A0A087YPX5_POEFO Loading...

Transmembrane protein 119b

AlphaFold DB , UniProt , Accession A0A087YPX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 196 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
1M46.5Very low59.6Low241 Ų241122.2 Ų122.2100%1.18767%0.67SS**  0113.70-81.6158.4123.700108.3
2H46.9Very low60.3Low171 Ų171118.8 Ų118.879%0.79266%0.66SS**  trans-83.9123.1-176-105.440.4000110.4G4H2-G4 PolarHBondContact O-N 3.13Å; H2-G4 VanDerWaalsContact O-N 3.13Å
3P55.5Low61.1Low113 Ų113115.3 Ų115.373%0.73464%0.644SS**THydrogen-bonded Turntrans-70.3-6.1-175.425.6-32.3000114.7
4G54.7Low61.8Low60 Ų60112.7 Ų112.762%0.61963%0.632SS**THydrogen-bonded Turntrans-75.9-24.1178.900000114.9H2 P8H2-G4 PolarHBondContact O-N 3.13Å; H2-G4 VanDerWaalsContact O-N 3.13Å; G4-P8 WeakPolarHBondContact O-CD 3.43Å
5A55.4Low62.2Low53 Ų53113.3 Ų113.344%0.43863%0.625SS.*SBendtrans-82.1-15.5-177.600000113.5P8 I9A5-P8 WeakPolarHBondContact O-CD 3.4Å; A5-P8 WeakPolarHBondContact O-CG 3.27Å; A5-I9 VanDerWaalsContact O-CD1 3.27Å; A5-I9 WeakPolarHBondContact O-CD1 3.37Å; A5-I9 VanDerWaalsContact O-CG1 3.27Å; A5-I9 WeakPolarHBondContact O-CG1 3.4Å
6L57.6Low62.3Low129 Ų129110.8 Ų110.868%0.67562%0.617SS**Hα-helixtrans-70.1-32.6-179.5-10880.1000112.8S10L6-S10 WeakPolarHBondContact O-CB 3.19Å; L6-S10 PolarHBondContact O-N 2.87Å
7R62.1Low62.4Low202 Ų202110.4 Ų110.476%0.76261%0.612SS**Hα-helixtrans-67.2-48.1-176.9-66.9-162.1167.3-167-3.6114.2I9 S10 L11R7-I9 VanDerWaalsContact C-N 3.34Å; R7-S10 PolarHBondContact O-N 3.16Å; R7-L11 PolarHBondContact O-N 3.5Å
8P65.1Low62.4Low74 Ų74107.7 Ų107.748%0.48160%0.602SS.*Hα-helixtrans-67.6-35.7177.425.1-34.1000112.3G4 A5 L11 C12G4-P8 WeakPolarHBondContact O-CD 3.43Å; A5-P8 WeakPolarHBondContact O-CD 3.4Å; A5-P8 WeakPolarHBondContact O-CG 3.27Å; P8-L11 PolarHBondContact O-N 3.33Å; P8-C12 WeakPolarHBondContact O-CB 3.37Å; P8-C12 PolarHBondContact O-N 2.83Å
9I70.8Confident61.9Low107 Ų107109.2 Ų109.255%0.54960%0.598SS.*Hα-helixtrans-66.2-43.6176.3-61.7170.4000110A5 R7 L11 C12 V13A5-I9 VanDerWaalsContact O-CD1 3.27Å; A5-I9 WeakPolarHBondContact O-CD1 3.37Å; A5-I9 VanDerWaalsContact O-CG1 3.27Å; A5-I9 WeakPolarHBondContact O-CG1 3.4Å; R7-I9 VanDerWaalsContact C-N 3.34Å; I9-L11 VanDerWaalsContact C-N 3.35Å; I9-L11 PolarHBondContact O-N 3.06Å; I9-C12 PolarHBondContact O-N 2.94Å; I9-V13 HydrophobicContact CG2-CG2 4.29Å; I9-V13 WeakPolarHBondContact O-CB 3.47Å; I9-V13 VanDerWaalsContact O-CG2 3.22Å; I9-V13 WeakPolarHBondContact O-CG2 3.4Å; I9-V13 PolarHBondContact O-N 3.13Å
10S71.6Confident61.3Low68 Ų68107.8 Ų107.848%0.47660%0.596SS.*Hα-helixtrans-61-41.8175.6-174.80000112.2L6 R7 V13 V14L6-S10 WeakPolarHBondContact O-CB 3.19Å; L6-S10 PolarHBondContact O-N 2.87Å; R7-S10 PolarHBondContact O-N 3.16Å; S10-V13 PolarHBondContact O-N 3.08Å; S10-V14 WeakPolarHBondContact O-CB 3.34Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 2.92Å
11L69.3Low60.7Low126 Ų126108.9 Ų108.966%0.6660%0.6SS**Hα-helixtrans-67.4-40.8177.3-79161.7000112.1R7 P8 I9 F15R7-L11 PolarHBondContact O-N 3.5Å; P8-L11 PolarHBondContact O-N 3.33Å; I9-L11 VanDerWaalsContact C-N 3.35Å; I9-L11 PolarHBondContact O-N 3.06Å; L11-F15 VanDerWaalsContact O-CB 3.28Å; L11-F15 WeakPolarHBondContact O-CB 3.41Å; L11-F15 PolarHBondContact O-N 2.93Å
12C68Low60.8Low82 Ų82101.2 Ų101.255%0.55458%0.575SS**Hα-helixtrans-62.2-45.8173.1-92.10000111.8P8 I9 F15 C16P8-C12 WeakPolarHBondContact O-CB 3.37Å; P8-C12 PolarHBondContact O-N 2.83Å; I9-C12 PolarHBondContact O-N 2.94Å; C12-F15 PolarHBondContact O-N 3.3Å; C12-C16 WeakPolarHBondContact O-CB 3.34Å; C12-C16 PolarHBondContact O-N 2.88Å; C12-C16 PolarHBondContact O-SG 2.96Å
13V70.4Confident60.8Low73 Ų7397.8 Ų97.844%0.44257%0.567SS.*Hα-helixtrans-64.4-43.7179.41720000110.8I9 S10 C16 I17I9-V13 HydrophobicContact CG2-CG2 4.29Å; I9-V13 WeakPolarHBondContact O-CB 3.47Å; I9-V13 VanDerWaalsContact O-CG2 3.22Å; I9-V13 WeakPolarHBondContact O-CG2 3.4Å; I9-V13 PolarHBondContact O-N 3.13Å; S10-V13 PolarHBondContact O-N 3.08Å; V13-C16 PolarHBondContact O-N 2.87Å; V13-I17 HydrophobicContact CG1-CD1 3.59Å; V13-I17 HydrophobicContact CG1-CG1 4.31Å; V13-I17 WeakPolarHBondContact O-CB 3.2Å; V13-I17 WeakPolarHBondContact O-CG1 3.29Å; V13-I17 PolarHBondContact O-N 3.36Å
14V71.2Confident60Low79 Ų79100.9 Ų100.948%0.47957%0.571SS.*Hα-helixtrans-61.3-46.9174.6171.40000110.5S10 C16 I17 S18S10-V14 WeakPolarHBondContact O-CB 3.34Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 2.92Å; V14-C16 VanDerWaalsContact C-N 3.33Å; V14-C16 PolarHBondContact O-N 2.8Å; V14-I17 PolarHBondContact O-N 2.93Å; V14-S18 WeakPolarHBondContact O-CB 3.27Å; V14-S18 PolarHBondContact O-N 3.45Å; V14-S18 PolarHBondContact O-OG 2.97Å
15F68.4Low59.2Low121 Ų121103.8 Ų103.853%0.53157%0.572SS.*Hα-helixtrans-62.3-38.3177.4-174.9-107.8000112.8L11 C12 R19L11-F15 VanDerWaalsContact O-CB 3.28Å; L11-F15 WeakPolarHBondContact O-CB 3.41Å; L11-F15 PolarHBondContact O-N 2.93Å; C12-F15 PolarHBondContact O-N 3.3Å; F15-R19 HydrophobicContact CE1-CG 4.42Å; F15-R19 HydrophobicContact CZ-CG 4.38Å; F15-R19 WeakPolarHBondContact O-CB 3.27Å; F15-R19 WeakPolarHBondContact O-CG 3.17Å; F15-R19 PolarHBondContact O-N 3.33Å
16C62.8Low58.6Low73 Ų73107.2 Ų107.249%0.49359%0.589SS.*Hα-helixtrans-67.1-41.8174.7-720000112.2C12 V13 V14 S20C12-C16 WeakPolarHBondContact O-CB 3.34Å; C12-C16 PolarHBondContact O-N 2.88Å; C12-C16 PolarHBondContact O-SG 2.96Å; V13-C16 PolarHBondContact O-N 2.87Å; V14-C16 VanDerWaalsContact C-N 3.33Å; V14-C16 PolarHBondContact O-N 2.8Å; C16-S20 WeakPolarHBondContact O-CB 3.41Å; C16-S20 PolarHBondContact O-N 3Å; C16-S20 PolarHBondContact O-OG 2.71Å
17I65.2Low57.9Low104 Ų104108 Ų10853%0.53359%0.593SS.*Hα-helixtrans-68.7-41.8176.2-65.5166.6000110.2V13 V14 S20 L21V13-I17 HydrophobicContact CG1-CD1 3.59Å; V13-I17 HydrophobicContact CG1-CG1 4.31Å; V13-I17 WeakPolarHBondContact O-CB 3.2Å; V13-I17 WeakPolarHBondContact O-CG1 3.29Å; V13-I17 PolarHBondContact O-N 3.36Å; V14-I17 PolarHBondContact O-N 2.93Å; I17-S20 CarbonylContact O-C 3.36Å; I17-S20 WeakPolarHBondContact O-CB 3.32Å; I17-S20 PolarHBondContact O-N 3.01Å; I17-L21 WeakPolarHBondContact O-CB 3.44Å; I17-L21 PolarHBondContact O-N 2.87Å
18S60.9Low57Low63 Ų63109 Ų10944%0.44160%0.599SS.*Hα-helixtrans-64.2-39.9176.8-59.40000112.3V14 S20 L21 A22V14-S18 WeakPolarHBondContact O-CB 3.27Å; V14-S18 PolarHBondContact O-N 3.45Å; V14-S18 PolarHBondContact O-OG 2.97Å; S18-S20 VanDerWaalsContact C-N 3.34Å; S18-L21 PolarHBondContact O-N 2.76Å; S18-A22 VanDerWaalsContact O-CB 3.26Å; S18-A22 WeakPolarHBondContact O-CB 3.34Å; S18-A22 PolarHBondContact O-N 3.43Å
19R53.7Low55.4Low136 Ų136108.6 Ų108.651%0.51361%0.609SS.*Hα-helixtrans-67.6-35.4172.5-74.1-176.486.7157.35.7112.2F15 L21 A22 T23F15-R19 HydrophobicContact CE1-CG 4.42Å; F15-R19 HydrophobicContact CZ-CG 4.38Å; F15-R19 WeakPolarHBondContact O-CB 3.27Å; F15-R19 WeakPolarHBondContact O-CG 3.17Å; F15-R19 PolarHBondContact O-N 3.33Å; R19-L21 VanDerWaalsContact C-N 3.34Å; R19-A22 PolarHBondContact O-N 2.83Å; R19-T23 PolarHBondContact O-N 2.95Å; R19-T23 VanDerWaalsContact O-N 3.09Å; R19-T23 PolarHBondContact O-OG1 3.11Å; R19-T23 VanDerWaalsContact O-OG1 3.09Å
20S50.6Low54.5Low80 Ų80108.9 Ų108.956%0.55962%0.617SS**Hα-helixtrans-70.3-30.3175.4-56.80000112.5C16 I17 S18 T23C16-S20 WeakPolarHBondContact O-CB 3.41Å; C16-S20 PolarHBondContact O-N 3Å; C16-S20 PolarHBondContact O-OG 2.71Å; I17-S20 CarbonylContact O-C 3.36Å; I17-S20 WeakPolarHBondContact O-CB 3.32Å; I17-S20 PolarHBondContact O-N 3.01Å; S18-S20 VanDerWaalsContact C-N 3.34Å; S20-T23 WeakPolarHBondContact CA-OG1 3.24Å; S20-T23 PolarHBondContact O-OG1 3.28Å
21L48.5Very low53.1Low132 Ų132113.3 Ų113.369%0.69164%0.635SS**Hα-helixtrans-81.6-29.8176-160.268.9000112I17 S18 R19I17-L21 WeakPolarHBondContact O-CB 3.44Å; I17-L21 PolarHBondContact O-N 2.87Å; S18-L21 PolarHBondContact O-N 2.76Å; R19-L21 VanDerWaalsContact C-N 3.34Å
22A48.4Very low51.9Low80 Ų80116.2 Ų116.266%0.66165%0.645SS**Hα-helixtrans-76.1-22.6173.800000113.2S18 R19 H24S18-A22 VanDerWaalsContact O-CB 3.26Å; S18-A22 WeakPolarHBondContact O-CB 3.34Å; S18-A22 PolarHBondContact O-N 3.43Å; R19-A22 PolarHBondContact O-N 2.83Å; A22-H24 PolarHBondContact O-N 2.9Å
23T46.2Very low50.2Low99 Ų99115.7 Ų115.761%0.60765%0.653SS**SBendtrans-79.297.3157.740.50000108.3R19 S20 L25R19-T23 PolarHBondContact O-N 2.95Å; R19-T23 VanDerWaalsContact O-N 3.09Å; R19-T23 PolarHBondContact O-OG1 3.11Å; R19-T23 VanDerWaalsContact O-OG1 3.09Å; S20-T23 WeakPolarHBondContact CA-OG1 3.24Å; S20-T23 PolarHBondContact O-OG1 3.28Å; T23-L25 PolarHBondContact O-N 2.89Å
24H39.6Very low48.9Very low178 Ų178118 Ų11882%0.82467%0.673SS**  trans-18.9104.2171.2-87.7-103.2000113.1A22 P26A22-H24 PolarHBondContact O-N 2.9Å; H24-P26 WeakPolarHBondContact O-CD 3.35Å
25L38.4Very low47.5Very low121 Ų121120.1 Ų120.163%0.63469%0.686SS**  trans-54.6119.6153.4-162.872.7000105T23 L27T23-L25 PolarHBondContact O-N 2.89Å; L25-L27 HydrophobicContact CD2-CD1 4.38Å; L25-L27 PolarHBondContact O-N 3.19Å
26P41.5Very low45.9Very low125 Ų125121.1 Ų121.181%0.81270%0.697SS**  trans-77.667175.533.8-30.7000106.5H24 Y28H24-P26 WeakPolarHBondContact O-CD 3.35Å; P26-Y28 PolarHBondContact O-N 3.49Å; P26-Y28 VanDerWaalsContact O-N 3.16Å
27L43Very low44.9Very low145 Ų145124 Ų12476%0.75970%0.703SS**  trans-74.7103.3164.1-15587.2000105.1L25 G29L25-L27 HydrophobicContact CD2-CD1 4.38Å; L25-L27 PolarHBondContact O-N 3.19Å; L27-G29 PolarHBondContact O-N 2.9Å
28Y43.3Very low43.7Very low222 Ų222127.7 Ų127.787%0.87172%0.718SS**  trans-38.2119.6168.9-139.5-98.5000110.3P26P26-Y28 PolarHBondContact O-N 3.49Å; P26-Y28 VanDerWaalsContact O-N 3.16Å
29G32.3Very low42.6Very low67 Ų67132.8 Ų132.869%0.69174%0.735SS**  trans-140.9116.3173.800000109.4L27L27-G29 PolarHBondContact O-N 2.9Å
30P52Low41.8Very low112 Ų112135.7 Ų135.773%0.72775%0.752SS**  trans-97.1106.7168.432.9-21.1000108.1
31L40.8Very low41Very low162 Ų162136.2 Ų136.285%0.84876%0.756SS**  trans-172.3114150.7-139.249.2000112.1
32E44.2Very low40.4Very low186 Ų186137.8 Ų137.887%0.86976%0.764SS**  26.7132.7123.4-134.3118.6161.100120.5
33G33.7Very low39.9Very low71 Ų71141.9 Ų141.973%0.73277%0.773SS**  trans117.590.2160.100000113.2
34S42.4Very low39.5Very low123 Ų123144.2 Ų144.286%0.8678%0.781SS**  68.3110.494.1-1680000114.8
35T40.8Very low39.3Very low123 Ų123140.5 Ų140.576%0.75578%0.776SS**  trans-13.7127.9153.8-86.80000116.5
36D34.8Very low39.1Very low141 Ų141139.2 Ų139.275%0.75478%0.777SS**  trans-158.1155.3133.7-164.8-40.7000106.9
37E42.8Very low39Very low135 Ų135139.1 Ų139.163%0.63177%0.774SS**  trans-79.9157.2-155.49.9-71.8124.200115.3
38E40.5Very low38.9Very low180 Ų180138 Ų13884%0.84177%0.772SS**  trans-37.8120.3162.948.1-150.194.300117.6
39E36.4Very low38.7Very low170 Ų170132.6 Ų132.679%0.79477%0.765SS**  trans-147.387.9151.2-155.2-178.2167.500111.3S41E39-S41 PolarHBondContact O-N 3.48Å
40F36.9Very low38.7Very low197 Ų197140.1 Ų140.186%0.86477%0.772SS**  trans-81.190.3165.3-74.4-78.6000108.9L42F40-L42 PolarHBondContact O-N 3.22Å
41S33.4Very low38.1Very low92 Ų92140.9 Ų140.964%0.64377%0.774SS**  trans-63.797.7167.5-46.80000109.3E39 I43E39-S41 PolarHBondContact O-N 3.48Å; S41-I43 PolarHBondContact O-N 3.15Å; S41-I43 VanDerWaalsContact O-N 3.17Å
42L37.1Very low37.8Very low165 Ų165140.6 Ų140.686%0.86477%0.769SS**  trans-57.5116.1172.1-79.2126.3000109.7F40 N44F40-L42 PolarHBondContact O-N 3.22Å; L42-N44 VanDerWaalsContact C-N 3.33Å; L42-N44 PolarHBondContact O-N 2.91Å
43I36.8Very low37.8Very low166 Ų166136.6 Ų136.685%0.85176%0.758SS**  trans-65.594171.8-55.5170.5000107.6S41 S45S41-I43 PolarHBondContact O-N 3.15Å; S41-I43 VanDerWaalsContact O-N 3.17Å; I43-S45 PolarHBondContact O-N 3.43Å; I43-S45 VanDerWaalsContact O-N 3.13Å
44N38.3Very low37.9Very low147 Ų147139.6 Ų139.679%0.78676%0.763SS**  trans-72.896.1170.9-168.620.4000108.6L42 S46L42-N44 VanDerWaalsContact C-N 3.33Å; L42-N44 PolarHBondContact O-N 2.91Å; N44-S46 PolarHBondContact O-N 2.93Å; N44-S46 VanDerWaalsContact O-N 3.08Å
45S35.3Very low38Very low101 Ų101141.9 Ų141.971%0.70676%0.76SS**  trans-77.191.5171.4-166.40000108.9I43 V47I43-S45 PolarHBondContact O-N 3.43Å; I43-S45 VanDerWaalsContact O-N 3.13Å; S45-V47 PolarHBondContact O-N 3.47Å
46S34.9Very low37.8Very low94 Ų94146.5 Ų146.566%0.65777%0.765SS**  trans-72107.3171.2178.30000109.7N44N44-S46 PolarHBondContact O-N 2.93Å; N44-S46 VanDerWaalsContact O-N 3.08Å
47V38.6Very low38.4Very low123 Ų123148.6 Ų148.675%0.74577%0.771SS**  trans-84.3112.6164170.80000107.5S45 P49S45-V47 PolarHBondContact O-N 3.47Å; V47-P49 VanDerWaalsContact O-CD 3.32Å; V47-P49 WeakPolarHBondContact O-CD 3.3Å
48V40.8Very low38.5Very low120 Ų120148.3 Ų148.373%0.72778%0.778SS**  trans-69.1121171.31760000109.3R50V48-R50 PolarHBondContact O-N 2.97Å
49P39.4Very low39Very low110 Ų110145.5 Ų145.571%0.71477%0.773SS**  trans-80.8120.1166.9-7.426.4000108.9V47 V51V47-P49 VanDerWaalsContact O-CD 3.32Å; V47-P49 WeakPolarHBondContact O-CD 3.3Å; P49-V51 PolarHBondContact O-N 3.44Å; P49-V51 VanDerWaalsContact O-N 3.12Å
50R33.4Very low40.1Very low225 Ų225142.1 Ų142.185%0.84977%0.766SS**  trans-60109.9170-172.9-177.9-169.8109.2-1.4108.9V48V48-R50 PolarHBondContact O-N 2.97Å
51V37.8Very low41.4Very low127 Ų127137.5 Ų137.577%0.7776%0.756SS**  trans-66.3128.4170.91760000109.1P49P49-V51 PolarHBondContact O-N 3.44Å; P49-V51 VanDerWaalsContact O-N 3.12Å
52H36.1Very low42.7Very low157 Ų157139.4 Ų139.473%0.72777%0.766SS**  trans-126.3125.7157.5-121.2-79000107.6
53P44Very low43.9Very low101 Ų101137.5 Ų137.566%0.65675%0.753SS**  trans-85.2140.3179.833.5-30.3000109.9
54T35.6Very low44.9Very low134 Ų134134.9 Ų134.982%0.82275%0.747SS**  trans-154.898150.816.70000108.4Y56T54-Y56 PolarHBondContact O-N 2.9Å
55E44.4Very low45.9Very low172 Ų172132.6 Ų132.680%0.80474%0.742SS**  trans-40.8117.1156.2-177.8176.6-142.300111.7
56Y36.8Very low47Very low219 Ų219136.1 Ų136.186%0.85974%0.74SS**  trans-157.8109138.3-73-60.7000109T54T54-Y56 PolarHBondContact O-N 2.9Å
57Q45.9Very low48.3Very low186 Ų186138.9 Ų138.987%0.86974%0.742SS**  trans-71119.4171.6-174.917323.800109.3
58T45.7Very low49.4Very low128 Ų128135.5 Ų135.579%0.78573%0.732SS**  trans-144.5113.7155.2-69.50000107.8
59T50.2Low51Low121 Ų121131.9 Ų131.974%0.74272%0.719SS**PPolyproline II helixtrans-49.1123.2174.4-53.60000111.3
60P61Low52.9Low99 Ų99131.2 Ų131.264%0.64371%0.71SS**PPolyproline II helixtrans-83.5148.5167.23.214.7000110.8
61P64.1Low55.5Low101 Ų101126.4 Ų126.466%0.65670%0.7SS**PPolyproline II helixtrans-66.3161.117328.4-31.4000111.4E63P61-E63 PolarHBondContact O-N 2.72Å
62P59.9Low57.9Low131 Ų131129.9 Ų129.985%0.85170%0.699SS**  trans-64.3110.2-177.225.8-32000110.4
63E62.7Low60.5Low126 Ų126127.4 Ų127.459%0.58969%0.688SS**  trans-59.7129.1177.5-70.4-8313300110.9P61 S65 R66P61-E63 PolarHBondContact O-N 2.72Å; E63-S65 PolarHBondContact O-N 3.32Å; E63-R66 IonicContact OE2-NE 2.73Å
64P57.8Low62.7Low111 Ų111128.5 Ų128.572%0.72168%0.683SS**  trans-68.9116.117227.7-31.6000109.8R66P64-R66 PolarHBondContact O-N 2.94Å; P64-R66 VanDerWaalsContact O-N 3.11Å
65S59.3Low65.3Low98 Ų98125.9 Ų125.969%0.68567%0.667SS**  trans13.883.4163.560.10000115.9E63 E67 G68E63-S65 PolarHBondContact O-N 3.32Å; S65-E67 PolarHBondContact O-N 3.39Å; S65-E67 VanDerWaalsContact O-N 3.12Å; S65-G68 PolarHBondContact O-N 3.45Å
66R58.6Low67.6Low176 Ų176125.7 Ų125.766%0.66466%0.659SS**THydrogen-bonded Turntrans-57.3-21.1178.5-165.39568.477.81.6113.4E63 P64 G68 G69 N70E63-R66 IonicContact OE2-NE 2.73Å; P64-R66 PolarHBondContact O-N 2.94Å; P64-R66 VanDerWaalsContact O-N 3.11Å; R66-G68 VanDerWaalsContact C-N 3.33Å; R66-G68 PolarHBondContact O-N 3Å; R66-G69 PolarHBondContact O-N 2.91Å; R66-N70 PolarHBondContact O-ND2 2.86Å
67E61.5Low70.3Confident152 Ų152120.1 Ų120.171%0.7164%0.639SS**Hα-helixtrans-57.5-37.8179.6-10781.6-157.400114.3S65 G69 N70S65-E67 PolarHBondContact O-N 3.39Å; S65-E67 VanDerWaalsContact O-N 3.12Å; E67-G69 VanDerWaalsContact C-N 3.32Å; E67-G69 PolarHBondContact O-N 3.39Å; E67-N70 PolarHBondContact O-N 3.45Å
68G62.2Low72.5Confident52 Ų52114.4 Ų114.454%0.53661%0.614SS.*Hα-helixtrans-70.3-25.9-173.600000114.2S65 R66S65-G68 PolarHBondContact O-N 3.45Å; R66-G68 VanDerWaalsContact C-N 3.33Å; R66-G68 PolarHBondContact O-N 3Å
69G73.6Confident74.8Confident44 Ų44115.4 Ų115.445%0.45461%0.61SS.*Hα-helixtrans-72-4017900000112.8R66 E67 L71 R72 E73R66-G69 PolarHBondContact O-N 2.91Å; E67-G69 VanDerWaalsContact C-N 3.32Å; E67-G69 PolarHBondContact O-N 3.39Å; G69-L71 PolarHBondContact O-N 3.46Å; G69-R72 PolarHBondContact O-N 2.96Å; G69-E73 PolarHBondContact O-N 3.46Å
70N79.3Confident76.9Confident96 Ų96116.1 Ų116.151%0.51361%0.605SS.*Hα-helixtrans-66.2-41.2-173.1-65.8-37.4000112.8R66 E67 R72 E73 F74R66-N70 PolarHBondContact O-ND2 2.86Å; E67-N70 PolarHBondContact O-N 3.45Å; N70-R72 VanDerWaalsContact C-N 3.35Å; N70-E73 PolarHBondContact O-N 3.21Å; N70-F74 WeakPolarHBondContact O-CB 3.16Å; N70-F74 PolarHBondContact O-N 2.96Å
71L88.2Confident78.5Confident123 Ų123114.1 Ų114.164%0.64459%0.589SS**Hα-helixtrans-68.8-35.1177.3-68.2178.2000112G69 F74 T75G69-L71 PolarHBondContact O-N 3.46Å; L71-F74 PolarHBondContact O-N 3.25Å; L71-T75 WeakPolarHBondContact O-CB 3.4Å; L71-T75 VanDerWaalsContact O-CG2 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 3.43Å; L71-T75 PolarHBondContact O-OG1 3.33Å
72R88.6Confident79.9Confident200 Ų200115.5 Ų115.576%0.75559%0.588SS**Hα-helixtrans-69.4-36.9177.2-166.9170.3-166-89.3-2.8111.8G69 N70 T75 R76G69-R72 PolarHBondContact O-N 2.96Å; N70-R72 VanDerWaalsContact C-N 3.35Å; R72-T75 WeakPolarHBondContact CA-OG1 3.45Å; R72-T75 PolarHBondContact O-OG1 2.91Å; R72-R76 WeakPolarHBondContact O-CB 3.01Å; R72-R76 PolarHBondContact O-N 3.23Å; R72-R76 VanDerWaalsContact O-N 3.15Å
73E90.3Very high81.6Confident105 Ų105115.8 Ų115.849%0.49158%0.582SS.*Hα-helixtrans-67.4-47173.3-149-173.1149.700110.9G69 N70 T75 R76 F77G69-E73 PolarHBondContact O-N 3.46Å; N70-E73 PolarHBondContact O-N 3.21Å; E73-T75 PolarHBondContact O-N 3.4Å; E73-R76 WeakPolarHBondContact O-CB 3.18Å; E73-R76 PolarHBondContact O-N 2.84Å; E73-F77 HydrophobicContact CB-CE2 4.36Å; E73-F77 HydrophobicContact CG-CD2 4.14Å; E73-F77 HydrophobicContact CG-CE2 3.54Å; E73-F77 HydrophobicContact CG-CZ 4.33Å; E73-F77 WeakPolarHBondContact O-CD2 3.49Å; E73-F77 PolarHBondContact O-N 3.4Å; E73-F77 WeakPolarHBondContact OE1-CE2 3.4Å
74F90.4Very high83.1Confident124 Ų124115.4 Ų115.454%0.54458%0.583SS.*Hα-helixtrans-59.1-45.8177.5-178.1-104.7000112.7N70 L71 R76 F77 L78N70-F74 WeakPolarHBondContact O-CB 3.16Å; N70-F74 PolarHBondContact O-N 2.96Å; L71-F74 PolarHBondContact O-N 3.25Å; F74-R76 PolarHBondContact O-N 3.49Å; F74-F77 WeakPolarHBondContact O-CB 3.47Å; F74-F77 PolarHBondContact O-N 3.26Å; F74-L78 HydrophobicContact CD1-CD1 3.94Å; F74-L78 HydrophobicContact CD1-CG 4.25Å; F74-L78 HydrophobicContact CE1-CD1 3.48Å; F74-L78 VanDerWaalsContact CE1-CD1 3.48Å; F74-L78 HydrophobicContact CE1-CD2 4.28Å; F74-L78 HydrophobicContact CE1-CG 3.93Å; F74-L78 HydrophobicContact CE2-CD2 4.47Å; F74-L78 HydrophobicContact CZ-CD1 4.05Å; F74-L78 HydrophobicContact CZ-CD2 4Å; F74-L78 HydrophobicContact CZ-CG 4.13Å; F74-L78 WeakPolarHBondContact O-CG 3.36Å; F74-L78 PolarHBondContact O-N 3.38Å
75T91.8Very high84.9Confident80 Ų80113.6 Ų113.649%0.49157%0.566SS.*Hα-helixtrans-63.3-40.4176.9450000112.2L71 R72 E73 F77 L78 E79L71-T75 WeakPolarHBondContact O-CB 3.4Å; L71-T75 VanDerWaalsContact O-CG2 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 3.43Å; L71-T75 PolarHBondContact O-OG1 3.33Å; R72-T75 WeakPolarHBondContact CA-OG1 3.45Å; R72-T75 PolarHBondContact O-OG1 2.91Å; E73-T75 PolarHBondContact O-N 3.4Å; T75-F77 VanDerWaalsContact C-N 3.34Å; T75-F77 PolarHBondContact O-N 3.48Å; T75-L78 WeakPolarHBondContact O-CB 3.23Å; T75-L78 PolarHBondContact O-N 2.97Å; T75-E79 PolarHBondContact O-N 2.72Å
76R92.6Very high86.7Confident167 Ų167113.8 Ų113.863%0.6356%0.559SS**Hα-helixtrans-61.5-41.3172.4179.7-175.1152144.5-0.5111.9R72 E73 F74 E79 E80R72-R76 WeakPolarHBondContact O-CB 3.01Å; R72-R76 PolarHBondContact O-N 3.23Å; R72-R76 VanDerWaalsContact O-N 3.15Å; E73-R76 WeakPolarHBondContact O-CB 3.18Å; E73-R76 PolarHBondContact O-N 2.84Å; F74-R76 PolarHBondContact O-N 3.49Å; R76-E79 PolarHBondContact O-N 3.47Å; R76-E80 WeakPolarHBondContact O-CB 3.48Å; R76-E80 PolarHBondContact O-N 2.66Å
77F92.4Very high88.6Confident103 Ų103110 Ų11045%0.45256%0.555SS.*Hα-helixtrans-63.7-41.4175.2-76.9-64.3000112.5E73 F74 T75 E79 N81E73-F77 HydrophobicContact CB-CE2 4.36Å; E73-F77 HydrophobicContact CG-CD2 4.14Å; E73-F77 HydrophobicContact CG-CE2 3.54Å; E73-F77 HydrophobicContact CG-CZ 4.33Å; E73-F77 WeakPolarHBondContact O-CD2 3.49Å; E73-F77 PolarHBondContact O-N 3.4Å; E73-F77 WeakPolarHBondContact OE1-CE2 3.4Å; F74-F77 WeakPolarHBondContact O-CB 3.47Å; F74-F77 PolarHBondContact O-N 3.26Å; T75-F77 VanDerWaalsContact C-N 3.34Å; T75-F77 PolarHBondContact O-N 3.48Å; F77-E79 VanDerWaalsContact C-N 3.35Å; F77-N81 WeakPolarHBondContact O-CB 3.46Å; F77-N81 PolarHBondContact O-N 3.49Å; F77-N81 VanDerWaalsContact O-N 3.08Å; F77-N81 PolarHBondContact O-ND2 3.45Å
78L92.2Very high90.2Very high66 Ų66105.4 Ų105.435%0.34654%0.54SS..Hα-helixtrans-59.4-49.5174.3-69.1-178.6000109.9F74 T75 E80 N81 M82 I85F74-L78 HydrophobicContact CD1-CD1 3.94Å; F74-L78 HydrophobicContact CD1-CG 4.25Å; F74-L78 HydrophobicContact CE1-CD1 3.48Å; F74-L78 VanDerWaalsContact CE1-CD1 3.48Å; F74-L78 HydrophobicContact CE1-CD2 4.28Å; F74-L78 HydrophobicContact CE1-CG 3.93Å; F74-L78 HydrophobicContact CE2-CD2 4.47Å; F74-L78 HydrophobicContact CZ-CD1 4.05Å; F74-L78 HydrophobicContact CZ-CD2 4Å; F74-L78 HydrophobicContact CZ-CG 4.13Å; F74-L78 WeakPolarHBondContact O-CG 3.36Å; F74-L78 PolarHBondContact O-N 3.38Å; T75-L78 WeakPolarHBondContact O-CB 3.23Å; T75-L78 PolarHBondContact O-N 2.97Å; L78-E80 PolarHBondContact O-N 2.96Å; L78-N81 CarbonylContact O-C 3.53Å; L78-N81 VanDerWaalsContact O-C 3.32Å; L78-N81 PolarHBondContact O-N 3.11Å; L78-N81 VanDerWaalsContact O-N 3.13Å; L78-M82 WeakPolarHBondContact O-CA 3.43Å; L78-M82 WeakPolarHBondContact O-CG 3.21Å; L78-M82 PolarHBondContact O-N 3.17Å; L78-I85 HydrophobicContact CD2-CD1 3.48Å; L78-I85 VanDerWaalsContact CD2-CD1 3.48Å
79E93.3Very high91.9Very high149 Ų149105.5 Ų105.570%0.69653%0.533SS*.Hα-helixtrans-58.3-47.3-179.4-171.2174.4-17200112.2T75 R76 F77 N81 M82T75-E79 PolarHBondContact O-N 2.72Å; R76-E79 PolarHBondContact O-N 3.47Å; F77-E79 VanDerWaalsContact C-N 3.35Å; E79-N81 PolarHBondContact O-N 2.72Å; E79-M82 WeakPolarHBondContact O-CG 3.41Å; E79-M82 PolarHBondContact O-N 2.82Å
80E94.8Very high93Very high136 Ų136106.9 Ų106.964%0.63653%0.533SS*.Hα-helixtrans-65.3-27.4178.8-169.4164.7-168.100112.6R76 L78R76-E80 WeakPolarHBondContact O-CB 3.48Å; R76-E80 PolarHBondContact O-N 2.66Å; L78-E80 PolarHBondContact O-N 2.96Å
81N95.4Very high93.8Very high57 Ų57107.4 Ų107.431%0.30554%0.535SS..THydrogen-bonded Turntrans-114.317.8-176.2-62.8-83.8000114F77 L78 E79 L83 L84 I85F77-N81 WeakPolarHBondContact O-CB 3.46Å; F77-N81 PolarHBondContact O-N 3.49Å; F77-N81 VanDerWaalsContact O-N 3.08Å; F77-N81 PolarHBondContact O-ND2 3.45Å; L78-N81 CarbonylContact O-C 3.53Å; L78-N81 VanDerWaalsContact O-C 3.32Å; L78-N81 PolarHBondContact O-N 3.11Å; L78-N81 VanDerWaalsContact O-N 3.13Å; E79-N81 PolarHBondContact O-N 2.72Å; N81-L83 VanDerWaalsContact C-N 3.28Å; N81-L83 PolarHBondContact O-N 3.31Å; N81-L83 VanDerWaalsContact O-N 3.16Å; N81-L84 PolarHBondContact O-N 3.31Å; N81-I85 HydrophobicContact CB-CD1 4.08Å; N81-I85 HydrophobicContact CB-CG1 4.3Å; N81-I85 WeakPolarHBondContact O-CG1 3.22Å; N81-I85 PolarHBondContact O-N 2.97Å
82M93.8Very high94.3Very high129 Ų129106.2 Ų106.264%0.63553%0.528SS*.Hα-helixtrans-51.8-45.4-173.7-78.7-117.3-73.600112.6L78 E79 L86L78-M82 WeakPolarHBondContact O-CA 3.43Å; L78-M82 WeakPolarHBondContact O-CG 3.21Å; L78-M82 PolarHBondContact O-N 3.17Å; E79-M82 WeakPolarHBondContact O-CG 3.41Å; E79-M82 PolarHBondContact O-N 2.82Å; M82-L86 VanDerWaalsContact O-CB 3.29Å; M82-L86 WeakPolarHBondContact O-CB 3.25Å; M82-L86 PolarHBondContact O-N 3.39Å
83L95.1Very high94.7Very high137 Ų137102.7 Ų102.772%0.71752%0.518SS*.Hα-helixtrans-68.2-41.5-179.5-67.8177.6000112.6N81 I85 L86 V87N81-L83 VanDerWaalsContact C-N 3.28Å; N81-L83 PolarHBondContact O-N 3.31Å; N81-L83 VanDerWaalsContact O-N 3.16Å; L83-I85 VanDerWaalsContact C-N 3.35Å; L83-L86 PolarHBondContact O-N 2.93Å; L83-V87 WeakPolarHBondContact O-CB 3.32Å; L83-V87 VanDerWaalsContact O-CG2 3.27Å; L83-V87 WeakPolarHBondContact O-CG2 3.38Å; L83-V87 PolarHBondContact O-N 2.85Å
84L94.7Very high95Very high119 Ų119102.2 Ų102.262%0.62352%0.519SS*.Hα-helixtrans-65.6-41.4178.5-71176.5000111.1N81 S88N81-L84 PolarHBondContact O-N 3.31Å; L84-S88 VanDerWaalsContact O-CB 3.23Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 2.89Å; L84-S88 PolarHBondContact O-OG 2.77Å
85I95.8Very high95.3Very high72 Ų7299.3 Ų99.337%0.36951%0.511SS..Hα-helixtrans-64.7-43.7176.1-64.6167.4000109.9L78 N81 L83 S88 S89L78-I85 HydrophobicContact CD2-CD1 3.48Å; L78-I85 VanDerWaalsContact CD2-CD1 3.48Å; N81-I85 HydrophobicContact CB-CD1 4.08Å; N81-I85 HydrophobicContact CB-CG1 4.3Å; N81-I85 WeakPolarHBondContact O-CG1 3.22Å; N81-I85 PolarHBondContact O-N 2.97Å; L83-I85 VanDerWaalsContact C-N 3.35Å; I85-S88 WeakPolarHBondContact CA-OG 3.29Å; I85-S88 PolarHBondContact O-OG 3.24Å; I85-S88 VanDerWaalsContact O-OG 3.11Å; I85-S89 WeakPolarHBondContact O-CB 3.5Å; I85-S89 PolarHBondContact O-N 3.4Å; I85-S89 PolarHBondContact O-OG 2.85Å
86L96.6Very high95.5Very high102 Ų102100 Ų10053%0.53451%0.511SS..Hα-helixtrans-64-46.8178.1-174.663.8000112M82 L83 S89 T90M82-L86 VanDerWaalsContact O-CB 3.29Å; M82-L86 WeakPolarHBondContact O-CB 3.25Å; M82-L86 PolarHBondContact O-N 3.39Å; L83-L86 PolarHBondContact O-N 2.93Å; L86-S89 WeakPolarHBondContact CA-OG 3.28Å; L86-S89 PolarHBondContact O-OG 3.34Å; L86-T90 HydrophobicContact CD1-CG2 4.3Å; L86-T90 WeakPolarHBondContact O-CB 3.2Å; L86-T90 WeakPolarHBondContact O-CG2 3.44Å; L86-T90 PolarHBondContact O-N 3.42Å; L86-T90 PolarHBondContact O-OG1 3.48Å
87V97.9Very high95.6Very high96 Ų9696.4 Ų96.458%0.58250%0.504SS*.Hα-helixtrans-66.9-44.5179.6172.70000111.3L83 T90 L91L83-V87 WeakPolarHBondContact O-CB 3.32Å; L83-V87 VanDerWaalsContact O-CG2 3.27Å; L83-V87 WeakPolarHBondContact O-CG2 3.38Å; L83-V87 PolarHBondContact O-N 2.85Å; V87-T90 WeakPolarHBondContact CA-OG1 3.35Å; V87-T90 PolarHBondContact O-OG1 2.8Å; V87-L91 VanDerWaalsContact O-CB 3.3Å; V87-L91 WeakPolarHBondContact O-CB 3.4Å; V87-L91 PolarHBondContact O-N 3.48Å
88S96.2Very high95.8Very high56 Ų5696.6 Ų96.639%0.39251%0.509SS..Hα-helixtrans-65.9-44.9178.558.70000111.9L84 I85 L91 I92L84-S88 VanDerWaalsContact O-CB 3.23Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 2.89Å; L84-S88 PolarHBondContact O-OG 2.77Å; I85-S88 WeakPolarHBondContact CA-OG 3.29Å; I85-S88 PolarHBondContact O-OG 3.24Å; I85-S88 VanDerWaalsContact O-OG 3.11Å; S88-L91 PolarHBondContact O-N 3.4Å; S88-I92 WeakPolarHBondContact O-CB 3.32Å; S88-I92 WeakPolarHBondContact O-CD1 3.44Å; S88-I92 WeakPolarHBondContact O-CG1 3.35Å; S88-I92 PolarHBondContact O-N 2.88Å
89S96.3Very high95.9Very high54 Ų5497.2 Ų97.238%0.37852%0.516SS..Hα-helixtrans-63.6-42.6177.860.50000112.3I85 L86 I92 F93I85-S89 WeakPolarHBondContact O-CB 3.5Å; I85-S89 PolarHBondContact O-N 3.4Å; I85-S89 PolarHBondContact O-OG 2.85Å; L86-S89 WeakPolarHBondContact CA-OG 3.28Å; L86-S89 PolarHBondContact O-OG 3.34Å; S89-I92 PolarHBondContact O-N 2.88Å; S89-F93 VanDerWaalsContact O-CB 3.25Å; S89-F93 WeakPolarHBondContact O-CB 3.4Å; S89-F93 PolarHBondContact O-N 3.5Å
90T97.6Very high95.8Very high74 Ų7494.2 Ų94.245%0.45451%0.51SS..Hα-helixtrans-65-40.9176.250.80000112.1L86 V87 F93 L94L86-T90 HydrophobicContact CD1-CG2 4.3Å; L86-T90 WeakPolarHBondContact O-CB 3.2Å; L86-T90 WeakPolarHBondContact O-CG2 3.44Å; L86-T90 PolarHBondContact O-N 3.42Å; L86-T90 PolarHBondContact O-OG1 3.48Å; V87-T90 WeakPolarHBondContact CA-OG1 3.35Å; V87-T90 PolarHBondContact O-OG1 2.8Å; T90-F93 PolarHBondContact O-N 3.47Å; T90-L94 VanDerWaalsContact O-CB 3.24Å; T90-L94 WeakPolarHBondContact O-CB 3.36Å; T90-L94 PolarHBondContact O-N 2.83Å
91L96.9Very high95.6Very high106 Ų10689.2 Ų89.256%0.55550%0.495SS*.Hα-helixtrans-62.6-47.4175-175.168.8000111.3V87 S88 F93 L94 T95V87-L91 VanDerWaalsContact O-CB 3.3Å; V87-L91 WeakPolarHBondContact O-CB 3.4Å; V87-L91 PolarHBondContact O-N 3.48Å; S88-L91 PolarHBondContact O-N 3.4Å; L91-F93 PolarHBondContact O-N 3.33Å; L91-L94 PolarHBondContact O-N 3.22Å; L91-T95 VanDerWaalsContact O-CG2 3.32Å; L91-T95 WeakPolarHBondContact O-CG2 3.31Å; L91-T95 PolarHBondContact O-N 3.09Å; L91-T95 PolarHBondContact O-OG1 3.37Å
92I97.1Very high95.3Very high98 Ų9889.1 Ų89.150%0.50350%0.502SS..Hα-helixtrans-59.6-49.6177-67.9162.6000109.7S88 S89 L94 T95 L96S88-I92 WeakPolarHBondContact O-CB 3.32Å; S88-I92 WeakPolarHBondContact O-CD1 3.44Å; S88-I92 WeakPolarHBondContact O-CG1 3.35Å; S88-I92 PolarHBondContact O-N 2.88Å; S89-I92 PolarHBondContact O-N 2.88Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 2.89Å; I92-T95 PolarHBondContact O-N 3.17Å; I92-T95 PolarHBondContact O-OG1 2.8Å; I92-L96 HydrophobicContact CG2-CD1 4.14Å; I92-L96 HydrophobicContact CG2-CG 4.49Å; I92-L96 WeakPolarHBondContact O-CG 3.33Å; I92-L96 PolarHBondContact O-N 3.47Å
93F97.1Very high95Very high127 Ų12788.5 Ų88.556%0.55750%0.496SS*.Hα-helixtrans-59.2-44.3178.8-175.4-106.8000112.1S89 T90 L91 T95 L96 L97S89-F93 VanDerWaalsContact O-CB 3.25Å; S89-F93 WeakPolarHBondContact O-CB 3.4Å; S89-F93 PolarHBondContact O-N 3.5Å; T90-F93 PolarHBondContact O-N 3.47Å; L91-F93 PolarHBondContact O-N 3.33Å; F93-T95 PolarHBondContact O-N 3.09Å; F93-L96 WeakPolarHBondContact O-CB 3.23Å; F93-L96 PolarHBondContact O-N 3.46Å; F93-L97 HydrophobicContact CD1-CD1 3.83Å; F93-L97 HydrophobicContact CD1-CG 4.22Å; F93-L97 HydrophobicContact CE1-CD1 3.38Å; F93-L97 HydrophobicContact CE1-CD2 4.36Å; F93-L97 HydrophobicContact CE1-CG 3.93Å; F93-L97 HydrophobicContact CE2-CD2 4.46Å; F93-L97 HydrophobicContact CZ-CD1 3.92Å; F93-L97 HydrophobicContact CZ-CD2 4.04Å; F93-L97 HydrophobicContact CZ-CG 4.08Å; F93-L97 WeakPolarHBondContact O-CG 3.31Å; F93-L97 PolarHBondContact O-N 3.12Å
94L97.4Very high94.5Very high94 Ų9486.8 Ų86.849%0.49248%0.483SS..Hα-helixtrans-60-45.6176.4-178.963.4000111.6T90 L91 I92 L96 L97 I98T90-L94 VanDerWaalsContact O-CB 3.24Å; T90-L94 WeakPolarHBondContact O-CB 3.36Å; T90-L94 PolarHBondContact O-N 2.83Å; L91-L94 PolarHBondContact O-N 3.22Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 2.89Å; L94-L96 VanDerWaalsContact C-N 3.32Å; L94-L96 PolarHBondContact O-N 3.01Å; L94-L97 PolarHBondContact O-N 2.91Å; L94-I98 HydrophobicContact CD1-CD1 4.17Å; L94-I98 HydrophobicContact CD1-CG1 4.42Å; L94-I98 HydrophobicContact CG-CD1 3.93Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.43Å
95T95.7Very high93.8Very high63 Ų6386.9 Ų86.939%0.38748%0.482SS..Hα-helixtrans-62.8-39.4177.362.90000112L91 I92 F93 I98 T99L91-T95 VanDerWaalsContact O-CG2 3.32Å; L91-T95 WeakPolarHBondContact O-CG2 3.31Å; L91-T95 PolarHBondContact O-N 3.09Å; L91-T95 PolarHBondContact O-OG1 3.37Å; I92-T95 PolarHBondContact O-N 3.17Å; I92-T95 PolarHBondContact O-OG1 2.8Å; F93-T95 PolarHBondContact O-N 3.09Å; T95-I98 PolarHBondContact O-N 3.41Å; T95-T99 WeakPolarHBondContact O-CB 3.06Å; T95-T99 PolarHBondContact O-N 3.49Å; T95-T99 PolarHBondContact O-OG1 2.89Å
96L96.3Very high92.8Very high95 Ų9586.8 Ų86.850%0.49749%0.487SS..Hα-helixtrans-63.3-43.9175.3-69.8175.4000111.3I92 F93 L94 T99 C100I92-L96 HydrophobicContact CG2-CD1 4.14Å; I92-L96 HydrophobicContact CG2-CG 4.49Å; I92-L96 WeakPolarHBondContact O-CG 3.33Å; I92-L96 PolarHBondContact O-N 3.47Å; F93-L96 WeakPolarHBondContact O-CB 3.23Å; F93-L96 PolarHBondContact O-N 3.46Å; L94-L96 VanDerWaalsContact C-N 3.32Å; L94-L96 PolarHBondContact O-N 3.01Å; L96-T99 PolarHBondContact O-N 3.48Å; L96-C100 WeakPolarHBondContact O-CB 3.36Å; L96-C100 PolarHBondContact O-N 3.18Å
97L95.9Very high91.4Very high91 Ų9189.2 Ų89.248%0.47649%0.49SS..Hα-helixtrans-61.6-46.7176.7-71.8-177000112.2F93 L94 T99 C100 G101F93-L97 HydrophobicContact CD1-CD1 3.83Å; F93-L97 HydrophobicContact CD1-CG 4.22Å; F93-L97 HydrophobicContact CE1-CD1 3.38Å; F93-L97 HydrophobicContact CE1-CD2 4.36Å; F93-L97 HydrophobicContact CE1-CG 3.93Å; F93-L97 HydrophobicContact CE2-CD2 4.46Å; F93-L97 HydrophobicContact CZ-CD1 3.92Å; F93-L97 HydrophobicContact CZ-CD2 4.04Å; F93-L97 HydrophobicContact CZ-CG 4.08Å; F93-L97 WeakPolarHBondContact O-CG 3.31Å; F93-L97 PolarHBondContact O-N 3.12Å; L94-L97 PolarHBondContact O-N 2.91Å; L97-T99 VanDerWaalsContact C-N 3.35Å; L97-T99 PolarHBondContact O-N 2.87Å; L97-C100 PolarHBondContact O-N 3.31Å; L97-G101 PolarHBondContact O-N 2.91Å
98I95.9Very high89.7Confident108 Ų10892.3 Ų92.355%0.55449%0.491SS*.Hα-helixtrans-60.3-47.6178.1-66.2164.8000110L94 T95 G101 A102L94-I98 HydrophobicContact CD1-CD1 4.17Å; L94-I98 HydrophobicContact CD1-CG1 4.42Å; L94-I98 HydrophobicContact CG-CD1 3.93Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.43Å; T95-I98 PolarHBondContact O-N 3.41Å; I98-G101 PolarHBondContact O-N 3.13Å; I98-A102 VanDerWaalsContact O-CB 3.31Å; I98-A102 WeakPolarHBondContact O-CB 3.42Å; I98-A102 PolarHBondContact O-N 3.29Å
99T94.2Very high88Confident79 Ų7996.5 Ų96.549%0.48551%0.508SS..Hα-helixtrans-68.1-42.7-177.7-44.20000111.6T95 L96 L97 A102 F103T95-T99 WeakPolarHBondContact O-CB 3.06Å; T95-T99 PolarHBondContact O-N 3.49Å; T95-T99 PolarHBondContact O-OG1 2.89Å; L96-T99 PolarHBondContact O-N 3.48Å; L97-T99 VanDerWaalsContact C-N 3.35Å; L97-T99 PolarHBondContact O-N 2.87Å; T99-A102 PolarHBondContact O-N 3.01Å; T99-F103 VanDerWaalsContact O-CB 3.31Å; T99-F103 WeakPolarHBondContact O-CB 3.26Å; T99-F103 PolarHBondContact O-N 3.09Å
100C91.3Very high86.2Confident85 Ų85102 Ų10257%0.57453%0.525SS*.Hα-helixtrans-63.4-45.5176.6-177.50000111.2L96 L97 F103 F104L96-C100 WeakPolarHBondContact O-CB 3.36Å; L96-C100 PolarHBondContact O-N 3.18Å; L97-C100 PolarHBondContact O-N 3.31Å; C100-F103 PolarHBondContact O-N 3.5Å; C100-F104 VanDerWaalsContact O-CB 3.31Å; C100-F104 WeakPolarHBondContact O-CB 3.31Å; C100-F104 PolarHBondContact O-N 3.05Å
101G90.3Very high84.4Confident32 Ų32104.4 Ų104.433%0.3354%0.539SS..Hα-helixtrans-59.4-48.3174.400000111.8L97 I98 F103 F104 M105L97-G101 PolarHBondContact O-N 2.91Å; I98-G101 PolarHBondContact O-N 3.13Å; G101-F103 VanDerWaalsContact C-N 3.35Å; G101-F103 PolarHBondContact O-N 2.85Å; G101-F104 PolarHBondContact O-N 3.06Å; G101-M105 WeakPolarHBondContact O-CB 3.37Å; G101-M105 VanDerWaalsContact O-CG 3.23Å; G101-M105 WeakPolarHBondContact O-CG 3.38Å; G101-M105 PolarHBondContact O-N 3.32Å
102A89.1Confident82.4Confident55 Ų55106 Ų10646%0.45555%0.548SS..Hα-helixtrans-59.3-44.8176.700000112I98 T99 M105 S106I98-A102 VanDerWaalsContact O-CB 3.31Å; I98-A102 WeakPolarHBondContact O-CB 3.42Å; I98-A102 PolarHBondContact O-N 3.29Å; T99-A102 PolarHBondContact O-N 3.01Å; A102-M105 PolarHBondContact O-N 3.29Å; A102-S106 VanDerWaalsContact O-CB 3.27Å; A102-S106 WeakPolarHBondContact O-CB 3.34Å; A102-S106 PolarHBondContact O-N 3.28Å; A102-S106 PolarHBondContact O-OG 3.16Å
103F87.3Confident80.7Confident116 Ų116105.1 Ų105.151%0.50955%0.551SS.*Hα-helixtrans-65.5-42.9178.6-176-109.1000112.5T99 C100 G101 S106 R107T99-F103 VanDerWaalsContact O-CB 3.31Å; T99-F103 WeakPolarHBondContact O-CB 3.26Å; T99-F103 PolarHBondContact O-N 3.09Å; C100-F103 PolarHBondContact O-N 3.5Å; G101-F103 VanDerWaalsContact C-N 3.35Å; G101-F103 PolarHBondContact O-N 2.85Å; F103-S106 PolarHBondContact O-N 2.99Å; F103-R107 WeakPolarHBondContact O-CG 3.44Å; F103-R107 PolarHBondContact O-N 2.88Å
104F84.7Confident79.1Confident100 Ų100110.2 Ų110.244%0.43957%0.568SS.*Hα-helixtrans-65.3-46176.7-176.7-96.2000111.6C100 G101 S106 R107 R108C100-F104 VanDerWaalsContact O-CB 3.31Å; C100-F104 WeakPolarHBondContact O-CB 3.31Å; C100-F104 PolarHBondContact O-N 3.05Å; G101-F104 PolarHBondContact O-N 3.06Å; F104-S106 VanDerWaalsContact C-N 3.32Å; F104-S106 PolarHBondContact O-N 2.76Å; F104-R107 PolarHBondContact O-N 2.67Å; F104-R107 VanDerWaalsContact O-N 3.13Å; F104-R108 HydrophobicContact CD1-CG 3.9Å; F104-R108 HydrophobicContact CE1-CG 3.73Å; F104-R108 HydrophobicContact CZ-CG 4.23Å; F104-R108 VanDerWaalsContact O-CG 3.29Å; F104-R108 WeakPolarHBondContact O-CG 3.4Å; F104-R108 PolarHBondContact O-N 3.01Å
105M79.6Confident77.5Confident121 Ų121113.2 Ų113.260%0.59658%0.58SS**Hα-helixtrans-61.7-40.3175.6-69-60.4-177.400111.6G101 A102 R107 R108 L109G101-M105 WeakPolarHBondContact O-CB 3.37Å; G101-M105 VanDerWaalsContact O-CG 3.23Å; G101-M105 WeakPolarHBondContact O-CG 3.38Å; G101-M105 PolarHBondContact O-N 3.32Å; A102-M105 PolarHBondContact O-N 3.29Å; M105-R107 VanDerWaalsContact C-N 3.25Å; M105-R107 PolarHBondContact O-N 3.4Å; M105-R108 PolarHBondContact O-N 2.79Å; M105-L109 WeakPolarHBondContact O-CD1 3.46Å; M105-L109 WeakPolarHBondContact O-CG 3.27Å; M105-L109 PolarHBondContact O-N 2.81Å; M105-L109 VanDerWaalsContact O-N 3.09Å
106S75.1Confident76.1Confident70 Ų70114.7 Ų114.749%0.4959%0.59SS.*Hα-helixtrans-61.9-32.5175.3-60.30000112.9A102 F103 F104A102-S106 VanDerWaalsContact O-CB 3.27Å; A102-S106 WeakPolarHBondContact O-CB 3.34Å; A102-S106 PolarHBondContact O-N 3.28Å; A102-S106 PolarHBondContact O-OG 3.16Å; F103-S106 PolarHBondContact O-N 2.99Å; F104-S106 VanDerWaalsContact C-N 3.32Å; F104-S106 PolarHBondContact O-N 2.76Å
107R67.3Low74.3Confident153 Ų153116.1 Ų116.158%0.57761%0.607SS**Hα-helixtrans-78.6-36174.9-72.2176.7175.8-114.5-4.3112.3F103 F104 M105 L109 K110F103-R107 WeakPolarHBondContact O-CG 3.44Å; F103-R107 PolarHBondContact O-N 2.88Å; F104-R107 PolarHBondContact O-N 2.67Å; F104-R107 VanDerWaalsContact O-N 3.13Å; M105-R107 VanDerWaalsContact C-N 3.25Å; M105-R107 PolarHBondContact O-N 3.4Å; R107-L109 VanDerWaalsContact C-N 3.29Å; R107-L109 PolarHBondContact O-N 3.29Å; R107-K110 PolarHBondContact O-N 3.12Å; R107-K110 VanDerWaalsContact O-N 3.16Å
108R62.4Low72.7Confident162 Ų162116.6 Ų116.661%0.61162%0.618SS**Hα-helixtrans-66.6-29.5177.7-69.5-73177.1176.4-2.3112.7F104 M105 K110F104-R108 HydrophobicContact CD1-CG 3.9Å; F104-R108 HydrophobicContact CE1-CG 3.73Å; F104-R108 HydrophobicContact CZ-CG 4.23Å; F104-R108 VanDerWaalsContact O-CG 3.29Å; F104-R108 WeakPolarHBondContact O-CG 3.4Å; F104-R108 PolarHBondContact O-N 3.01Å; M105-R108 PolarHBondContact O-N 2.79Å; R108-K110 PolarHBondContact O-N 3.11Å
109L60.6Low71Confident144 Ų144119.8 Ų119.875%0.75463%0.628SS**THydrogen-bonded Turntrans-71-10.5174.6-70.4158.8000113.8M105 R107M105-L109 WeakPolarHBondContact O-CD1 3.46Å; M105-L109 WeakPolarHBondContact O-CG 3.27Å; M105-L109 PolarHBondContact O-N 2.81Å; M105-L109 VanDerWaalsContact O-N 3.09Å; R107-L109 VanDerWaalsContact C-N 3.29Å; R107-L109 PolarHBondContact O-N 3.29Å
110K59.3Low69.8Low169 Ų169119.9 Ų119.974%0.73563%0.63SS**THydrogen-bonded Turntrans-980.8-178.2-77.3177.4166.81800115R107 R108R107-K110 PolarHBondContact O-N 3.12Å; R107-K110 VanDerWaalsContact O-N 3.16Å; R108-K110 PolarHBondContact O-N 3.11Å
111V58.8Low68.3Low124 Ų124122 Ų12275%0.75265%0.645SS**SBendtrans-103.8-4.3-175.6-173.70000113.1
112N56.1Low67Low139 Ų139128.8 Ų128.874%0.74367%0.666SS**  trans-110.965.7177.9-160.329000111.7
113S60Low65.8Low80 Ų80131.9 Ų131.956%0.55967%0.672SS**  trans-127.216-177.354.50000114.5H115 P116S113-H115 PolarHBondContact O-N 3.27Å; S113-P116 WeakPolarHBondContact O-CD 3.38Å
114Y64.4Low64.6Low234 Ų234136 Ų13692%0.91869%0.686SS**SBendtrans-68-16164.9-126.9-87.9000112.2
115H62.6Low63.8Low158 Ų158133.7 Ų133.773%0.73168%0.68SS**SBendtrans-150.998.2153.5-100.7-54.1000107.5S113 C117S113-H115 PolarHBondContact O-N 3.27Å; H115-C117 PolarHBondContact O-N 3.3Å
116P66.9Low63.3Low93 Ų93133.1 Ų133.160%0.60468%0.679SS**  trans-57.1132.5164.227.1-32.3000107.1S113 S118S113-P116 WeakPolarHBondContact O-CD 3.38Å; P116-S118 PolarHBondContact O-N 3.16Å; P116-S118 VanDerWaalsContact O-N 3.11Å
117C59.6Low62.7Low126 Ų126136.7 Ų136.785%0.85169%0.688SS**SBendtrans-18.2108.2-175.9-66.70000113.1H115H115-C117 PolarHBondContact O-N 3.3Å
118S60.3Low62.5Low101 Ų101137.8 Ų137.871%0.70670%0.7SS**SBendtrans4.2118.2165.556.60000114.7P116P116-S118 PolarHBondContact O-N 3.16Å; P116-S118 VanDerWaalsContact O-N 3.11Å
119F61.4Low62.6Low175 Ų175133.5 Ų133.577%0.76869%0.689SS**SBendtrans28.9117.3150.7-101.2-95.4000115.9S121F119-S121 PolarHBondContact O-N 3.43Å
120P68.6Low62.7Low80 Ų80133.8 Ų133.852%0.51968%0.684SS.*  trans-43.5123.5179.113.6-26.1000110.6K122 Y124P120-K122 CarbonylContact O-C 3.44Å; P120-K122 PolarHBondContact O-N 2.98Å; P120-Y124 HydrophobicContact CG-CD2 3.88Å; P120-Y124 HydrophobicContact CG-CE2 3.5Å
121S60.7Low62.8Low129 Ų129131 Ų13190%0.90268%0.681SS**SBendtrans-62.9-5.3-175.473.60000113.3F119 M123F119-S121 PolarHBondContact O-N 3.43Å; S121-M123 PolarHBondContact O-N 3.1Å
122K62.8Low63Low175 Ų175127.3 Ų127.376%0.76167%0.669SS**SBendtrans-78.6102.4163.5-59.7-163.1180-177.30107.4P120 Y124P120-K122 CarbonylContact O-C 3.44Å; P120-K122 PolarHBondContact O-N 2.98Å; K122-Y124 PolarHBondContact O-N 3.28Å
123M64.1Low63.5Low120 Ų120123.9 Ų123.959%0.59167%0.666SS**  trans-26.3111162.5-115.3167.7119.800109S121 V125S121-M123 PolarHBondContact O-N 3.1Å; M123-V125 HydrophobicContact CB-CB 4.13Å; M123-V125 HydrophobicContact CE-CB 3.89Å; M123-V125 HydrophobicContact CE-CG1 3.85Å; M123-V125 HydrophobicContact CE-CG2 4.45Å; M123-V125 HydrophobicContact CG-CB 4.02Å; M123-V125 HydrophobicContact CG-CG2 4.29Å; M123-V125 PolarHBondContact O-N 3.22Å
124Y62Low63.5Low203 Ų203124.9 Ų124.980%0.79667%0.669SS**SBendtrans-70.433.4167.5-107.4-94000110.8P120 K122P120-Y124 HydrophobicContact CG-CD2 3.88Å; P120-Y124 HydrophobicContact CG-CE2 3.5Å; K122-Y124 PolarHBondContact O-N 3.28Å
125V66.4Low63.2Low51 Ų51122.4 Ų122.431%0.30966%0.663SS.*SBendtrans-131107.7-171.5-178.50000102.9M123 H127 D129M123-V125 HydrophobicContact CB-CB 4.13Å; M123-V125 HydrophobicContact CE-CB 3.89Å; M123-V125 HydrophobicContact CE-CG1 3.85Å; M123-V125 HydrophobicContact CE-CG2 4.45Å; M123-V125 HydrophobicContact CG-CB 4.02Å; M123-V125 HydrophobicContact CG-CG2 4.29Å; M123-V125 PolarHBondContact O-N 3.22Å; V125-H127 PolarHBondContact O-N 3.13Å; V125-D129 WeakPolarHBondContact CG1-O 3.29Å
126D69.3Low63Low109 Ų109120.2 Ų120.258%0.58366%0.663SS**  trans-47.7138.2172-170-11.3000108.1Q128 D129D126-Q128 PolarHBondContact O-N 3.17Å; D126-Q128 PolarHBondContact OD1-N 3.08Å; D126-D129 HydrophobicContact CB-CB 4.16Å; D126-D129 CarbonylContact O-C 3.32Å; D126-D129 WeakPolarHBondContact O-CA 3.32Å; D126-D129 PolarHBondContact O-N 2.88Å
127H64.1Low62.6Low145 Ų145125.1 Ų125.167%0.67168%0.675SS**THydrogen-bonded Turntrans-61.1-16.2177.5-101.7-32.5000112.2V125 K130V125-H127 PolarHBondContact O-N 3.13Å; H127-K130 WeakPolarHBondContact O-CE 3.44Å; H127-K130 WeakPolarHBondContact O-CG 2.88Å
128Q61.7Low62.6Low177 Ų177126.6 Ų126.683%0.82767%0.674SS**THydrogen-bonded Turntrans-81.3-21.5170.6-61.1-77.530.100113.7D126D126-Q128 PolarHBondContact O-N 3.17Å; D126-Q128 PolarHBondContact OD1-N 3.08Å
129D64.1Low62.2Low72 Ų72128.9 Ų128.939%0.38567%0.674SS.*  trans-109.148.8-179.9-170.915.3000111.3V125 D126 T131 G132V125-D129 WeakPolarHBondContact CG1-O 3.29Å; D126-D129 HydrophobicContact CB-CB 4.16Å; D126-D129 CarbonylContact O-C 3.32Å; D126-D129 WeakPolarHBondContact O-CA 3.32Å; D126-D129 PolarHBondContact O-N 2.88Å; D129-T131 PolarHBondContact O-N 3.29Å; D129-G132 PolarHBondContact O-N 2.93Å; D129-G132 WeakPolarHBondContact OD1-CA 3.49Å; D129-G132 PolarHBondContact OD1-N 3.19Å; D129-G132 VanDerWaalsContact OD1-N 3.1Å
130K64Low61.9Low150 Ų150127 Ų12765%0.65268%0.676SS**THydrogen-bonded Turntrans-60.2-13.3180-74.1176.7-178.6178.70114.5H127H127-K130 WeakPolarHBondContact O-CE 3.44Å; H127-K130 WeakPolarHBondContact O-CG 2.88Å
131T61.8Low61Low109 Ų109132.1 Ų132.167%0.66969%0.693SS**THydrogen-bonded Turntrans-103.3-15.1-174-45.40000112.6D129 T134D129-T131 PolarHBondContact O-N 3.29Å; T131-T134 HydrophobicContact CG2-CG2 4.12Å
132G61.6Low60.4Low48 Ų48129.6 Ų129.650%0.49568%0.681SS.*SBendtrans60.999-179.300000112D129D129-G132 PolarHBondContact O-N 2.93Å; D129-G132 WeakPolarHBondContact OD1-CA 3.49Å; D129-G132 PolarHBondContact OD1-N 3.19Å; D129-G132 VanDerWaalsContact OD1-N 3.1Å
133G66.8Low59.7Low67 Ų67130.4 Ų130.469%0.69168%0.684SS**SBendtrans71.452.6161.900000115.7
134T59.5Low58.8Low101 Ų101129.2 Ų129.262%0.6269%0.693SS**  trans-109.77.3166.446.60000113.9T131 P136T131-T134 HydrophobicContact CG2-CG2 4.12Å; T134-P136 WeakPolarHBondContact O-CD 3.09Å
135K59.2Low58.2Low182 Ų182125.6 Ų125.679%0.79169%0.692SS**SBendtrans-75.3110.8162.2-165.9171.9-174.3176.10106.6F137K135-F137 PolarHBondContact O-N 3.23Å
136P58.2Low57Low112 Ų112128.4 Ų128.473%0.72771%0.711SS**  trans-58116.2167.625.6-31.5000105.5T134 N138T134-P136 WeakPolarHBondContact O-CD 3.09Å; P136-N138 PolarHBondContact O-N 2.98Å; P136-N138 VanDerWaalsContact O-N 3.1Å
137F58.1Low55.7Low196 Ų196132.8 Ų132.886%0.8673%0.728SS**  trans-51.9123.3158.8-84.2-94.1000105K135 E139K135-F137 PolarHBondContact O-N 3.23Å; F137-E139 PolarHBondContact O-N 3.1Å
138N59.3Low54.7Low156 Ų156133.6 Ų133.683%0.83474%0.737SS**  trans-67.786.6168.6-17313000105.3P136 V140P136-N138 PolarHBondContact O-N 2.98Å; P136-N138 VanDerWaalsContact O-N 3.1Å; N138-V140 PolarHBondContact O-N 2.95Å
139E53.5Low53.4Low150 Ų150133.5 Ų133.570%0.70174%0.736SS**  trans-52.9105.8174.6-170167.6-174.700106.1F137 Q141F137-E139 PolarHBondContact O-N 3.1Å; E139-Q141 PolarHBondContact O-N 2.75Å
140V55.1Low52.5Low135 Ų135139.3 Ų139.382%0.81876%0.764SS**  trans-51.9111.7169.8172.60000105N138 A142N138-V140 PolarHBondContact O-N 2.95Å; V140-A142 PolarHBondContact O-N 2.95Å
141Q49Very low51.5Low187 Ų187139.5 Ų139.587%0.87477%0.767SS**  trans-37.899-171.9-78.8178.52900110.6E139 K143E139-Q141 PolarHBondContact O-N 2.75Å; Q141-K143 VanDerWaalsContact C-N 3.26Å; Q141-K143 PolarHBondContact O-N 2.92Å
142A48.2Very low51.1Low77 Ų77140.8 Ų140.864%0.63678%0.777SS**  trans-67.899.8164.500000104.3V140 A144V140-A142 PolarHBondContact O-N 2.95Å; A142-A144 PolarHBondContact O-N 2.91Å
143K47.6Very low50.9Low191 Ų191142.5 Ų142.583%0.8378%0.777SS**  trans-55.9104.2175.2-171.2173.7-176.3-179.70107.1Q141 V145Q141-K143 VanDerWaalsContact C-N 3.26Å; Q141-K143 PolarHBondContact O-N 2.92Å; K143-V145 PolarHBondContact O-N 2.87Å
144A45.4Very low50.7Low95 Ų95143.5 Ų143.579%0.78577%0.767SS**  trans-54.5124.8178.700000109.5A142A142-A144 PolarHBondContact O-N 2.91Å
145V49.2Very low51Low127 Ų127143 Ų14377%0.7777%0.768SS**  trans-109.7128.5162.4178.90000106.2K143K143-V145 PolarHBondContact O-N 2.87Å
146P40.8Very low51.4Low111 Ų111139.8 Ų139.872%0.72176%0.759SS**  trans-61.7139.7-174.4-1930.6000112L148P146-L148 PolarHBondContact O-N 2.75Å
147E42.9Very low52.3Low200 Ų200140.8 Ų140.894%0.93575%0.752SS**  trans-50.5113.1160.9-168178.9176.500109
148L42.6Very low53.2Low162 Ų162136.6 Ų136.685%0.84874%0.735SS**  trans-130.8132.4167.9-148.7150.1000108.5P146P146-L148 PolarHBondContact O-N 2.75Å
149E35.3Very low54.2Low176 Ų176133.8 Ų133.882%0.82272%0.719SS**  trans-52.9151.2-163.1-62.9-167.4132.600116.9E151E149-E151 PolarHBondContact O-N 3.26Å
150M45.6Very low55.6Low194 Ų194132.9 Ų132.996%0.95672%0.715SS**  trans-12.7104.3150.8-153.5168.283.500116.4
151E41.8Very low56.9Low154 Ų154129 Ų12972%0.7270%0.697SS**  trans-139.5142.5150.2-168.1154.8110.300106.5E149 V153E149-E151 PolarHBondContact O-N 3.26Å; E151-V153 HydrophobicContact CB-CG2 3.98Å; E151-V153 HydrophobicContact CG-CG2 4.28Å; E151-V153 PolarHBondContact O-N 3.38Å
152P52.7Low58.5Low135 Ų135125.5 Ų125.588%0.87768%0.681SS**  trans-76.168.6179.832.3-30.5000108.1D154P152-D154 PolarHBondContact O-N 3.2Å
153V58.4Low60.3Low84 Ų84126.8 Ų126.851%0.50968%0.676SS.*  trans-75.1122.1175.4-178.20000105.8E151 S155E151-V153 HydrophobicContact CB-CG2 3.98Å; E151-V153 HydrophobicContact CG-CG2 4.28Å; E151-V153 PolarHBondContact O-N 3.38Å; V153-S155 VanDerWaalsContact C-N 3.27Å; V153-S155 WeakPolarHBondContact O-CA 3.22Å; V153-S155 PolarHBondContact O-N 3.45Å
154D62.8Low62.1Low89 Ų89123.7 Ų123.748%0.47667%0.668SS.*  trans-44.386.7-178-142.5-10.2000110.3P152 N156 K157 Q158P152-D154 PolarHBondContact O-N 3.2Å; D154-N156 PolarHBondContact O-N 3.08Å; D154-K157 HydrophobicContact CB-CB 4.39Å; D154-K157 HydrophobicContact CB-CD 4.04Å; D154-K157 HydrophobicContact CB-CG 4.26Å; D154-K157 WeakPolarHBondContact O-CB 3.36Å; D154-K157 PolarHBondContact O-N 3.33Å; D154-K157 WeakPolarHBondContact OD2-CD 3.44Å; D154-K157 VanDerWaalsContact OD2-CE 3.24Å; D154-K157 WeakPolarHBondContact OD2-CE 3.4Å; D154-K157 IonicContact OD2-NZ 3.93Å; D154-K157 PolarHBondContact OD2-NZ 2.9Å; D154-Q158 PolarHBondContact O-N 3.15Å
155S64.6Low63.7Low91 Ų91127.2 Ų127.264%0.63666%0.661SS**Hα-helixtrans-60.5-26.5-16557.40000111.5V153 Q158 L159V153-S155 VanDerWaalsContact C-N 3.27Å; V153-S155 WeakPolarHBondContact O-CA 3.22Å; V153-S155 PolarHBondContact O-N 3.45Å; S155-Q158 PolarHBondContact O-N 2.96Å; S155-L159 WeakPolarHBondContact O-CB 3.27Å; S155-L159 PolarHBondContact O-N 3.47Å
156N69.5Low65.2Low113 Ų113123.7 Ų123.760%0.60465%0.645SS**Hα-helixtrans-64-43173.7-158.9-96.4000112.3D154 Q160D154-N156 PolarHBondContact O-N 3.08Å; N156-Q160 VanDerWaalsContact O-CB 3.31Å; N156-Q160 WeakPolarHBondContact O-CB 3.34Å; N156-Q160 PolarHBondContact O-N 3.04Å
157K75.3Confident67.1Low133 Ų133121 Ų12158%0.57863%0.632SS**Hα-helixtrans-70.1-37.8177.3-67.5179.4179.8145.40111.8D154 Q160 A161D154-K157 HydrophobicContact CB-CB 4.39Å; D154-K157 HydrophobicContact CB-CD 4.04Å; D154-K157 HydrophobicContact CB-CG 4.26Å; D154-K157 WeakPolarHBondContact O-CB 3.36Å; D154-K157 PolarHBondContact O-N 3.33Å; D154-K157 WeakPolarHBondContact OD2-CD 3.44Å; D154-K157 VanDerWaalsContact OD2-CE 3.24Å; D154-K157 WeakPolarHBondContact OD2-CE 3.4Å; D154-K157 IonicContact OD2-NZ 3.93Å; D154-K157 PolarHBondContact OD2-NZ 2.9Å; K157-Q160 PolarHBondContact O-N 3.32Å; K157-A161 WeakPolarHBondContact O-CB 3.25Å; K157-A161 PolarHBondContact O-N 2.71Å
158Q77.3Confident68.6Low109 Ų109115 Ų11551%0.50961%0.613SS.*Hα-helixtrans-67.3-44.6177.9-170.9169.3-0.800111.5D154 S155 Q160 A161 E162D154-Q158 PolarHBondContact O-N 3.15Å; S155-Q158 PolarHBondContact O-N 2.96Å; Q158-Q160 VanDerWaalsContact C-N 3.33Å; Q158-Q160 PolarHBondContact O-N 3.27Å; Q158-A161 PolarHBondContact O-N 3.47Å; Q158-E162 PolarHBondContact O-N 2.95Å
159L80.6Confident69.8Low96 Ų96111.6 Ų111.650%0.50360%0.602SS.*Hα-helixtrans-62.5-40.9174.3-178.561.8000111.4S155 A161 E162 I163S155-L159 WeakPolarHBondContact O-CB 3.27Å; S155-L159 PolarHBondContact O-N 3.47Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 2.81Å; L159-E162 PolarHBondContact O-N 3.28Å; L159-I163 HydrophobicContact CD1-CD1 4.17Å; L159-I163 HydrophobicContact CD1-CG1 4.35Å; L159-I163 HydrophobicContact CG-CD1 3.92Å; L159-I163 VanDerWaalsContact O-CG1 3.27Å; L159-I163 WeakPolarHBondContact O-CG1 3.47Å; L159-I163 PolarHBondContact O-N 2.65Å
160Q83.4Confident71Confident132 Ų132110 Ų11062%0.61760%0.599SS**Hα-helixtrans-64.9-38.7177.3-149.9-179.428.700111.9N156 K157 Q158 L164N156-Q160 VanDerWaalsContact O-CB 3.31Å; N156-Q160 WeakPolarHBondContact O-CB 3.34Å; N156-Q160 PolarHBondContact O-N 3.04Å; K157-Q160 PolarHBondContact O-N 3.32Å; Q158-Q160 VanDerWaalsContact C-N 3.33Å; Q158-Q160 PolarHBondContact O-N 3.27Å; Q160-L164 VanDerWaalsContact O-CB 3.32Å; Q160-L164 WeakPolarHBondContact O-CB 3.42Å; Q160-L164 PolarHBondContact O-N 3.25Å
161A81.9Confident71.8Confident53 Ų53111.3 Ų111.344%0.43859%0.593SS.*Hα-helixtrans-67.3-37.1174.900000112.4K157 Q158 L159 R165K157-A161 WeakPolarHBondContact O-CB 3.25Å; K157-A161 PolarHBondContact O-N 2.71Å; Q158-A161 PolarHBondContact O-N 3.47Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 2.81Å; A161-R165 VanDerWaalsContact O-CB 3.25Å; A161-R165 WeakPolarHBondContact O-CB 3.47Å; A161-R165 PolarHBondContact O-N 3.43Å
162E83.4Confident72.6Confident113 Ų113109.3 Ų109.353%0.52859%0.592SS.*Hα-helixtrans-69.3-44174.5-82.6-165.6151.100112.7Q158 L159 L164 R165 A166Q158-E162 PolarHBondContact O-N 2.95Å; L159-E162 PolarHBondContact O-N 3.28Å; E162-L164 VanDerWaalsContact C-N 3.3Å; E162-L164 PolarHBondContact O-N 2.95Å; E162-R165 PolarHBondContact O-N 2.88Å; E162-A166 WeakPolarHBondContact O-CB 3.41Å; E162-A166 PolarHBondContact O-N 3.47Å
163I85.4Confident72.5Confident104 Ų104108.8 Ų108.853%0.53359%0.588SS.*Hα-helixtrans-60-44.2175.5-69.2167.7000109.9L159 A166 A167L159-I163 HydrophobicContact CD1-CD1 4.17Å; L159-I163 HydrophobicContact CD1-CG1 4.35Å; L159-I163 HydrophobicContact CG-CD1 3.92Å; L159-I163 VanDerWaalsContact O-CG1 3.27Å; L159-I163 WeakPolarHBondContact O-CG1 3.47Å; L159-I163 PolarHBondContact O-N 2.65Å; I163-A166 PolarHBondContact O-N 3.43Å; I163-A167 WeakPolarHBondContact O-CB 3.19Å; I163-A167 PolarHBondContact O-N 3.39Å
164L84.4Confident72.2Confident127 Ų127110.4 Ų110.467%0.66560%0.603SS**Hα-helixtrans-64.4-42.2178.1-171.769.2000111.7Q160 E162 A167 S168Q160-L164 VanDerWaalsContact O-CB 3.32Å; Q160-L164 WeakPolarHBondContact O-CB 3.42Å; Q160-L164 PolarHBondContact O-N 3.25Å; E162-L164 VanDerWaalsContact C-N 3.3Å; E162-L164 PolarHBondContact O-N 2.95Å; L164-A167 PolarHBondContact O-N 3.43Å; L164-S168 WeakPolarHBondContact O-CB 3.4Å; L164-S168 PolarHBondContact O-N 3.03Å; L164-S168 PolarHBondContact O-OG 2.91Å
165R80.7Confident71.1Confident168 Ų168115.9 Ų115.963%0.63462%0.623SS**Hα-helixtrans-64.4-44.4177-176.8-172.1-67177.1-1.6111.7A161 E162 S168 S169A161-R165 VanDerWaalsContact O-CB 3.25Å; A161-R165 WeakPolarHBondContact O-CB 3.47Å; A161-R165 PolarHBondContact O-N 3.43Å; E162-R165 PolarHBondContact O-N 2.88Å; R165-S168 WeakPolarHBondContact CA-OG 3.31Å; R165-S168 PolarHBondContact O-N 3.48Å; R165-S168 PolarHBondContact O-OG 3.17Å; R165-S169 WeakPolarHBondContact O-CB 3.32Å; R165-S169 PolarHBondContact O-N 2.84Å; R165-S169 PolarHBondContact O-OG 2.7Å
166A80.6Confident69.8Low53 Ų53117.2 Ų117.244%0.43863%0.631SS.*Hα-helixtrans-64.2-45.6176.500000110.6E162 I163 S168 S169 L170E162-A166 WeakPolarHBondContact O-CB 3.41Å; E162-A166 PolarHBondContact O-N 3.47Å; I163-A166 PolarHBondContact O-N 3.43Å; A166-S168 PolarHBondContact O-N 2.85Å; A166-S169 WeakPolarHBondContact O-CB 3.24Å; A166-S169 PolarHBondContact O-N 3.48Å; A166-S169 VanDerWaalsContact O-N 3.15Å; A166-L170 WeakPolarHBondContact O-CG 3.48Å; A166-L170 PolarHBondContact O-N 3.23Å; A166-L170 VanDerWaalsContact O-N 3.08Å
167A80.7Confident68.5Low55 Ų55117.7 Ų117.746%0.45564%0.64SS.*Hα-helixtrans-63.6-38.9177.500000112.9I163 L164 S169 L170 R171I163-A167 WeakPolarHBondContact O-CB 3.19Å; I163-A167 PolarHBondContact O-N 3.39Å; L164-A167 PolarHBondContact O-N 3.43Å; A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.38Å; A167-L170 PolarHBondContact O-N 2.84Å; A167-R171 PolarHBondContact O-N 3.4Å
168S73.7Confident66.5Low75 Ų75121 Ų12152%0.52466%0.657SS.*Hα-helixtrans-69.1-29.8174.963.10000112.6L164 R165 A166 L170 R171L164-S168 WeakPolarHBondContact O-CB 3.4Å; L164-S168 PolarHBondContact O-N 3.03Å; L164-S168 PolarHBondContact O-OG 2.91Å; R165-S168 WeakPolarHBondContact CA-OG 3.31Å; R165-S168 PolarHBondContact O-N 3.48Å; R165-S168 PolarHBondContact O-OG 3.17Å; A166-S168 PolarHBondContact O-N 2.85Å; S168-L170 VanDerWaalsContact C-N 3.32Å; S168-R171 PolarHBondContact O-N 3.16Å
169S67Low64.6Low90 Ų90119.9 Ų119.963%0.62967%0.667SS**Hα-helixtrans-73.3-26.3176.3-53.60000112.4R165 A166 A167 R171R165-S169 WeakPolarHBondContact O-CB 3.32Å; R165-S169 PolarHBondContact O-N 2.84Å; R165-S169 PolarHBondContact O-OG 2.7Å; A166-S169 WeakPolarHBondContact O-CB 3.24Å; A166-S169 PolarHBondContact O-N 3.48Å; A166-S169 VanDerWaalsContact O-N 3.15Å; A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.38Å; S169-R171 VanDerWaalsContact C-N 3.33Å
170L61.6Low62.6Low142 Ų142119.9 Ų119.974%0.74368%0.681SS**Hα-helixtrans-79.9-14.7175-68.2170000113.2A166 A167 S168 T172A166-L170 WeakPolarHBondContact O-CG 3.48Å; A166-L170 PolarHBondContact O-N 3.23Å; A166-L170 VanDerWaalsContact O-N 3.08Å; A167-L170 PolarHBondContact O-N 2.84Å; S168-L170 VanDerWaalsContact C-N 3.32Å; L170-T172 VanDerWaalsContact C-N 3.28Å; L170-T172 PolarHBondContact O-N 3.02Å
171R62.6Low60.3Low221 Ų221122.7 Ų122.783%0.83469%0.694SS**SBendtrans-77.784.8171.9-160.9172.1-178.1123.8-2.2108.2A167 S168 S169A167-R171 PolarHBondContact O-N 3.4Å; S168-R171 PolarHBondContact O-N 3.16Å; S169-R171 VanDerWaalsContact C-N 3.33Å
172T58.7Low58Low113 Ų113125.2 Ų125.269%0.69371%0.709SS**  trans-41.8132.8177.851.40000112L170 S174L170-T172 VanDerWaalsContact C-N 3.28Å; L170-T172 PolarHBondContact O-N 3.02Å; T172-S174 PolarHBondContact O-N 3.42Å; T172-S174 VanDerWaalsContact O-N 3.16Å
173P50.3Low55.7Low123 Ų123125.6 Ų125.680%0.79972%0.724SS**  trans-64117.8161.323.3-23.2000107.4K175P173-K175 PolarHBondContact O-N 2.95Å
174S52.2Low53.4Low119 Ų119129.4 Ų129.483%0.83274%0.739SS**  trans-55.4110.116954.50000109.3T172T172-S174 PolarHBondContact O-N 3.42Å; T172-S174 VanDerWaalsContact O-N 3.16Å
175K39.9Very low51Low204 Ų204129.7 Ų129.789%0.88775%0.746SS**  trans-149.8126.8156.7-153.5151.6-177.9173.20111.1P173P173-K175 PolarHBondContact O-N 2.95Å
176C36.1Very low48.9Very low118 Ų118126.7 Ų126.780%0.79776%0.758SS**  trans-46.1155.9-175.4-80.20000116.2
177P42.3Very low46.9Very low123 Ų123128.3 Ų128.380%0.79977%0.771SS**  trans-71.7129.2171.930.3-31.6000110.8A179P177-A179 PolarHBondContact O-N 2.96Å
178Q34.7Very low44.8Very low202 Ų202132.3 Ų132.394%0.94479%0.785SS**  trans-81.9105.7167.5-154.9172.323.900107.4
179A37.3Very low43.5Very low86 Ų86134.5 Ų134.571%0.71180%0.797SS**  trans-93139.3172.300000109.9P177P177-A179 PolarHBondContact O-N 2.96Å
180A36.9Very low42.1Very low97 Ų97133.7 Ų133.780%0.80279%0.792SS**  trans54.9109.9150.400000118.8
181E36.2Very low41.6Very low190 Ų190132.3 Ų132.389%0.88879%0.791SS**  -147.4108.412442.5-165.8148.900110.2
182S34.2Very low41Very low107 Ų107130.6 Ų130.675%0.74879%0.793SS**  trans-61.7134.7155.747.90000109.6
183S34.7Very low40.3Very low121 Ų121132.3 Ų132.385%0.84680%0.798SS**  trans-146.4113.5146.4-83.60000109.2
184E37.4Very low40.1Very low183 Ų183133.2 Ų133.286%0.85580%0.796SS**  trans-57.1135.3170.1-57.9157.2145.500109.8
185T33.8Very low39.7Very low133 Ų133134.8 Ų134.882%0.81679%0.794SS**  trans-15697.2142-710000107.1
186A35.2Very low39.4Very low105 Ų105138.1 Ų138.187%0.86881%0.809SS**  trans-69.7124.1155.700000108.1
187A38.9Very low39.6Very low88 Ų88139.2 Ų139.273%0.72781%0.809SS**  trans-149.7118.2154.200000108.4
188D38Very low39.5Very low139 Ų139140 Ų14074%0.74381%0.81SS**  trans-45.1154175.7-174.347.6000115.1S190D188-S190 VanDerWaalsContact CG-N 3.27Å; D188-S190 PolarHBondContact OD1-N 2.98Å; D188-S190 PolarHBondContact OD2-N 2.73Å
189P46Very low39.7Very low120 Ų120136.6 Ų136.678%0.77980%0.802SS**  -132.7112.5125.233.6-22.3000113.1
190S37.9Very low39.9Very low73 Ų73139.5 Ų139.551%0.5181%0.808SS.*  trans-55.3140.1157.7-1750000111.5D188D188-S190 VanDerWaalsContact CG-N 3.27Å; D188-S190 PolarHBondContact OD1-N 2.98Å; D188-S190 PolarHBondContact OD2-N 2.73Å
191P50.1Low40.1Very low113 Ų113142.2 Ų142.273%0.73481%0.808SS**  trans-86.4127168.333-26.3000109.4
192E49.7Very low40.3Very low185 Ų185139 Ų13986%0.86480%0.803SS**  trans-108.3122.5166.6-57.2-147.3156.900109.6
193D44.3Very low40.8Very low150 Ų150141.3 Ų141.380%0.80281%0.807SS**  trans-70.9143.9175-72.1-52.2000112.2
194D45.6Very low41.2Very low141 Ų141142.8 Ų142.875%0.75480%0.804SS**  trans30.2143.4141.9-92.9-73000124.7
195L45Very low41.5Very low153 Ų153139.5 Ų139.580%0.80180%0.799SS**  trans79.399.1150.3-99.175.6000120.6
196K34.3Very low42.2Very low274 Ų274140.1 Ų140.1100%1.19180%0.798SS**  151.90102.3-171.5169.9-177179.40113.3

Retrieved 196 of 196 residues in 35.4 ms (Link to these results)