CG 3.65Å; F115-M119 HydrophobicContact CZ-SD 3.86Å; F115-M119 WeakPolarHBondContact O-CG 3.35Å; F115-M119 PolarHBondContact O-N 2.89Å; L116-M119 WeakPolarHBondContact O-CB 3.45Å; L116-M119 PolarHBondContact O-N 2.81Å; M119-R121 PolarHBondContact O-N 3.11Å; M119-F122 PolarHBondContact O-N 2.96Å; M119-M123 VanDerWaalsContact O-CG 3.31Å; M119-M123 WeakPolarHBondContact O-CG 3.26Å; M119-M123 PolarHBondContact O-N 3.34Å; M119-F139 HydrophobicContact CE-CE1 3.99Å; M119-F139 HydrophobicContact SD-CD1 4.48Å; M119-F139 HydrophobicContact SD-CE1 4.27Å; M119-L140 HydrophobicContact SD-CB 4.17Å; M119-L140 HydrophobicContact SD-CD1 4.35Å; M119-L140 HydrophobicContact SD-CG 4.08Å; M119-R143 HydrophobicContact CE-CB 4.02Å; M119-R143 HydrophobicContact CE-CG 3.68Å
120D93.2Very high90.6Very high97 Ų9764.1 Ų64.152%0.51935%0.352SS..Hα-helixtrans-61.3-47.5-177.4-171.949.2000111.4L116 M117 F122 M123 I124L116-D120 WeakPolarHBondContact O-CB 3.41Å; L116-D120 PolarHBondContact O-N 3.46Å; M117-D120 PolarHBondContact O-N 3.31Å; D120-F122 VanDerWaalsContact C-N 3.34Å; D120-F122 PolarHBondContact O-N 3.1Å; D120-M123 PolarHBondContact O-N 3.42Å; D120-I124 WeakPolarHBondContact O-CG1 3.28Å; D120-I124 PolarHBondContact O-N 3.07Å
121R91Very high90.4Very high133 Ų13366 Ų6650%0.50235%0.353SS..Hα-helixtrans-54.1-51.2173.9-173.9-177.5-62.7-153.91.6111.3T99 M117 M119 M123 I124 F125T99-R121 HydrophobicContact CG2-CG 4.21Å; M117-R121 WeakPolarHBondContact O-CB 3.26Å; M117-R121 PolarHBondContact O-N 3.24Å; M119-R121 PolarHBondContact O-N 3.11Å; R121-M123 VanDerWaalsContact C-N 3.32Å; R121-M123 PolarHBondContact O-N 3.4Å; R121-I124 PolarHBondContact O-N 2.03Å; R121-F125 HydrophobicContact CG-CD2 3.63Å; R121-F125 HydrophobicContact CG-CE2 3.56Å; R121-F125 WeakPolarHBondContact O-CD2 3.45Å; R121-F125 PolarHBondContact O-N 2.94Å
122F91.5Very high90.5Very high21 Ų2162.6 Ų62.69%0.09234%0.343CS..Hα-helixtrans-61.3-41.4-179-171.7-91.9000111.9L101 P102 Q118 M119 D120 I124 F125 Q126 F130 F139L101-F122 HydrophobicContact CD1-CE2 4.16Å; L101-F122 HydrophobicContact CD1-CZ 4.17Å; P102-F122 HydrophobicContact CG-CB 3.71Å; P102-F122 HydrophobicContact CG-CD2 4.2Å; P102-F122 HydrophobicContact CG-CG 4Å; Q118-F122 WeakPolarHBondContact O-CB 3.18Å; Q118-F122 PolarHBondContact O-N 3.35Å; M119-F122 PolarHBondContact O-N 2.96Å; D120-F122 VanDerWaalsContact C-N 3.34Å; D120-F122 PolarHBondContact O-N 3.1Å; F122-I124 PolarHBondContact O-N 3Å; F122-F125 PolarHBondContact O-N 2.92Å; F122-Q126 HydrophobicContact CD1-CB 4.37Å; F122-Q126 HydrophobicContact CD1-CG 4.29Å; F122-Q126 HydrophobicContact CD2-CG 4.29Å; F122-Q126 HydrophobicContact CE1-CB 4.15Å; F122-Q126 HydrophobicContact CE1-CG 3.98Å; F122-Q126 HydrophobicContact CE2-CG 3.98Å; F122-Q126 HydrophobicContact CG-CG 4.45Å; F122-Q126 HydrophobicContact CZ-CB 4.45Å; F122-Q126 HydrophobicContact CZ-CG 3.82Å; F122-Q126 VanDerWaalsContact O-CB 3.28Å; F122-Q126 WeakPolarHBondContact O-CB 3.37Å; F122-Q126 PolarHBondContact O-N 2.96Å; F122-F130 HydrophobicContact CD1-CE2 4.21Å; F122-F130 AromaticContact CE1-CE2 3.55Å; F122-F130 HydrophobicContact CE1-CE2 3.55Å; F122-F130 AromaticContact CE1-CZ 3.83Å; F122-F130 HydrophobicContact CE1-CZ 3.83Å; F122-F130 HydrophobicContact CZ-CE2 4.49Å; F122-F139 HydrophobicContact CD1-CD1 4.27Å; F122-F139 AromaticContact CD1-CE1 3.4Å; F122-F139 HydrophobicContact CD1-CE1 3.4Å; F122-F139 VanDerWaalsContact CD1-CE1 3.4Å; F122-F139 HydrophobicContact CD1-CE2 4.37Å; F122-F139 AromaticContact CD1-CZ 3.46Å; F122-F139 HydrophobicContact CD1-CZ 3.46Å; F122-F139 VanDerWaalsContact CD1-CZ 3.46Å; F122-F139 HydrophobicContact CE1-CD1 4.28Å; F122-F139 HydrophobicContact CE1-CD2 4.36Å; F122-F139 AromaticContact CE1-CE1 3.52Å; F122-F139 HydrophobicContact CE1-CE1 3.52Å; F122-F139 AromaticContact CE1-CE2 3.63Å; F122-F139 HydrophobicContact CE1-CE2 3.63Å; F122-F139 AromaticContact CE1-CZ 3.13Å; F122-F139 HydrophobicContact CE1-CZ 3.13Å; F122-F139 HydrophobicContact CE2-CZ 4.34Å; F122-F139 HydrophobicContact CG-CE1 4.21Å; F122-F139 HydrophobicContact CG-CZ 4.18Å; F122-F139 HydrophobicContact CZ-CE1 4.42Å; F122-F139 AromaticContact CZ-CE2 3.98Å; F122-F139 HydrophobicContact CZ-CE2 3.98Å; F122-F139 AromaticContact CZ-CZ 3.64Å; F122-F139 HydrophobicContact CZ-CZ 3.64Å
123M91.4Very high90.6Very high17 Ų1766.5 Ų66.58%0.08436%0.361CS..Hα-helixtrans-64.3-38.4177.4-69.2-60.7175.700112.5M119 D120 R121 A127 F130 R136 F139 Y166M119-M123 VanDerWaalsContact O-CG 3.31Å; M119-M123 WeakPolarHBondContact O-CG 3.26Å; M119-M123 PolarHBondContact O-N 3.34Å; D120-M123 PolarHBondContact O-N 3.42Å; R121-M123 VanDerWaalsContact C-N 3.32Å; R121-M123 PolarHBondContact O-N 3.4Å; M123-A127 VanDerWaalsContact O-CA 3.24Å; M123-A127 WeakPolarHBondContact O-CA 3.41Å; M123-A127 WeakPolarHBondContact O-CB 2.97Å; M123-A127 PolarHBondContact O-N 3.23Å; M123-F130 HydrophobicContact SD-CB 4.41Å; M123-F130 HydrophobicContact SD-CD2 4.05Å; M123-F130 HydrophobicContact SD-CG 4.22Å; M123-R136 HydrophobicContact CE-CB 3.91Å; M123-R136 HydrophobicContact CE-CG 4.21Å; M123-R136 HydrophobicContact SD-CB 4.26Å; M123-R136 HydrophobicContact SD-CG 3.9Å; M123-F139 HydrophobicContact CE-CB 4.37Å; M123-F139 HydrophobicContact CE-CD1 3.53Å; M123-F139 HydrophobicContact CE-CE1 4.29Å; M123-F139 HydrophobicContact CE-CG 4.33Å; M123-Y166 HydrophobicContact CE-CE2 3.91Å; M123-Y166 HydrophobicContact CG-CE1 4.42Å
124I89.6Confident90.6Very high112 Ų11264.1 Ų64.157%0.57434%0.342SS*.Hα-helixtrans-64.1-49175.9-68164.2000110.5D120 R121 F122D120-I124 WeakPolarHBondContact O-CG1 3.28Å; D120-I124 PolarHBondContact O-N 3.07Å; R121-I124 PolarHBondContact O-N 2.03Å; F122-I124 PolarHBondContact O-N 3Å
125F86.5Confident90.7Very high94 Ų9467 Ų6741%0.41235%0.347SS..Hα-helixtrans-74-26-177.1-76.9-70.5000113.8T99 R121 F122T99-F125 HydrophobicContact CG2-CB 3.65Å; T99-F125 HydrophobicContact CG2-CD2 3.22Å; T99-F125 HydrophobicContact CG2-CE2 3.99Å; T99-F125 HydrophobicContact CG2-CG 3.58Å; R121-F125 HydrophobicContact CG-CD2 3.63Å; R121-F125 HydrophobicContact CG-CE2 3.56Å; R121-F125 WeakPolarHBondContact O-CD2 3.45Å; R121-F125 PolarHBondContact O-N 2.94Å; F122-F125 PolarHBondContact O-N 2.92Å
126Q87.1Confident90.7Very high36 Ų3670.1 Ų70.117%0.16836%0.358CS..THydrogen-bonded Turntrans-112.124.3-178.6-59.8-67.6-35.700112.4F122 S128 R129 F130F122-Q126 HydrophobicContact CD1-CB 4.37Å; F122-Q126 HydrophobicContact CD1-CG 4.29Å; F122-Q126 HydrophobicContact CD2-CG 4.29Å; F122-Q126 HydrophobicContact CE1-CB 4.15Å; F122-Q126 HydrophobicContact CE1-CG 3.98Å; F122-Q126 HydrophobicContact CE2-CG 3.98Å; F122-Q126 HydrophobicContact CG-CG 4.45Å; F122-Q126 HydrophobicContact CZ-CB 4.45Å; F122-Q126 HydrophobicContact CZ-CG 3.82Å; F122-Q126 VanDerWaalsContact O-CB 3.28Å; F122-Q126 WeakPolarHBondContact O-CB 3.37Å; F122-Q126 PolarHBondContact O-N 2.96Å; Q126-S128 PolarHBondContact O-N 3.41Å; Q126-R129 HydrophobicContact CB-CB 4.46Å; Q126-R129 WeakPolarHBondContact O-CB 3.46Å; Q126-R129 PolarHBondContact O-N 3.46Å; Q126-F130 HydrophobicContact CB-CD2 4.17Å; Q126-F130 HydrophobicContact CB-CE2 3.86Å; Q126-F130 WeakPolarHBondContact O-CD2 3.15Å
127A84.4Confident90.8Very high51 Ų5169 Ų6942%0.42135%0.352SS..G310 helixtrans-52.8-37.2-173.700000113.4M123 R129 F130M123-A127 VanDerWaalsContact O-CA 3.24Å; M123-A127 WeakPolarHBondContact O-CA 3.41Å; M123-A127 WeakPolarHBondContact O-CB 2.97Å; M123-A127 PolarHBondContact O-N 3.23Å; A127-R129 PolarHBondContact O-N 3.27Å; A127-F130 CarbonylContact O-C 3.5Å; A127-F130 PolarHBondContact O-N 3.43Å
128S86.2Confident90.8Very high109 Ų10966.2 Ų66.276%0.76235%0.346SS*.G310 helixtrans-67-19.3178.164.60000114.3Q126Q126-S128 PolarHBondContact O-N 3.41Å
129R85.6Confident90.8Very high179 Ų17964.9 Ų64.968%0.67534%0.34SS*.G310 helixtrans-86.6-17177.3-72.8-76.3163.179.1-2.6113Q126 A127 P131Q126-R129 HydrophobicContact CB-CB 4.46Å; Q126-R129 WeakPolarHBondContact O-CB 3.46Å; Q126-R129 PolarHBondContact O-N 3.46Å; A127-R129 PolarHBondContact O-N 3.27Å; R129-P131 VanDerWaalsContact C-CD 3.43Å; R129-P131 WeakPolarHBondContact O-CD 3.2Å
130F86.6Confident90.9Very high28 Ų2864.9 Ų64.912%0.12334%0.34CS..  trans-128.866.7-177.5-52.3-80.8000110.8F122 M123 Q126 A127 G132 E135 R136 F139F122-F130 HydrophobicContact CD1-CE2 4.21Å; F122-F130 AromaticContact CE1-CE2 3.55Å; F122-F130 HydrophobicContact CE1-CE2 3.55Å; F122-F130 AromaticContact CE1-CZ 3.83Å; F122-F130 HydrophobicContact CE1-CZ 3.83Å; F122-F130 HydrophobicContact CZ-CE2 4.49Å; M123-F130 HydrophobicContact SD-CB 4.41Å; M123-F130 HydrophobicContact SD-CD2 4.05Å; M123-F130 HydrophobicContact SD-CG 4.22Å; Q126-F130 HydrophobicContact CB-CD2 4.17Å; Q126-F130 HydrophobicContact CB-CE2 3.86Å; Q126-F130 WeakPolarHBondContact O-CD2 3.15Å; A127-F130 CarbonylContact O-C 3.5Å; A127-F130 PolarHBondContact O-N 3.43Å; F130-G132 VanDerWaalsContact C-N 3.33Å; F130-E135 HydrophobicContact CD1-CB 4.09Å; F130-R136 HydrophobicContact CB-CG 3.56Å; F130-R136 HydrophobicContact CG-CG 4.39Å; F130-R136 PolarHBondContact O-NE 3.4Å; F130-R136 PolarHBondContact O-NH2 3.5Å; F130-F139 HydrophobicContact CD1-CB 4.26Å; F130-F139 HydrophobicContact CE1-CB 3.65Å; F130-F139 HydrophobicContact CE1-CD2 4.02Å; F130-F139 AromaticContact CE1-CG 3.86Å; F130-F139 HydrophobicContact CE1-CG 3.86Å; F130-F139 HydrophobicContact CZ-CB 4.2Å; F130-F139 HydrophobicContact CZ-CD1 4.48Å; F130-F139 AromaticContact CZ-CD2 3.8Å; F130-F139 HydrophobicContact CZ-CD2 3.8Å; F130-F139 HydrophobicContact CZ-CE2 4.31Å; F130-F139 AromaticContact CZ-CG 3.88Å; F130-F139 HydrophobicContact CZ-CG 3.88Å
131P84.2Confident91Very high106 Ų10661.6 Ų61.669%0.68832%0.323SS*.  trans-67.8-33.1-179.427.5-33.9000112.4R129R129-P131 VanDerWaalsContact C-CD 3.43Å; R129-P131 WeakPolarHBondContact O-CD 3.2Å
132G92.1Very high91.2Very high24 Ų2458 Ų5825%0.24732%0.318CS..SBendtrans-100.8156.5178.800000113.7F130 A134 E135 R136F130-G132 VanDerWaalsContact C-N 3.33Å; G132-A134 VanDerWaalsContact C-N 3.34Å; G132-E135 WeakPolarHBondContact CA-OE2 3.42Å; G132-E135 PolarHBondContact N-OE2 3.43Å; G132-E135 VanDerWaalsContact O-OE2 3.1Å; G132-R136 WeakPolarHBondContact O-CG 3.23Å; G132-R136 PolarHBondContact O-N 3.01Å
133E94.6Very high91.5Very high88 Ų8859.8 Ų59.841%0.41132%0.324SS..Hα-helixtrans-70.7-32.3-179.5-60.7-156.3142.500112.3E135 R136 V137 N164 N165E133-E135 PolarHBondContact O-N 3.09Å; E133-R136 PolarHBondContact O-N 3.07Å; E133-V137 WeakPolarHBondContact O-CG2 3.31Å; E133-V137 PolarHBondContact O-N 3.42Å; E133-N164 VanDerWaalsContact CB-O 3.29Å; E133-N164 WeakPolarHBondContact CB-O 3.36Å; E133-N165 WeakPolarHBondContact OE2-CA 3.09Å
134A93.4Very high91.7Very high28 Ų2859.1 Ų59.123%0.23132%0.321CS..Hα-helixtrans-62.6-42.117800000111.8G132 R136 V137 A138 N164G132-A134 VanDerWaalsContact C-N 3.34Å; A134-R136 VanDerWaalsContact C-N 3.34Å; A134-V137 PolarHBondContact O-N 2.89Å; A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 2.99Å; A134-N164 VanDerWaalsContact CB-OD1 3.29Å; A134-N164 WeakPolarHBondContact CB-OD1 3.29Å
135E93.6Very high91.9Very high94 Ų9456.4 Ų56.444%0.43931%0.31SS..Hα-helixtrans-66.5-37.4177-62.780.7-177.700111.3F130 G132 E133 A138 F139F130-E135 HydrophobicContact CD1-CB 4.09Å; G132-E135 WeakPolarHBondContact CA-OE2 3.42Å; G132-E135 PolarHBondContact N-OE2 3.43Å; G132-E135 VanDerWaalsContact O-OE2 3.1Å; E133-E135 PolarHBondContact O-N 3.09Å; E135-A138 PolarHBondContact O-N 3.22Å; E135-F139 WeakPolarHBondContact O-CB 3.33Å; E135-F139 PolarHBondContact O-N 2.66Å
136R95.4Very high92.2Very high72 Ų7253.8 Ų53.827%0.27231%0.31SS..Hα-helixtrans-64.9-42.9175.6-64.1175.3-172.4-175.70.8111.7M123 F130 G132 E133 A134 L140 Y166M123-R136 HydrophobicContact CE-CB 3.91Å; M123-R136 HydrophobicContact CE-CG 4.21Å; M123-R136 HydrophobicContact SD-CB 4.26Å; M123-R136 HydrophobicContact SD-CG 3.9Å; F130-R136 HydrophobicContact CB-CG 3.56Å; F130-R136 HydrophobicContact CG-CG 4.39Å; F130-R136 PolarHBondContact O-NE 3.4Å; F130-R136 PolarHBondContact O-NH2 3.5Å; G132-R136 WeakPolarHBondContact O-CG 3.23Å; G132-R136 PolarHBondContact O-N 3.01Å; E133-R136 PolarHBondContact O-N 3.07Å; A134-R136 VanDerWaalsContact C-N 3.34Å; R136-L140 WeakPolarHBondContact O-CB 3.5Å; R136-L140 PolarHBondContact O-N 2.83Å; R136-Y166 HydrophobicContact CB-CD1 4.46Å; R136-Y166 HydrophobicContact CB-CD2 3.46Å; R136-Y166 VanDerWaalsContact CB-CD2 3.46Å; R136-Y166 HydrophobicContact CB-CE2 3.95Å; R136-Y166 HydrophobicContact CB-CG 3.75Å
137V96.4Very high92.3Very high0 Ų055.5 Ų55.50%032%0.317CS..Hα-helixtrans-64.2-48.4175.51730000110.3E133 A134 F139 L140 V141 M156 R163 Y166 F169E133-V137 WeakPolarHBondContact O-CG2 3.31Å; E133-V137 PolarHBondContact O-N 3.42Å; A134-V137 PolarHBondContact O-N 2.89Å; V137-F139 VanDerWaalsContact C-N 3.3Å; V137-F139 PolarHBondContact O-N 2.9Å; V137-L140 PolarHBondContact O-N 3.4Å; V137-V141 HydrophobicContact CG1-CG2 4.42Å; V137-V141 WeakPolarHBondContact O-CG2 3.47Å; V137-V141 PolarHBondContact O-N 3.46Å; V137-M156 HydrophobicContact CG1-CE 4.27Å; V137-M156 HydrophobicContact CG1-SD 3.64Å; V137-R163 WeakPolarHBondContact CB-O 3.4Å; V137-Y166 HydrophobicContact CG2-CD2 4.26Å; V137-F169 HydrophobicContact CG1-CD2 3.64Å; V137-F169 HydrophobicContact CG1-CE2 3.99Å; V137-F169 HydrophobicContact CG1-CG 4.17Å; V137-F169 HydrophobicContact CG2-CB 4.2Å
138A94.4Very high92.8Very high48 Ų4853 Ų5340%0.39730%0.297SS..Hα-helixtrans-58.7-42.5178.300000112A134 E135 V141 S142A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 2.99Å; E135-A138 PolarHBondContact O-N 3.22Å; A138-V141 PolarHBondContact O-N 3.28Å; A138-S142 PolarHBondContact O-N 3.34Å
139F95.3Very high93.1Very high26 Ų2652.8 Ų52.811%0.11428%0.284CS..Hα-helixtrans-63.3-46.9175.3176.9-97.9000112.2L101 M119 F122 M123 F130 E135 V137 V141 S142 R143L101-F139 HydrophobicContact CD1-CE2 3.74Å; L101-F139 HydrophobicContact CD1-CZ 3.65Å; M119-F139 HydrophobicContact CE-CE1 3.99Å; M119-F139 HydrophobicContact SD-CD1 4.48Å; M119-F139 HydrophobicContact SD-CE1 4.27Å; F122-F139 HydrophobicContact CD1-CD1 4.27Å; F122-F139 AromaticContact CD1-CE1 3.4Å; F122-F139 HydrophobicContact CD1-CE1 3.4Å; F122-F139 VanDerWaalsContact CD1-CE1 3.4Å; F122-F139 HydrophobicContact CD1-CE2 4.37Å; F122-F139 AromaticContact CD1-CZ 3.46Å; F122-F139 HydrophobicContact CD1-CZ 3.46Å; F122-F139 VanDerWaalsContact CD1-CZ 3.46Å; F122-F139 HydrophobicContact CE1-CD1 4.28Å; F122-F139 HydrophobicContact CE1-CD2 4.36Å; F122-F139 AromaticContact CE1-CE1 3.52Å; F122-F139 HydrophobicContact CE1-CE1 3.52Å; F122-F139 AromaticContact CE1-CE2 3.63Å; F122-F139 HydrophobicContact CE1-CE2 3.63Å; F122-F139 AromaticContact CE1-CZ 3.13Å; F122-F139 HydrophobicContact CE1-CZ 3.13Å; F122-F139 HydrophobicContact CE2-CZ 4.34Å; F122-F139 HydrophobicContact CG-CE1 4.21Å; F122-F139 HydrophobicContact CG-CZ 4.18Å; F122-F139 HydrophobicContact CZ-CE1 4.42Å; F122-F139 AromaticContact CZ-CE2 3.98Å; F122-F139 HydrophobicContact CZ-CE2 3.98Å; F122-F139 AromaticContact CZ-CZ 3.64Å; F122-F139 HydrophobicContact CZ-CZ 3.64Å; M123-F139 HydrophobicContact CE-CB 4.37Å; M123-F139 HydrophobicContact CE-CD1 3.53Å; M123-F139 HydrophobicContact CE-CE1 4.29Å; M123-F139 HydrophobicContact CE-CG 4.33Å; F130-F139 HydrophobicContact CD1-CB 4.26Å; F130-F139 HydrophobicContact CE1-CB 3.65Å; F130-F139 HydrophobicContact CE1-CD2 4.02Å; F130-F139 AromaticContact CE1-CG 3.86Å; F130-F139 HydrophobicContact CE1-CG 3.86Å; F130-F139 HydrophobicContact CZ-CB 4.2Å; F130-F139 HydrophobicContact CZ-CD1 4.48Å; F130-F139 AromaticContact CZ-CD2 3.8Å; F130-F139 HydrophobicContact CZ-CD2 3.8Å; F130-F139 HydrophobicContact CZ-CE2 4.31Å; F130-F139 AromaticContact CZ-CG 3.88Å; F130-F139 HydrophobicContact CZ-CG 3.88Å; E135-F139 WeakPolarHBondContact O-CB 3.33Å; E135-F139 PolarHBondContact O-N 2.66Å; V137-F139 VanDerWaalsContact C-N 3.3Å; V137-F139 PolarHBondContact O-N 2.9Å; F139-V141 VanDerWaalsContact C-N 3.3Å; F139-V141 PolarHBondContact O-N 2.94Å; F139-S142 WeakPolarHBondContact O-CB 3.49Å; F139-S142 PolarHBondContact O-N 2.94Å; F139-S142 VanDerWaalsContact O-N 3.1Å; F139-S142 PolarHBondContact O-OG 3.43Å; F139-R143 HydrophobicContact CE1-CG 4.18Å; F139-R143 HydrophobicContact CZ-CG 4.16Å; F139-R143 PolarHBondContact O-N 3.38Å
140L96.4Very high93.5Very high0 Ų051.6 Ų51.60%028%0.284CS..Hα-helixtrans-57.7-45.6177179.3154.3000111.1F115 M119 R136 V137 S142 R143 L144 Y166 F169 L170F115-L140 HydrophobicContact CZ-CG 4.45Å; M119-L140 HydrophobicContact SD-CB 4.17Å; M119-L140 HydrophobicContact SD-CD1 4.35Å; M119-L140 HydrophobicContact SD-CG 4.08Å; R136-L140 WeakPolarHBondContact O-CB 3.5Å; R136-L140 PolarHBondContact O-N 2.83Å; V137-L140 PolarHBondContact O-N 3.4Å; L140-S142 VanDerWaalsContact C-N 3.28Å; L140-S142 PolarHBondContact O-N 3.41Å; L140-R143 WeakPolarHBondContact O-CA 3.41Å; L140-R143 WeakPolarHBondContact O-CB 3.42Å; L140-R143 PolarHBondContact O-N 3.23Å; L140-L144 HydrophobicContact CD2-CD1 4.16Å; L140-L144 HydrophobicContact CD2-CD2 4.28Å; L140-L144 HydrophobicContact CD2-CG 4.31Å; L140-L144 PolarHBondContact O-N 3.01Å; L140-Y166 HydrophobicContact CB-CE2 4.19Å; L140-Y166 HydrophobicContact CD1-CE2 3.77Å; L140-F169 HydrophobicContact CD1-CD1 4.47Å; L140-F169 HydrophobicContact CD2-CD1 3.64Å; L140-F169 HydrophobicContact CD2-CE1 3.38Å; L140-F169 HydrophobicContact CD2-CZ 4.37Å; L140-L170 HydrophobicContact CD1-CD2 3.37Å; L140-L170 HydrophobicContact CD1-CG 4.19Å
141V96.1Very high93.9Very high28 Ų2852.4 Ų52.417%0.1729%0.286CS..Hα-helixtrans-61.2-37.1177.1173.30000111.5V137 A138 F139 R143 L144 A152 M156 F169V137-V141 HydrophobicContact CG1-CG2 4.42Å; V137-V141 WeakPolarHBondContact O-CG2 3.47Å; V137-V141 PolarHBondContact O-N 3.46Å; A138-V141 PolarHBondContact O-N 3.28Å; F139-V141 VanDerWaalsContact C-N 3.3Å; F139-V141 PolarHBondContact O-N 2.94Å; V141-R143 PolarHBondContact O-N 3.45Å; V141-R143 VanDerWaalsContact O-N 3.1Å; V141-L144 HydrophobicContact CG2-CD1 4.35Å; V141-L144 WeakPolarHBondContact O-CB 3.48Å; V141-L144 PolarHBondContact O-N 3.37Å; V141-A152 HydrophobicContact CG1-CB 4.13Å; V141-A152 HydrophobicContact CG2-CB 4.1Å; V141-M156 HydrophobicContact CG1-CG 4.31Å; V141-M156 HydrophobicContact CG2-CG 4.1Å; V141-M156 HydrophobicContact CG2-SD 3.73Å; V141-F169 HydrophobicContact CG2-CE1 4.18Å; V141-F169 HydrophobicContact CG2-CE2 4.04Å; V141-F169 HydrophobicContact CG2-CZ 3.57Å
142S95.3Very high94.4Very high57 Ų5747.3 Ų47.340%0.39925%0.253SS..Hα-helixtrans-62.6-16.8174.486.20000114.2A138 F139 L140A138-S142 PolarHBondContact O-N 3.34Å; F139-S142 WeakPolarHBondContact O-CB 3.49Å; F139-S142 PolarHBondContact O-N 2.94Å; F139-S142 VanDerWaalsContact O-N 3.1Å; F139-S142 PolarHBondContact O-OG 3.43Å; L140-S142 VanDerWaalsContact C-N 3.28Å; L140-S142 PolarHBondContact O-N 3.41Å
143R96.4Very high94.5Very high58 Ų5850.9 Ų50.922%0.21927%0.266CS..THydrogen-bonded Turntrans-98.11.5175.6-57.4-59.999.6-157.21.5112.4P104 F105 F115 M119 F139 L140 V141P104-R143 CarbonylContact C-O 3.55Å; P104-R143 WeakPolarHBondContact CA-O 3.43Å; F105-R143 PolarHBondContact N-O 2.94Å; F115-R143 HydrophobicContact CE2-CB 3.81Å; F115-R143 HydrophobicContact CZ-CB 4.14Å; M119-R143 HydrophobicContact CE-CB 4.02Å; M119-R143 HydrophobicContact CE-CG 3.68Å; F139-R143 HydrophobicContact CE1-CG 4.18Å; F139-R143 HydrophobicContact CZ-CG 4.16Å; F139-R143 PolarHBondContact O-N 3.38Å; L140-R143 WeakPolarHBondContact O-CA 3.41Å; L140-R143 WeakPolarHBondContact O-CB 3.42Å; L140-R143 PolarHBondContact O-N 3.23Å; V141-R143 PolarHBondContact O-N 3.45Å; V141-R143 VanDerWaalsContact O-N 3.1Å
144L96.4Very high94.5Very high4 Ų450.4 Ų50.42%0.02127%0.27CS..BIsolated β-bridgetrans-87.8145171.9-54.2-180000109.5F105 F115 L140 V141 A148 E149 W151 A152 F169 L173F105-L144 HydrophobicContact CB-CD2 4.19Å; F105-L144 HydrophobicContact CD1-CD2 3.88Å; F105-L144 WeakPolarHBondContact O-CA 3.43Å; F115-L144 HydrophobicContact CE1-CD2 4.19Å; F115-L144 HydrophobicContact CZ-CD2 4Å; L140-L144 HydrophobicContact CD2-CD1 4.16Å; L140-L144 HydrophobicContact CD2-CD2 4.28Å; L140-L144 HydrophobicContact CD2-CG 4.31Å; L140-L144 PolarHBondContact O-N 3.01Å; V141-L144 HydrophobicContact CG2-CD1 4.35Å; V141-L144 WeakPolarHBondContact O-CB 3.48Å; V141-L144 PolarHBondContact O-N 3.37Å; L144-A148 HydrophobicContact CB-CB 4.15Å; L144-A148 HydrophobicContact CD2-CB 4.19Å; L144-E149 HydrophobicContact CB-CB 4.27Å; L144-W151 HydrophobicContact CD1-CZ3 4.48Å; L144-A152 HydrophobicContact CD1-CB 3.63Å; L144-F169 HydrophobicContact CD1-CE1 4.46Å; L144-L173 HydrophobicContact CD2-CD1 4.41Å
145T93.8Very high94.6Very high54 Ų5450.8 Ų50.833%0.33127%0.267SS..  trans-135.7165174.857.10000110.4P104 F105 S106 E147 A148 E149P104-T145 HydrophobicContact CB-CG2 3.6Å; F105-T145 PolarHBondContact O-N 3.45Å; S106-T145 CarbonylContact C-O 3.47Å; S106-T145 WeakPolarHBondContact CA-O 3.38Å; S106-T145 WeakPolarHBondContact CA-OG1 3.44Å; T145-E147 PolarHBondContact O-N 3.24Å; T145-A148 PolarHBondContact O-N 2.99Å; T145-A148 VanDerWaalsContact O-N 3.17Å; T145-E149 PolarHBondContact O-N 3.49Å
146G92.6Very high94.6Very high40 Ų4048.6 Ų48.641%0.41226%0.257SS..Hα-helixtrans61.7-119.216800000113.8K150G146-K150 WeakPolarHBondContact O-CG 3.44Å; G146-K150 PolarHBondContact O-N 3.33Å
147E89.6Confident94.5Very high71 Ų7149.6 Ų49.633%0.33227%0.265SS..Hα-helixtrans-74.1-36-179.3-175171.9169.100111.8S106 T145 K150 W151 R190S106-E147 PolarHBondContact O-N 3.48Å; T145-E147 PolarHBondContact O-N 3.24Å; E147-K150 PolarHBondContact O-N 2.88Å; E147-W151 WeakPolarHBondContact O-CB 3.43Å; E147-W151 PolarHBondContact O-N 3.22Å; E147-R190 VanDerWaalsContact CD-NH1 3.28Å; E147-R190 IonicContact OE1-CZ 3.34Å; E147-R190 IonicContact OE1-NH1 2.94Å; E147-R190 PolarHBondContact OE1-NH1 3.31Å; E147-R190 IonicContact OE1-NH2 3.64Å; E147-R190 PolarHBondContact OE1-NH2 3.34Å; E147-R190 IonicContact OE2-CZ 3.4Å; E147-R190 IonicContact OE2-NH1 2.73Å; E147-R190 PolarHBondContact OE2-NH1 3.01Å; E147-R190 IonicContact OE2-NH2 3.07Å; E147-R190 PolarHBondContact OE2-NH2 2.87Å
148A93.4Very high94.3Very high0 Ų055 Ų550%030%0.3CS..Hα-helixtrans-66.6-37.9178.500000113F105 S106 L144 T145 W151 A152 Y177F105-A148 HydrophobicContact CD1-CB 3.75Å; F105-A148 HydrophobicContact CE1-CB 4.01Å; F105-A148 WeakPolarHBondContact O-CB 3.47Å; S106-A148 PolarHBondContact O-N 3.01Å; L144-A148 HydrophobicContact CB-CB 4.15Å; L144-A148 HydrophobicContact CD2-CB 4.19Å; T145-A148 PolarHBondContact O-N 2.99Å; T145-A148 VanDerWaalsContact O-N 3.17Å; A148-W151 PolarHBondContact O-N 3.48Å; A148-A152 PolarHBondContact O-N 3.03Å; A148-A152 VanDerWaalsContact O-N 3.12Å; A148-Y177 VanDerWaalsContact CA-OH 3.27Å; A148-Y177 WeakPolarHBondContact CA-OH 3.48Å; A148-Y177 HydrophobicContact CB-CE2 4.47Å
149E94.5Very high94.1Very high103 Ų10359.4 Ų59.448%0.48132%0.317SS..Hα-helixtrans-63.1-47.4175.1-174.4-178.8-176.900111.3L144 T145 W151 A152 I153L144-E149 HydrophobicContact CB-CB 4.27Å; T145-E149 PolarHBondContact O-N 3.49Å; E149-W151 VanDerWaalsContact C-N 3.27Å; E149-W151 PolarHBondContact O-N 3.19Å; E149-A152 WeakPolarHBondContact O-CB 3.45Å; E149-A152 PolarHBondContact O-N 2.98Å; E149-I153 PolarHBondContact O-N 3.23Å
150K93Very high94.1Very high155 Ų15558.9 Ų58.967%0.67432%0.316SS*.Hα-helixtrans-60-38.1176.9-68.7174-174.2-179.90112.4G146 E147 A152G146-K150 WeakPolarHBondContact O-CG 3.44Å; G146-K150 PolarHBondContact O-N 3.33Å; E147-K150 PolarHBondContact O-N 2.88Å; K150-A152 VanDerWaalsContact C-N 3.3Å; K150-A152 PolarHBondContact O-N 2.99Å
151W95.2Very high93.9Very high44 Ų4464 Ų6417%0.16735%0.35CS..Hα-helixtrans-65.5-31.9176.1166.180.7000112.7L144 E147 A148 E149 P154 H155 F169 E172 L173 T176 Y177L144-W151 HydrophobicContact CD1-CZ3 4.48Å; E147-W151 WeakPolarHBondContact O-CB 3.43Å; E147-W151 PolarHBondContact O-N 3.22Å; A148-W151 PolarHBondContact O-N 3.48Å; E149-W151 VanDerWaalsContact C-N 3.27Å; E149-W151 PolarHBondContact O-N 3.19Å; W151-P154 WeakPolarHBondContact O-CD 3.45Å; W151-P154 WeakPolarHBondContact O-CG 3.27Å; W151-H155 AromaticContact CE2-CD2 3.93Å; W151-H155 AromaticContact CE2-NE2 3.7Å; W151-H155 AromaticContact CZ2-CD2 3.96Å; W151-H155 AromaticContact CZ2-NE2 3.77Å; W151-H155 AromaticContact NE1-NE2 3.68Å; W151-H155 PolarHBondContact O-CD2 3.4Å; W151-F169 HydrophobicContact CH2-CE1 4.12Å; W151-F169 HydrophobicContact CH2-CZ 4.39Å; W151-F169 AromaticContact CZ3-CE1 3.8Å; W151-F169 HydrophobicContact CZ3-CE1 3.8Å; W151-F169 AromaticContact CZ3-CZ 3.99Å; W151-F169 HydrophobicContact CZ3-CZ 3.99Å; W151-E172 HydrophobicContact CZ2-CB 4.5Å; W151-E172 HydrophobicContact CZ2-CG 3.98Å; W151-L173 HydrophobicContact CE3-CD1 4.15Å; W151-L173 VanDerWaalsContact CH2-CA 3.49Å; W151-L173 HydrophobicContact CH2-CB 3.87Å; W151-L173 HydrophobicContact CH2-CD1 3.83Å; W151-L173 HydrophobicContact CH2-CG 4.48Å; W151-L173 HydrophobicContact CZ3-CB 4.29Å; W151-L173 HydrophobicContact CZ3-CD1 3.43Å; W151-L173 VanDerWaalsContact CZ3-CD1 3.43Å; W151-L173 HydrophobicContact CZ3-CG 4.48Å; W151-T176 HydrophobicContact CG-CG2 4.49Å; W151-T176 PolarHBondContact NE1-OG1 3.05Å; W151-Y177 AromaticContact CD2-CE2 3.99Å; W151-Y177 HydrophobicContact CD2-CE2 3.99Å; W151-Y177 HydrophobicContact CE3-CE2 4.02Å; W151-Y177 HydrophobicContact CG-CE2 4.36Å; W151-Y177 HydrophobicContact CZ3-CE2 4.48Å
152A95.6Very high93.8Very high0 Ų064.1 Ų64.10%035%0.349CS..Hα-helixtrans-75.3-24.3-178.800000114.3V141 L144 A148 E149 K150 H155 M156 F169V141-A152 HydrophobicContact CG1-CB 4.13Å; V141-A152 HydrophobicContact CG2-CB 4.1Å; L144-A152 HydrophobicContact CD1-CB 3.63Å; A148-A152 PolarHBondContact O-N 3.03Å; A148-A152 VanDerWaalsContact O-N 3.12Å; E149-A152 WeakPolarHBondContact O-CB 3.45Å; E149-A152 PolarHBondContact O-N 2.98Å; K150-A152 VanDerWaalsContact C-N 3.3Å; K150-A152 PolarHBondContact O-N 2.99Å; A152-H155 WeakPolarHBondContact O-CA 3.44Å; A152-H155 WeakPolarHBondContact O-CB 3.47Å; A152-H155 PolarHBondContact O-N 3.22Å; A152-M156 PolarHBondContact O-N 3.34Å; A152-F169 HydrophobicContact CB-CZ 4.02Å
153I93.3Very high93.8Very high99 Ų9966 Ų6651%0.50835%0.348SS..G310 helixtrans-47.5-53.5-177.3-62.7173.3000113.9E149 H155 M156E149-I153 PolarHBondContact O-N 3.23Å; I153-H155 PolarHBondContact O-N 2.73Å; I153-M156 PolarHBondContact O-N 3.48Å
154P94.4Very high93.7Very high78 Ų7867.2 Ų67.251%0.50636%0.359SS..G310 helixtrans-64.2-29.2179.225.1-36.1000113W151 M156W151-P154 WeakPolarHBondContact O-CD 3.45Å; W151-P154 WeakPolarHBondContact O-CG 3.27Å; P154-M156 PolarHBondContact O-N 3.13Å
155H94.6Very high93.7Very high36 Ų3670 Ų7017%0.16737%0.373CS..G310 helixtrans-76-13179.6-60.3-55.9000113.3W151 A152 I153 S160 L162 F169W151-H155 AromaticContact CE2-CD2 3.93Å; W151-H155 AromaticContact CE2-NE2 3.7Å; W151-H155 AromaticContact CZ2-CD2 3.96Å; W151-H155 AromaticContact CZ2-NE2 3.77Å; W151-H155 AromaticContact NE1-NE2 3.68Å; W151-H155 PolarHBondContact O-CD2 3.4Å; A152-H155 WeakPolarHBondContact O-CA 3.44Å; A152-H155 WeakPolarHBondContact O-CB 3.47Å; A152-H155 PolarHBondContact O-N 3.22Å; I153-H155 PolarHBondContact O-N 2.73Å; H155-S160 WeakPolarHBondContact CA-OG 3.37Å; H155-S160 WeakPolarHBondContact O-CB 3.43Å; H155-S160 PolarHBondContact O-OG 3.42Å; H155-L162 HydrophobicContact CB-CB 4.47Å; H155-L162 HydrophobicContact CB-CD1 4.48Å; H155-L162 WeakPolarHBondContact ND1-CD1 3.47Å; H155-F169 HydrophobicContact CB-CD2 4.39Å; H155-F169 HydrophobicContact CB-CE2 3.68Å; H155-F169 HydrophobicContact CB-CZ 4.43Å
156M94.3Very high93.8Very high47 Ų4767.8 Ų67.823%0.23236%0.359CS..G310 helixtrans-97.41.7178.7-65.9-55.1-69.300114.1V137 V141 A152 I153 P154 R163 F169V137-M156 HydrophobicContact CG1-CE 4.27Å; V137-M156 HydrophobicContact CG1-SD 3.64Å; V141-M156 HydrophobicContact CG1-CG 4.31Å; V141-M156 HydrophobicContact CG2-CG 4.1Å; V141-M156 HydrophobicContact CG2-SD 3.73Å; A152-M156 PolarHBondContact O-N 3.34Å; I153-M156 PolarHBondContact O-N 3.48Å; P154-M156 PolarHBondContact O-N 3.13Å; M156-R163 HydrophobicContact CE-CG 4.31Å; M156-R163 WeakPolarHBondContact O-CD 3.42Å; M156-R163 HydrophobicContact SD-CG 4.5Å; M156-F169 HydrophobicContact SD-CE2 4.34Å
157Q93.9Very high94Very high94 Ų9471.3 Ų71.344%0.43937%0.365SS..SBendtrans-65.4152175.5-63.7-59.3-37.500111.6D159 S160 R163Q157-D159 WeakPolarHBondContact CB-OD1 3.49Å; Q157-D159 PolarHBondContact O-N 3Å; Q157-S160 VanDerWaalsContact O-CB 3.31Å; Q157-S160 WeakPolarHBondContact O-CB 3.19Å; Q157-S160 PolarHBondContact O-N 3.43Å; Q157-R163 WeakPolarHBondContact O-CD 3.43Å
158P91Very high94.4Very high114 Ų11468.7 Ų68.774%0.7436%0.357SS*.THydrogen-bonded Turntrans-58.3-29.5-176.1-25.334.9000114.7
159D91.6Very high94.5Very high139 Ų13968.7 Ų68.774%0.74336%0.357SS*.THydrogen-bonded Turntrans-84.5-11.3179.462.1-33.6000113.5Q157 P161Q157-D159 WeakPolarHBondContact CB-OD1 3.49Å; Q157-D159 PolarHBondContact O-N 3Å; D159-P161 WeakPolarHBondContact O-CD 3.48Å
160S93.9Very high94.6Very high15 Ų1564.2 Ų64.211%0.10534%0.336CS..  trans-72.5123.1-178.8172.60000111.3H155 Q157 L162 R163H155-S160 WeakPolarHBondContact CA-OG 3.37Å; H155-S160 WeakPolarHBondContact O-CB 3.43Å; H155-S160 PolarHBondContact O-OG 3.42Å; Q157-S160 VanDerWaalsContact O-CB 3.31Å; Q157-S160 WeakPolarHBondContact O-CB 3.19Å; Q157-S160 PolarHBondContact O-N 3.43Å; S160-L162 PolarHBondContact O-N 3.3Å; S160-L162 PolarHBondContact OG-N 3.45Å; S160-R163 WeakPolarHBondContact O-CB 3.33Å; S160-R163 PolarHBondContact O-N 3.08Å
161P92.6Very high94.8Very high108 Ų10859.4 Ų59.470%0.70133%0.325SS*.THydrogen-bonded Turntrans-67.6-17.8175.928.9-35.3000112.4D159 N165D159-P161 WeakPolarHBondContact O-CD 3.48Å; P161-N165 WeakPolarHBondContact O-CB 3.47Å
162L95.3Very high94.8Very high30 Ų3059.1 Ų59.116%0.15733%0.326CS..THydrogen-bonded Turntrans-79.1-19.8179.7-64.8175.5000112.8H155 S160 N164 N165 F169 E172H155-L162 HydrophobicContact CB-CB 4.47Å; H155-L162 HydrophobicContact CB-CD1 4.48Å; H155-L162 WeakPolarHBondContact ND1-CD1 3.47Å; S160-L162 PolarHBondContact O-N 3.3Å; S160-L162 PolarHBondContact OG-N 3.45Å; L162-N164 PolarHBondContact O-N 3.45Å; L162-N165 PolarHBondContact O-N 2.89Å; L162-F169 HydrophobicContact CB-CD2 4.12Å; L162-E172 HydrophobicContact CD1-CB 4.19Å; L162-E172 HydrophobicContact CD1-CG 3.88Å
163R93.5Very high94.7Very high97 Ų9759.1 Ų59.137%0.36633%0.326SS..THydrogen-bonded Turntrans-60.4-32.7-178.6-173.8-178.3177.8-80.73.4112.6V137 M156 Q157 S160V137-R163 WeakPolarHBondContact CB-O 3.4Å; M156-R163 HydrophobicContact CE-CG 4.31Å; M156-R163 WeakPolarHBondContact O-CD 3.42Å; M156-R163 HydrophobicContact SD-CG 4.5Å; Q157-R163 WeakPolarHBondContact O-CD 3.43Å; S160-R163 WeakPolarHBondContact O-CB 3.33Å; S160-R163 PolarHBondContact O-N 3.08Å
164N95.1Very high94.8Very high84 Ų8458.4 Ų58.445%0.44932%0.317SS..THydrogen-bonded Turntrans-116.422.1-179.4-51.7-41.9000111.9E133 A134 L162E133-N164 VanDerWaalsContact CB-O 3.29Å; E133-N164 WeakPolarHBondContact CB-O 3.36Å; A134-N164 VanDerWaalsContact CB-OD1 3.29Å; A134-N164 WeakPolarHBondContact CB-OD1 3.29Å; L162-N164 PolarHBondContact O-N 3.45Å
165N96.8Very high94.7Very high62 Ų6262.3 Ų62.333%0.33232%0.321SS..  trans-133.293.4-179.2-178-11.8000110.2E133 P161 L162 Q167 G168 F169E133-N165 WeakPolarHBondContact OE2-CA 3.09Å; P161-N165 WeakPolarHBondContact O-CB 3.47Å; L162-N165 PolarHBondContact O-N 2.89Å; N165-Q167 PolarHBondContact O-N 3.21Å; N165-Q167 PolarHBondContact OD1-N 3.3Å; N165-G168 PolarHBondContact O-N 3.01Å; N165-G168 PolarHBondContact OD1-N 2.96Å; N165-F169 WeakPolarHBondContact O-CB 3.15Å; N165-F169 PolarHBondContact O-N 3.22Å
166Y96.4Very high94.6Very high8 Ų861 Ų613%0.03132%0.316CS..Hα-helixtrans-63.1-43.8-174.9-178.2-111.9000112.6M123 R136 V137 L140 F169 L170M123-Y166 HydrophobicContact CE-CE2 3.91Å; M123-Y166 HydrophobicContact CG-CE1 4.42Å; R136-Y166 HydrophobicContact CB-CD1 4.46Å; R136-Y166 HydrophobicContact CB-CD2 3.46Å; R136-Y166 VanDerWaalsContact CB-CD2 3.46Å; R136-Y166 HydrophobicContact CB-CE2 3.95Å; R136-Y166 HydrophobicContact CB-CG 3.75Å; V137-Y166 HydrophobicContact CG2-CD2 4.26Å; L140-Y166 HydrophobicContact CB-CE2 4.19Å; L140-Y166 HydrophobicContact CD1-CE2 3.77Å; Y166-F169 PolarHBondContact O-N 3.23Å; Y166-L170 HydrophobicContact CD1-CD1 3.96Å; Y166-L170 HydrophobicContact CE1-CD1 3.42Å; Y166-L170 VanDerWaalsContact CE1-CD1 3.42Å; Y166-L170 HydrophobicContact CE1-CG 4.18Å; Y166-L170 HydrophobicContact CE2-CD1 4.4Å; Y166-L170 HydrophobicContact CE2-CG 4.32Å; Y166-L170 WeakPolarHBondContact O-CG 3.31Å; Y166-L170 PolarHBondContact O-N 2.92Å
167Q96.3Very high94.3Very high114 Ų11458.8 Ų58.853%0.53331%0.305SS..Hα-helixtrans-67.9-41-179.9-69.5-59.3-28.400111.9N165 F169 L170 A171N165-Q167 PolarHBondContact O-N 3.21Å; N165-Q167 PolarHBondContact OD1-N 3.3Å; Q167-F169 VanDerWaalsContact C-N 3.33Å; Q167-F169 PolarHBondContact O-N 3.19Å; Q167-L170 PolarHBondContact O-N 3.46Å; Q167-A171 WeakPolarHBondContact O-CB 3.4Å; Q167-A171 PolarHBondContact O-N 3.24Å
168G97.3Very high93.8Very high16 Ų1662.1 Ų62.117%0.16532%0.318CS..Hα-helixtrans-59.6-44.4173.100000111.6N165 L170 A171 E172N165-G168 PolarHBondContact O-N 3.01Å; N165-G168 PolarHBondContact OD1-N 2.96Å; G168-L170 PolarHBondContact O-N 3.22Å; G168-A171 PolarHBondContact O-N 3.29Å; G168-E172 WeakPolarHBondContact O-CB 3.33Å; G168-E172 PolarHBondContact O-N 3.39Å
169F97.1Very high92.9Very high0 Ų058.1 Ų58.10%029%0.293CS..Hα-helixtrans-62.2-44.6177.8-159.7-74.7000111.6V137 L140 V141 L144 W151 A152 H155 M156 L162 N165 Y166 Q167 A171 E172 L173V137-F169 HydrophobicContact CG1-CD2 3.64Å; V137-F169 HydrophobicContact CG1-CE2 3.99Å; V137-F169 HydrophobicContact CG1-CG 4.17Å; V137-F169 HydrophobicContact CG2-CB 4.2Å; L140-F169 HydrophobicContact CD1-CD1 4.47Å; L140-F169 HydrophobicContact CD2-CD1 3.64Å; L140-F169 HydrophobicContact CD2-CE1 3.38Å; L140-F169 HydrophobicContact CD2-CZ 4.37Å; V141-F169 HydrophobicContact CG2-CE1 4.18Å; V141-F169 HydrophobicContact CG2-CE2 4.04Å; V141-F169 HydrophobicContact CG2-CZ 3.57Å; L144-F169 HydrophobicContact CD1-CE1 4.46Å; W151-F169 HydrophobicContact CH2-CE1 4.12Å; W151-F169 HydrophobicContact CH2-CZ 4.39Å; W151-F169 AromaticContact CZ3-CE1 3.8Å; W151-F169 HydrophobicContact CZ3-CE1 3.8Å; W151-F169 AromaticContact CZ3-CZ 3.99Å; W151-F169 HydrophobicContact CZ3-CZ 3.99Å; A152-F169 HydrophobicContact CB-CZ 4.02Å; H155-F169 HydrophobicContact CB-CD2 4.39Å; H155-F169 HydrophobicContact CB-CE2 3.68Å; H155-F169 HydrophobicContact CB-CZ 4.43Å; M156-F169 HydrophobicContact SD-CE2 4.34Å; L162-F169 HydrophobicContact CB-CD2 4.12Å; N165-F169 WeakPolarHBondContact O-CB 3.15Å; N165-F169 PolarHBondContact O-N 3.22Å; Y166-F169 PolarHBondContact O-N 3.23Å; Q167-F169 VanDerWaalsContact C-N 3.33Å; Q167-F169 PolarHBondContact O-N 3.19Å; F169-A171 VanDerWaalsContact C-N 3.34Å; F169-A171 PolarHBondContact O-N 2.71Å; F169-E172 PolarHBondContact O-N 2.91Å; F169-L173 WeakPolarHBondContact O-CB 3.47Å; F169-L173 PolarHBondContact O-N 2.93Å
170L96.3Very high91.5Very high9 Ų955.9 Ų55.95%0.04729%0.286CS..Hα-helixtrans-62.8-38.8175.6-73176.9000112.7L116 L140 Y166 Q167 G168 E172 R174L116-L170 HydrophobicContact CD2-CD2 3.59Å; L140-L170 HydrophobicContact CD1-CD2 3.37Å; L140-L170 HydrophobicContact CD1-CG 4.19Å; Y166-L170 HydrophobicContact CD1-CD1 3.96Å; Y166-L170 HydrophobicContact CE1-CD1 3.42Å; Y166-L170 VanDerWaalsContact CE1-CD1 3.42Å; Y166-L170 HydrophobicContact CE1-CG 4.18Å; Y166-L170 HydrophobicContact CE2-CD1 4.4Å; Y166-L170 HydrophobicContact CE2-CG 4.32Å; Y166-L170 WeakPolarHBondContact O-CG 3.31Å; Y166-L170 PolarHBondContact O-N 2.92Å; Q167-L170 PolarHBondContact O-N 3.46Å; G168-L170 PolarHBondContact O-N 3.22Å; L170-E172 VanDerWaalsContact C-N 3.35Å; L170-R174 WeakPolarHBondContact O-CB 3.33Å; L170-R174 VanDerWaalsContact O-CG 3.26Å; L170-R174 WeakPolarHBondContact O-CG 3.46Å; L170-R174 PolarHBondContact O-N 3.33Å
171A95.9Very high89.9Confident54 Ų5461.9 Ų61.945%0.44632%0.316SS..Hα-helixtrans-63.2-43.517600000111.3Q167 G168 F169 R174 R175Q167-A171 WeakPolarHBondContact O-CB 3.4Å; Q167-A171 PolarHBondContact O-N 3.24Å; G168-A171 PolarHBondContact O-N 3.29Å; F169-A171 VanDerWaalsContact C-N 3.34Å; F169-A171 PolarHBondContact O-N 2.71Å; A171-R174 PolarHBondContact O-N 2.95Å; A171-R175 WeakPolarHBondContact O-CB 3.4Å; A171-R175 PolarHBondContact O-N 3.32Å
172E95.3Very high88.5Confident37 Ų3763.4 Ų63.417%0.17331%0.308CS..Hα-helixtrans-69.2-38179.8-16744-13900112.1W151 L162 G168 F169 L170 R175 T176W151-E172 HydrophobicContact CZ2-CB 4.5Å; W151-E172 HydrophobicContact CZ2-CG 3.98Å; L162-E172 HydrophobicContact CD1-CB 4.19Å; L162-E172 HydrophobicContact CD1-CG 3.88Å; G168-E172 WeakPolarHBondContact O-CB 3.33Å; G168-E172 PolarHBondContact O-N 3.39Å; F169-E172 PolarHBondContact O-N 2.91Å; L170-E172 VanDerWaalsContact C-N 3.35Å; E172-R175 VanDerWaalsContact CD-NE 3.31Å; E172-R175 PolarHBondContact O-N 3.36Å; E172-R175 IonicContact OE1-CZ 3.24Å; E172-R175 VanDerWaalsContact OE1-CZ 3.24Å; E172-R175 IonicContact OE1-NE 2.79Å; E172-R175 PolarHBondContact OE1-NE 3.38Å; E172-R175 IonicContact OE1-NH2 2.62Å; E172-R175 PolarHBondContact OE1-NH2 2.98Å; E172-R175 IonicContact OE2-CZ 3.52Å; E172-R175 IonicContact OE2-NE 3.51Å; E172-R175 PolarHBondContact OE2-NE 3.41Å; E172-R175 IonicContact OE2-NH2 3.54Å; E172-T176 WeakPolarHBondContact O-CB 3.34Å; E172-T176 PolarHBondContact O-N 3.48Å; E172-T176 PolarHBondContact O-OG1 3.36Å
173L95.1Very high87Confident0 Ų063.1 Ų63.10%031%0.305CS..Hα-helixtrans-60.6-49171.3-175.673.7000111F105 L112 F115 L116 L144 W151 F169 R175 T176 Y177F105-L173 HydrophobicContact CD1-CD1 4.47Å; F105-L173 HydrophobicContact CE1-CD1 4.17Å; L112-L173 HydrophobicContact CD1-CD2 4.23Å; L112-L173 HydrophobicContact CD1-CG 4.17Å; F115-L173 HydrophobicContact CD1-CD2 4.3Å; F115-L173 HydrophobicContact CE1-CD2 3.86Å; L116-L173 HydrophobicContact CD2-CD2 4.06Å; L144-L173 HydrophobicContact CD2-CD1 4.41Å; W151-L173 HydrophobicContact CE3-CD1 4.15Å; W151-L173 VanDerWaalsContact CH2-CA 3.49Å; W151-L173 HydrophobicContact CH2-CB 3.87Å; W151-L173 HydrophobicContact CH2-CD1 3.83Å; W151-L173 HydrophobicContact CH2-CG 4.48Å; W151-L173 HydrophobicContact CZ3-CB 4.29Å; W151-L173 HydrophobicContact CZ3-CD1 3.43Å; W151-L173 VanDerWaalsContact CZ3-CD1 3.43Å; W151-L173 HydrophobicContact CZ3-CG 4.48Å; F169-L173 WeakPolarHBondContact O-CB 3.47Å; F169-L173 PolarHBondContact O-N 2.93Å; L173-R175 PolarHBondContact O-N 3Å; L173-T176 PolarHBondContact O-N 3.26Å; L173-Y177 HydrophobicContact CD1-CD2 3.69Å; L173-Y177 HydrophobicContact CD1-CE2 3.88Å; L173-Y177 HydrophobicContact CG-CD2 4.35Å; L173-Y177 WeakPolarHBondContact O-CD2 3.42Å; L173-Y177 PolarHBondContact O-N 2.93Å
174R93.9Very high85.6Confident85 Ų8561.3 Ų61.332%0.32131%0.311SS..Hα-helixtrans-59.2-47.1175.2-72.8173.3-169.6115.9-0.3111.1L116 L170 A171 T176 Y177 K178L116-R174 HydrophobicContact CD1-CG 3.66Å; L170-R174 WeakPolarHBondContact O-CB 3.33Å; L170-R174 VanDerWaalsContact O-CG 3.26Å; L170-R174 WeakPolarHBondContact O-CG 3.46Å; L170-R174 PolarHBondContact O-N 3.33Å; A171-R174 PolarHBondContact O-N 2.95Å; R174-T176 PolarHBondContact O-N 3.37Å; R174-Y177 PolarHBondContact O-N 3.44Å; R174-K178 WeakPolarHBondContact O-CB 3.39Å; R174-K178 PolarHBondContact O-N 3.49Å
175R92.1Very high84.5Confident160 Ų16066.2 Ų66.260%0.60432%0.324SS*.Hα-helixtrans-57.9-38.9179.4-170.3-175.777.7102.30.3112A171 E172 L173A171-R175 WeakPolarHBondContact O-CB 3.4Å; A171-R175 PolarHBondContact O-N 3.32Å; E172-R175 VanDerWaalsContact CD-NE 3.31Å; E172-R175 PolarHBondContact O-N 3.36Å; E172-R175 IonicContact OE1-CZ 3.24Å; E172-R175 VanDerWaalsContact OE1-CZ 3.24Å; E172-R175 IonicContact OE1-NE 2.79Å; E172-R175 PolarHBondContact OE1-NE 3.38Å; E172-R175 IonicContact OE1-NH2 2.62Å; E172-R175 PolarHBondContact OE1-NH2 2.98Å; E172-R175 IonicContact OE2-CZ 3.52Å; E172-R175 IonicContact OE2-NE 3.51Å; E172-R175 PolarHBondContact OE2-NE 3.41Å; E172-R175 IonicContact OE2-NH2 3.54Å; L173-R175 PolarHBondContact O-N 3Å
176T92Very high83.3Confident7 Ų767.6 Ų67.64%0.04332%0.324CS..Hα-helixtrans-72.4-47.8-178.8-61.70000111.5W151 E172 L173 R174 H183 R186W151-T176 HydrophobicContact CG-CG2 4.49Å; W151-T176 PolarHBondContact NE1-OG1 3.05Å; E172-T176 WeakPolarHBondContact O-CB 3.34Å; E172-T176 PolarHBondContact O-N 3.48Å; E172-T176 PolarHBondContact O-OG1 3.36Å; L173-T176 PolarHBondContact O-N 3.26Å; R174-T176 PolarHBondContact O-N 3.37Å; T176-H183 PolarHBondContact O-NE2 3.46Å; T176-R186 PolarHBondContact O-NH2 3.12Å
177Y89.7Confident82.1Confident2 Ų269.3 Ų69.31%0.00834%0.34CS..Hα-helixtrans-103.7-11.8-166.3-67.3-80.2000116.4F105 G107 P109 A148 W151 L173 R174 S179 H183F105-Y177 HydrophobicContact CE1-CD1 4.08Å; F105-Y177 AromaticContact CE1-CD2 3.92Å; F105-Y177 HydrophobicContact CE1-CD2 3.92Å; F105-Y177 HydrophobicContact CE1-CE1 4.36Å; F105-Y177 HydrophobicContact CE1-CE2 4.23Å; F105-Y177 AromaticContact CE1-CG 3.86Å; F105-Y177 HydrophobicContact CE1-CG 3.86Å; F105-Y177 AromaticContact CZ-CD1 3.96Å; F105-Y177 HydrophobicContact CZ-CD1 3.96Å; F105-Y177 HydrophobicContact CZ-CD2 4.35Å; F105-Y177 AromaticContact CZ-CG 3.84Å; F105-Y177 HydrophobicContact CZ-CG 3.84Å; G107-Y177 WeakPolarHBondContact O-CD1 3.49Å; G107-Y177 WeakPolarHBondContact O-CE1 3.25Å; P109-Y177 VanDerWaalsContact CB-O 3.23Å; P109-Y177 WeakPolarHBondContact CB-O 3.45Å; P109-Y177 WeakPolarHBondContact CG-O 3.46Å; A148-Y177 VanDerWaalsContact CA-OH 3.27Å; A148-Y177 WeakPolarHBondContact CA-OH 3.48Å; A148-Y177 HydrophobicContact CB-CE2 4.47Å; W151-Y177 AromaticContact CD2-CE2 3.99Å; W151-Y177 HydrophobicContact CD2-CE2 3.99Å; W151-Y177 HydrophobicContact CE3-CE2 4.02Å; W151-Y177 HydrophobicContact CG-CE2 4.36Å; W151-Y177 HydrophobicContact CZ3-CE2 4.48Å; L173-Y177 HydrophobicContact CD1-CD2 3.69Å; L173-Y177 HydrophobicContact CD1-CE2 3.88Å; L173-Y177 HydrophobicContact CG-CD2 4.35Å; L173-Y177 WeakPolarHBondContact O-CD2 3.42Å; L173-Y177 PolarHBondContact O-N 2.93Å; R174-Y177 PolarHBondContact O-N 3.44Å; Y177-S179 PolarHBondContact O-N 3.32Å; Y177-S179 VanDerWaalsContact O-N 3.11Å; Y177-H183 WeakPolarHBondContact CA-NE2 3.31Å; Y177-H183 AromaticContact CD1-CE1 3.28Å; Y177-H183 WeakPolarHBondContact CD1-CE1 3.47Å; Y177-H183 AromaticContact CD1-NE2 3.18Å; Y177-H183 WeakPolarHBondContact CD1-NE2 3.36Å; Y177-H183 AromaticContact CE1-CE1 3.26Å; Y177-H183 WeakPolarHBondContact CE1-CE1 3.46Å; Y177-H183 AromaticContact CE1-NE2 3.67Å; Y177-H183 AromaticContact CG-NE2 3.79Å
178K83.2Confident81.1Confident163 Ų16369.3 Ų69.371%0.70934%0.34SS*.SBendtrans-73.50.7-176.2-165.3176.2-176.4-174.80114.5L112 R174L112-K178 HydrophobicContact CD2-CB 4.1Å; R174-K178 WeakPolarHBondContact O-CB 3.39Å; R174-K178 PolarHBondContact O-N 3.49Å
179S72.1Confident80.3Confident30 Ų3073 Ų7321%0.2136%0.355CS..  trans-126.1113.5-176.9-177.40000113Y177 L181 R182 H183Y177-S179 PolarHBondContact O-N 3.32Å; Y177-S179 VanDerWaalsContact O-N 3.11Å; S179-L181 PolarHBondContact O-N 3.31Å; S179-L181 PolarHBondContact OG-N 3.03Å; S179-R182 PolarHBondContact O-N 3.39Å; S179-R182 PolarHBondContact OG-N 3.43Å; S179-H183 PolarHBondContact O-N 2.96Å
180P62.2Low79.5Confident92 Ų9278.7 Ų78.760%0.59738%0.376SS*.Hα-helixtrans-56.1-38.1170.2-22.731.5000111.8R182 H183 A184P180-R182 PolarHBondContact O-N 3.26Å; P180-H183 PolarHBondContact O-N 3.41Å; P180-A184 WeakPolarHBondContact O-CB 3.32Å; P180-A184 PolarHBondContact O-N 3.48Å
181L60Low78.7Confident142 Ų14285.6 Ų85.674%0.74341%0.406SS*.Hα-helixtrans-65.5-36.3-180-65174.3000112.6S179 R185S179-L181 PolarHBondContact O-N 3.31Å; S179-L181 PolarHBondContact OG-N 3.03Å; L181-R185 WeakPolarHBondContact O-CB 3.18Å; L181-R185 PolarHBondContact O-N 3.05Å
182R62.8Low78.1Confident140 Ų14086 Ų8653%0.52840%0.403SS..Hα-helixtrans-72.1-39.1178.2-69.7-176-179.6-95.50.6111.7S179 P180 R186S179-R182 PolarHBondContact O-N 3.39Å; S179-R182 PolarHBondContact OG-N 3.43Å; P180-R182 PolarHBondContact O-N 3.26Å; R182-R186 WeakPolarHBondContact O-CB 3.32Å; R182-R186 VanDerWaalsContact O-CG 3.31Å; R182-R186 WeakPolarHBondContact O-CG 3.19Å; R182-R186 PolarHBondContact O-N 3.48Å
183H63.3Low77.6Confident23 Ų2387.3 Ų87.311%0.10642%0.416CS..Hα-helixtrans-71-42.4174.5-79.5-78.5000112.2P109 T176 Y177 S179 P180 R185 R186 A187P109-H183 HydrophobicContact CG-CB 4.42Å; T176-H183 PolarHBondContact O-NE2 3.46Å; Y177-H183 WeakPolarHBondContact CA-NE2 3.31Å; Y177-H183 AromaticContact CD1-CE1 3.28Å; Y177-H183 WeakPolarHBondContact CD1-CE1 3.47Å; Y177-H183 AromaticContact CD1-NE2 3.18Å; Y177-H183 WeakPolarHBondContact CD1-NE2 3.36Å; Y177-H183 AromaticContact CE1-CE1 3.26Å; Y177-H183 WeakPolarHBondContact CE1-CE1 3.46Å; Y177-H183 AromaticContact CE1-NE2 3.67Å; Y177-H183 AromaticContact CG-NE2 3.79Å; S179-H183 PolarHBondContact O-N 2.96Å; P180-H183 PolarHBondContact O-N 3.41Å; H183-R185 VanDerWaalsContact C-N 3.33Å; H183-R185 PolarHBondContact O-N 3.23Å; H183-R186 PolarHBondContact O-N 3.02Å; H183-A187 VanDerWaalsContact O-CB 3.25Å; H183-A187 WeakPolarHBondContact O-CB 3.33Å; H183-A187 PolarHBondContact O-N 3.19Å
184A65.7Low76.9Confident60 Ų6090.2 Ų90.250%0.49644%0.441SS..Hα-helixtrans-58.3-45.1172.200000111.3P180 A187 Q188P180-A184 WeakPolarHBondContact O-CB 3.32Å; P180-A184 PolarHBondContact O-N 3.48Å; A184-A187 PolarHBondContact O-N 2.93Å; A184-Q188 VanDerWaalsContact O-CB 3.26Å; A184-Q188 WeakPolarHBondContact O-CB 3.49Å; A184-Q188 PolarHBondContact O-N 3.37Å
185R70.3Confident76.4Confident186 Ų18689.5 Ų89.570%0.70245%0.448SS*.Hα-helixtrans-64-44.7175.4-175.1175.5-178177.31.1112.3L181 H183 Q188 I189L181-R185 WeakPolarHBondContact O-CB 3.18Å; L181-R185 PolarHBondContact O-N 3.05Å; H183-R185 VanDerWaalsContact C-N 3.33Å; H183-R185 PolarHBondContact O-N 3.23Å; R185-Q188 PolarHBondContact O-N 2.92Å; R185-I189 HydrophobicContact CG-CD1 3.91Å; R185-I189 HydrophobicContact CG-CG1 4.49Å; R185-I189 WeakPolarHBondContact O-CB 3.04Å; R185-I189 WeakPolarHBondContact O-CD1 2.99Å; R185-I189 WeakPolarHBondContact O-CG1 3.29Å; R185-I189 PolarHBondContact O-N 3.49Å
186R71.9Confident76.1Confident91 Ų9186.4 Ų86.434%0.34344%0.444SS..Hα-helixtrans-63.2-44.7176.4-80.4-175-101.9-113.48.6111.8T176 R182 H183 Q188 I189 R190T176-R186 PolarHBondContact O-NH2 3.12Å; R182-R186 WeakPolarHBondContact O-CB 3.32Å; R182-R186 VanDerWaalsContact O-CG 3.31Å; R182-R186 WeakPolarHBondContact O-CG 3.19Å; R182-R186 PolarHBondContact O-N 3.48Å; H183-R186 PolarHBondContact O-N 3.02Å; R186-Q188 VanDerWaalsContact C-N 3.33Å; R186-Q188 PolarHBondContact O-N 2.82Å; R186-I189 PolarHBondContact O-N 3.03Å; R186-R190 WeakPolarHBondContact O-CG 3.35Å; R186-R190 PolarHBondContact O-N 3.2Å
187A72.6Confident75.9Confident44 Ų4494.5 Ų94.536%0.36447%0.474SS..Hα-helixtrans-60.8-42.5175.100000111.5H183 A184 R190 K191H183-A187 VanDerWaalsContact O-CB 3.25Å; H183-A187 WeakPolarHBondContact O-CB 3.33Å; H183-A187 PolarHBondContact O-N 3.19Å; A184-A187 PolarHBondContact O-N 2.93Å; A187-R190 PolarHBondContact O-N 2.88Å; A187-K191 WeakPolarHBondContact O-CB 3.48Å; A187-K191 PolarHBondContact O-N 3.42Å
188Q74.6Confident75.7Confident114 Ų11496.5 Ų96.553%0.53349%0.49SS..Hα-helixtrans-66.1-40.2175.8-17171.8-34.400112.4A184 R185 R186 R190 K191 T192A184-Q188 VanDerWaalsContact O-CB 3.26Å; A184-Q188 WeakPolarHBondContact O-CB 3.49Å; A184-Q188 PolarHBondContact O-N 3.37Å; R185-Q188 PolarHBondContact O-N 2.92Å; R186-Q188 VanDerWaalsContact C-N 3.33Å; R186-Q188 PolarHBondContact O-N 2.82Å; Q188-R190 VanDerWaalsContact C-N 3.35Å; Q188-K191 PolarHBondContact O-N 2.86Å; Q188-T192 HydrophobicContact CG-CG2 4.48Å; Q188-T192 WeakPolarHBondContact O-CB 3.44Å; Q188-T192 WeakPolarHBondContact O-CG2 3.46Å; Q188-T192 PolarHBondContact O-N 3.17Å; Q188-T192 PolarHBondContact O-OG1 3.19Å
189I79.4Confident75.8Confident93 Ų9392.4 Ų92.448%0.47748%0.479SS..Hα-helixtrans-60.9-44.4172.7-70163.3000110.2R185 R186 T192 S193R185-I189 HydrophobicContact CG-CD1 3.91Å; R185-I189 HydrophobicContact CG-CG1 4.49Å; R185-I189 WeakPolarHBondContact O-CB 3.04Å; R185-I189 WeakPolarHBondContact O-CD1 2.99Å; R185-I189 WeakPolarHBondContact O-CG1 3.29Å; R185-I189 PolarHBondContact O-N 3.49Å; R186-I189 PolarHBondContact O-N 3.03Å; I189-T192 WeakPolarHBondContact CA-OG1 3.42Å; I189-T192 PolarHBondContact O-N 3.38Å; I189-T192 PolarHBondContact O-OG1 3.49Å; I189-T192 VanDerWaalsContact O-OG1 3.05Å; I189-S193 WeakPolarHBondContact O-CB 3.39Å; I189-S193 PolarHBondContact O-N 3.18Å; I189-S193 PolarHBondContact O-OG 3.25Å; I189-S193 VanDerWaalsContact O-OG 3.06Å
190R80.4Confident76.6Confident120 Ų12099.8 Ų99.845%0.45350%0.502SS..Hα-helixtrans-59.6-49.3175.8-71.1-171.7-68.1-139.18.9111.4E147 R186 A187 Q188 T192 S193 A194E147-R190 VanDerWaalsContact CD-NH1 3.28Å; E147-R190 IonicContact OE1-CZ 3.34Å; E147-R190 IonicContact OE1-NH1 2.94Å; E147-R190 PolarHBondContact OE1-NH1 3.31Å; E147-R190 IonicContact OE1-NH2 3.64Å; E147-R190 PolarHBondContact OE1-NH2 3.34Å; E147-R190 IonicContact OE2-CZ 3.4Å; E147-R190 IonicContact OE2-NH1 2.73Å; E147-R190 PolarHBondContact OE2-NH1 3.01Å; E147-R190 IonicContact OE2-NH2 3.07Å; E147-R190 PolarHBondContact OE2-NH2 2.87Å; R186-R190 WeakPolarHBondContact O-CG 3.35Å; R186-R190 PolarHBondContact O-N 3.2Å; A187-R190 PolarHBondContact O-N 2.88Å; Q188-R190 VanDerWaalsContact C-N 3.35Å; R190-T192 PolarHBondContact O-N 3.37Å; R190-S193 WeakPolarHBondContact CA-OG 3.35Å; R190-S193 PolarHBondContact O-N 2.87Å; R190-S193 PolarHBondContact O-OG 2.97Å; R190-A194 PolarHBondContact O-N 3.27Å
191K81.1Confident77.9Confident154 Ų154101 Ų10167%0.6750%0.5SS*.Hα-helixtrans-61-46.7-179.9-169.4175.2-177.8179.60112.4A187 Q188 S195A187-K191 WeakPolarHBondContact O-CB 3.48Å; A187-K191 PolarHBondContact O-N 3.42Å; Q188-K191 PolarHBondContact O-N 2.86Å; K191-S195 PolarHBondContact O-N 3.47Å; K191-S195 VanDerWaalsContact O-N 3.1Å
192T82.9Confident79Confident63 Ų6398.8 Ų98.839%0.38748%0.481SS..Hα-helixtrans-68.3-37.9177.452.40000111.9Q188 I189 R190 S195 N196Q188-T192 HydrophobicContact CG-CG2 4.48Å; Q188-T192 WeakPolarHBondContact O-CB 3.44Å; Q188-T192 WeakPolarHBondContact O-CG2 3.46Å; Q188-T192 PolarHBondContact O-N 3.17Å; Q188-T192 PolarHBondContact O-OG1 3.19Å; I189-T192 WeakPolarHBondContact CA-OG1 3.42Å; I189-T192 PolarHBondContact O-N 3.38Å; I189-T192 PolarHBondContact O-OG1 3.49Å; I189-T192 VanDerWaalsContact O-OG1 3.05Å; R190-T192 PolarHBondContact O-N 3.37Å; T192-S195 PolarHBondContact O-N 2.95Å; T192-N196 VanDerWaalsContact O-CB 3.27Å; T192-N196 WeakPolarHBondContact O-CB 3.48Å; T192-N196 PolarHBondContact O-N 3.25Å; T192-N196 PolarHBondContact O-ND2 3.22Å
193S84.3Confident80.2Confident64 Ų6497.1 Ų97.145%0.44848%0.48SS..Hα-helixtrans-66.1-39.417771.60000112.9I189 R190 N196 R197I189-S193 WeakPolarHBondContact O-CB 3.39Å; I189-S193 PolarHBondContact O-N 3.18Å; I189-S193 PolarHBondContact O-OG 3.25Å; I189-S193 VanDerWaalsContact O-OG 3.06Å; R190-S193 WeakPolarHBondContact CA-OG 3.35Å; R190-S193 PolarHBondContact O-N 2.87Å; R190-S193 PolarHBondContact O-OG 2.97Å; S193-N196 PolarHBondContact O-N 3.46Å; S193-R197 WeakPolarHBondContact O-CB 3.24Å; S193-R197 PolarHBondContact O-N 3.44Å
194A80.3Confident81.4Confident62 Ų62101.4 Ų101.451%0.51250%0.501SS..Hα-helixtrans-65.5-44.5174.500000111.6R190 R197 A198R190-A194 PolarHBondContact O-N 3.27Å; A194-R197 PolarHBondContact O-N 3.02Å; A194-A198 PolarHBondContact O-N 2.99Å; A194-A198 VanDerWaalsContact O-N 3.11Å
195S83.8Confident82.4Confident69 Ų69102.9 Ų102.948%0.48350%0.5SS..Hα-helixtrans-60.9-46.6174.1-178.50000111.7K191 T192 R197 A198 V199K191-S195 PolarHBondContact O-N 3.47Å; K191-S195 VanDerWaalsContact O-N 3.1Å; T192-S195 PolarHBondContact O-N 2.95Å; S195-R197 VanDerWaalsContact C-N 3.33Å; S195-R197 PolarHBondContact O-N 2.85Å; S195-A198 PolarHBondContact O-N 3.18Å; S195-V199 WeakPolarHBondContact O-CG2 3.39Å; S195-V199 PolarHBondContact O-N 2.96Å
196N85.5Confident83.1Confident95 Ų9595.4 Ų95.451%0.50848%0.476SS..Hα-helixtrans-63.6-36.1178-71.8-19.8000112.5T192 S193 V199 R200T192-N196 VanDerWaalsContact O-CB 3.27Å; T192-N196 WeakPolarHBondContact O-CB 3.48Å; T192-N196 PolarHBondContact O-N 3.25Å; T192-N196 PolarHBondContact O-ND2 3.22Å; S193-N196 PolarHBondContact O-N 3.46Å; N196-V199 PolarHBondContact O-N 3.07Å; N196-R200 WeakPolarHBondContact O-CB 3.4Å; N196-R200 VanDerWaalsContact O-CG 3.25Å; N196-R200 WeakPolarHBondContact O-CG 3.39Å; N196-R200 PolarHBondContact O-N 3.27Å
197R87Confident83.8Confident178 Ų17899.4 Ų99.467%0.67249%0.491SS*.Hα-helixtrans-62.7-47.9174.2-178.6179.6-83.1-176.2-7.2110.9S193 A194 S195 V199 R200 E201S193-R197 WeakPolarHBondContact O-CB 3.24Å; S193-R197 PolarHBondContact O-N 3.44Å; A194-R197 PolarHBondContact O-N 3.02Å; S195-R197 VanDerWaalsContact C-N 3.33Å; S195-R197 PolarHBondContact O-N 2.85Å; R197-V199 VanDerWaalsContact C-N 3.34Å; R197-V199 PolarHBondContact O-N 3.36Å; R197-R200 PolarHBondContact O-N 2.98Å; R197-E201 WeakPolarHBondContact CG-OE1 3.36Å; R197-E201 WeakPolarHBondContact O-CG 3.28Å; R197-E201 PolarHBondContact O-N 3.34Å
198A86.8Confident84.4Confident43 Ų43102.8 Ų102.836%0.35550%0.499SS..Hα-helixtrans-62.8-38.5177.500000112.8A194 S195 R202A194-A198 PolarHBondContact O-N 2.99Å; A194-A198 VanDerWaalsContact O-N 3.11Å; S195-A198 PolarHBondContact O-N 3.18Å; A198-R202 PolarHBondContact O-N 2.91Å; A198-R202 VanDerWaalsContact O-N 3.07Å
199V85.6Confident84.8Confident77 Ų77100 Ų10047%0.46749%0.488SS..Hα-helixtrans-63.5-44.7174.5172.40000110.9S195 N196 R197 R202 Q203S195-V199 WeakPolarHBondContact O-CG2 3.39Å; S195-V199 PolarHBondContact O-N 2.96Å; N196-V199 PolarHBondContact O-N 3.07Å; R197-V199 VanDerWaalsContact C-N 3.34Å; R197-V199 PolarHBondContact O-N 3.36Å; V199-R202 PolarHBondContact O-N 3.1Å; V199-Q203 WeakPolarHBondContact O-CB 3.48Å; V199-Q203 PolarHBondContact O-N 2.62Å
200R87.2Confident84.8Confident186 Ų18699.4 Ų99.470%0.70250%0.497SS*.Hα-helixtrans-64.9-42.5178.4-74.8176.1120.2168.11.1112.5N196 R197 R202 Q203 M204N196-R200 WeakPolarHBondContact O-CB 3.4Å; N196-R200 VanDerWaalsContact O-CG 3.25Å; N196-R200 WeakPolarHBondContact O-CG 3.39Å; N196-R200 PolarHBondContact O-N 3.27Å; R197-R200 PolarHBondContact O-N 2.98Å; R200-R202 VanDerWaalsContact C-N 3.32Å; R200-R202 PolarHBondContact O-N 3.4Å; R200-Q203 PolarHBondContact O-N 3.42Å; R200-M204 WeakPolarHBondContact O-CB 3.36Å; R200-M204 VanDerWaalsContact O-CG 3.28Å; R200-M204 WeakPolarHBondContact O-CG 3.41Å; R200-M204 PolarHBondContact O-N 2.9Å
201E89.8Confident84.7Confident116 Ų11698.1 Ų98.154%0.54251%0.511SS..Hα-helixtrans-60-42.3175.1-76.9170.2-172.300111.5R197 M204 L205R197-E201 WeakPolarHBondContact CG-OE1 3.36Å; R197-E201 WeakPolarHBondContact O-CG 3.28Å; R197-E201 PolarHBondContact O-N 3.34Å; E201-M204 WeakPolarHBondContact O-CB 3.45Å; E201-M204 PolarHBondContact O-N 3.1Å; E201-L205 PolarHBondContact O-N 3.36Å
202R82.8Confident84.6Confident96 Ų9694 Ų9436%0.36251%0.506SS..Hα-helixtrans-64.4-45.2174.7-170.9-178.9-55.1159.59.1112.2A198 V199 R200 M204 L205 C206 H220A198-R202 PolarHBondContact O-N 2.91Å; A198-R202 VanDerWaalsContact O-N 3.07Å; V199-R202 PolarHBondContact O-N 3.1Å; R200-R202 VanDerWaalsContact C-N 3.32Å; R200-R202 PolarHBondContact O-N 3.4Å; R202-M204 PolarHBondContact O-N 2.87Å; R202-L205 PolarHBondContact O-N 2.76Å; R202-C206 WeakPolarHBondContact O-CB 3.08Å; R202-C206 PolarHBondContact O-N 2.9Å; R202-H220 PolarHBondContact NH2-CD2 3.45Å
203Q88.3Confident84.1Confident105 Ų10594.3 Ų94.349%0.49152%0.522SS..Hα-helixtrans-63.4-34-179.6-161.2168.431.200111.5V199 R200 R207V199-Q203 WeakPolarHBondContact O-CB 3.48Å; V199-Q203 PolarHBondContact O-N 2.62Å; R200-Q203 PolarHBondContact O-N 3.42Å; Q203-R207 VanDerWaalsContact O-CG 3.31Å; Q203-R207 WeakPolarHBondContact O-CG 3.38Å; Q203-R207 PolarHBondContact O-N 2.94Å; Q203-R207 VanDerWaalsContact O-N 3.17Å
204M89.1Confident83.2Confident114 Ų11495.3 Ų95.356%0.56253%0.526SS*.Hα-helixtrans-65.1-50.2171.2-74.5-88.3-77.100112.1R200 E201 R202 C206 R207 Q208R200-M204 WeakPolarHBondContact O-CB 3.36Å; R200-M204 VanDerWaalsContact O-CG 3.28Å; R200-M204 WeakPolarHBondContact O-CG 3.41Å; R200-M204 PolarHBondContact O-N 2.9Å; E201-M204 WeakPolarHBondContact O-CB 3.45Å; E201-M204 PolarHBondContact O-N 3.1Å; R202-M204 PolarHBondContact O-N 2.87Å; M204-C206 PolarHBondContact O-N 3.09Å; M204-R207 PolarHBondContact O-N 3.25Å; M204-Q208 WeakPolarHBondContact O-CG 3.36Å; M204-Q208 PolarHBondContact O-N 3.01Å
205L87.5Confident82.4Confident91 Ų9195.2 Ų95.248%0.47653%0.531SS..Hα-helixtrans-59.1-45178-87.1165.2000112.3E201 R202 R207 Q208 L209E201-L205 PolarHBondContact O-N 3.36Å; R202-L205 PolarHBondContact O-N 2.76Å; L205-R207 VanDerWaalsContact C-N 3.33Å; L205-R207 PolarHBondContact O-N 3.49Å; L205-Q208 PolarHBondContact O-N 2.92Å; L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 2.92Å
206C83.9Confident81.5Confident28 Ų2898 Ų9819%0.18955%0.547CS..Hα-helixtrans-58.3-43.5175.4-81.90000112.6R202 M204 Q208 L209 A210 C217R202-C206 WeakPolarHBondContact O-CB 3.08Å; R202-C206 PolarHBondContact O-N 2.9Å; M204-C206 PolarHBondContact O-N 3.09Å; C206-Q208 VanDerWaalsContact C-N 3.33Å; C206-Q208 PolarHBondContact O-N 2.73Å; C206-L209 PolarHBondContact O-N 3.23Å; C206-A210 WeakPolarHBondContact O-CB 3.27Å; C206-A210 PolarHBondContact O-N 2.95Å; C206-C217 HydrophobicContact CB-CB 4.44Å; C206-C217 WeakPolarHBondContact CB-SG 3.47Å; C206-C217 WeakPolarHBondContact SG-CB 3.4Å; C206-C217 CovalentContact SG-SG 2.03Å; C206-C217 PolarHBondContact SG-SG 3.42Å
207R86.1Confident80.6Confident175 Ų17596.6 Ų96.666%0.6654%0.544SS*.Hα-helixtrans-64.3-38.1177.3-76.7177.3-178.2-166.71111.9Q203 M204 L205 A211Q203-R207 VanDerWaalsContact O-CG 3.31Å; Q203-R207 WeakPolarHBondContact O-CG 3.38Å; Q203-R207 PolarHBondContact O-N 2.94Å; Q203-R207 VanDerWaalsContact O-N 3.17Å; M204-R207 PolarHBondContact O-N 3.25Å; L205-R207 VanDerWaalsContact C-N 3.33Å; L205-R207 PolarHBondContact O-N 3.49Å; R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 2.9Å; R207-A211 VanDerWaalsContact O-N 3.1Å
208Q85.9Confident79.7Confident116 Ų11691.8 Ų91.854%0.54254%0.536SS..Hα-helixtrans-67.1-44.7177.6-70.7173.122.200112.1M204 L205 C206 A211 A212M204-Q208 WeakPolarHBondContact O-CG 3.36Å; M204-Q208 PolarHBondContact O-N 3.01Å; L205-Q208 PolarHBondContact O-N 2.92Å; C206-Q208 VanDerWaalsContact C-N 3.33Å; C206-Q208 PolarHBondContact O-N 2.73Å; Q208-A211 PolarHBondContact O-N 3.29Å; Q208-A212 WeakPolarHBondContact O-CB 3.28Å; Q208-A212 PolarHBondContact O-N 2.93Å
209L83.3Confident78.6Confident56 Ų5696.5 Ų96.529%0.29356%0.56SS.*Hα-helixtrans-64.9-39.9177.4-68.8174.2000112.4L205 C206 A211 A212 G213 T214L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 2.92Å; C206-L209 PolarHBondContact O-N 3.23Å; L209-A211 VanDerWaalsContact C-N 3.33Å; L209-A211 PolarHBondContact O-N 2.98Å; L209-A212 PolarHBondContact O-N 3.38Å; L209-G213 PolarHBondContact O-N 3.27Å; L209-G213 VanDerWaalsContact O-N 3.13Å; L209-T214 PolarHBondContact O-N 2.92Å
210A79.3Confident77.1Confident80 Ų8098.5 Ų98.566%0.66156%0.564SS**Hα-helixtrans-63-38.1174.800000112.3C206C206-A210 WeakPolarHBondContact O-CB 3.27Å; C206-A210 PolarHBondContact O-N 2.95Å
211A78.8Confident75.4Confident92 Ų9295.6 Ų95.676%0.7657%0.569SS**Hα-helixtrans-71.3-30.5175.400000113R207 Q208 L209R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 2.9Å; R207-A211 VanDerWaalsContact O-N 3.1Å; Q208-A211 PolarHBondContact O-N 3.29Å; L209-A211 VanDerWaalsContact C-N 3.33Å; L209-A211 PolarHBondContact O-N 2.98Å
212A78.9Confident73.3Confident67 Ų6794.4 Ų94.455%0.55458%0.579SS**THydrogen-bonded Turntrans-86.4-0.9179.100000114Q208 L209 T214Q208-A212 WeakPolarHBondContact O-CB 3.28Å; Q208-A212 PolarHBondContact O-N 2.93Å; L209-A212 PolarHBondContact O-N 3.38Å; A212-T214 PolarHBondContact O-N 3.46Å
213G71.2Confident71.5Confident71 Ų7194.7 Ų94.773%0.73260%0.596SS**THydrogen-bonded Turntrans67.214.5-179.600000114.7L209L209-G213 PolarHBondContact O-N 3.27Å; L209-G213 VanDerWaalsContact O-N 3.13Å
214T67.2Low69.4Low85 Ų8597.7 Ų97.752%0.52162%0.615SS.*  trans-111.295.7-173.2330000111.8L209 A212L209-T214 PolarHBondContact O-N 2.92Å; A212-T214 PolarHBondContact O-N 3.46Å
215G63.3Low67.3Low59 Ų5995.6 Ų95.661%0.60862%0.623SS**  trans69.2166.8154.900000119.1
216P64.2Low65Low128 Ų12897.5 Ų97.583%0.83164%0.638SS**PPolyproline II helixtrans-77.3152.9-177.129.4-32.4000113.6
217C67.4Low62.7Low65 Ų65101.3 Ų101.344%0.43967%0.665SS.*PPolyproline II helixtrans-57.8139.3-179.2-73.10000114C206 V219C206-C217 HydrophobicContact CB-CB 4.44Å; C206-C217 WeakPolarHBondContact CB-SG 3.47Å; C206-C217 WeakPolarHBondContact SG-CB 3.4Å; C206-C217 CovalentContact SG-SG 2.03Å; C206-C217 PolarHBondContact SG-SG 3.42Å; C217-V219 PolarHBondContact O-N 3.05Å
218P66.6Low60.5Low78 Ų7898.8 Ų98.851%0.50667%0.672SS.*PPolyproline II helixtrans-69.4129.3175.723.8-29.2000112.6
219V63.8Low58.3Low141 Ų14197.6 Ų97.686%0.85568%0.681SS**PPolyproline II helixtrans-89.8140.7173-88.50000111.2C217C217-V219 PolarHBondContact O-N 3.05Å
220H54.2Low56.2Low120 Ų120100.9 Ų100.956%0.55671%0.706SS**PPolyproline II helixtrans-78.6144.6-174.9-134.1-104.3000112.2R202 A222R202-H220 PolarHBondContact NH2-CD2 3.45Å; H220-A222 PolarHBondContact O-N 3.09Å
221P51.3Low54.5Low125 Ų125101.8 Ų101.881%0.81271%0.713SS**THydrogen-bonded Turntrans-77.717.9-179.129.7-34.3000115.7
222A46.7Very low52.7Low90 Ų90105.3 Ų105.374%0.74472%0.719SS**THydrogen-bonded Turntrans-103.820.1-178.500000114.3H220H220-A222 PolarHBondContact O-N 3.09Å
223S44.3Very low51Low102 Ų102107.6 Ų107.671%0.71373%0.728SS**  trans-112.641174.5-172.90000112
224N43.6Very low49.8Very low168 Ų168109.2 Ų109.290%0.89873%0.734SS**  trans-103.785.8162.5-92.88.5000108
225G45.1Very low48.6Very low70 Ų70114.4 Ų114.472%0.72275%0.753SS**  trans173.234.5-178.700000114.6
226T39.1Very low47.7Very low131 Ų131115.8 Ų115.880%0.80476%0.758SS**  trans-144.2105159-44.60000106.5
227S36.6Very low46.6Very low108 Ų108121.4 Ų121.476%0.75576%0.763SS**PPolyproline II helixtrans-48.7136.9171.7-68.70000109.9A229S227-A229 PolarHBondContact O-N 3.41Å
228P39.2Very low45.3Very low123 Ų123125.4 Ų125.480%0.79978%0.78SS**PPolyproline II helixtrans-62.7129.4164.226.8-29.3000108
229A39.7Very low44Very low90 Ų90133.6 Ų133.674%0.74482%0.818SS**PPolyproline II helixtrans-53.3139.717300000110.1S227 A231S227-A229 PolarHBondContact O-N 3.41Å; A229-A231 PolarHBondContact O-N 3.06Å
230P40.8Very low43Very low125 Ų125133.2 Ų133.281%0.81282%0.816SS**PPolyproline II helixtrans-66.2129.2178.525.6-29.9000109.8L232P230-L232 PolarHBondContact O-N 3.45Å
231A43.6Very low42.4Very low99 Ų99133.9 Ų133.982%0.81883%0.83SS**PPolyproline II helixtrans-59.1125.7175.300000110.4A229A229-A231 PolarHBondContact O-N 3.06Å
232L40.1Very low41.9Very low166 Ų166134.4 Ų134.487%0.86983%0.831SS**PPolyproline II helixtrans-68.4133168.2-78.6161.3000109.4P230P230-L232 PolarHBondContact O-N 3.45Å
233P43Very low41.6Very low116 Ų116137 Ų13775%0.75384%0.836SS**PPolyproline II helixtrans-72.9139.5178.327.7-31000111.4Q235P233-Q235 PolarHBondContact O-N 3.43Å
234A47Very low41.5Very low104 Ų104139.2 Ų139.286%0.8684%0.844SS**PPolyproline II helixtrans-57120.3177.800000111.7
235Q41.8Very low41.3Very low194 Ų194137.3 Ų137.391%0.90784%0.84SS**PPolyproline II helixtrans-78.1122.2162.3-91.4-177.1-18.800109.4P233P233-Q235 PolarHBondContact O-N 3.43Å
236A43.1Very low41.1Very low88 Ų88142.1 Ų142.173%0.72785%0.849SS**PPolyproline II helixtrans-54.8132.9171.800000111.3N238A236-N238 PolarHBondContact O-N 3.34Å
237R41.3Very low41.2Very low246 Ų246142.9 Ų142.993%0.92885%0.852SS**PPolyproline II helixtrans-71120.5163.1-71.2170.686.2161.14107.8
238N39.9Very low41.6Very low150 Ų150145.8 Ų145.880%0.80286%0.86SS**  trans-120.1141.5154.5-96.6-58.9000107.8A236A236-N238 PolarHBondContact O-N 3.34Å
239L39.9Very low41.8Very low249 Ų249147.9 Ų147.9100%1.30487%0.866SS**  trans93.60-172.3-55.6171.6000114.5

Retrieved 239 of 239 residues in 1107.6 ms (Link to these results)