A0A5K4F088_SCHMA Loading...

t-SNARE coiled-coil homology domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F088, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 340 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
1M45.1Very low60.8Low236 Ų236127 Ų127100%1.16368%0.677SS**  0950-68.1-167.1164.800108.3R3M1-R3 PolarHBondContact O-N 2.9Å
2S47.2Very low60.6Low125 Ų125125.6 Ų125.687%0.87467%0.669SS**  trans-70.1108.6177.6-175.90000107.8D4S2-D4 PolarHBondContact O-N 3.44Å
3R55.8Low60.6Low228 Ų228122.2 Ų122.286%0.8666%0.656SS**  trans-73.4106.9174.9-72.5-174.3172177.4-1.9106.8M1 I5M1-R3 PolarHBondContact O-N 2.9Å; R3-I5 PolarHBondContact O-N 3.05Å
4D56.6Low60.3Low116 Ų116119.3 Ų119.362%0.6265%0.649SS**  trans-66114.5174.9-166.1-16.3000108.8S2 S6 P7S2-D4 PolarHBondContact O-N 3.44Å; D4-S6 VanDerWaalsContact C-N 3.28Å; D4-S6 WeakPolarHBondContact OD1-CB 3.44Å; D4-S6 PolarHBondContact OD1-N 2.71Å; D4-S6 VanDerWaalsContact OD1-N 3.13Å; D4-S6 PolarHBondContact OD1-OG 3.07Å; D4-P7 WeakPolarHBondContact O-CD 3.27Å
5I64.8Low59.9Low106 Ų106117.1 Ų117.154%0.54465%0.647SS.*  trans-86.1-4-175.5-61.5166.7000110.7R3 P7 L8 F9R3-I5 PolarHBondContact O-N 3.05Å; I5-P7 VanDerWaalsContact C-N 3.34Å; I5-L8 HydrophobicContact CG2-CB 4.08Å; I5-L8 HydrophobicContact CG2-CD1 4.19Å; I5-L8 WeakPolarHBondContact O-CB 3.24Å; I5-L8 PolarHBondContact O-N 2.88Å; I5-F9 PolarHBondContact O-N 3.05Å
6S73.6Confident58.8Low69 Ų69117.4 Ų117.448%0.48365%0.645SS.*Hα-helixtrans-45.5-43.5176.5-59.20000115.2D4 L8 F9 T10D4-S6 VanDerWaalsContact C-N 3.28Å; D4-S6 WeakPolarHBondContact OD1-CB 3.44Å; D4-S6 PolarHBondContact OD1-N 2.71Å; D4-S6 VanDerWaalsContact OD1-N 3.13Å; D4-S6 PolarHBondContact OD1-OG 3.07Å; S6-L8 PolarHBondContact O-N 3.45Å; S6-F9 WeakPolarHBondContact O-CB 3.31Å; S6-F9 PolarHBondContact O-N 2.91Å; S6-F9 VanDerWaalsContact O-N 3.17Å; S6-T10 PolarHBondContact O-N 3.33Å; S6-T10 PolarHBondContact O-OG1 3.03Å
7P66.9Low58Low84 Ų84120.3 Ų120.355%0.54565%0.65SS.*Hα-helixtrans-67.7-32.5178.524.8-33.6000113.9D4 I5 F9 T10 S11D4-P7 WeakPolarHBondContact O-CD 3.27Å; I5-P7 VanDerWaalsContact C-N 3.34Å; P7-F9 VanDerWaalsContact C-N 3.27Å; P7-F9 PolarHBondContact O-N 3.02Å; P7-T10 WeakPolarHBondContact CA-OG1 3.42Å; P7-T10 PolarHBondContact O-OG1 3.44Å; P7-S11 VanDerWaalsContact O-CB 3.29Å; P7-S11 WeakPolarHBondContact O-CB 3.47Å; P7-S11 PolarHBondContact O-N 3.23Å
8L60.4Low57.2Low117 Ų117119.6 Ų119.661%0.61365%0.652SS**Hα-helixtrans-66.1-36.4173.2-79.4166.9000110.4I5 S6 L12I5-L8 HydrophobicContact CG2-CB 4.08Å; I5-L8 HydrophobicContact CG2-CD1 4.19Å; I5-L8 WeakPolarHBondContact O-CB 3.24Å; I5-L8 PolarHBondContact O-N 2.88Å; S6-L8 PolarHBondContact O-N 3.45Å; L8-L12 WeakPolarHBondContact O-CB 3.43Å; L8-L12 PolarHBondContact O-N 3.37Å; L8-L12 VanDerWaalsContact O-N 3.08Å
9F66.9Low56.2Low145 Ų145120.1 Ų120.164%0.63666%0.66SS**Hα-helixtrans-69.8-46.3178.1-127.4-89.2000112.3I5 S6 P7 S11 L12 V13I5-F9 PolarHBondContact O-N 3.05Å; S6-F9 WeakPolarHBondContact O-CB 3.31Å; S6-F9 PolarHBondContact O-N 2.91Å; S6-F9 VanDerWaalsContact O-N 3.17Å; P7-F9 VanDerWaalsContact C-N 3.27Å; P7-F9 PolarHBondContact O-N 3.02Å; F9-S11 PolarHBondContact O-N 3.19Å; F9-L12 PolarHBondContact O-N 2.95Å; F9-V13 HydrophobicContact CD1-CG2 4.23Å; F9-V13 WeakPolarHBondContact O-CB 3.22Å; F9-V13 VanDerWaalsContact O-CG2 3.23Å; F9-V13 WeakPolarHBondContact O-CG2 3.46Å; F9-V13 PolarHBondContact O-N 3.35Å
10T64.5Low55.2Low96 Ų96121.4 Ų121.459%0.58966%0.664SS**Hα-helixtrans-67.5-35.5177.835.20000112.5S6 P7 S14S6-T10 PolarHBondContact O-N 3.33Å; S6-T10 PolarHBondContact O-OG1 3.03Å; P7-T10 WeakPolarHBondContact CA-OG1 3.42Å; P7-T10 PolarHBondContact O-OG1 3.44Å; T10-S14 WeakPolarHBondContact O-CB 3.49Å; T10-S14 PolarHBondContact O-N 2.91Å; T10-S14 PolarHBondContact O-OG 2.74Å
11S67.2Low54.4Low75 Ų75120.8 Ų120.852%0.52467%0.666SS.*Hα-helixtrans-64.9-40173.5-1720000112.2P7 F9 S14 S15P7-S11 VanDerWaalsContact O-CB 3.29Å; P7-S11 WeakPolarHBondContact O-CB 3.47Å; P7-S11 PolarHBondContact O-N 3.23Å; F9-S11 PolarHBondContact O-N 3.19Å; S11-S14 PolarHBondContact O-OG 2.73Å; S11-S15 PolarHBondContact O-N 2.77Å; S11-S15 PolarHBondContact O-OG 2.81Å
12L57.8Low53.8Low110 Ų110119.3 Ų119.358%0.57665%0.653SS**Hα-helixtrans-69.7-42.5177-106.2151.8000111.9L8 F9 S14 S15 I16L8-L12 WeakPolarHBondContact O-CB 3.43Å; L8-L12 PolarHBondContact O-N 3.37Å; L8-L12 VanDerWaalsContact O-N 3.08Å; F9-L12 PolarHBondContact O-N 2.95Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.44Å; L12-S15 WeakPolarHBondContact CA-OG 3.48Å; L12-S15 PolarHBondContact O-N 2.85Å; L12-S15 PolarHBondContact O-OG 3.44Å; L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.16Å; L12-I16 PolarHBondContact O-N 3.49Å; L12-I16 VanDerWaalsContact O-N 3.09Å
13V61.6Low53Low82 Ų82120.1 Ų120.150%0.49765%0.647SS.*Hα-helixtrans-65.9-36.1178.2172.40000111.5F9 I16 K17F9-V13 HydrophobicContact CD1-CG2 4.23Å; F9-V13 WeakPolarHBondContact O-CB 3.22Å; F9-V13 VanDerWaalsContact O-CG2 3.23Å; F9-V13 WeakPolarHBondContact O-CG2 3.46Å; F9-V13 PolarHBondContact O-N 3.35Å; V13-I16 PolarHBondContact O-N 2.79Å; V13-K17 PolarHBondContact O-N 2.73Å
14S56Low51.8Low81 Ų81113.8 Ų113.857%0.56664%0.638SS**Hα-helixtrans-67-37.3175.672.40000112T10 S11 L12 I16 K17T10-S14 WeakPolarHBondContact O-CB 3.49Å; T10-S14 PolarHBondContact O-N 2.91Å; T10-S14 PolarHBondContact O-OG 2.74Å; S11-S14 PolarHBondContact O-OG 2.73Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.44Å; S14-I16 VanDerWaalsContact C-N 3.26Å; S14-I16 PolarHBondContact O-N 2.77Å; S14-K17 PolarHBondContact O-N 2.88Å
15S54Low50.6Low87 Ų87113.3 Ų113.361%0.60864%0.644SS**Hα-helixtrans-69.5-19.8172.644.60000114.4S11 L12S11-S15 PolarHBondContact O-N 2.77Å; S11-S15 PolarHBondContact O-OG 2.81Å; L12-S15 WeakPolarHBondContact CA-OG 3.48Å; L12-S15 PolarHBondContact O-N 2.85Å; L12-S15 PolarHBondContact O-OG 3.44Å
16I43.2Very low49Very low122 Ų122115.4 Ų115.463%0.62665%0.654SS**Hα-helixtrans-84.8-19.1175.7-68.6164.1000111.7L12 V13 S14 P18L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.16Å; L12-I16 PolarHBondContact O-N 3.49Å; L12-I16 VanDerWaalsContact O-N 3.09Å; V13-I16 PolarHBondContact O-N 2.79Å; S14-I16 VanDerWaalsContact C-N 3.26Å; S14-I16 PolarHBondContact O-N 2.77Å; I16-P18 WeakPolarHBondContact O-CD 3.45Å; I16-P18 VanDerWaalsContact O-N 3.09Å
17K43.9Very low47Very low166 Ų166117.5 Ų117.572%0.72267%0.669SS**SBendtrans-70.1110.3175.6-124.1177.1-174.9179.40107.9V13 S14 T19V13-K17 PolarHBondContact O-N 2.73Å; S14-K17 PolarHBondContact O-N 2.88Å; K17-T19 PolarHBondContact O-N 3.28Å
18P45Very low45.2Very low107 Ų107120.3 Ų120.370%0.69568%0.675SS**  trans-63.9111.3-178.327.1-31.5000106.8I16 I20I16-P18 WeakPolarHBondContact O-CD 3.45Å; I16-P18 VanDerWaalsContact O-N 3.09Å; P18-I20 PolarHBondContact O-N 2.7Å
19T36.8Very low43.9Very low129 Ų129123.7 Ų123.779%0.79169%0.688SS**  trans-59.595168.5-55.80000106.4K17 P21K17-T19 PolarHBondContact O-N 3.28Å; T19-P21 WeakPolarHBondContact O-CD 3.47Å
20I36.4Very low42.1Very low147 Ų147125.7 Ų125.775%0.75470%0.699SS**  trans-54.7111.1169.9-62.8164.6000104.9P18 K22P18-I20 PolarHBondContact O-N 2.7Å; I20-K22 PolarHBondContact O-N 2.92Å
21P38Very low40.5Very low108 Ų108128.5 Ų128.570%0.70170%0.703SS**  trans-68.1113.3-177.3-2.816.1000106.5T19 L23T19-P21 WeakPolarHBondContact O-CD 3.47Å; P21-L23 PolarHBondContact O-N 2.92Å
22K32.2Very low38.7Very low205 Ų205134.8 Ų134.889%0.89172%0.721SS**  trans-64.479.7159.3-81.6179.4174.5178.10107.2I20 S24I20-K22 PolarHBondContact O-N 2.92Å; K22-S24 VanDerWaalsContact C-N 3.29Å; K22-S24 PolarHBondContact O-N 3.39Å
23L30.7Very low37.4Very low143 Ų143139.4 Ų139.475%0.74974%0.736SS**  trans-89.379.1167.6-166.167000107.4P21P21-L23 PolarHBondContact O-N 2.92Å
24S31.2Very low36Very low94 Ų94139.4 Ų139.466%0.65774%0.737SS**  trans-71.7129.1161.545.80000109K22K22-S24 VanDerWaalsContact C-N 3.29Å; K22-S24 PolarHBondContact O-N 3.39Å
25S31.9Very low35.1Very low107 Ų107141.4 Ų141.475%0.74875%0.751SS**  trans57.988.1157.462.60000117.5
26I31.4Very low34.3Very low150 Ų150144.2 Ų144.277%0.76976%0.758SS**  trans-117.1129.5143.9-66.3176.2000107.6
27S31.2Very low34.1Very low113 Ų113141.5 Ų141.579%0.7975%0.747SS**  trans-62153-164.4-45.60000115.3E29S27-E29 VanDerWaalsContact C-N 3.35Å; S27-E29 PolarHBondContact O-N 3.43Å; S27-E29 VanDerWaalsContact O-N 3.09Å
28E29.8Very low33.9Very low143 Ų143136.1 Ų136.167%0.66874%0.739SS**SBendtrans-71.420.3-166-98.5-95142.500117.9K31E28-K31 IonicContact OE1-NZ 3.76Å; E28-K31 PolarHBondContact OE1-NZ 3.25Å; E28-K31 IonicContact OE2-NZ 2.79Å
29E31.6Very low33.8Very low188 Ų188136.4 Ų136.488%0.87973%0.727SS**  trans-1002.3-163-100.5-176.9172.200119.9S27S27-E29 VanDerWaalsContact C-N 3.35Å; S27-E29 PolarHBondContact O-N 3.43Å; S27-E29 VanDerWaalsContact O-N 3.09Å
30E30.4Very low34.4Very low186 Ų186134.3 Ų134.387%0.86971%0.708SS**  trans-119.565.9172.8-72.7-159.4154.800113.5
31K29.3Very low35.2Very low156 Ų156134.5 Ų134.568%0.67870%0.704SS**  trans-107.319.8-177.2-118.9178.4-170.9168.70116.5E28E28-K31 IonicContact OE1-NZ 3.76Å; E28-K31 PolarHBondContact OE1-NZ 3.25Å; E28-K31 IonicContact OE2-NZ 2.79Å
32K30.4Very low36.4Very low207 Ų207131.5 Ų131.590%0.969%0.685SS**SBendtrans-127.15.8-173.6-88.6-174.1178.71780120.2
33K29.7Very low38Very low206 Ų206122 Ų12290%0.89664%0.644SS**SBendtrans-134.65.9174.4-84.8-172177.2179.10118.2
34T32.6Very low39.8Very low83 Ų83118.9 Ų118.951%0.50963%0.625SS.*  trans-119.323.5-169.58.80000115.2L36 T37T34-L36 PolarHBondContact O-N 3.44Å; T34-L36 VanDerWaalsContact O-N 3.17Å; T34-T37 HydrophobicContact CG2-CG2 3.79Å; T34-T37 WeakPolarHBondContact CG2-OG1 3.31Å; T34-T37 PolarHBondContact O-N 2.86Å; T34-T37 VanDerWaalsContact O-N 3.17Å; T34-T37 PolarHBondContact O-OG1 3.45Å
35S37.6Very low41.7Very low123 Ų123116.8 Ų116.886%0.8661%0.609SS**THydrogen-bonded Turntrans-66.9-12.2178.754.90000115
36L36.1Very low43.4Very low145 Ų145114 Ų11476%0.75958%0.582SS**THydrogen-bonded Turntrans-87.5-18.5172.6-115.292000114.3T34T34-L36 PolarHBondContact O-N 3.44Å; T34-L36 VanDerWaalsContact O-N 3.17Å
37T39.2Very low45Very low66 Ų66107.2 Ų107.241%0.40555%0.548SS..Hα-helixtrans-84.2-17.6-171.359.30000114.4T34 Y39 E40 F41T34-T37 HydrophobicContact CG2-CG2 3.79Å; T34-T37 WeakPolarHBondContact CG2-OG1 3.31Å; T34-T37 PolarHBondContact O-N 2.86Å; T34-T37 VanDerWaalsContact O-N 3.17Å; T34-T37 PolarHBondContact O-OG1 3.45Å; T37-Y39 VanDerWaalsContact C-N 3.26Å; T37-Y39 PolarHBondContact O-N 2.87Å; T37-E40 PolarHBondContact O-N 3.29Å; T37-F41 WeakPolarHBondContact O-CB 3.38Å; T37-F41 PolarHBondContact O-N 3.04Å
38G39.9Very low46.8Very low53 Ų53106.9 Ų106.955%0.54653%0.534SS..Hα-helixtrans-61.8-33.4179.800000113.4S42G38-S42 PolarHBondContact O-N 2.74Å
39Y44Very low48.8Very low112 Ų112102.7 Ų102.744%0.43952%0.521SS..Hα-helixtrans-81.3-29.9179-138.2-97.1000112.8T37 S42 F43 L105T37-Y39 VanDerWaalsContact C-N 3.26Å; T37-Y39 PolarHBondContact O-N 2.87Å; Y39-S42 PolarHBondContact O-OG 2.87Å; Y39-F43 PolarHBondContact O-N 3.19Å; Y39-L105 HydrophobicContact CD1-CD1 3.99Å; Y39-L105 HydrophobicContact CD1-CG 4.45Å; Y39-L105 HydrophobicContact CE1-CD1 3.1Å; Y39-L105 HydrophobicContact CE1-CG 3.85Å; Y39-L105 HydrophobicContact CE2-CD1 4.46Å; Y39-L105 VanDerWaalsContact OH-CD1 3.28Å; Y39-L105 WeakPolarHBondContact OH-CD1 3.39Å
40E48.5Very low50.6Low86 Ų8693.8 Ų93.840%0.40248%0.479SS..Hα-helixtrans-72.6-40.7174.5-172.5170.1-161.100111.2T37 S42 F43 Q44T37-E40 PolarHBondContact O-N 3.29Å; E40-S42 VanDerWaalsContact C-N 3.28Å; E40-S42 PolarHBondContact O-N 3.1Å; E40-F43 PolarHBondContact O-N 2.92Å; E40-Q44 PolarHBondContact O-N 2.86Å
41F52.9Low52.4Low151 Ų15189.9 Ų89.966%0.66246%0.461SS*.Hα-helixtrans-59.9-39.8173.3-166.1-103.4000111.1T37 T45T37-F41 WeakPolarHBondContact O-CB 3.38Å; T37-F41 PolarHBondContact O-N 3.04Å; F41-T45 HydrophobicContact CD1-CG2 3.72Å; F41-T45 HydrophobicContact CD2-CG2 4.19Å; F41-T45 HydrophobicContact CE1-CG2 3.44Å; F41-T45 VanDerWaalsContact CE1-CG2 3.44Å; F41-T45 HydrophobicContact CE2-CG2 3.92Å; F41-T45 HydrophobicContact CG-CG2 4.1Å; F41-T45 HydrophobicContact CZ-CG2 3.53Å; F41-T45 VanDerWaalsContact O-CB 3.28Å; F41-T45 WeakPolarHBondContact O-CB 3.23Å; F41-T45 WeakPolarHBondContact O-CG2 3.21Å; F41-T45 PolarHBondContact O-N 2.89Å; F41-T45 PolarHBondContact O-OG1 3.47Å
42S63.7Low54.4Low45 Ų4585.5 Ų85.532%0.31545%0.449SS..Hα-helixtrans-68.8-36.7179.573.30000113.4G38 Y39 E40 T45 R46G38-S42 PolarHBondContact O-N 2.74Å; Y39-S42 PolarHBondContact O-OG 2.87Å; E40-S42 VanDerWaalsContact C-N 3.28Å; E40-S42 PolarHBondContact O-N 3.1Å; S42-T45 PolarHBondContact O-OG1 2.9Å; S42-R46 WeakPolarHBondContact O-CB 3.36Å; S42-R46 PolarHBondContact O-N 3.38Å
43F65.1Low56.3Low5 Ų576.9 Ų76.92%0.02242%0.415CS..Hα-helixtrans-66.2-51.2173.5178.8-87.1000111Y39 E40 R46 A47 L102 L105 I106 R139 I142Y39-F43 PolarHBondContact O-N 3.19Å; E40-F43 PolarHBondContact O-N 2.92Å; F43-R46 PolarHBondContact O-N 3.47Å; F43-A47 HydrophobicContact CE1-CB 4.31Å; F43-A47 WeakPolarHBondContact O-CB 3.5Å; F43-A47 PolarHBondContact O-N 3.06Å; F43-L102 HydrophobicContact CD2-CD2 3.64Å; F43-L102 HydrophobicContact CE2-CD2 3.67Å; F43-L102 HydrophobicContact CG-CD2 4.33Å; F43-L102 HydrophobicContact CZ-CD2 4.39Å; F43-L105 HydrophobicContact CB-CD2 3.68Å; F43-L105 HydrophobicContact CD2-CD2 3.91Å; F43-L105 HydrophobicContact CG-CD2 4.29Å; F43-I106 HydrophobicContact CE2-CD1 4.03Å; F43-I106 HydrophobicContact CE2-CG1 3.95Å; F43-R139 HydrophobicContact CD1-CG 3.97Å; F43-R139 HydrophobicContact CD2-CG 4.43Å; F43-R139 HydrophobicContact CE1-CB 4.13Å; F43-R139 HydrophobicContact CE1-CG 3.74Å; F43-R139 HydrophobicContact CE2-CB 4.12Å; F43-R139 HydrophobicContact CE2-CG 4.24Å; F43-R139 HydrophobicContact CG-CG 4.34Å; F43-R139 HydrophobicContact CZ-CB 3.79Å; F43-R139 HydrophobicContact CZ-CG 3.89Å; F43-I142 HydrophobicContact CE1-CD1 4.39Å; F43-I142 HydrophobicContact CE1-CG2 4.4Å; F43-I142 HydrophobicContact CZ-CG2 4.39Å
44Q69.7Low58.1Low77 Ų7767.6 Ų67.636%0.3638%0.375SS..Hα-helixtrans-65.1-48.5-174.3-17862.615.600111.6E40 R46 A47 E48E40-Q44 PolarHBondContact O-N 2.86Å; Q44-R46 PolarHBondContact O-N 3.24Å; Q44-A47 PolarHBondContact O-N 3.34Å; Q44-E48 WeakPolarHBondContact CG-OE1 3.35Å; Q44-E48 PolarHBondContact NE2-OE1 2.92Å; Q44-E48 WeakPolarHBondContact O-CB 3.48Å; Q44-E48 WeakPolarHBondContact O-CG 3.32Å; Q44-E48 PolarHBondContact O-N 2.97Å
45T70.6Confident60.2Low51 Ų5170 Ų7031%0.31338%0.378SS..Hα-helixtrans-58.7-33.1176.551.70000112.2F41 S42 S49F41-T45 HydrophobicContact CD1-CG2 3.72Å; F41-T45 HydrophobicContact CD2-CG2 4.19Å; F41-T45 HydrophobicContact CE1-CG2 3.44Å; F41-T45 VanDerWaalsContact CE1-CG2 3.44Å; F41-T45 HydrophobicContact CE2-CG2 3.92Å; F41-T45 HydrophobicContact CG-CG2 4.1Å; F41-T45 HydrophobicContact CZ-CG2 3.53Å; F41-T45 VanDerWaalsContact O-CB 3.28Å; F41-T45 WeakPolarHBondContact O-CB 3.23Å; F41-T45 WeakPolarHBondContact O-CG2 3.21Å; F41-T45 PolarHBondContact O-N 2.89Å; F41-T45 PolarHBondContact O-OG1 3.47Å; S42-T45 PolarHBondContact O-OG1 2.9Å; T45-S49 VanDerWaalsContact O-CB 3.26Å; T45-S49 WeakPolarHBondContact O-CB 3.28Å; T45-S49 PolarHBondContact O-N 2.9Å
46R68.6Low61.9Low49 Ų4967.2 Ų67.219%0.18536%0.356CS..Hα-helixtrans-79.2-35.1179.1-169.2158.3173.9-126.7-40.4113.4S42 F43 Q44 L50 L98 Q101 L102S42-R46 WeakPolarHBondContact O-CB 3.36Å; S42-R46 PolarHBondContact O-N 3.38Å; F43-R46 PolarHBondContact O-N 3.47Å; Q44-R46 PolarHBondContact O-N 3.24Å; R46-L50 PolarHBondContact O-N 2.92Å; R46-L98 HydrophobicContact CG-CD2 3.98Å; R46-L98 PolarHBondContact NH2-O 3.25Å; R46-Q101 VanDerWaalsContact CZ-CB 3.49Å; R46-Q101 VanDerWaalsContact CZ-CD 3.42Å; R46-Q101 VanDerWaalsContact NE-OE1 3.11Å; R46-Q101 VanDerWaalsContact NH1-CB 3.34Å; R46-Q101 PolarHBondContact NH1-O 3.1Å; R46-Q101 VanDerWaalsContact NH1-O 3.1Å; R46-L102 HydrophobicContact CB-CD2 4.16Å; R46-L102 HydrophobicContact CG-CD2 4.07Å; R46-L102 HydrophobicContact CG-CG 4.36Å; R46-L102 VanDerWaalsContact NH2-N 3.15Å
47A63.8Low63.2Low6 Ų660.4 Ų60.45%0.0532%0.321CS..Hα-helixtrans-64.5-41.4169.500000111.1F43 Q44 L50 H51 I142 L146F43-A47 HydrophobicContact CE1-CB 4.31Å; F43-A47 WeakPolarHBondContact O-CB 3.5Å; F43-A47 PolarHBondContact O-N 3.06Å; Q44-A47 PolarHBondContact O-N 3.34Å; A47-L50 PolarHBondContact O-N 3.29Å; A47-H51 WeakPolarHBondContact O-CB 3.44Å; A47-H51 PolarHBondContact O-N 3.16Å; A47-I142 HydrophobicContact CB-CG2 4.23Å; A47-L146 HydrophobicContact CB-CD1 4.18Å
48E68.9Low64.5Low107 Ų10759.3 Ų59.350%0.532%0.316SS..Hα-helixtrans-66.7-41.1175.1-72.9174.9-175.100112.4Q44 L50 H51 S52Q44-E48 WeakPolarHBondContact CG-OE1 3.35Å; Q44-E48 PolarHBondContact NE2-OE1 2.92Å; Q44-E48 WeakPolarHBondContact O-CB 3.48Å; Q44-E48 WeakPolarHBondContact O-CG 3.32Å; Q44-E48 PolarHBondContact O-N 2.97Å; E48-L50 VanDerWaalsContact C-N 3.34Å; E48-L50 PolarHBondContact O-N 3.38Å; E48-H51 PolarHBondContact O-N 3.34Å; E48-S52 WeakPolarHBondContact O-CB 3.41Å; E48-S52 PolarHBondContact O-N 2.87Å; E48-S52 PolarHBondContact O-OG 3.44Å; E48-S52 VanDerWaalsContact O-OG 3.05Å
49S71.6Confident66.1Low55 Ų5560.8 Ų60.839%0.38531%0.311SS..Hα-helixtrans-60.2-42.7172.3178.10000111.6T45 S52 S53T45-S49 VanDerWaalsContact O-CB 3.26Å; T45-S49 WeakPolarHBondContact O-CB 3.28Å; T45-S49 PolarHBondContact O-N 2.9Å; S49-S52 PolarHBondContact O-OG 2.92Å; S49-S53 WeakPolarHBondContact O-CB 3.49Å; S49-S53 PolarHBondContact O-N 3.3Å; S49-S53 PolarHBondContact O-OG 2.93Å
50L69.3Low67.2Low0 Ų060.6 Ų60.60%031%0.311CS..Hα-helixtrans-67-44.2175.2-174.1147.6000111.7R46 A47 E48 S52 S53 L54 L98 L99 L102 L146R46-L50 PolarHBondContact O-N 2.92Å; A47-L50 PolarHBondContact O-N 3.29Å; E48-L50 VanDerWaalsContact C-N 3.34Å; E48-L50 PolarHBondContact O-N 3.38Å; L50-S52 PolarHBondContact O-N 3.11Å; L50-S53 WeakPolarHBondContact O-CB 3.47Å; L50-S53 PolarHBondContact O-N 3.4Å; L50-L54 VanDerWaalsContact O-CB 3.26Å; L50-L54 WeakPolarHBondContact O-CB 3.28Å; L50-L54 PolarHBondContact O-N 3.39Å; L50-L98 HydrophobicContact CB-CD1 4.29Å; L50-L98 HydrophobicContact CD1-CB 3.66Å; L50-L99 HydrophobicContact CD1-CD2 3.74Å; L50-L99 HydrophobicContact CD1-CG 3.79Å; L50-L102 HydrophobicContact CD1-CD1 4.38Å; L50-L146 HydrophobicContact CD2-CB 4.01Å; L50-L146 HydrophobicContact CD2-CD1 4.06Å; L50-L146 HydrophobicContact CD2-CD2 3.68Å; L50-L146 HydrophobicContact CD2-CG 4.11Å
51H68.1Low67.9Low105 Ų10556.7 Ų56.749%0.48629%0.292SS..Hα-helixtrans-63-41.8179.2-176.473.8000111.9A47 E48 L54 K55 L146A47-H51 WeakPolarHBondContact O-CB 3.44Å; A47-H51 PolarHBondContact O-N 3.16Å; E48-H51 PolarHBondContact O-N 3.34Å; H51-L54 PolarHBondContact O-N 3.1Å; H51-K55 VanDerWaalsContact O-CB 3.32Å; H51-K55 WeakPolarHBondContact O-CB 3.36Å; H51-K55 PolarHBondContact O-N 2.89Å; H51-L146 HydrophobicContact CB-CD2 4.31Å
52S72.8Confident68.6Low63 Ų6355.5 Ų55.544%0.44129%0.287SS..Hα-helixtrans-64.5-41.2174.261.90000111.8E48 S49 L50 K55 V56E48-S52 WeakPolarHBondContact O-CB 3.41Å; E48-S52 PolarHBondContact O-N 2.87Å; E48-S52 PolarHBondContact O-OG 3.44Å; E48-S52 VanDerWaalsContact O-OG 3.05Å; S49-S52 PolarHBondContact O-OG 2.92Å; L50-S52 PolarHBondContact O-N 3.11Å; S52-K55 PolarHBondContact O-N 3.34Å; S52-V56 WeakPolarHBondContact O-CB 3.39Å; S52-V56 VanDerWaalsContact O-CG2 3.26Å; S52-V56 WeakPolarHBondContact O-CG2 3.21Å; S52-V56 PolarHBondContact O-N 3.04Å
53S70.4Confident68.5Low27 Ų2760.5 Ų60.519%0.18930%0.299CS..Hα-helixtrans-62.2-43174.4-59.60000112.3S49 L50 V56 L57S49-S53 WeakPolarHBondContact O-CB 3.49Å; S49-S53 PolarHBondContact O-N 3.3Å; S49-S53 PolarHBondContact O-OG 2.93Å; L50-S53 WeakPolarHBondContact O-CB 3.47Å; L50-S53 PolarHBondContact O-N 3.4Å; S53-V56 PolarHBondContact O-N 2.93Å; S53-L57 WeakPolarHBondContact O-CB 3.44Å; S53-L57 PolarHBondContact O-N 3.13Å
54L67.4Low68.2Low10 Ų1060.6 Ų60.65%0.05230%0.3CS..Hα-helixtrans-65.1-41.5176.6-173.378.9000111.8L50 H51 L57 S58 E149 L150 L153L50-L54 VanDerWaalsContact O-CB 3.26Å; L50-L54 WeakPolarHBondContact O-CB 3.28Å; L50-L54 PolarHBondContact O-N 3.39Å; H51-L54 PolarHBondContact O-N 3.1Å; L54-L57 WeakPolarHBondContact O-CB 3.34Å; L54-L57 PolarHBondContact O-N 2.87Å; L54-S58 PolarHBondContact O-N 3.1Å; L54-E149 HydrophobicContact CD2-CB 3.57Å; L54-E149 HydrophobicContact CD2-CG 4.28Å; L54-L150 HydrophobicContact CD1-CD1 4.21Å; L54-L153 HydrophobicContact CD1-CB 4.45Å; L54-L153 HydrophobicContact CD1-CD2 3.24Å; L54-L153 HydrophobicContact CG-CD2 4.07Å
55K75.9Confident67.6Low133 Ų13361.6 Ų61.658%0.57830%0.304SS*.Hα-helixtrans-64.5-41.6175.4-175.1172.1-175.7171.40111.5H51 S52 L57 S58 N59H51-K55 VanDerWaalsContact O-CB 3.32Å; H51-K55 WeakPolarHBondContact O-CB 3.36Å; H51-K55 PolarHBondContact O-N 2.89Å; S52-K55 PolarHBondContact O-N 3.34Å; K55-L57 VanDerWaalsContact C-N 3.33Å; K55-S58 PolarHBondContact O-N 2.9Å; K55-N59 PolarHBondContact O-N 3.35Å; K55-N59 VanDerWaalsContact O-N 3.08Å; K55-N59 PolarHBondContact O-ND2 3.44Å
56V72.5Confident67.1Low65 Ų6566.1 Ų66.139%0.39432%0.322SS..Hα-helixtrans-61.1-44.1173166.30000110.3S52 S53 N59 Y60 L91S52-V56 WeakPolarHBondContact O-CB 3.39Å; S52-V56 VanDerWaalsContact O-CG2 3.26Å; S52-V56 WeakPolarHBondContact O-CG2 3.21Å; S52-V56 PolarHBondContact O-N 3.04Å; S53-V56 PolarHBondContact O-N 2.93Å; V56-N59 PolarHBondContact O-N 3.25Å; V56-Y60 HydrophobicContact CB-CE2 4.5Å; V56-Y60 HydrophobicContact CG1-CD2 3.57Å; V56-Y60 HydrophobicContact CG1-CE2 3.09Å; V56-Y60 WeakPolarHBondContact O-CD2 3.48Å; V56-Y60 PolarHBondContact O-N 2.86Å; V56-L91 HydrophobicContact CG1-CD2 4.45Å
57L65Low66.2Low2 Ų267.1 Ų67.11%0.0133%0.33CS..Hα-helixtrans-62-44.7176.1-17753000112.9S53 L54 K55 N59 Y60 L61 V88 L91 I92 L153S53-L57 WeakPolarHBondContact O-CB 3.44Å; S53-L57 PolarHBondContact O-N 3.13Å; L54-L57 WeakPolarHBondContact O-CB 3.34Å; L54-L57 PolarHBondContact O-N 2.87Å; K55-L57 VanDerWaalsContact C-N 3.33Å; L57-N59 VanDerWaalsContact C-N 3.29Å; L57-N59 PolarHBondContact O-N 2.89Å; L57-Y60 PolarHBondContact O-N 2.83Å; L57-Y60 VanDerWaalsContact O-N 3.14Å; L57-L61 WeakPolarHBondContact O-CB 3.36Å; L57-L61 PolarHBondContact O-N 3.38Å; L57-V88 HydrophobicContact CD1-CB 3.98Å; L57-V88 HydrophobicContact CD1-CG1 3.74Å; L57-V88 HydrophobicContact CD1-CG2 3.61Å; L57-L91 HydrophobicContact CB-CD2 3.55Å; L57-L91 HydrophobicContact CB-CG 4.19Å; L57-L91 HydrophobicContact CD1-CB 4.47Å; L57-L91 HydrophobicContact CD1-CD2 3.98Å; L57-L91 HydrophobicContact CD1-CG 4.47Å; L57-L91 HydrophobicContact CD2-CG 4.36Å; L57-L91 HydrophobicContact CG-CD2 4.18Å; L57-I92 HydrophobicContact CD2-CD1 4.44Å; L57-I92 HydrophobicContact CD2-CG1 3.57Å; L57-L153 HydrophobicContact CB-CD2 3.91Å; L57-L153 HydrophobicContact CD2-CD2 3.23Å; L57-L153 HydrophobicContact CD2-CG 3.84Å; L57-L153 HydrophobicContact CG-CD1 4.35Å; L57-L153 HydrophobicContact CG-CD2 3.49Å; L57-L153 VanDerWaalsContact CG-CD2 3.49Å; L57-L153 HydrophobicContact CG-CG 4.05Å
58S66.7Low65.6Low43 Ų4367 Ų6730%0.30133%0.329SS..Hα-helixtrans-58.6-40.9175.4-179.40000111.8L54 K55 L61 K62L54-S58 PolarHBondContact O-N 3.1Å; K55-S58 PolarHBondContact O-N 2.9Å; S58-L61 PolarHBondContact O-N 2.73Å; S58-K62 WeakPolarHBondContact O-CG 3.5Å; S58-K62 PolarHBondContact O-N 3.39Å
59N73.6Confident64.8Low85 Ų8565.4 Ų65.446%0.45533%0.334SS..Hα-helixtrans-67.8-39.7175.1-72.3-49.4000112.4K55 V56 L57 L61 K62 R63K55-N59 PolarHBondContact O-N 3.35Å; K55-N59 VanDerWaalsContact O-N 3.08Å; K55-N59 PolarHBondContact O-ND2 3.44Å; V56-N59 PolarHBondContact O-N 3.25Å; L57-N59 VanDerWaalsContact C-N 3.29Å; L57-N59 PolarHBondContact O-N 2.89Å; N59-L61 VanDerWaalsContact C-N 3.34Å; N59-K62 PolarHBondContact O-N 2.76Å; N59-R63 PolarHBondContact O-N 2.95Å
60Y65.9Low63.8Low108 Ų10864.4 Ų64.442%0.42433%0.332SS..Hα-helixtrans-62.5-41.5174.6-75.4-51.5000112V56 L57 R63 I64 L84 L91V56-Y60 HydrophobicContact CB-CE2 4.5Å; V56-Y60 HydrophobicContact CG1-CD2 3.57Å; V56-Y60 HydrophobicContact CG1-CE2 3.09Å; V56-Y60 WeakPolarHBondContact O-CD2 3.48Å; V56-Y60 PolarHBondContact O-N 2.86Å; L57-Y60 PolarHBondContact O-N 2.83Å; L57-Y60 VanDerWaalsContact O-N 3.14Å; Y60-R63 CarbonylContact O-C 3.59Å; Y60-R63 WeakPolarHBondContact O-CB 3.37Å; Y60-R63 PolarHBondContact O-N 3.22Å; Y60-R63 VanDerWaalsContact O-N 3.15Å; Y60-I64 WeakPolarHBondContact O-CG1 3.45Å; Y60-I64 PolarHBondContact O-N 2.92Å; Y60-L84 HydrophobicContact CD1-CD1 4.19Å; Y60-L84 HydrophobicContact CG-CD1 4.44Å; Y60-L91 HydrophobicContact CD2-CD2 4.39Å
61L64.4Low62.6Low4 Ų464.5 Ų64.52%0.02133%0.333CS..Hα-helixtrans-65.7-43177.8-159.966.8000111.7L57 S58 N59 R63 I64 H65 L153 L156 E160L57-L61 WeakPolarHBondContact O-CB 3.36Å; L57-L61 PolarHBondContact O-N 3.38Å; S58-L61 PolarHBondContact O-N 2.73Å; N59-L61 VanDerWaalsContact C-N 3.34Å; L61-R63 PolarHBondContact O-N 3.38Å; L61-I64 HydrophobicContact CD1-CD1 4.05Å; L61-I64 WeakPolarHBondContact O-CA 3.36Å; L61-I64 WeakPolarHBondContact O-CB 3.36Å; L61-I64 PolarHBondContact O-N 3.07Å; L61-I64 VanDerWaalsContact O-N 3.1Å; L61-H65 PolarHBondContact O-N 2.9Å; L61-L153 HydrophobicContact CD2-CD1 3.47Å; L61-L153 VanDerWaalsContact CD2-CD1 3.47Å; L61-L156 HydrophobicContact CD2-CB 3.96Å; L61-L156 HydrophobicContact CD2-CD2 3.4Å; L61-L156 VanDerWaalsContact CD2-CD2 3.4Å; L61-L156 HydrophobicContact CD2-CG 3.52Å; L61-L156 HydrophobicContact CG-CD2 4.33Å; L61-L156 HydrophobicContact CG-CG 4.4Å; L61-E160 VanDerWaalsContact CD1-CD 3.4Å; L61-E160 WeakPolarHBondContact CD1-OE2 3.29Å; L61-E160 WeakPolarHBondContact CG-OE1 3.45Å
62K66.7Low61.7Low126 Ų12661.4 Ų61.455%0.54832%0.319SS..Hα-helixtrans-57.5-38.8170.8-73.8175.2-175.8178.20112.3S58 N59 H65 Q66S58-K62 WeakPolarHBondContact O-CG 3.5Å; S58-K62 PolarHBondContact O-N 3.39Å; N59-K62 PolarHBondContact O-N 2.76Å; K62-H65 WeakPolarHBondContact O-CB 3.49Å; K62-H65 PolarHBondContact O-N 2.92Å; K62-Q66 WeakPolarHBondContact O-CG 3.45Å; K62-Q66 PolarHBondContact O-N 3.03Å
63R61Low60.6Low150 Ų15061.8 Ų61.857%0.56633%0.333SS*.Hα-helixtrans-69.9-37.8176.4-168.5176.7-178.9176.7-0.4111.9N59 Y60 L61 H65 L67N59-R63 PolarHBondContact O-N 2.95Å; Y60-R63 CarbonylContact O-C 3.59Å; Y60-R63 WeakPolarHBondContact O-CB 3.37Å; Y60-R63 PolarHBondContact O-N 3.22Å; Y60-R63 VanDerWaalsContact O-N 3.15Å; L61-R63 PolarHBondContact O-N 3.38Å; R63-H65 VanDerWaalsContact C-N 3.35Å; R63-L67 HydrophobicContact CG-CD1 4.07Å; R63-L67 WeakPolarHBondContact O-CB 3.42Å; R63-L67 VanDerWaalsContact O-CG 3.26Å; R63-L67 WeakPolarHBondContact O-CG 3.49Å; R63-L67 PolarHBondContact O-N 3.25Å
64I59.3Low59.8Low7 Ų763.4 Ų63.44%0.03634%0.34CS..Hα-helixtrans-57.5-51.6169.4-69.2164000109.3Y60 L61 Q66 L67 T68 H81 L84 V88 E160Y60-I64 WeakPolarHBondContact O-CG1 3.45Å; Y60-I64 PolarHBondContact O-N 2.92Å; L61-I64 HydrophobicContact CD1-CD1 4.05Å; L61-I64 WeakPolarHBondContact O-CA 3.36Å; L61-I64 WeakPolarHBondContact O-CB 3.36Å; L61-I64 PolarHBondContact O-N 3.07Å; L61-I64 VanDerWaalsContact O-N 3.1Å; I64-Q66 PolarHBondContact O-N 2.85Å; I64-L67 PolarHBondContact O-N 2.76Å; I64-L67 VanDerWaalsContact O-N 3.13Å; I64-T68 WeakPolarHBondContact CG2-OG1 3.37Å; I64-T68 WeakPolarHBondContact O-CB 3.49Å; I64-T68 PolarHBondContact O-N 3.27Å; I64-T68 PolarHBondContact O-OG1 3.07Å; I64-H81 PolarHBondContact O-CE1 3.16Å; I64-L84 HydrophobicContact CB-CD2 4.31Å; I64-L84 HydrophobicContact CD1-CB 4.5Å; I64-L84 HydrophobicContact CD1-CD1 4.5Å; I64-L84 HydrophobicContact CD1-CD2 4.04Å; I64-L84 HydrophobicContact CD1-CG 3.63Å; I64-L84 HydrophobicContact CG1-CB 4.26Å; I64-L84 HydrophobicContact CG1-CD1 4.42Å; I64-L84 HydrophobicContact CG1-CD2 3.16Å; I64-L84 HydrophobicContact CG1-CG 3.34Å; I64-V88 HydrophobicContact CD1-CG2 3.79Å; I64-E160 VanDerWaalsContact CG2-OE2 3.26Å; I64-E160 WeakPolarHBondContact CG2-OE2 3.38Å
65H56.7Low59.3Low97 Ų9767.1 Ų67.145%0.44937%0.367SS..Hα-helixtrans-55.2-50.2-178.9-172.383.3000111.6L61 K62 R63 L67 T68 A69L61-H65 PolarHBondContact O-N 2.9Å; K62-H65 WeakPolarHBondContact O-CB 3.49Å; K62-H65 PolarHBondContact O-N 2.92Å; R63-H65 VanDerWaalsContact C-N 3.35Å; H65-L67 VanDerWaalsContact C-N 3.35Å; H65-L67 PolarHBondContact O-N 3.41Å; H65-T68 PolarHBondContact O-N 2.86Å; H65-A69 PolarHBondContact O-N 2.85Å
66Q61.2Low58.4Low147 Ų14764.6 Ų64.669%0.68736%0.363SS*.Hα-helixtrans-59.6-41.5176.4-73.6175.8-2.700113.1K62 I64K62-Q66 WeakPolarHBondContact O-CG 3.45Å; K62-Q66 PolarHBondContact O-N 3.03Å; I64-Q66 PolarHBondContact O-N 2.85Å
67L49.9Very low57.6Low70 Ų7065 Ų6537%0.36636%0.359SS..Hα-helixtrans-73.6-37.1179.6-70.8171.6000111.7R63 I64 H65 A69 G70 T71R63-L67 HydrophobicContact CG-CD1 4.07Å; R63-L67 WeakPolarHBondContact O-CB 3.42Å; R63-L67 VanDerWaalsContact O-CG 3.26Å; R63-L67 WeakPolarHBondContact O-CG 3.49Å; R63-L67 PolarHBondContact O-N 3.25Å; I64-L67 PolarHBondContact O-N 2.76Å; I64-L67 VanDerWaalsContact O-N 3.13Å; H65-L67 VanDerWaalsContact C-N 3.35Å; H65-L67 PolarHBondContact O-N 3.41Å; L67-A69 VanDerWaalsContact C-N 3.3Å; L67-A69 PolarHBondContact O-N 3.39Å; L67-G70 PolarHBondContact O-N 2.76Å; L67-T71 WeakPolarHBondContact O-CG2 3.26Å; L67-T71 PolarHBondContact O-N 2.96Å
68T51.2Low57.2Low4 Ų468.6 Ų68.63%0.02538%0.376CS..Hα-helixtrans-67.3-31.2-176.6-34.70000112.7I64 H65 G70 T71 H81 R163 Q164 L167I64-T68 WeakPolarHBondContact CG2-OG1 3.37Å; I64-T68 WeakPolarHBondContact O-CB 3.49Å; I64-T68 PolarHBondContact O-N 3.27Å; I64-T68 PolarHBondContact O-OG1 3.07Å; H65-T68 PolarHBondContact O-N 2.86Å; T68-G70 PolarHBondContact O-N 3.14Å; T68-T71 PolarHBondContact O-N 2.74Å; T68-T71 PolarHBondContact O-OG1 3.39Å; T68-T71 VanDerWaalsContact O-OG1 3.14Å; T68-H81 PolarHBondContact OG1-CE1 2.91Å; T68-R163 PolarHBondContact OG1-NH2 2.87Å; T68-Q164 VanDerWaalsContact CG2-OE1 3.25Å; T68-L167 HydrophobicContact CG2-CD1 4.31Å
69A51.4Low56.8Low72 Ų7275.7 Ų75.760%0.59540%0.396SS*.THydrogen-bonded Turntrans-54.6-24.9171.200000112.6H65 L67H65-A69 PolarHBondContact O-N 2.85Å; L67-A69 VanDerWaalsContact C-N 3.3Å; L67-A69 PolarHBondContact O-N 3.39Å
70G50Low56.1Low34 Ų3476.1 Ų76.135%0.35140%0.398SS..THydrogen-bonded Turntrans-115.312.5-178.100000116.1L67 T68 K77L67-G70 PolarHBondContact O-N 2.76Å; T68-G70 PolarHBondContact O-N 3.14Å; G70-K77 VanDerWaalsContact O-CD 3.24Å; G70-K77 WeakPolarHBondContact O-CD 3.48Å; G70-K77 PolarHBondContact O-NZ 2.85Å
71T45.2Very low55.5Low3 Ų371.5 Ų71.52%0.01838%0.38CS..  trans-87.4-12.7-17152.10000116.9L67 T68 G73 N74 K77 H81L67-T71 WeakPolarHBondContact O-CG2 3.26Å; L67-T71 PolarHBondContact O-N 2.96Å; T68-T71 PolarHBondContact O-N 2.74Å; T68-T71 PolarHBondContact O-OG1 3.39Å; T68-T71 VanDerWaalsContact O-OG1 3.14Å; T71-G73 PolarHBondContact O-N 3.32Å; T71-G73 VanDerWaalsContact O-N 3.12Å; T71-N74 PolarHBondContact O-N 3.15Å; T71-K77 HydrophobicContact CG2-CB 3.28Å; T71-K77 HydrophobicContact CG2-CD 3.86Å; T71-K77 HydrophobicContact CG2-CG 4.19Å; T71-H81 WeakPolarHBondContact CG2-CD2 3.23Å; T71-H81 WeakPolarHBondContact CG2-NE2 3.32Å
72L49.2Very low55.4Low39 Ų3974.2 Ų74.220%0.20440%0.403CS..THydrogen-bonded Turntrans-67117.7-179.6-142.483.4000110.7L167 Q273L72-L167 HydrophobicContact CD1-CB 4.42Å; L72-L167 HydrophobicContact CD1-CD2 4.06Å; L72-Q273 PolarHBondContact O-NE2 3.35Å
73G48.9Very low55.3Low71 Ų7173 Ų7373%0.73240%0.4SS*.THydrogen-bonded Turntrans101-7.8-179.900000115.6T71T71-G73 PolarHBondContact O-N 3.32Å; T71-G73 VanDerWaalsContact O-N 3.12Å
74N54.9Low55.4Low61 Ų6167.1 Ų67.133%0.32638%0.379SS..  trans-118.8107.5-179.9-163.3-20.2000112.5T71 T76 K77 Q78T71-N74 PolarHBondContact O-N 3.15Å; N74-T76 PolarHBondContact ND2-OG1 3.39Å; N74-T76 PolarHBondContact O-N 3.43Å; N74-T76 PolarHBondContact OD1-N 2.94Å; N74-T76 PolarHBondContact OD1-OG1 3.26Å; N74-K77 HydrophobicContact CB-CB 4.24Å; N74-K77 HydrophobicContact CB-CD 3.96Å; N74-K77 HydrophobicContact CB-CG 3.82Å; N74-K77 PolarHBondContact O-N 3.38Å; N74-Q78 PolarHBondContact O-N 2.89Å; N74-Q78 VanDerWaalsContact O-N 3.1Å
75S56.4Low55.5Low88 Ų8869.2 Ų69.262%0.61539%0.392SS*.Hα-helixtrans-57.8-30.8177.759.30000113Q78 R79S75-Q78 PolarHBondContact O-N 2.92Å; S75-R79 PolarHBondContact O-N 3.23Å
76T56.9Low56Low80 Ų8070.5 Ų70.549%0.49140%0.399SS..Hα-helixtrans-68.7-38.6176.770.40000111N74 R79 L80N74-T76 PolarHBondContact ND2-OG1 3.39Å; N74-T76 PolarHBondContact O-N 3.43Å; N74-T76 PolarHBondContact OD1-N 2.94Å; N74-T76 PolarHBondContact OD1-OG1 3.26Å; T76-R79 PolarHBondContact O-N 3.48Å; T76-L80 WeakPolarHBondContact O-CG 3.49Å; T76-L80 PolarHBondContact O-N 3.49Å
77K55.8Low56.1Low74 Ų7467.9 Ų67.932%0.32239%0.389SS..Hα-helixtrans-69.8-38.8177.4-55.4-176.7177.5-1780110.8G70 T71 N74 R79 L80 H81G70-K77 VanDerWaalsContact O-CD 3.24Å; G70-K77 WeakPolarHBondContact O-CD 3.48Å; G70-K77 PolarHBondContact O-NZ 2.85Å; T71-K77 HydrophobicContact CG2-CB 3.28Å; T71-K77 HydrophobicContact CG2-CD 3.86Å; T71-K77 HydrophobicContact CG2-CG 4.19Å; N74-K77 HydrophobicContact CB-CB 4.24Å; N74-K77 HydrophobicContact CB-CD 3.96Å; N74-K77 HydrophobicContact CB-CG 3.82Å; N74-K77 PolarHBondContact O-N 3.38Å; K77-R79 VanDerWaalsContact C-N 3.33Å; K77-R79 PolarHBondContact O-N 2.84Å; K77-L80 PolarHBondContact O-N 2.86Å; K77-H81 PolarHBondContact O-CD2 2.77Å; K77-H81 PolarHBondContact O-N 3.13Å
78Q56.8Low56.8Low78 Ų7864.7 Ų64.736%0.36437%0.373SS..Hα-helixtrans-59.1-42171.3-71.1-179-15.400112.6N74 S75 H81 A82N74-Q78 PolarHBondContact O-N 2.89Å; N74-Q78 VanDerWaalsContact O-N 3.1Å; S75-Q78 PolarHBondContact O-N 2.92Å; Q78-H81 WeakPolarHBondContact O-CB 3.49Å; Q78-H81 PolarHBondContact O-N 3.43Å; Q78-A82 PolarHBondContact O-N 3.43Å
79R57.3Low57.6Low191 Ų19166.1 Ų66.172%0.72138%0.382SS*.Hα-helixtrans-62.8-46.1175.4-173.9-177.6178.296.32.9111.9S75 T76 K77 H81 A82 E83S75-R79 PolarHBondContact O-N 3.23Å; T76-R79 PolarHBondContact O-N 3.48Å; K77-R79 VanDerWaalsContact C-N 3.33Å; K77-R79 PolarHBondContact O-N 2.84Å; R79-H81 PolarHBondContact O-N 2.88Å; R79-A82 PolarHBondContact O-N 2.88Å; R79-E83 PolarHBondContact O-N 3.26Å
80L58.8Low58.3Low95 Ų9565.7 Ų65.750%0.49737%0.371SS..Hα-helixtrans-61.1-33.9175.7-71.5173.6000111.8T76 K77 L84T76-L80 WeakPolarHBondContact O-CG 3.49Å; T76-L80 PolarHBondContact O-N 3.49Å; K77-L80 PolarHBondContact O-N 2.86Å; L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 PolarHBondContact O-N 2.79Å
81H53.7Low58.9Low10 Ų1065.2 Ų65.25%0.04636%0.361CS..Hα-helixtrans-67.5-43172.6-81.7-63.1000113.5I64 T68 T71 K77 Q78 R79 E83 L84 T85I64-H81 PolarHBondContact O-CE1 3.16Å; T68-H81 PolarHBondContact OG1-CE1 2.91Å; T71-H81 WeakPolarHBondContact CG2-CD2 3.23Å; T71-H81 WeakPolarHBondContact CG2-NE2 3.32Å; K77-H81 PolarHBondContact O-CD2 2.77Å; K77-H81 PolarHBondContact O-N 3.13Å; Q78-H81 WeakPolarHBondContact O-CB 3.49Å; Q78-H81 PolarHBondContact O-N 3.43Å; R79-H81 PolarHBondContact O-N 2.88Å; H81-E83 VanDerWaalsContact C-N 3.34Å; H81-L84 PolarHBondContact O-N 3.16Å; H81-T85 VanDerWaalsContact O-CB 3.28Å; H81-T85 WeakPolarHBondContact O-CB 3.28Å; H81-T85 PolarHBondContact O-N 3.33Å; H81-T85 PolarHBondContact O-OG1 3.02Å
82A62.6Low59.9Low62 Ų6265.8 Ų65.851%0.51236%0.364SS..Hα-helixtrans-60.2-48.3177.600000110.5Q78 R79 L84 T85 E86Q78-A82 PolarHBondContact O-N 3.43Å; R79-A82 PolarHBondContact O-N 2.88Å; A82-L84 VanDerWaalsContact C-N 3.34Å; A82-L84 PolarHBondContact O-N 2.95Å; A82-T85 PolarHBondContact O-N 3.35Å; A82-E86 PolarHBondContact O-N 3.24Å
83E64Low60.8Low101 Ų10169.8 Ų69.847%0.47238%0.381SS..Hα-helixtrans-61.2-42.1176.9-173179.517400111.9R79 H81 E86 N87R79-E83 PolarHBondContact O-N 3.26Å; H81-E83 VanDerWaalsContact C-N 3.34Å; E83-E86 PolarHBondContact O-N 2.99Å; E83-N87 VanDerWaalsContact O-CG 3.29Å; E83-N87 PolarHBondContact O-N 2.99Å; E83-N87 PolarHBondContact O-ND2 2.82Å
84L63.5Low61.8Low26 Ų2671.2 Ų71.214%0.13637%0.369CS..Hα-helixtrans-70.9-33.9178.3-170.448.9000112.1Y60 I64 L80 H81 A82 N87 V88Y60-L84 HydrophobicContact CD1-CD1 4.19Å; Y60-L84 HydrophobicContact CG-CD1 4.44Å; I64-L84 HydrophobicContact CB-CD2 4.31Å; I64-L84 HydrophobicContact CD1-CB 4.5Å; I64-L84 HydrophobicContact CD1-CD1 4.5Å; I64-L84 HydrophobicContact CD1-CD2 4.04Å; I64-L84 HydrophobicContact CD1-CG 3.63Å; I64-L84 HydrophobicContact CG1-CB 4.26Å; I64-L84 HydrophobicContact CG1-CD1 4.42Å; I64-L84 HydrophobicContact CG1-CD2 3.16Å; I64-L84 HydrophobicContact CG1-CG 3.34Å; L80-L84 WeakPolarHBondContact O-CB 3.3Å; L80-L84 PolarHBondContact O-N 2.79Å; H81-L84 PolarHBondContact O-N 3.16Å; A82-L84 VanDerWaalsContact C-N 3.34Å; A82-L84 PolarHBondContact O-N 2.95Å; L84-N87 PolarHBondContact O-N 2.67Å; L84-V88 WeakPolarHBondContact O-CB 3.49Å; L84-V88 VanDerWaalsContact O-CG2 3.23Å; L84-V88 WeakPolarHBondContact O-CG2 3.12Å; L84-V88 PolarHBondContact O-N 3.42Å
85T62.5Low62.1Low50 Ų5068.4 Ų68.431%0.30735%0.354SS..Hα-helixtrans-65.9-41.7174.4-56.90000110.8H81 A82 V88 T89H81-T85 VanDerWaalsContact O-CB 3.28Å; H81-T85 WeakPolarHBondContact O-CB 3.28Å; H81-T85 PolarHBondContact O-N 3.33Å; H81-T85 PolarHBondContact O-OG1 3.02Å; A82-T85 PolarHBondContact O-N 3.35Å; T85-V88 WeakPolarHBondContact O-CB 3.37Å; T85-V88 PolarHBondContact O-N 3.36Å; T85-T89 WeakPolarHBondContact O-CG2 3.36Å; T85-T89 PolarHBondContact O-N 3.29Å
86E65.9Low62.7Low125 Ų12566.7 Ų66.758%0.58434%0.339SS*.Hα-helixtrans-63.1-44.9174.3-174.8177.4-17700111.5A82 E83 V88 T89 V90A82-E86 PolarHBondContact O-N 3.24Å; E83-E86 PolarHBondContact O-N 2.99Å; E86-V88 VanDerWaalsContact C-N 3.25Å; E86-V88 PolarHBondContact O-N 3.17Å; E86-T89 PolarHBondContact O-N 3.35Å; E86-T89 VanDerWaalsContact O-N 3.12Å; E86-T89 PolarHBondContact O-OG1 3.07Å; E86-V90 WeakPolarHBondContact O-CG2 3.45Å; E86-V90 PolarHBondContact O-N 3.29Å
87N63.9Low63.4Low91 Ų9167.5 Ų67.549%0.48734%0.34SS..Hα-helixtrans-60.3-37.7174.3-72.4-28.9000112.1E83 L84 L91E83-N87 VanDerWaalsContact O-CG 3.29Å; E83-N87 PolarHBondContact O-N 2.99Å; E83-N87 PolarHBondContact O-ND2 2.82Å; L84-N87 PolarHBondContact O-N 2.67Å; N87-L91 WeakPolarHBondContact O-CB 3.22Å; N87-L91 PolarHBondContact O-N 2.68Å
88V64.3Low63.9Low4 Ų465.4 Ų65.42%0.02433%0.332CS..Hα-helixtrans-67.3-40.4174.3163.80000111.7L57 I64 L84 T85 E86 L91 I92 R157L57-V88 HydrophobicContact CD1-CB 3.98Å; L57-V88 HydrophobicContact CD1-CG1 3.74Å; L57-V88 HydrophobicContact CD1-CG2 3.61Å; I64-V88 HydrophobicContact CD1-CG2 3.79Å; L84-V88 WeakPolarHBondContact O-CB 3.49Å; L84-V88 VanDerWaalsContact O-CG2 3.23Å; L84-V88 WeakPolarHBondContact O-CG2 3.12Å; L84-V88 PolarHBondContact O-N 3.42Å; T85-V88 WeakPolarHBondContact O-CB 3.37Å; T85-V88 PolarHBondContact O-N 3.36Å; E86-V88 VanDerWaalsContact C-N 3.25Å; E86-V88 PolarHBondContact O-N 3.17Å; V88-L91 PolarHBondContact O-N 3.39Å; V88-I92 HydrophobicContact CG1-CD1 3.72Å; V88-I92 HydrophobicContact CG1-CG1 4.31Å; V88-I92 WeakPolarHBondContact O-CB 3.47Å; V88-I92 VanDerWaalsContact O-CG1 3.3Å; V88-I92 WeakPolarHBondContact O-CG1 3.29Å; V88-I92 PolarHBondContact O-N 3.37Å; V88-R157 HydrophobicContact CG1-CG 4.04Å
89T67.3Low64.4Low34 Ų3462.3 Ų62.321%0.20932%0.319CS..Hα-helixtrans-63.6-46.9178.362.40000111.1T85 E86 L91 I92 E93T85-T89 WeakPolarHBondContact O-CG2 3.36Å; T85-T89 PolarHBondContact O-N 3.29Å; E86-T89 PolarHBondContact O-N 3.35Å; E86-T89 VanDerWaalsContact O-N 3.12Å; E86-T89 PolarHBondContact O-OG1 3.07Å; T89-L91 VanDerWaalsContact C-N 3.28Å; T89-L91 PolarHBondContact O-N 2.83Å; T89-I92 PolarHBondContact O-N 2.83Å; T89-E93 WeakPolarHBondContact O-CB 3.12Å; T89-E93 WeakPolarHBondContact O-CG 3.32Å; T89-E93 PolarHBondContact O-N 2.82Å
90V67.4Low65Low63 Ų6356 Ų5638%0.38231%0.307SS..Hα-helixtrans-59.8-41.6177174.60000110.5E86 E93 Q94E86-V90 WeakPolarHBondContact O-CG2 3.45Å; E86-V90 PolarHBondContact O-N 3.29Å; V90-E93 PolarHBondContact O-N 3.43Å; V90-Q94 WeakPolarHBondContact O-CB 3.4Å; V90-Q94 VanDerWaalsContact O-CG 3.26Å; V90-Q94 WeakPolarHBondContact O-CG 3.35Å; V90-Q94 PolarHBondContact O-N 3.19Å
91L63Low65.5Low23 Ų2355.7 Ų55.712%0.1230%0.303CS..Hα-helixtrans-70.6-38.2179.8-17055.9000112.6V56 L57 Y60 N87 V88 T89 Q94 C95V56-L91 HydrophobicContact CG1-CD2 4.45Å; L57-L91 HydrophobicContact CB-CD2 3.55Å; L57-L91 HydrophobicContact CB-CG 4.19Å; L57-L91 HydrophobicContact CD1-CB 4.47Å; L57-L91 HydrophobicContact CD1-CD2 3.98Å; L57-L91 HydrophobicContact CD1-CG 4.47Å; L57-L91 HydrophobicContact CD2-CG 4.36Å; L57-L91 HydrophobicContact CG-CD2 4.18Å; Y60-L91 HydrophobicContact CD2-CD2 4.39Å; N87-L91 WeakPolarHBondContact O-CB 3.22Å; N87-L91 PolarHBondContact O-N 2.68Å; V88-L91 PolarHBondContact O-N 3.39Å; T89-L91 VanDerWaalsContact C-N 3.28Å; T89-L91 PolarHBondContact O-N 2.83Å; L91-Q94 PolarHBondContact O-N 2.85Å; L91-C95 WeakPolarHBondContact O-CB 3.39Å; L91-C95 PolarHBondContact O-N 3.31Å; L91-C95 PolarHBondContact O-SG 3.31Å
92I64.3Low66.1Low16 Ų1655.2 Ų55.28%0.08230%0.301CS..Hα-helixtrans-62.5-46172.2-70.7170.2000109.8L57 V88 T89 Q94 C95 T96 K154 R157L57-I92 HydrophobicContact CD2-CD1 4.44Å; L57-I92 HydrophobicContact CD2-CG1 3.57Å; V88-I92 HydrophobicContact CG1-CD1 3.72Å; V88-I92 HydrophobicContact CG1-CG1 4.31Å; V88-I92 WeakPolarHBondContact O-CB 3.47Å; V88-I92 VanDerWaalsContact O-CG1 3.3Å; V88-I92 WeakPolarHBondContact O-CG1 3.29Å; V88-I92 PolarHBondContact O-N 3.37Å; T89-I92 PolarHBondContact O-N 2.83Å; I92-Q94 PolarHBondContact O-N 3.42Å; I92-C95 CarbonylContact O-C 3.59Å; I92-C95 PolarHBondContact O-N 3.01Å; I92-C95 VanDerWaalsContact O-N 3.16Å; I92-T96 HydrophobicContact CG2-CG2 4.23Å; I92-T96 WeakPolarHBondContact O-CG2 3.17Å; I92-T96 PolarHBondContact O-N 3.15Å; I92-T96 PolarHBondContact O-OG1 2.83Å; I92-K154 HydrophobicContact CG2-CG 4.16Å; I92-R157 HydrophobicContact CD1-CB 4.15Å; I92-R157 HydrophobicContact CD1-CG 3.84Å
93E68.5Low66.5Low123 Ų12357.6 Ų57.658%0.57530%0.3SS*.Hα-helixtrans-57.9-47.5176.3-75.9172-165.700111.2T89 V90 C95 T96 L97T89-E93 WeakPolarHBondContact O-CB 3.12Å; T89-E93 WeakPolarHBondContact O-CG 3.32Å; T89-E93 PolarHBondContact O-N 2.82Å; V90-E93 PolarHBondContact O-N 3.43Å; E93-C95 VanDerWaalsContact C-N 3.34Å; E93-C95 PolarHBondContact O-N 3.19Å; E93-T96 WeakPolarHBondContact CA-OG1 3.41Å; E93-T96 PolarHBondContact O-N 2.99Å; E93-T96 PolarHBondContact O-OG1 3.34Å; E93-L97 WeakPolarHBondContact O-CB 3.39Å; E93-L97 PolarHBondContact O-N 3.05Å
94Q69.5Low66.8Low101 Ų10157.7 Ų57.747%0.47230%0.303SS..Hα-helixtrans-58.1-43.8173.9-73.11749.900112.3V90 L91 I92 L97 L98V90-Q94 WeakPolarHBondContact O-CB 3.4Å; V90-Q94 VanDerWaalsContact O-CG 3.26Å; V90-Q94 WeakPolarHBondContact O-CG 3.35Å; V90-Q94 PolarHBondContact O-N 3.19Å; L91-Q94 PolarHBondContact O-N 2.85Å; I92-Q94 PolarHBondContact O-N 3.42Å; Q94-L97 PolarHBondContact O-N 3.19Å; Q94-L98 WeakPolarHBondContact O-CB 3.48Å; Q94-L98 WeakPolarHBondContact O-CG 3.39Å; Q94-L98 PolarHBondContact O-N 3.38Å
95C61.2Low66.9Low1 Ų157.3 Ų57.31%0.00730%0.302CS..Hα-helixtrans-66.3-39.2177.4-67.90000112L91 I92 E93 L98 L99 L150L91-C95 WeakPolarHBondContact O-CB 3.39Å; L91-C95 PolarHBondContact O-N 3.31Å; L91-C95 PolarHBondContact O-SG 3.31Å; I92-C95 CarbonylContact O-C 3.59Å; I92-C95 PolarHBondContact O-N 3.01Å; I92-C95 VanDerWaalsContact O-N 3.16Å; E93-C95 VanDerWaalsContact C-N 3.34Å; E93-C95 PolarHBondContact O-N 3.19Å; C95-L98 PolarHBondContact O-N 3.12Å; C95-L99 PolarHBondContact O-N 3.01Å; C95-L150 HydrophobicContact CB-CD1 3.72Å; C95-L150 HydrophobicContact CB-CD2 4.36Å
96T69.7Low67.1Low52 Ų5255.5 Ų55.532%0.31929%0.29SS..Hα-helixtrans-65.5-39175.358.80000111.9I92 E93 L99 A100 L150I92-T96 HydrophobicContact CG2-CG2 4.23Å; I92-T96 WeakPolarHBondContact O-CG2 3.17Å; I92-T96 PolarHBondContact O-N 3.15Å; I92-T96 PolarHBondContact O-OG1 2.83Å; E93-T96 WeakPolarHBondContact CA-OG1 3.41Å; E93-T96 PolarHBondContact O-N 2.99Å; E93-T96 PolarHBondContact O-OG1 3.34Å; T96-L99 PolarHBondContact O-N 3.42Å; T96-A100 WeakPolarHBondContact O-CB 3.48Å; T96-A100 PolarHBondContact O-N 2.83Å; T96-L150 HydrophobicContact CG2-CD2 3.74Å
97L71.1Confident66.9Low97 Ų9753.8 Ų53.851%0.50828%0.282SS..Hα-helixtrans-64-48.6174.6-172.5156.3000109.8E93 Q94 L99 A100 Q101E93-L97 WeakPolarHBondContact O-CB 3.39Å; E93-L97 PolarHBondContact O-N 3.05Å; Q94-L97 PolarHBondContact O-N 3.19Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 2.78Å; L97-A100 WeakPolarHBondContact O-CB 3.48Å; L97-A100 PolarHBondContact O-N 2.76Å; L97-Q101 VanDerWaalsContact CD2-CD 3.43Å; L97-Q101 HydrophobicContact CD2-CG 3.71Å; L97-Q101 WeakPolarHBondContact O-CG 3.28Å; L97-Q101 PolarHBondContact O-N 3.35Å
98L67.8Low67.2Low30 Ų3051.8 Ų51.816%0.15727%0.273CS..Hα-helixtrans-59.9-39.2177.5-77.5175000112.1R46 L50 Q94 C95 L102R46-L98 HydrophobicContact CG-CD2 3.98Å; R46-L98 PolarHBondContact NH2-O 3.25Å; L50-L98 HydrophobicContact CB-CD1 4.29Å; L50-L98 HydrophobicContact CD1-CB 3.66Å; Q94-L98 WeakPolarHBondContact O-CB 3.48Å; Q94-L98 WeakPolarHBondContact O-CG 3.39Å; Q94-L98 PolarHBondContact O-N 3.38Å; C95-L98 PolarHBondContact O-N 3.12Å; L98-L102 WeakPolarHBondContact O-CB 3.44Å; L98-L102 VanDerWaalsContact O-CG 3.28Å; L98-L102 WeakPolarHBondContact O-CG 3.19Å; L98-L102 PolarHBondContact O-N 2.86Å
99L66Low67.1Low14 Ų1452.7 Ų52.77%0.07328%0.278CS..Hα-helixtrans-62.4-44.9170.7-77.8-173.3000112L50 C95 T96 L97 Q101 L102 K103 L146 L150L50-L99 HydrophobicContact CD1-CD2 3.74Å; L50-L99 HydrophobicContact CD1-CG 3.79Å; C95-L99 PolarHBondContact O-N 3.01Å; T96-L99 PolarHBondContact O-N 3.42Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 2.78Å; L99-Q101 PolarHBondContact O-N 3.19Å; L99-L102 WeakPolarHBondContact O-CB 3.34Å; L99-L102 PolarHBondContact O-N 2.71Å; L99-L102 VanDerWaalsContact O-N 3.08Å; L99-K103 WeakPolarHBondContact O-CB 3.24Å; L99-K103 PolarHBondContact O-N 2.93Å; L99-L146 HydrophobicContact CD2-CB 3.97Å; L99-L150 HydrophobicContact CD1-CB 4.04Å; L99-L150 HydrophobicContact CD1-CD2 3.26Å; L99-L150 HydrophobicContact CD1-CG 4.26Å; L99-L150 HydrophobicContact CG-CD2 4.1Å
100A70Confident67Low59 Ų5956 Ų5649%0.48829%0.29SS..Hα-helixtrans-59.1-46.9-179.600000111.7T96 L97 L102 K103 D104T96-A100 WeakPolarHBondContact O-CB 3.48Å; T96-A100 PolarHBondContact O-N 2.83Å; L97-A100 WeakPolarHBondContact O-CB 3.48Å; L97-A100 PolarHBondContact O-N 2.76Å; A100-L102 VanDerWaalsContact C-N 3.31Å; A100-L102 PolarHBondContact O-N 3.31Å; A100-K103 WeakPolarHBondContact O-CB 3.47Å; A100-K103 PolarHBondContact O-N 3.13Å; A100-D104 PolarHBondContact O-N 3.16Å
101Q70.3Confident66.8Low87 Ų8756.9 Ų56.941%0.40729%0.293SS..Hα-helixtrans-78.8-10.4177.821.2149.2-93.600113.3R46 L97 L99 L105R46-Q101 VanDerWaalsContact CZ-CB 3.49Å; R46-Q101 VanDerWaalsContact CZ-CD 3.42Å; R46-Q101 VanDerWaalsContact NE-OE1 3.11Å; R46-Q101 VanDerWaalsContact NH1-CB 3.34Å; R46-Q101 PolarHBondContact NH1-O 3.1Å; R46-Q101 VanDerWaalsContact NH1-O 3.1Å; L97-Q101 VanDerWaalsContact CD2-CD 3.43Å; L97-Q101 HydrophobicContact CD2-CG 3.71Å; L97-Q101 WeakPolarHBondContact O-CG 3.28Å; L97-Q101 PolarHBondContact O-N 3.35Å; L99-Q101 PolarHBondContact O-N 3.19Å; Q101-L105 PolarHBondContact O-N 3.05Å
102L64.8Low66.6Low0 Ų060.7 Ų60.70%031%0.312CS..Hα-helixtrans-78.4-41.2165.4-78.3170.8000110.5F43 R46 L50 L98 L99 A100 D104 L105 I106F43-L102 HydrophobicContact CD2-CD2 3.64Å; F43-L102 HydrophobicContact CE2-CD2 3.67Å; F43-L102 HydrophobicContact CG-CD2 4.33Å; F43-L102 HydrophobicContact CZ-CD2 4.39Å; R46-L102 HydrophobicContact CB-CD2 4.16Å; R46-L102 HydrophobicContact CG-CD2 4.07Å; R46-L102 HydrophobicContact CG-CG 4.36Å; R46-L102 VanDerWaalsContact NH2-N 3.15Å; L50-L102 HydrophobicContact CD1-CD1 4.38Å; L98-L102 WeakPolarHBondContact O-CB 3.44Å; L98-L102 VanDerWaalsContact O-CG 3.28Å; L98-L102 WeakPolarHBondContact O-CG 3.19Å; L98-L102 PolarHBondContact O-N 2.86Å; L99-L102 WeakPolarHBondContact O-CB 3.34Å; L99-L102 PolarHBondContact O-N 2.71Å; L99-L102 VanDerWaalsContact O-N 3.08Å; A100-L102 VanDerWaalsContact C-N 3.31Å; A100-L102 PolarHBondContact O-N 3.31Å; L102-D104 VanDerWaalsContact C-N 3.3Å; L102-D104 PolarHBondContact O-N 3.12Å; L102-L105 WeakPolarHBondContact O-CB 3.26Å; L102-L105 PolarHBondContact O-N 2.98Å; L102-I106 WeakPolarHBondContact O-CG1 3.48Å; L102-I106 PolarHBondContact O-N 3.42Å
103K70.9Confident66.5Low112 Ų11261 Ų6149%0.48732%0.315SS..Hα-helixtrans-57.7-44.8172.1-176.3-177.3173.6-174.90110.9L99 A100 L105 I106 H107L99-K103 WeakPolarHBondContact O-CB 3.24Å; L99-K103 PolarHBondContact O-N 2.93Å; A100-K103 WeakPolarHBondContact O-CB 3.47Å; A100-K103 PolarHBondContact O-N 3.13Å; K103-L105 VanDerWaalsContact C-N 3.34Å; K103-L105 PolarHBondContact O-N 2.69Å; K103-I106 PolarHBondContact O-N 3.3Å; K103-H107 WeakPolarHBondContact CE-NE2 3.39Å; K103-H107 PolarHBondContact O-CD2 3.28Å; K103-H107 PolarHBondContact O-N 3.03Å
104D70.5Confident66Low103 Ų10360.6 Ų60.655%0.55131%0.312SS*.Hα-helixtrans-62.7-39.7176.3-165.739.1000112.4A100 L102 I106 H107 T108A100-D104 PolarHBondContact O-N 3.16Å; L102-D104 VanDerWaalsContact C-N 3.3Å; L102-D104 PolarHBondContact O-N 3.12Å; D104-I106 VanDerWaalsContact C-N 3.31Å; D104-I106 PolarHBondContact O-N 3.49Å; D104-H107 PolarHBondContact O-N 2.8Å; D104-T108 WeakPolarHBondContact O-CB 3.44Å; D104-T108 PolarHBondContact O-N 3.29Å; D104-T108 PolarHBondContact O-OG1 3.47Å
105L66.2Low65.4Low19 Ų1959.8 Ų59.810%0.09931%0.314CS..Hα-helixtrans-63.5-37.1175-157.965.2000112.2Y39 F43 Q101 L102 K103 T109Y39-L105 HydrophobicContact CD1-CD1 3.99Å; Y39-L105 HydrophobicContact CD1-CG 4.45Å; Y39-L105 HydrophobicContact CE1-CD1 3.1Å; Y39-L105 HydrophobicContact CE1-CG 3.85Å; Y39-L105 HydrophobicContact CE2-CD1 4.46Å; Y39-L105 VanDerWaalsContact OH-CD1 3.28Å; Y39-L105 WeakPolarHBondContact OH-CD1 3.39Å; F43-L105 HydrophobicContact CB-CD2 3.68Å; F43-L105 HydrophobicContact CD2-CD2 3.91Å; F43-L105 HydrophobicContact CG-CD2 4.29Å; Q101-L105 PolarHBondContact O-N 3.05Å; L102-L105 WeakPolarHBondContact O-CB 3.26Å; L102-L105 PolarHBondContact O-N 2.98Å; K103-L105 VanDerWaalsContact C-N 3.34Å; K103-L105 PolarHBondContact O-N 2.69Å; L105-T109 WeakPolarHBondContact O-CB 3.37Å; L105-T109 PolarHBondContact O-N 3.1Å; L105-T109 PolarHBondContact O-OG1 3.42Å
106I66.2Low65Low11 Ų1162.1 Ų62.16%0.05633%0.326CS..Hα-helixtrans-69.7-43175.3-67.6166.1000111.1F43 L102 K103 D104 T109 K110 R139 L140 H143F43-I106 HydrophobicContact CE2-CD1 4.03Å; F43-I106 HydrophobicContact CE2-CG1 3.95Å; L102-I106 WeakPolarHBondContact O-CG1 3.48Å; L102-I106 PolarHBondContact O-N 3.42Å; K103-I106 PolarHBondContact O-N 3.3Å; D104-I106 VanDerWaalsContact C-N 3.31Å; D104-I106 PolarHBondContact O-N 3.49Å; I106-T109 WeakPolarHBondContact O-CB 3.4Å; I106-T109 PolarHBondContact O-N 2.78Å; I106-K110 PolarHBondContact O-N 3.14Å; I106-R139 HydrophobicContact CD1-CB 4.49Å; I106-R139 HydrophobicContact CG1-CB 4.25Å; I106-L140 HydrophobicContact CG2-CD2 3.7Å; I106-L140 HydrophobicContact CG2-CG 3.95Å; I106-H143 HydrophobicContact CD1-CB 3.53Å
107H63.1Low64.4Low90 Ų9064.9 Ų64.942%0.41734%0.335SS..Hα-helixtrans-61.8-45.5175-77.4-65.7000111.5K103 D104 T109 K110 D111K103-H107 WeakPolarHBondContact CE-NE2 3.39Å; K103-H107 PolarHBondContact O-CD2 3.28Å; K103-H107 PolarHBondContact O-N 3.03Å; D104-H107 PolarHBondContact O-N 2.8Å; H107-T109 VanDerWaalsContact C-N 3.29Å; H107-T109 PolarHBondContact O-N 2.99Å; H107-K110 WeakPolarHBondContact O-CB 3.38Å; H107-K110 PolarHBondContact O-N 3.42Å; H107-D111 PolarHBondContact O-N 3.45Å
108T68.6Low63.6Low48 Ų4864.4 Ų64.429%0.29434%0.34SS..Hα-helixtrans-57.1-43.2173.7-56.50000111.3D104 K110 D111 I112D104-T108 WeakPolarHBondContact O-CB 3.44Å; D104-T108 PolarHBondContact O-N 3.29Å; D104-T108 PolarHBondContact O-OG1 3.47Å; T108-K110 VanDerWaalsContact C-N 3.34Å; T108-K110 PolarHBondContact O-N 3.12Å; T108-D111 PolarHBondContact O-N 3.06Å; T108-I112 HydrophobicContact CG2-CD1 4.16Å; T108-I112 WeakPolarHBondContact O-CD1 3.41Å; T108-I112 VanDerWaalsContact O-CG1 3.28Å; T108-I112 WeakPolarHBondContact O-CG1 3.24Å; T108-I112 PolarHBondContact O-N 3.22Å; T108-I112 VanDerWaalsContact O-N 3.12Å
109T63.5Low62.9Low23 Ų2368.5 Ų68.514%0.14136%0.361CS..Hα-helixtrans-63.1-39.2176.3-530000111.9L105 I106 H107 S113 I136 R139L105-T109 WeakPolarHBondContact O-CB 3.37Å; L105-T109 PolarHBondContact O-N 3.1Å; L105-T109 PolarHBondContact O-OG1 3.42Å; I106-T109 WeakPolarHBondContact O-CB 3.4Å; I106-T109 PolarHBondContact O-N 2.78Å; H107-T109 VanDerWaalsContact C-N 3.29Å; H107-T109 PolarHBondContact O-N 2.99Å; T109-S113 PolarHBondContact O-N 2.99Å; T109-S113 VanDerWaalsContact O-N 3.16Å; T109-I136 HydrophobicContact CG2-CD1 4.3Å; T109-I136 HydrophobicContact CG2-CG1 3.78Å; T109-R139 PolarHBondContact OG1-NH1 3Å
110K65.5Low62.2Low103 Ų10370.7 Ų70.745%0.44838%0.375SS..Hα-helixtrans-70.9-35.8179.3-174178.9-176.6176.60112.8I106 H107 T108 S113 K114I106-K110 PolarHBondContact O-N 3.14Å; H107-K110 WeakPolarHBondContact O-CB 3.38Å; H107-K110 PolarHBondContact O-N 3.42Å; T108-K110 VanDerWaalsContact C-N 3.34Å; T108-K110 PolarHBondContact O-N 3.12Å; K110-S113 PolarHBondContact O-N 2.78Å; K110-S113 PolarHBondContact O-OG 3.25Å; K110-K114 WeakPolarHBondContact O-CG 3.49Å; K110-K114 PolarHBondContact O-N 3.18Å; K110-K114 VanDerWaalsContact O-N 3.17Å
111D63.1Low61.3Low83 Ų8373 Ų7344%0.44439%0.387SS..Hα-helixtrans-71.9-38.2177.9-68.8-30.7000111H107 T108 S113 K114 V115H107-D111 PolarHBondContact O-N 3.45Å; T108-D111 PolarHBondContact O-N 3.06Å; D111-S113 VanDerWaalsContact C-N 3.32Å; D111-S113 PolarHBondContact O-N 2.84Å; D111-K114 PolarHBondContact O-N 2.64Å; D111-K114 IonicContact OD1-NZ 3.67Å; D111-V115 WeakPolarHBondContact O-CG2 3.33Å; D111-V115 PolarHBondContact O-N 2.77Å; D111-V115 VanDerWaalsContact O-N 3.1Å
112I58.9Low60.6Low103 Ų10375.4 Ų75.453%0.52840%0.402SS..Hα-helixtrans-57.9-44.4170.4-66164.9000110.7T108 K114 V115 D116T108-I112 HydrophobicContact CG2-CD1 4.16Å; T108-I112 WeakPolarHBondContact O-CD1 3.41Å; T108-I112 VanDerWaalsContact O-CG1 3.28Å; T108-I112 WeakPolarHBondContact O-CG1 3.24Å; T108-I112 PolarHBondContact O-N 3.22Å; T108-I112 VanDerWaalsContact O-N 3.12Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 2.88Å; I112-V115 PolarHBondContact O-N 3.25Å; I112-D116 WeakPolarHBondContact O-CB 3.24Å; I112-D116 PolarHBondContact O-N 3.33Å
113S60.9Low60Low21 Ų2182.5 Ų82.515%0.14744%0.435CS..Hα-helixtrans-66.4-33.4-179.673.60000113.5T109 K110 D111 D116 Q117T109-S113 PolarHBondContact O-N 2.99Å; T109-S113 VanDerWaalsContact O-N 3.16Å; K110-S113 PolarHBondContact O-N 2.78Å; K110-S113 PolarHBondContact O-OG 3.25Å; D111-S113 VanDerWaalsContact C-N 3.32Å; D111-S113 PolarHBondContact O-N 2.84Å; S113-D116 PolarHBondContact O-N 3.37Å; S113-Q117 WeakPolarHBondContact O-CG 3.29Å; S113-Q117 PolarHBondContact O-N 3.26Å
114K59.5Low59.2Low116 Ų11684 Ų8450%0.50445%0.448SS..Hα-helixtrans-67.2-41.9174.6-73.1176.8-177.8171.60111.8K110 D111 I112 D116 S118K110-K114 WeakPolarHBondContact O-CG 3.49Å; K110-K114 PolarHBondContact O-N 3.18Å; K110-K114 VanDerWaalsContact O-N 3.17Å; D111-K114 PolarHBondContact O-N 2.64Å; D111-K114 IonicContact OD1-NZ 3.67Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 2.88Å; K114-D116 VanDerWaalsContact C-N 3.34Å; K114-S118 PolarHBondContact O-N 3.24Å
115V56Low58.5Low84 Ų8482.1 Ų82.151%0.50944%0.438SS..Hα-helixtrans-64.7-42.3175.3175.50000110.1D111 I112 Q117 S118 I119D111-V115 WeakPolarHBondContact O-CG2 3.33Å; D111-V115 PolarHBondContact O-N 2.77Å; D111-V115 VanDerWaalsContact O-N 3.1Å; I112-V115 PolarHBondContact O-N 3.25Å; V115-Q117 PolarHBondContact O-N 3.37Å; V115-S118 PolarHBondContact O-N 3.39Å; V115-S118 VanDerWaalsContact O-N 3.07Å; V115-S118 PolarHBondContact O-OG 3.14Å; V115-I119 HydrophobicContact CG1-CD1 3.93Å; V115-I119 PolarHBondContact O-N 3.36Å
116D53Low58.2Low50 Ų5086 Ų8627%0.26747%0.467SS..Hα-helixtrans-64.6-40-179.4-147.325.4000112I112 S113 K114 S118 I119 T120 K132I112-D116 WeakPolarHBondContact O-CB 3.24Å; I112-D116 PolarHBondContact O-N 3.33Å; S113-D116 PolarHBondContact O-N 3.37Å; K114-D116 VanDerWaalsContact C-N 3.34Å; D116-S118 PolarHBondContact O-N 3.03Å; D116-I119 PolarHBondContact O-N 3.4Å; D116-I119 VanDerWaalsContact O-N 3.13Å; D116-T120 WeakPolarHBondContact O-CB 3.33Å; D116-T120 PolarHBondContact O-N 3.28Å; D116-T120 PolarHBondContact O-OG1 2.74Å; D116-K132 IonicContact OD2-NZ 3.07Å; D116-K132 PolarHBondContact OD2-NZ 3.03Å
117Q55.8Low58Low109 Ų10991.4 Ų91.451%0.50950%0.496SS..Hα-helixtrans-61.1-32.2172.7-76.7174.6500112.9S113 V115S113-Q117 WeakPolarHBondContact O-CG 3.29Å; S113-Q117 PolarHBondContact O-N 3.26Å; V115-Q117 PolarHBondContact O-N 3.37Å
118S54.3Low58Low88 Ų8891.5 Ų91.562%0.61550%0.498SS*.Hα-helixtrans-75.4-24.6176.365.20000113.5K114 V115 D116K114-S118 PolarHBondContact O-N 3.24Å; V115-S118 PolarHBondContact O-N 3.39Å; V115-S118 VanDerWaalsContact O-N 3.07Å; V115-S118 PolarHBondContact O-OG 3.14Å; D116-S118 PolarHBondContact O-N 3.03Å
119I54.1Low57.7Low116 Ų11691.2 Ų91.260%0.59550%0.498SS*.Hα-helixtrans-91-32.9-179.9-63171.9000111.4V115 D116 S121V115-I119 HydrophobicContact CG1-CD1 3.93Å; V115-I119 PolarHBondContact O-N 3.36Å; D116-I119 PolarHBondContact O-N 3.4Å; D116-I119 VanDerWaalsContact O-N 3.13Å; I119-S121 VanDerWaalsContact C-N 3.33Å; I119-S121 PolarHBondContact O-N 3.39Å; I119-S121 VanDerWaalsContact O-N 3.11Å
120T50.4Low57.9Low59 Ų5994.6 Ų94.636%0.36252%0.516SS..  trans-90.859.6-174.8510000112.6D116D116-T120 WeakPolarHBondContact O-CB 3.33Å; D116-T120 PolarHBondContact O-N 3.28Å; D116-T120 PolarHBondContact O-OG1 2.74Å
121S52.2Low58.3Low107 Ų10794.6 Ų94.675%0.74852%0.52SS*.  trans-86.17.616559.50000113I119I119-S121 VanDerWaalsContact C-N 3.33Å; I119-S121 PolarHBondContact O-N 3.39Å; I119-S121 VanDerWaalsContact O-N 3.11Å
122I54.8Low58.9Low139 Ų13994.4 Ų94.471%0.71352%0.516SS*.SBendtrans-131.5101.2-170.4-49.7177.5000109.1
123H53.2Low59.5Low149 Ų14992.2 Ų92.269%0.6951%0.505SS*.SBendtrans82.3119.8157.9-138-0.3000119D125H123-D125 VanDerWaalsContact C-N 3.31Å; H123-D125 PolarHBondContact O-N 3.12Å
124D54Low60.1Low142 Ų14297.2 Ų97.276%0.75953%0.526SS*.SBendtrans46.117153.1-62.45000121.8S126D124-S126 PolarHBondContact O-N 2.86Å
125D54.6Low60.7Low64 Ų6494 Ų9434%0.34251%0.514SS..THydrogen-bonded Turntrans-8510.3-177.5-85.4-23.7000116.3H123 N127 I128 S129H123-D125 VanDerWaalsContact C-N 3.31Å; H123-D125 PolarHBondContact O-N 3.12Å; D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 2.77Å; D125-N127 VanDerWaalsContact O-N 3.16Å; D125-I128 PolarHBondContact O-N 2.96Å; D125-I128 VanDerWaalsContact O-N 3.13Å; D125-S129 WeakPolarHBondContact O-CB 3.25Å; D125-S129 PolarHBondContact O-N 3Å
126S60Low61.6Low102 Ų10290.9 Ų90.971%0.71349%0.494SS*.Hα-helixtrans-56.2-39.3-173.966.10000113D124 N130D124-S126 PolarHBondContact O-N 2.86Å; S126-N130 WeakPolarHBondContact O-CB 3.5Å; S126-N130 PolarHBondContact O-N 3.06Å
127N62.9Low62.6Low124 Ų12493.8 Ų93.866%0.66351%0.509SS*.Hα-helixtrans-73.5-38.2-179.3-154.28.4000112.3D125 N130 N131D125-N127 VanDerWaalsContact C-N 3.26Å; D125-N127 PolarHBondContact O-N 2.77Å; D125-N127 VanDerWaalsContact O-N 3.16Å; N127-N130 PolarHBondContact O-N 3.01Å; N127-N131 PolarHBondContact O-N 2.92Å
128I62.2Low63.4Low91 Ų9193.3 Ų93.347%0.46751%0.507SS..Hα-helixtrans-68.3-44.4177.3-64179.5000110.3D125 N130 N131 K132D125-I128 PolarHBondContact O-N 2.96Å; D125-I128 VanDerWaalsContact O-N 3.13Å; I128-N130 VanDerWaalsContact C-N 3.31Å; I128-N130 PolarHBondContact O-N 3.3Å; I128-N131 PolarHBondContact O-N 3.44Å; I128-K132 HydrophobicContact CG2-CD 4.17Å; I128-K132 WeakPolarHBondContact O-CG 3.21Å; I128-K132 PolarHBondContact O-N 3.35Å
129S62.1Low64.5Low42 Ų4289.8 Ų89.829%0.29448%0.48SS..Hα-helixtrans-59.9-42.1175.3-173.60000111.4D125 K132 N133D125-S129 WeakPolarHBondContact O-CB 3.25Å; D125-S129 PolarHBondContact O-N 3Å; S129-K132 PolarHBondContact O-N 2.77Å; S129-N133 VanDerWaalsContact O-CG 3.23Å; S129-N133 PolarHBondContact O-N 2.94Å; S129-N133 PolarHBondContact O-ND2 3.03Å; S129-N133 VanDerWaalsContact O-ND2 3.09Å
130N69.3Low65.4Low95 Ų9588.1 Ų88.151%0.50847%0.472SS..Hα-helixtrans-63.7-45.9177.3-165.828.3000112.5S126 N127 I128 K132 N133 Q134S126-N130 WeakPolarHBondContact O-CB 3.5Å; S126-N130 PolarHBondContact O-N 3.06Å; N127-N130 PolarHBondContact O-N 3.01Å; I128-N130 VanDerWaalsContact C-N 3.31Å; I128-N130 PolarHBondContact O-N 3.3Å; N130-K132 PolarHBondContact O-N 2.95Å; N130-N133 PolarHBondContact O-N 3.44Å; N130-Q134 PolarHBondContact O-N 3.17Å
131N73.5Confident66.6Low103 Ų10388.8 Ų88.855%0.55148%0.476SS*.Hα-helixtrans-62.7-41.3177.1-167.40.4000111.7N127 I128 N133 Q134 L135N127-N131 PolarHBondContact O-N 2.92Å; I128-N131 PolarHBondContact O-N 3.44Å; N131-N133 PolarHBondContact O-N 3.31Å; N131-Q134 PolarHBondContact O-N 3.01Å; N131-L135 PolarHBondContact O-N 3.13Å
132K74.5Confident67.5Low79 Ų7985.2 Ų85.234%0.34345%0.448SS..Hα-helixtrans-58.8-45.4173.1-73.6173.3178.1172.10111.8D116 I128 S129 N130 L135 I136D116-K132 IonicContact OD2-NZ 3.07Å; D116-K132 PolarHBondContact OD2-NZ 3.03Å; I128-K132 HydrophobicContact CG2-CD 4.17Å; I128-K132 WeakPolarHBondContact O-CG 3.21Å; I128-K132 PolarHBondContact O-N 3.35Å; S129-K132 PolarHBondContact O-N 2.77Å; N130-K132 PolarHBondContact O-N 2.95Å; K132-L135 PolarHBondContact O-N 3.2Å; K132-I136 VanDerWaalsContact O-CG1 3.3Å; K132-I136 WeakPolarHBondContact O-CG1 3.39Å; K132-I136 PolarHBondContact O-N 2.6Å
133N72.2Confident68.3Low57 Ų5780.1 Ų80.131%0.30542%0.421SS..Hα-helixtrans-63.9-41.6177.3-69.9-34000112S129 N130 N131 L135 I136 L137S129-N133 VanDerWaalsContact O-CG 3.23Å; S129-N133 PolarHBondContact O-N 2.94Å; S129-N133 PolarHBondContact O-ND2 3.03Å; S129-N133 VanDerWaalsContact O-ND2 3.09Å; N130-N133 PolarHBondContact O-N 3.44Å; N131-N133 PolarHBondContact O-N 3.31Å; N133-L135 VanDerWaalsContact C-N 3.35Å; N133-L135 PolarHBondContact O-N 3.33Å; N133-I136 PolarHBondContact O-N 3.35Å; N133-L137 WeakPolarHBondContact O-CG 3.43Å; N133-L137 PolarHBondContact O-N 2.93Å
134Q74Confident69.4Low125 Ų12579.9 Ų79.958%0.58442%0.418SS*.Hα-helixtrans-61.7-42175.1-175178.5-5.100111.7N130 N131 I136 L137 H138N130-Q134 PolarHBondContact O-N 3.17Å; N131-Q134 PolarHBondContact O-N 3.01Å; Q134-I136 PolarHBondContact O-N 2.79Å; Q134-L137 PolarHBondContact O-N 3.48Å; Q134-H138 WeakPolarHBondContact O-CB 3.42Å; Q134-H138 PolarHBondContact O-N 3.39Å
135L72.7Confident70.4Confident49 Ų4978.3 Ų78.326%0.25741%0.409SS..Hα-helixtrans-63.1-41.6176-175.764.8000111.8N131 K132 N133 H138 R139N131-L135 PolarHBondContact O-N 3.13Å; K132-L135 PolarHBondContact O-N 3.2Å; N133-L135 VanDerWaalsContact C-N 3.35Å; N133-L135 PolarHBondContact O-N 3.33Å; L135-H138 PolarHBondContact O-N 2.72Å; L135-R139 WeakPolarHBondContact O-CB 3.42Å; L135-R139 VanDerWaalsContact O-CG 3.26Å; L135-R139 WeakPolarHBondContact O-CG 3.08Å; L135-R139 PolarHBondContact O-N 3.36Å
136I74.1Confident71.2Confident19 Ų1975.9 Ų75.910%0.09740%0.396CS..Hα-helixtrans-61.9-44.5175.2-67.7164.5000110.5T109 K132 N133 Q134 R139 L140T109-I136 HydrophobicContact CG2-CD1 4.3Å; T109-I136 HydrophobicContact CG2-CG1 3.78Å; K132-I136 VanDerWaalsContact O-CG1 3.3Å; K132-I136 WeakPolarHBondContact O-CG1 3.39Å; K132-I136 PolarHBondContact O-N 2.6Å; N133-I136 PolarHBondContact O-N 3.35Å; Q134-I136 PolarHBondContact O-N 2.79Å; I136-R139 PolarHBondContact O-N 3.43Å; I136-L140 HydrophobicContact CG2-CD1 4.03Å; I136-L140 WeakPolarHBondContact O-CB 3.21Å; I136-L140 WeakPolarHBondContact O-CG 3.47Å; I136-L140 PolarHBondContact O-N 3.38Å
137L74.7Confident72.1Confident110 Ų11072.6 Ų72.658%0.57637%0.373SS*.Hα-helixtrans-62.1-45.4176.1-73.5169.9000111.6N133 Q134 R139 L140 T141N133-L137 WeakPolarHBondContact O-CG 3.43Å; N133-L137 PolarHBondContact O-N 2.93Å; Q134-L137 PolarHBondContact O-N 3.48Å; L137-R139 PolarHBondContact O-N 3.38Å; L137-L140 WeakPolarHBondContact O-CB 3.29Å; L137-L140 PolarHBondContact O-N 2.85Å; L137-T141 WeakPolarHBondContact O-CG2 3.38Å; L137-T141 PolarHBondContact O-N 2.84Å; L137-T141 PolarHBondContact O-OG1 3.13Å
138H72.6Confident72.8Confident99 Ų9972.5 Ų72.546%0.45837%0.369SS..Hα-helixtrans-59-45.8176.7-179.6-115000111.6Q134 L135 L140 T141 I142Q134-H138 WeakPolarHBondContact O-CB 3.42Å; Q134-H138 PolarHBondContact O-N 3.39Å; L135-H138 PolarHBondContact O-N 2.72Å; H138-L140 VanDerWaalsContact C-N 3.34Å; H138-L140 PolarHBondContact O-N 2.84Å; H138-T141 WeakPolarHBondContact CA-OG1 3.49Å; H138-T141 PolarHBondContact O-N 2.63Å; H138-T141 PolarHBondContact O-OG1 2.97Å; H138-I142 WeakPolarHBondContact CE1-CD1 2.89Å; H138-I142 WeakPolarHBondContact O-CG1 3.43Å; H138-I142 PolarHBondContact O-N 2.85Å
139R76.2Confident73.1Confident15 Ų1573.5 Ų73.56%0.05737%0.371CS..Hα-helixtrans-61.5-40.9175.7-70.5176.7-179.9-174.41.9112.3F43 I106 T109 L135 I136 L137 I142 H143F43-R139 HydrophobicContact CD1-CG 3.97Å; F43-R139 HydrophobicContact CD2-CG 4.43Å; F43-R139 HydrophobicContact CE1-CB 4.13Å; F43-R139 HydrophobicContact CE1-CG 3.74Å; F43-R139 HydrophobicContact CE2-CB 4.12Å; F43-R139 HydrophobicContact CE2-CG 4.24Å; F43-R139 HydrophobicContact CG-CG 4.34Å; F43-R139 HydrophobicContact CZ-CB 3.79Å; F43-R139 HydrophobicContact CZ-CG 3.89Å; I106-R139 HydrophobicContact CD1-CB 4.49Å; I106-R139 HydrophobicContact CG1-CB 4.25Å; T109-R139 PolarHBondContact OG1-NH1 3Å; L135-R139 WeakPolarHBondContact O-CB 3.42Å; L135-R139 VanDerWaalsContact O-CG 3.26Å; L135-R139 WeakPolarHBondContact O-CG 3.08Å; L135-R139 PolarHBondContact O-N 3.36Å; I136-R139 PolarHBondContact O-N 3.43Å; L137-R139 PolarHBondContact O-N 3.38Å; R139-I142 PolarHBondContact O-N 3.1Å; R139-H143 WeakPolarHBondContact O-CB 3.35Å; R139-H143 PolarHBondContact O-N 2.84Å
140L74.3Confident73.8Confident80 Ų8071.5 Ų71.542%0.41936%0.358SS..Hα-helixtrans-63.5-42.1173.9-81.2165.7000112I106 I136 L137 H138 H143 K144I106-L140 HydrophobicContact CG2-CD2 3.7Å; I106-L140 HydrophobicContact CG2-CG 3.95Å; I136-L140 HydrophobicContact CG2-CD1 4.03Å; I136-L140 WeakPolarHBondContact O-CB 3.21Å; I136-L140 WeakPolarHBondContact O-CG 3.47Å; I136-L140 PolarHBondContact O-N 3.38Å; L137-L140 WeakPolarHBondContact O-CB 3.29Å; L137-L140 PolarHBondContact O-N 2.85Å; H138-L140 VanDerWaalsContact C-N 3.34Å; H138-L140 PolarHBondContact O-N 2.84Å; L140-H143 PolarHBondContact O-N 3.47Å; L140-K144 WeakPolarHBondContact O-CB 3.37Å; L140-K144 PolarHBondContact O-N 3.17Å
141T73.8Confident74.1Confident74 Ų7470.2 Ų70.245%0.45435%0.351SS..Hα-helixtrans-65.1-43.2177.353.40000112L137 H138 H143 K144 L145L137-T141 WeakPolarHBondContact O-CG2 3.38Å; L137-T141 PolarHBondContact O-N 2.84Å; L137-T141 PolarHBondContact O-OG1 3.13Å; H138-T141 WeakPolarHBondContact CA-OG1 3.49Å; H138-T141 PolarHBondContact O-N 2.63Å; H138-T141 PolarHBondContact O-OG1 2.97Å; T141-H143 PolarHBondContact O-N 2.9Å; T141-K144 PolarHBondContact O-N 3.46Å; T141-L145 WeakPolarHBondContact O-CG 3.19Å; T141-L145 PolarHBondContact O-N 3.35Å
142I71.7Confident73.9Confident31 Ų3168.7 Ų68.716%0.15935%0.348CS..Hα-helixtrans-61-47.5175.2-71.3170.8000110.4F43 A47 H138 R139 K144 L145 L146F43-I142 HydrophobicContact CE1-CD1 4.39Å; F43-I142 HydrophobicContact CE1-CG2 4.4Å; F43-I142 HydrophobicContact CZ-CG2 4.39Å; A47-I142 HydrophobicContact CB-CG2 4.23Å; H138-I142 WeakPolarHBondContact CE1-CD1 2.89Å; H138-I142 WeakPolarHBondContact O-CG1 3.43Å; H138-I142 PolarHBondContact O-N 2.85Å; R139-I142 PolarHBondContact O-N 3.1Å; I142-K144 VanDerWaalsContact C-N 3.3Å; I142-K144 PolarHBondContact O-N 3.4Å; I142-L145 PolarHBondContact O-N 3.25Å; I142-L146 HydrophobicContact CG2-CD1 3.63Å; I142-L146 HydrophobicContact CG2-CG 4.2Å; I142-L146 WeakPolarHBondContact O-CB 3.22Å; I142-L146 WeakPolarHBondContact O-CG 3.31Å; I142-L146 PolarHBondContact O-N 3.08Å
143H72.4Confident73.5Confident33 Ų3365.6 Ų65.615%0.15334%0.335CS..Hα-helixtrans-59.8-41.8177.3176-78.9000111.8I106 R139 L140 T141 L146 S147I106-H143 HydrophobicContact CD1-CB 3.53Å; R139-H143 WeakPolarHBondContact O-CB 3.35Å; R139-H143 PolarHBondContact O-N 2.84Å; L140-H143 PolarHBondContact O-N 3.47Å; T141-H143 PolarHBondContact O-N 2.9Å; H143-L146 PolarHBondContact O-N 3.43Å; H143-S147 VanDerWaalsContact O-CB 3.25Å; H143-S147 WeakPolarHBondContact O-CB 3.49Å; H143-S147 PolarHBondContact O-N 2.94Å
144K76Confident73.7Confident144 Ų14466.3 Ų66.363%0.62634%0.336SS*.Hα-helixtrans-61.5-47.9177.2-173.3-178.9177-174.60111.4L140 T141 I142 S147 E148L140-K144 WeakPolarHBondContact O-CB 3.37Å; L140-K144 PolarHBondContact O-N 3.17Å; T141-K144 PolarHBondContact O-N 3.46Å; I142-K144 VanDerWaalsContact C-N 3.3Å; I142-K144 PolarHBondContact O-N 3.4Å; K144-S147 PolarHBondContact O-N 2.87Å; K144-E148 WeakPolarHBondContact O-CB 3.44Å; K144-E148 PolarHBondContact O-N 2.88Å
145L74.6Confident73.7Confident109 Ų10968 Ų6857%0.57134%0.341SS*.Hα-helixtrans-61.6-46.4177.6-70170.9000111.8T141 I142 S147 E148 E149T141-L145 WeakPolarHBondContact O-CG 3.19Å; T141-L145 PolarHBondContact O-N 3.35Å; I142-L145 PolarHBondContact O-N 3.25Å; L145-S147 VanDerWaalsContact C-N 3.32Å; L145-S147 PolarHBondContact O-N 2.9Å; L145-E148 PolarHBondContact O-N 3.38Å; L145-E149 WeakPolarHBondContact O-CB 3.5Å; L145-E149 WeakPolarHBondContact O-CG 3.26Å; L145-E149 PolarHBondContact O-N 2.92Å
146L72.2Confident73.3Confident13 Ų1369.6 Ų69.67%0.06835%0.349CS..Hα-helixtrans-65.3-35178.1-70173.9000112.4A47 L50 H51 L99 I142 H143 L150A47-L146 HydrophobicContact CB-CD1 4.18Å; L50-L146 HydrophobicContact CD2-CB 4.01Å; L50-L146 HydrophobicContact CD2-CD1 4.06Å; L50-L146 HydrophobicContact CD2-CD2 3.68Å; L50-L146 HydrophobicContact CD2-CG 4.11Å; H51-L146 HydrophobicContact CB-CD2 4.31Å; L99-L146 HydrophobicContact CD2-CB 3.97Å; I142-L146 HydrophobicContact CG2-CD1 3.63Å; I142-L146 HydrophobicContact CG2-CG 4.2Å; I142-L146 WeakPolarHBondContact O-CB 3.22Å; I142-L146 WeakPolarHBondContact O-CG 3.31Å; I142-L146 PolarHBondContact O-N 3.08Å; H143-L146 PolarHBondContact O-N 3.43Å; L146-L150 WeakPolarHBondContact O-CB 3.22Å; L146-L150 PolarHBondContact O-N 2.77Å
147S78.8Confident73.2Confident33 Ų3371.3 Ų71.323%0.23136%0.355CS..Hα-helixtrans-68.7-42.9174.4-172.70000111.8H143 K144 L145 L150 D151H143-S147 VanDerWaalsContact O-CB 3.25Å; H143-S147 WeakPolarHBondContact O-CB 3.49Å; H143-S147 PolarHBondContact O-N 2.94Å; K144-S147 PolarHBondContact O-N 2.87Å; L145-S147 VanDerWaalsContact C-N 3.32Å; L145-S147 PolarHBondContact O-N 2.9Å; S147-L150 PolarHBondContact O-N 2.96Å; S147-D151 WeakPolarHBondContact O-CB 3.32Å; S147-D151 PolarHBondContact O-N 3.44Å
148E76Confident73Confident122 Ų12269.8 Ų69.857%0.5735%0.345SS*.Hα-helixtrans-63.6-43.8177.8-177.5171.4-178.800111.4K144 L145 D151 S152K144-E148 WeakPolarHBondContact O-CB 3.44Å; K144-E148 PolarHBondContact O-N 2.88Å; L145-E148 PolarHBondContact O-N 3.38Å; E148-D151 PolarHBondContact O-N 3.48Å; E148-S152 WeakPolarHBondContact O-CB 3.42Å; E148-S152 PolarHBondContact O-N 3.27Å
149E69.8Low72.6Confident111 Ų11166.8 Ų66.852%0.51934%0.335SS..Hα-helixtrans-62.2-43.2172.6-79.1-69.6164.800112.3L54 L145 D151 S152 L153L54-E149 HydrophobicContact CD2-CB 3.57Å; L54-E149 HydrophobicContact CD2-CG 4.28Å; L145-E149 WeakPolarHBondContact O-CB 3.5Å; L145-E149 WeakPolarHBondContact O-CG 3.26Å; L145-E149 PolarHBondContact O-N 2.92Å; E149-D151 VanDerWaalsContact C-N 3.31Å; E149-D151 PolarHBondContact O-N 2.68Å; E149-S152 WeakPolarHBondContact O-CB 3.41Å; E149-S152 PolarHBondContact O-N 3.23Å; E149-L153 VanDerWaalsContact O-CB 3.31Å; E149-L153 WeakPolarHBondContact O-CB 3.44Å; E149-L153 PolarHBondContact O-N 3.47Å
150L75.8Confident72Confident1 Ų167 Ų671%0.00534%0.336CS..Hα-helixtrans-63.4-39175.8-176.265.9000111.5L54 C95 T96 L99 L146 S147 L153 K154L54-L150 HydrophobicContact CD1-CD1 4.21Å; C95-L150 HydrophobicContact CB-CD1 3.72Å; C95-L150 HydrophobicContact CB-CD2 4.36Å; T96-L150 HydrophobicContact CG2-CD2 3.74Å; L99-L150 HydrophobicContact CD1-CB 4.04Å; L99-L150 HydrophobicContact CD1-CD2 3.26Å; L99-L150 HydrophobicContact CD1-CG 4.26Å; L99-L150 HydrophobicContact CG-CD2 4.1Å; L146-L150 WeakPolarHBondContact O-CB 3.22Å; L146-L150 PolarHBondContact O-N 2.77Å; S147-L150 PolarHBondContact O-N 2.96Å; L150-L153 PolarHBondContact O-N 3Å; L150-K154 VanDerWaalsContact O-CG 3.3Å; L150-K154 WeakPolarHBondContact O-CG 3.44Å; L150-K154 PolarHBondContact O-N 3.49Å
151D75.9Confident71.7Confident68 Ų6865.9 Ų65.936%0.36433%0.33SS..Hα-helixtrans-71.8-36.6178.5-72.4-22.4000112.2S147 E148 E149 L153 K154 K155S147-D151 WeakPolarHBondContact O-CB 3.32Å; S147-D151 PolarHBondContact O-N 3.44Å; E148-D151 PolarHBondContact O-N 3.48Å; E149-D151 VanDerWaalsContact C-N 3.31Å; E149-D151 PolarHBondContact O-N 2.68Å; D151-L153 VanDerWaalsContact C-N 3.29Å; D151-L153 PolarHBondContact O-N 3Å; D151-K154 PolarHBondContact O-N 3.34Å; D151-K154 IonicContact OD1-NZ 2.66Å; D151-K154 PolarHBondContact OD1-NZ 3.1Å; D151-K155 WeakPolarHBondContact O-CG 2.98Å; D151-K155 PolarHBondContact O-N 3.33Å
152S69.8Low71.2Confident71 Ų7169.2 Ų69.250%0.49734%0.335SS..Hα-helixtrans-57.3-45.2168.2-176.40000110.9E148 E149 K155 L156E148-S152 WeakPolarHBondContact O-CB 3.42Å; E148-S152 PolarHBondContact O-N 3.27Å; E149-S152 WeakPolarHBondContact O-CB 3.41Å; E149-S152 PolarHBondContact O-N 3.23Å; S152-K155 WeakPolarHBondContact O-CB 3.46Å; S152-K155 PolarHBondContact O-N 2.89Å; S152-L156 PolarHBondContact O-N 3.08Å
153L65.3Low70.8Confident14 Ų1468.2 Ų68.27%0.07333%0.329CS..Hα-helixtrans-69.9-36.9-179.5-166.457.2000113.2L54 L57 L61 E149 L150 D151 L156 R157L54-L153 HydrophobicContact CD1-CB 4.45Å; L54-L153 HydrophobicContact CD1-CD2 3.24Å; L54-L153 HydrophobicContact CG-CD2 4.07Å; L57-L153 HydrophobicContact CB-CD2 3.91Å; L57-L153 HydrophobicContact CD2-CD2 3.23Å; L57-L153 HydrophobicContact CD2-CG 3.84Å; L57-L153 HydrophobicContact CG-CD1 4.35Å; L57-L153 HydrophobicContact CG-CD2 3.49Å; L57-L153 VanDerWaalsContact CG-CD2 3.49Å; L57-L153 HydrophobicContact CG-CG 4.05Å; L61-L153 HydrophobicContact CD2-CD1 3.47Å; L61-L153 VanDerWaalsContact CD2-CD1 3.47Å; E149-L153 VanDerWaalsContact O-CB 3.31Å; E149-L153 WeakPolarHBondContact O-CB 3.44Å; E149-L153 PolarHBondContact O-N 3.47Å; L150-L153 PolarHBondContact O-N 3Å; D151-L153 VanDerWaalsContact C-N 3.29Å; D151-L153 PolarHBondContact O-N 3Å; L153-L156 PolarHBondContact O-N 3Å; L153-R157 WeakPolarHBondContact O-CB 3.1Å; L153-R157 PolarHBondContact O-N 3.46Å
154K77.1Confident70.2Confident72 Ų7268.5 Ų68.531%0.31333%0.33SS..Hα-helixtrans-61.7-44.3170.3-75171.9-170157.20111.3I92 L150 D151 R157 E158I92-K154 HydrophobicContact CG2-CG 4.16Å; L150-K154 VanDerWaalsContact O-CG 3.3Å; L150-K154 WeakPolarHBondContact O-CG 3.44Å; L150-K154 PolarHBondContact O-N 3.49Å; D151-K154 PolarHBondContact O-N 3.34Å; D151-K154 IonicContact OD1-NZ 2.66Å; D151-K154 PolarHBondContact OD1-NZ 3.1Å; K154-R157 PolarHBondContact O-N 2.81Å; K154-E158 WeakPolarHBondContact O-CB 3.36Å; K154-E158 PolarHBondContact O-N 3.29Å
155K74.6Confident69.7Low160 Ų16066.7 Ų66.770%0.69632%0.324SS*.Hα-helixtrans-61.8-45.1177.1-76177.1-179.4-179.60111.7D151 S152 R157 E158 S159D151-K155 WeakPolarHBondContact O-CG 2.98Å; D151-K155 PolarHBondContact O-N 3.33Å; S152-K155 WeakPolarHBondContact O-CB 3.46Å; S152-K155 PolarHBondContact O-N 2.89Å; K155-R157 VanDerWaalsContact C-N 3.33Å; K155-R157 PolarHBondContact O-N 2.96Å; K155-E158 WeakPolarHBondContact O-CB 3.26Å; K155-E158 PolarHBondContact O-N 3.17Å; K155-S159 PolarHBondContact O-N 2.86Å
156L64.1Low69Low83 Ų8367.2 Ų67.244%0.43532%0.318SS..Hα-helixtrans-64.3-38177.4-173.160.1000111.9L61 S152 L153 S159 E160L61-L156 HydrophobicContact CD2-CB 3.96Å; L61-L156 HydrophobicContact CD2-CD2 3.4Å; L61-L156 VanDerWaalsContact CD2-CD2 3.4Å; L61-L156 HydrophobicContact CD2-CG 3.52Å; L61-L156 HydrophobicContact CG-CD2 4.33Å; L61-L156 HydrophobicContact CG-CG 4.4Å; S152-L156 PolarHBondContact O-N 3.08Å; L153-L156 PolarHBondContact O-N 3Å; L156-S159 PolarHBondContact O-N 3.38Å; L156-S159 PolarHBondContact O-OG 3.44Å; L156-E160 WeakPolarHBondContact O-CG 3.28Å; L156-E160 PolarHBondContact O-N 2.9Å
157R71.1Confident68.4Low54 Ų5467.2 Ų67.220%0.20432%0.318CS..Hα-helixtrans-64.7-42.2172.1168.8-84.1-153.8-66.311.3112.1V88 I92 L153 K154 K155 S159 E160 I161V88-R157 HydrophobicContact CG1-CG 4.04Å; I92-R157 HydrophobicContact CD1-CB 4.15Å; I92-R157 HydrophobicContact CD1-CG 3.84Å; L153-R157 WeakPolarHBondContact O-CB 3.1Å; L153-R157 PolarHBondContact O-N 3.46Å; K154-R157 PolarHBondContact O-N 2.81Å; K155-R157 VanDerWaalsContact C-N 3.33Å; K155-R157 PolarHBondContact O-N 2.96Å; R157-S159 VanDerWaalsContact C-N 3.35Å; R157-E160 PolarHBondContact O-N 3.28Å; R157-I161 VanDerWaalsContact NH1-CG1 3.29Å; R157-I161 WeakPolarHBondContact O-CG1 3.44Å; R157-I161 PolarHBondContact O-N 3.49Å
158E71Confident67.5Low79 Ų7969 Ų6937%0.36933%0.327SS..Hα-helixtrans-63.7-40.4177.8179.563.2-157.700111.2K154 K155 E160 I161 R162K154-E158 WeakPolarHBondContact O-CB 3.36Å; K154-E158 PolarHBondContact O-N 3.29Å; K155-E158 WeakPolarHBondContact O-CB 3.26Å; K155-E158 PolarHBondContact O-N 3.17Å; E158-E160 VanDerWaalsContact C-N 3.32Å; E158-E160 PolarHBondContact O-N 3.22Å; E158-I161 PolarHBondContact O-N 3.28Å; E158-R162 WeakPolarHBondContact O-CG 3.47Å; E158-R162 PolarHBondContact O-N 3.15Å; E158-R162 VanDerWaalsContact O-N 3.08Å; E158-R162 IonicContact OE1-CZ 3.68Å; E158-R162 IonicContact OE1-NE 3.44Å; E158-R162 PolarHBondContact OE1-NE 2.99Å; E158-R162 IonicContact OE1-NH2 2.64Å; E158-R162 PolarHBondContact OE1-NH2 3.44Å; E158-R162 VanDerWaalsContact OE1-NH2 3.1Å
159S63.7Low66.9Low35 Ų3568 Ų6825%0.24532%0.323CS..Hα-helixtrans-63.6-39.5174.173.90000111.5K155 L156 R157 R162 R163K155-S159 PolarHBondContact O-N 2.86Å; L156-S159 PolarHBondContact O-N 3.38Å; L156-S159 PolarHBondContact O-OG 3.44Å; R157-S159 VanDerWaalsContact C-N 3.35Å; S159-R162 PolarHBondContact O-N 3.02Å; S159-R163 WeakPolarHBondContact O-CB 3.43Å; S159-R163 PolarHBondContact O-N 3.45Å
160E64.1Low66.1Low19 Ų1966.4 Ų66.49%0.08931%0.314CS..Hα-helixtrans-66.4-41.4175.9-76.3-171.3-176.700113.9L61 I64 L156 R157 E158 R163 Q164L61-E160 VanDerWaalsContact CD1-CD 3.4Å; L61-E160 WeakPolarHBondContact CD1-OE2 3.29Å; L61-E160 WeakPolarHBondContact CG-OE1 3.45Å; I64-E160 VanDerWaalsContact CG2-OE2 3.26Å; I64-E160 WeakPolarHBondContact CG2-OE2 3.38Å; L156-E160 WeakPolarHBondContact O-CG 3.28Å; L156-E160 PolarHBondContact O-N 2.9Å; R157-E160 PolarHBondContact O-N 3.28Å; E158-E160 VanDerWaalsContact C-N 3.32Å; E158-E160 PolarHBondContact O-N 3.22Å; E160-R163 PolarHBondContact O-N 2.87Å; E160-Q164 PolarHBondContact O-N 3.5Å
161I67.8Low65.2Low58 Ų5867.8 Ų67.830%0.29732%0.324SS..Hα-helixtrans-59.4-49.4173.3-64.3170.3000109.8R157 E158 R163 Q164 Q165R157-I161 VanDerWaalsContact NH1-CG1 3.29Å; R157-I161 WeakPolarHBondContact O-CG1 3.44Å; R157-I161 PolarHBondContact O-N 3.49Å; E158-I161 PolarHBondContact O-N 3.28Å; I161-R163 VanDerWaalsContact C-N 3.26Å; I161-R163 PolarHBondContact O-N 3.44Å; I161-Q164 CarbonylContact O-C 3.59Å; I161-Q164 PolarHBondContact O-N 2.92Å; I161-Q165 PolarHBondContact O-N 3.29Å
162R64.1Low64.3Low144 Ų14466 Ų6654%0.54332%0.322SS..Hα-helixtrans-61.3-37.2-178.4-72.4178.6-170.4-168.91.3112E158 S159 R166E158-R162 WeakPolarHBondContact O-CG 3.47Å; E158-R162 PolarHBondContact O-N 3.15Å; E158-R162 VanDerWaalsContact O-N 3.08Å; E158-R162 IonicContact OE1-CZ 3.68Å; E158-R162 IonicContact OE1-NE 3.44Å; E158-R162 PolarHBondContact OE1-NE 2.99Å; E158-R162 IonicContact OE1-NH2 2.64Å; E158-R162 PolarHBondContact OE1-NH2 3.44Å; E158-R162 VanDerWaalsContact OE1-NH2 3.1Å; S159-R162 PolarHBondContact O-N 3.02Å; R162-R166 WeakPolarHBondContact O-CB 3.35Å; R162-R166 WeakPolarHBondContact O-CG 3.35Å; R162-R166 PolarHBondContact O-N 2.88Å; R162-R166 VanDerWaalsContact O-N 3.12Å; R162-R166 PolarHBondContact O-NE 2.93Å
163R62.6Low63.7Low10 Ų1067.8 Ų67.84%0.03833%0.326CS..Hα-helixtrans-62.3-45.9172.5-178.5172.270.970.112111T68 S159 E160 I161 R166 L167 L283T68-R163 PolarHBondContact OG1-NH2 2.87Å; S159-R163 WeakPolarHBondContact O-CB 3.43Å; S159-R163 PolarHBondContact O-N 3.45Å; E160-R163 PolarHBondContact O-N 2.87Å; I161-R163 VanDerWaalsContact C-N 3.26Å; I161-R163 PolarHBondContact O-N 3.44Å; R163-R166 PolarHBondContact O-N 2.67Å; R163-L167 HydrophobicContact CG-CD1 4.23Å; R163-L167 WeakPolarHBondContact O-CG 3.41Å; R163-L167 PolarHBondContact O-N 3.47Å; R163-L283 HydrophobicContact CB-CD2 4.17Å; R163-L283 HydrophobicContact CG-CD1 4.36Å; R163-L283 HydrophobicContact CG-CD2 3.47Å; R163-L283 VanDerWaalsContact CG-CD2 3.47Å
164Q59Low63.2Low39 Ų3968.6 Ų68.618%0.18233%0.33CS..Hα-helixtrans-68.7-40.5-179.9-172.259.427.800112.6T68 E160 I161 R166 L167 V168T68-Q164 VanDerWaalsContact CG2-OE1 3.25Å; E160-Q164 PolarHBondContact O-N 3.5Å; I161-Q164 CarbonylContact O-C 3.59Å; I161-Q164 PolarHBondContact O-N 2.92Å; Q164-R166 VanDerWaalsContact C-N 3.31Å; Q164-R166 PolarHBondContact O-N 3.17Å; Q164-L167 CarbonylContact O-C 3.58Å; Q164-L167 PolarHBondContact O-N 3.07Å; Q164-L167 VanDerWaalsContact O-N 3.14Å; Q164-V168 HydrophobicContact CG-CG2 4.19Å; Q164-V168 WeakPolarHBondContact O-CB 3.31Å; Q164-V168 WeakPolarHBondContact O-CG2 3.43Å; Q164-V168 PolarHBondContact O-N 3.21Å
165Q66.3Low62.1Low106 Ų10667.2 Ų67.250%0.49533%0.332SS..Hα-helixtrans-58.8-45.9175.4-178.4176.2-11.700110.2I161 L167 V168 E169I161-Q165 PolarHBondContact O-N 3.29Å; Q165-L167 VanDerWaalsContact C-N 3.34Å; Q165-L167 PolarHBondContact O-N 3.48Å; Q165-V168 PolarHBondContact O-N 3.48Å; Q165-E169 HydrophobicContact CG-CG 4.25Å; Q165-E169 VanDerWaalsContact CG-OE1 3.24Å; Q165-E169 WeakPolarHBondContact CG-OE1 3.44Å; Q165-E169 PolarHBondContact NE2-OE1 2.88Å; Q165-E169 WeakPolarHBondContact O-CB 3.45Å; Q165-E169 VanDerWaalsContact O-CG 3.29Å; Q165-E169 WeakPolarHBondContact O-CG 3.28Å; Q165-E169 PolarHBondContact O-N 3.47Å
166R60.9Low61.1Low119 Ų11963.9 Ų63.945%0.44933%0.325SS..Hα-helixtrans-59-43173.4-75.9-175-75.6170.9-1.1112.2R162 R163 Q164 F170 L283R162-R166 WeakPolarHBondContact O-CB 3.35Å; R162-R166 WeakPolarHBondContact O-CG 3.35Å; R162-R166 PolarHBondContact O-N 2.88Å; R162-R166 VanDerWaalsContact O-N 3.12Å; R162-R166 PolarHBondContact O-NE 2.93Å; R163-R166 PolarHBondContact O-N 2.67Å; Q164-R166 VanDerWaalsContact C-N 3.31Å; Q164-R166 PolarHBondContact O-N 3.17Å; R166-F170 WeakPolarHBondContact O-CB 3.41Å; R166-F170 PolarHBondContact O-N 3.34Å; R166-L283 HydrophobicContact CB-CD1 4.31Å
167L58.3Low60.5Low13 Ų1361.5 Ų61.57%0.06832%0.321CS..Hα-helixtrans-65.7-40.8176.4-72168.2000112.8T68 L72 R163 Q164 Q165 S171 M280T68-L167 HydrophobicContact CG2-CD1 4.31Å; L72-L167 HydrophobicContact CD1-CB 4.42Å; L72-L167 HydrophobicContact CD1-CD2 4.06Å; R163-L167 HydrophobicContact CG-CD1 4.23Å; R163-L167 WeakPolarHBondContact O-CG 3.41Å; R163-L167 PolarHBondContact O-N 3.47Å; Q164-L167 CarbonylContact O-C 3.58Å; Q164-L167 PolarHBondContact O-N 3.07Å; Q164-L167 VanDerWaalsContact O-N 3.14Å; Q165-L167 VanDerWaalsContact C-N 3.34Å; Q165-L167 PolarHBondContact O-N 3.48Å; L167-S171 VanDerWaalsContact O-CB 3.24Å; L167-S171 WeakPolarHBondContact O-CB 3.43Å; L167-S171 PolarHBondContact O-N 2.95Å; L167-S171 PolarHBondContact O-OG 2.96Å; L167-M280 HydrophobicContact CD1-SD 3.94Å; L167-M280 HydrophobicContact CD2-SD 4.2Å
168V60.7Low59.6Low70 Ų7061 Ų6142%0.42432%0.323SS..Hα-helixtrans-69.6-50.8-179.9171.20000110.4Q164 Q165 F170 S171 G172Q164-V168 HydrophobicContact CG-CG2 4.19Å; Q164-V168 WeakPolarHBondContact O-CB 3.31Å; Q164-V168 WeakPolarHBondContact O-CG2 3.43Å; Q164-V168 PolarHBondContact O-N 3.21Å; Q165-V168 PolarHBondContact O-N 3.48Å; V168-F170 PolarHBondContact O-N 2.95Å; V168-S171 PolarHBondContact O-N 3.42Å; V168-S171 PolarHBondContact O-OG 3.12Å; V168-G172 PolarHBondContact O-N 3.02Å
169E63.6Low58.6Low101 Ų10166.1 Ų66.147%0.47234%0.339SS..Hα-helixtrans-54.9-42.9175.3-72.6174.8-175.900110.4Q165 G172 N173Q165-E169 HydrophobicContact CG-CG 4.25Å; Q165-E169 VanDerWaalsContact CG-OE1 3.24Å; Q165-E169 WeakPolarHBondContact CG-OE1 3.44Å; Q165-E169 PolarHBondContact NE2-OE1 2.88Å; Q165-E169 WeakPolarHBondContact O-CB 3.45Å; Q165-E169 VanDerWaalsContact O-CG 3.29Å; Q165-E169 WeakPolarHBondContact O-CG 3.28Å; Q165-E169 PolarHBondContact O-N 3.47Å; E169-G172 PolarHBondContact O-N 2.79Å; E169-N173 WeakPolarHBondContact O-CB 3.23Å; E169-N173 PolarHBondContact O-N 3.42Å; E169-N173 PolarHBondContact O-ND2 2.88Å; E169-N173 PolarHBondContact O-OD1 3.26Å
170F53.1Low57.8Low78 Ų7867.7 Ų67.734%0.34235%0.35SS..Hα-helixtrans-73.6-43.6-179.1-154-103.2000113R166 V168 G172 N173 L174 L279R166-F170 WeakPolarHBondContact O-CB 3.41Å; R166-F170 PolarHBondContact O-N 3.34Å; V168-F170 PolarHBondContact O-N 2.95Å; F170-G172 PolarHBondContact O-N 3.3Å; F170-N173 PolarHBondContact O-N 3.27Å; F170-L174 HydrophobicContact CD1-CD1 3.36Å; F170-L174 HydrophobicContact CD1-CG 4.08Å; F170-L174 HydrophobicContact CE1-CD1 3.58Å; F170-L174 HydrophobicContact CE1-CD2 4.43Å; F170-L174 HydrophobicContact CE1-CG 4.04Å; F170-L174 HydrophobicContact CG-CD1 4.37Å; F170-L174 WeakPolarHBondContact O-CB 3.49Å; F170-L174 WeakPolarHBondContact O-CD1 3.37Å; F170-L174 WeakPolarHBondContact O-CG 3.41Å; F170-L174 PolarHBondContact O-N 2.93Å; F170-L279 HydrophobicContact CD1-CD1 3.9Å; F170-L279 HydrophobicContact CD2-CD1 4.45Å; F170-L279 HydrophobicContact CE1-CD1 3.54Å; F170-L279 HydrophobicContact CE2-CD1 4.14Å; F170-L279 HydrophobicContact CG-CD1 4.35Å; F170-L279 HydrophobicContact CZ-CD1 3.68Å
171S56.5Low56.9Low31 Ų3170.5 Ų70.522%0.21737%0.369CS..Hα-helixtrans-61.9-33.5173.172.70000112L167 V168 A175L167-S171 VanDerWaalsContact O-CB 3.24Å; L167-S171 WeakPolarHBondContact O-CB 3.43Å; L167-S171 PolarHBondContact O-N 2.95Å; L167-S171 PolarHBondContact O-OG 2.96Å; V168-S171 PolarHBondContact O-N 3.42Å; V168-S171 PolarHBondContact O-OG 3.12Å; S171-A175 WeakPolarHBondContact O-CB 3.46Å; S171-A175 PolarHBondContact O-N 3.27Å
172G57.3Low55.9Low30 Ų3069.5 Ų69.531%0.30937%0.369SS..Hα-helixtrans-67.1-45.3172.900000111.8V168 E169 F170 A175 T176V168-G172 PolarHBondContact O-N 3.02Å; E169-G172 PolarHBondContact O-N 2.79Å; F170-G172 PolarHBondContact O-N 3.3Å; G172-A175 PolarHBondContact O-N 3.47Å; G172-T176 VanDerWaalsContact O-CB 3.28Å; G172-T176 WeakPolarHBondContact O-CB 3.46Å; G172-T176 PolarHBondContact O-N 2.91Å; G172-T176 PolarHBondContact O-OG1 3.02Å
173N57Low54.8Low109 Ų10966.7 Ų66.758%0.58338%0.377SS*.Hα-helixtrans-63.5-42.4175.1-68.4-18.3000111.6E169 F170 T176 G177E169-N173 WeakPolarHBondContact O-CB 3.23Å; E169-N173 PolarHBondContact O-N 3.42Å; E169-N173 PolarHBondContact O-ND2 2.88Å; E169-N173 PolarHBondContact O-OD1 3.26Å; F170-N173 PolarHBondContact O-N 3.27Å; N173-T176 PolarHBondContact O-N 3.3Å; N173-G177 PolarHBondContact O-N 3.49Å
174L54.2Low54Low31 Ų3171.6 Ų71.616%0.16241%0.412CS..Hα-helixtrans-64.1-48.6174.6-76.8156.2000111.6F170 T176 G177 V178 N272 S276F170-L174 HydrophobicContact CD1-CD1 3.36Å; F170-L174 HydrophobicContact CD1-CG 4.08Å; F170-L174 HydrophobicContact CE1-CD1 3.58Å; F170-L174 HydrophobicContact CE1-CD2 4.43Å; F170-L174 HydrophobicContact CE1-CG 4.04Å; F170-L174 HydrophobicContact CG-CD1 4.37Å; F170-L174 WeakPolarHBondContact O-CB 3.49Å; F170-L174 WeakPolarHBondContact O-CD1 3.37Å; F170-L174 WeakPolarHBondContact O-CG 3.41Å; F170-L174 PolarHBondContact O-N 2.93Å; L174-T176 VanDerWaalsContact C-N 3.25Å; L174-T176 PolarHBondContact O-N 3.09Å; L174-G177 PolarHBondContact O-N 2.71Å; L174-V178 WeakPolarHBondContact O-CG2 3.18Å; L174-V178 PolarHBondContact O-N 2.93Å; L174-N272 HydrophobicContact CD2-CB 4.09Å; L174-S276 VanDerWaalsContact CD1-OG 3.26Å; L174-S276 WeakPolarHBondContact CD1-OG 3.3Å
175A55.2Low53.2Low42 Ų4272 Ų7235%0.34743%0.427SS..Hα-helixtrans-62.3-36.4177.400000111.4S171 G172 R179S171-A175 WeakPolarHBondContact O-CB 3.46Å; S171-A175 PolarHBondContact O-N 3.27Å; G172-A175 PolarHBondContact O-N 3.47Å; A175-R179 WeakPolarHBondContact O-CB 3.3Å; A175-R179 WeakPolarHBondContact O-CD 3.23Å; A175-R179 WeakPolarHBondContact O-CG 3.41Å; A175-R179 PolarHBondContact O-N 3.41Å
176T53Low52.2Low91 Ų9168.1 Ų68.156%0.55841%0.411SS*.Hα-helixtrans-68-41.3175-55.80000111G172 N173 L174 R179 S180G172-T176 VanDerWaalsContact O-CB 3.28Å; G172-T176 WeakPolarHBondContact O-CB 3.46Å; G172-T176 PolarHBondContact O-N 2.91Å; G172-T176 PolarHBondContact O-OG1 3.02Å; N173-T176 PolarHBondContact O-N 3.3Å; L174-T176 VanDerWaalsContact C-N 3.25Å; L174-T176 PolarHBondContact O-N 3.09Å; T176-R179 PolarHBondContact O-N 3.26Å; T176-S180 WeakPolarHBondContact O-CB 3.44Å; T176-S180 PolarHBondContact O-N 2.96Å; T176-S180 PolarHBondContact O-OG 3.42Å
177G52Low51.7Low33 Ų3367.9 Ų67.934%0.3442%0.418SS..Hα-helixtrans-64.1-41.4174.100000113.4N173 L174 S180 V181N173-G177 PolarHBondContact O-N 3.49Å; L174-G177 PolarHBondContact O-N 2.71Å; G177-S180 WeakPolarHBondContact CA-OG 3.25Å; G177-S180 PolarHBondContact O-N 3.4Å; G177-S180 PolarHBondContact O-OG 2.86Å; G177-V181 WeakPolarHBondContact O-CG2 3.35Å; G177-V181 PolarHBondContact O-N 3.42Å; G177-V181 VanDerWaalsContact O-N 3.14Å
178V50.6Low51.3Low43 Ų4368.8 Ų68.826%0.26142%0.424SS..Hα-helixtrans-70.6-38.7176.5176.80000111L174 V181 A182 N272L174-V178 WeakPolarHBondContact O-CG2 3.18Å; L174-V178 PolarHBondContact O-N 2.93Å; V178-V181 PolarHBondContact O-N 3.31Å; V178-A182 WeakPolarHBondContact O-CB 3.4Å; V178-A182 PolarHBondContact O-N 2.92Å; V178-N272 VanDerWaalsContact CG2-ND2 3.3Å; V178-N272 WeakPolarHBondContact CG2-ND2 3.45Å
179R49.8Very low50.7Low187 Ų18771.3 Ų71.371%0.70644%0.44SS*.Hα-helixtrans-68.9-35.7175.3-74.3172-167.8-95.32.6112.2A175 T176 V181 A182 A183A175-R179 WeakPolarHBondContact O-CB 3.3Å; A175-R179 WeakPolarHBondContact O-CD 3.23Å; A175-R179 WeakPolarHBondContact O-CG 3.41Å; A175-R179 PolarHBondContact O-N 3.41Å; T176-R179 PolarHBondContact O-N 3.26Å; R179-V181 VanDerWaalsContact C-N 3.32Å; R179-A182 PolarHBondContact O-N 3.32Å; R179-A183 WeakPolarHBondContact O-CB 3.34Å; R179-A183 PolarHBondContact O-N 2.96Å
180S47.1Very low49.9Very low68 Ų6869.5 Ų69.548%0.47644%0.442SS..Hα-helixtrans-66.9-37.5175.864.90000110.9T176 G177 S184T176-S180 WeakPolarHBondContact O-CB 3.44Å; T176-S180 PolarHBondContact O-N 2.96Å; T176-S180 PolarHBondContact O-OG 3.42Å; G177-S180 WeakPolarHBondContact CA-OG 3.25Å; G177-S180 PolarHBondContact O-N 3.4Å; G177-S180 PolarHBondContact O-OG 2.86Å; S180-S184 VanDerWaalsContact O-CB 3.26Å; S180-S184 WeakPolarHBondContact O-CB 3.37Å; S180-S184 PolarHBondContact O-N 3.2Å
181V46.3Very low49.6Very low78 Ų7872.7 Ų72.747%0.47345%0.453SS..Hα-helixtrans-64.7-44.6171.1174.10000111.4G177 V178 R179 I265G177-V181 WeakPolarHBondContact O-CG2 3.35Å; G177-V181 PolarHBondContact O-N 3.42Å; G177-V181 VanDerWaalsContact O-N 3.14Å; V178-V181 PolarHBondContact O-N 3.31Å; R179-V181 VanDerWaalsContact C-N 3.32Å; V181-I265 HydrophobicContact CG1-CG1 4.39Å
182A45.7Very low49.2Very low37 Ų3776.2 Ų76.231%0.30647%0.469SS..Hα-helixtrans-69-36.6178.300000113.4V178 R179 T186V178-A182 WeakPolarHBondContact O-CB 3.4Å; V178-A182 PolarHBondContact O-N 2.92Å; R179-A182 PolarHBondContact O-N 3.32Å; A182-T186 PolarHBondContact O-N 3.08Å; A182-T186 VanDerWaalsContact O-N 3.16Å
183A41.9Very low48.4Very low85 Ų8583.1 Ų83.170%0.70249%0.49SS*.Hα-helixtrans-75.1-28.9179.100000112.1R179 G185R179-A183 WeakPolarHBondContact O-CB 3.34Å; R179-A183 PolarHBondContact O-N 2.96Å; A183-G185 PolarHBondContact O-N 3.4Å; A183-G185 VanDerWaalsContact O-N 3.07Å
184S45.1Very low47.7Very low112 Ų11287.7 Ų87.778%0.78350%0.499SS*.THydrogen-bonded Turntrans-713.4177.3-166.80000114.1S180S180-S184 VanDerWaalsContact O-CB 3.26Å; S180-S184 WeakPolarHBondContact O-CB 3.37Å; S180-S184 PolarHBondContact O-N 3.2Å
185G41.7Very low47.3Very low47 Ų4791.9 Ų91.949%0.48553%0.528SS..THydrogen-bonded Turntrans13980168.400000110.7A183A183-G185 PolarHBondContact O-N 3.4Å; A183-G185 VanDerWaalsContact O-N 3.07Å
186T47Very low46.6Very low26 Ų2696.6 Ų96.616%0.1655%0.548CS..  trans171.5104.1136.629.80000108.8A182 V188 L258A182-T186 PolarHBondContact O-N 3.08Å; A182-T186 VanDerWaalsContact O-N 3.16Å; T186-V188 WeakPolarHBondContact O-CG2 3.42Å; T186-V188 PolarHBondContact O-N 3.44Å; T186-L258 HydrophobicContact CG2-CD2 3.13Å
187N48.9Very low45.9Very low113 Ų113100.6 Ų100.660%0.60456%0.557SS**  trans-71.266.8164.31.5-28.5000106.7T189 A190 Y191N187-T189 PolarHBondContact O-N 3.37Å; N187-T189 VanDerWaalsContact O-N 3.07Å; N187-A190 HydrophobicContact CB-CB 4.45Å; N187-A190 WeakPolarHBondContact O-CB 3.26Å; N187-A190 PolarHBondContact O-N 3.26Å; N187-Y191 WeakPolarHBondContact O-CD2 3.18Å
188V49.9Very low45.4Very low33 Ų33109.1 Ų109.120%0.258%0.581CS.*Hα-helixtrans-55.3-30.1-175.2-179.80000111T186 A190 Y191 L192 A262T186-V188 WeakPolarHBondContact O-CG2 3.42Å; T186-V188 PolarHBondContact O-N 3.44Å; V188-A190 VanDerWaalsContact C-N 3.3Å; V188-A190 PolarHBondContact O-N 2.85Å; V188-Y191 PolarHBondContact O-N 2.93Å; V188-L192 HydrophobicContact CG1-CD1 3.72Å; V188-L192 HydrophobicContact CG1-CG 4.01Å; V188-L192 WeakPolarHBondContact O-CG 3.45Å; V188-L192 PolarHBondContact O-N 3.14Å; V188-A262 HydrophobicContact CG1-CB 3.89Å; V188-A262 HydrophobicContact CG2-CB 4.38Å
189T47.8Very low44.7Very low123 Ų123113.6 Ų113.676%0.75560%0.603SS**Hα-helixtrans-66.1-27.1176.844.30000113.9N187N187-T189 PolarHBondContact O-N 3.37Å; N187-T189 VanDerWaalsContact O-N 3.07Å
190A48Very low44Very low62 Ų62112.2 Ų112.251%0.51261%0.61SS.*Hα-helixtrans-71.7-35.7174.200000111.5N187 V188N187-A190 HydrophobicContact CB-CB 4.45Å; N187-A190 WeakPolarHBondContact O-CB 3.26Å; N187-A190 PolarHBondContact O-N 3.26Å; V188-A190 VanDerWaalsContact C-N 3.3Å; V188-A190 PolarHBondContact O-N 2.85Å
191Y45.9Very low43.7Very low145 Ų145112.3 Ų112.357%0.56961%0.61SS**Hα-helixtrans-85.7-26.6-178.4-63.3-81.3000113.8N187 V188 K193N187-Y191 WeakPolarHBondContact O-CD2 3.18Å; V188-Y191 PolarHBondContact O-N 2.93Å; Y191-K193 PolarHBondContact O-N 3.16Å
192L48.3Very low43.2Very low106 Ų106116.4 Ų116.456%0.55563%0.63SS**SBendtrans-75.9-7.1172.8-73.9174.4000113.5V188 R194V188-L192 HydrophobicContact CG1-CD1 3.72Å; V188-L192 HydrophobicContact CG1-CG 4.01Å; V188-L192 WeakPolarHBondContact O-CG 3.45Å; V188-L192 PolarHBondContact O-N 3.14Å; L192-R194 PolarHBondContact O-N 2.94Å
193K41.6Very low43.4Very low175 Ų175120.5 Ų120.576%0.76165%0.651SS**SBendtrans-68.182.8165.7-168.7175.9-177.5-172.90107.5Y191 P195Y191-K193 PolarHBondContact O-N 3.16Å; K193-P195 VanDerWaalsContact O-N 3.08Å
194R40.7Very low43.2Very low205 Ų205126.4 Ų126.477%0.77466%0.661SS**  trans-35.2115.6174.6-168.3176.1-169.1-146.83.4108L192 N196L192-R194 PolarHBondContact O-N 2.94Å; R194-N196 PolarHBondContact O-N 3.35Å
195P46.5Very low43.1Very low119 Ų119129.4 Ų129.477%0.77367%0.667SS**  trans-65.796.2173.325.1-29.7000105.5K193 K197K193-P195 VanDerWaalsContact O-N 3.08Å; P195-K197 VanDerWaalsContact C-N 3.3Å; P195-K197 PolarHBondContact O-N 3.08Å
196N41.5Very low42.8Very low141 Ų141138.4 Ų138.475%0.75469%0.687SS**  trans-67.8103.6171.3-145.729000104.7R194R194-N196 PolarHBondContact O-N 3.35Å
197K37.4Very low42.1Very low175 Ų175149.2 Ų149.276%0.76172%0.724SS**SBendtrans-42.8135.6176.7-133.8178.5178.5178.80110.3P195P195-K197 VanDerWaalsContact C-N 3.3Å; P195-K197 PolarHBondContact O-N 3.08Å
198Y41.3Very low41.3Very low212 Ų212155.3 Ų155.383%0.83174%0.739SS**  trans68.787.8170.1-69.7-94.2000117.1
199D35.7Very low40.4Very low137 Ų137156.9 Ų156.973%0.73376%0.762SS**  trans-134.298.2140.9-165.6-13.2000108.4S201D199-S201 VanDerWaalsContact C-N 3.29Å; D199-S201 VanDerWaalsContact CG-OG 3.3Å; D199-S201 PolarHBondContact O-N 2.85Å; D199-S201 VanDerWaalsContact O-N 3.13Å; D199-S201 PolarHBondContact OD1-OG 2.93Å
200N36.1Very low39.8Very low157 Ų157157.5 Ų157.584%0.8476%0.761SS**  trans-76.682.8170.6-170.43.7000107.2
201S40.4Very low39.3Very low70 Ų70160.8 Ų160.849%0.4977%0.77SS.*  trans-150.859.4171.157.30000112.5D199 T203D199-S201 VanDerWaalsContact C-N 3.29Å; D199-S201 VanDerWaalsContact CG-OG 3.3Å; D199-S201 PolarHBondContact O-N 2.85Å; D199-S201 VanDerWaalsContact O-N 3.13Å; D199-S201 PolarHBondContact OD1-OG 2.93Å; S201-T203 PolarHBondContact O-N 2.79Å
202D36.6Very low38.9Very low165 Ų165159.7 Ų159.788%0.88277%0.774SS**  trans-65.975.9156.8-84.9-39.3000110.4
203T48.2Very low38.4Very low122 Ų122162.9 Ų162.975%0.74879%0.792SS**  trans-15860.6162.147.40000112.5S201S201-T203 PolarHBondContact O-N 2.79Å
204K38.2Very low37.9Very low209 Ų209160.6 Ų160.691%0.90979%0.788SS**  trans-135.557.4160.1-68.8-171.9-176.8167.90112.3R206K204-R206 VanDerWaalsContact C-N 3.25Å; K204-R206 PolarHBondContact O-N 3.25Å
205L42.3Very low37.8Very low176 Ų176158.5 Ų158.592%0.92179%0.792SS**  trans-64.992.5153.5-92.2125000109.1R207L205-R207 PolarHBondContact O-N 2.91Å
206R35.8Very low37.4Very low236 Ų236161.7 Ų161.789%0.89179%0.793SS**  trans30.788.7139-150.5170.3164163.3-6.1116.1K204 R208K204-R206 VanDerWaalsContact C-N 3.25Å; K204-R206 PolarHBondContact O-N 3.25Å; R206-R208 PolarHBondContact O-N 3.32Å; R206-R208 VanDerWaalsContact O-N 3.15Å
207R32.4Very low37.2Very low252 Ų252160.5 Ų160.595%0.95179%0.792SS**  trans-51.7105.8163.9-160.1-178.5-167.5-169.33.9111L205L205-R207 PolarHBondContact O-N 2.91Å
208R33.2Very low37.2Very low241 Ų241159.8 Ų159.891%0.90980%0.796SS**  trans-127.6104.7156.1-169.9170.7178.9165.5-1.2106.6R206R206-R208 PolarHBondContact O-N 3.32Å; R206-R208 VanDerWaalsContact O-N 3.15Å
209G30.7Very low37.1Very low67 Ų67156.2 Ų156.269%0.69179%0.791SS**  trans-65.7153.5177.800000111.4
210N35Very low37.3Very low136 Ų136156.1 Ų156.173%0.72780%0.795SS**  177.1130.997-167.136.4000109.6
211N38.4Very low37.6Very low131 Ų131156 Ų15670%0.70179%0.794SS**  trans63.4108.3148.7-74.4-7000121.6
212N36.3Very low37.4Very low122 Ų122159.3 Ų159.365%0.65281%0.806SS**  81.579.9109.5-147.739.5000116.3N214N212-N214 PolarHBondContact OD1-ND2 3.47Å
213D38.4Very low37.7Very low173 Ų173162.5 Ų162.593%0.92581%0.807SS**  trans-131.9102.4142.6-106.5-33.7000109.3
214N31.4Very low37.4Very low127 Ų127163.4 Ų163.468%0.67980%0.803SS**  trans-80.4110.2172.5-65.5-58.2000108N212N212-N214 PolarHBondContact OD1-ND2 3.47Å
215N38.6Very low37.5Very low160 Ų160161.2 Ų161.286%0.85680%0.796SS**  trans-174.6142.9143.6-104.4-26.2000112.9
216K38.3Very low37.5Very low186 Ų186156.5 Ų156.581%0.80978%0.777SS**  trans74.685.6167-99.5154.4169.1174.20116.2
217T37.2Very low37.9Very low117 Ų117154 Ų15472%0.71877%0.768SS**  69.999.597.259.80000113.4
218N36.5Very low38.5Very low160 Ų160149.3 Ų149.386%0.85676%0.757SS**  6.7118.2128.7-49.7-20.1000114.1
219D38.5Very low39.1Very low137 Ų137144.2 Ų144.273%0.73374%0.743SS**  169.2121.593.4-157.51000108.9L221D219-L221 PolarHBondContact O-N 2.89Å; D219-L221 VanDerWaalsContact O-N 3.1Å
220V40.9Very low40.2Very low134 Ų134147 Ų14781%0.81274%0.738SS**  trans2.989.6155.2-171.40000115.4
221L41.8Very low40.7Very low155 Ų155146.8 Ų146.881%0.81274%0.737SS**  trans-126.883.7161.2-159.177.3000109.4D219 Y223D219-L221 PolarHBondContact O-N 2.89Å; D219-L221 VanDerWaalsContact O-N 3.1Å; L221-Y223 PolarHBondContact O-N 3.23Å
222N37.5Very low41.6Very low139 Ų139144.1 Ų144.174%0.74372%0.719SS**  36.161.1127.4-163.36.5000115.2H224N222-H224 PolarHBondContact O-N 2.95Å; N222-H224 VanDerWaalsContact O-N 3.1Å
223Y42Very low42.9Very low232 Ų232142.5 Ų142.591%0.9171%0.714SS**  trans-81.687.3157.3-121.9-91.7000106.4L221 E225L221-Y223 PolarHBondContact O-N 3.23Å; Y223-E225 PolarHBondContact O-N 3.41Å
224H42.5Very low44.5Very low142 Ų142142 Ų14266%0.65771%0.706SS**  trans26.494140.7-119.5-64.3000112.2N222 S226N222-H224 PolarHBondContact O-N 2.95Å; N222-H224 VanDerWaalsContact O-N 3.1Å; H224-S226 PolarHBondContact O-N 2.84Å
225E40.1Very low46.6Very low162 Ų162141.6 Ų141.676%0.75770%0.704SS**  trans-53.476.9136.2-168.1168171.400106.1Y223 R227Y223-E225 PolarHBondContact O-N 3.41Å; E225-R227 HydrophobicContact CG-CG 4.39Å; E225-R227 PolarHBondContact O-N 3.27Å
226S42.4Very low48.6Very low77 Ų77138.3 Ų138.354%0.53868%0.683SS.*  trans-63.376.515056.30000104.1H224 H228H224-S226 PolarHBondContact O-N 2.84Å; S226-H228 PolarHBondContact O-N 2.86Å
227R43.4Very low50.5Low185 Ų185134.4 Ų134.470%0.69867%0.671SS**  -38.179.1124.3-93.8175.7162.4158.3-5.7106.2E225 E229E225-R227 HydrophobicContact CG-CG 4.39Å; E225-R227 PolarHBondContact O-N 3.27Å; R227-E229 HydrophobicContact CB-CG 4.43Å; R227-E229 PolarHBondContact O-N 3.31Å
228H44.8Very low52.5Low153 Ų153136.8 Ų136.871%0.70867%0.666SS**  trans-57.584.5136.9-85.9-66.4000103.4S226 E230S226-H228 PolarHBondContact O-N 2.86Å; H228-E230 HydrophobicContact CB-CG 4.4Å; H228-E230 PolarHBondContact O-N 3.06Å
229E46.4Very low54.6Low134 Ų134133 Ų13363%0.62665%0.649SS**  trans-55.569.8136.9-70174.8174.800105.1R227 N231R227-E229 HydrophobicContact CB-CG 4.43Å; R227-E229 PolarHBondContact O-N 3.31Å; E229-N231 PolarHBondContact O-N 3.37Å; E229-N231 PolarHBondContact O-ND2 2.87Å; E229-N231 VanDerWaalsContact O-ND2 3.07Å
230E53.4Low56.7Low126 Ų126129.8 Ų129.859%0.58963%0.632SS**  trans-56.192.6146.3-88.2179169.600102.5H228 F232H228-E230 HydrophobicContact CB-CG 4.4Å; H228-E230 PolarHBondContact O-N 3.06Å; E230-F232 HydrophobicContact CB-CD2 3.97Å; E230-F232 HydrophobicContact CB-CE2 3.6Å; E230-F232 HydrophobicContact CB-CZ 4.02Å; E230-F232 WeakPolarHBondContact O-CD2 3.48Å; E230-F232 PolarHBondContact O-N 3.18Å; E230-F232 WeakPolarHBondContact OE2-CZ 3.43Å
231N47Very low58.7Low130 Ų130130.1 Ų130.170%0.69563%0.625SS**  trans-64.974.7165.6-76.7-84000104.3E229 T233E229-N231 PolarHBondContact O-N 3.37Å; E229-N231 PolarHBondContact O-ND2 2.87Å; E229-N231 VanDerWaalsContact O-ND2 3.07Å; N231-T233 PolarHBondContact O-N 3.4Å
232F56.8Low60.7Low76 Ų76126.5 Ų126.533%0.33361%0.605SS.*  trans-47.8117.7165.6-75.1-78.1000104.7E230 E234 E236 L237 L240E230-F232 HydrophobicContact CB-CD2 3.97Å; E230-F232 HydrophobicContact CB-CE2 3.6Å; E230-F232 HydrophobicContact CB-CZ 4.02Å; E230-F232 WeakPolarHBondContact O-CD2 3.48Å; E230-F232 PolarHBondContact O-N 3.18Å; E230-F232 WeakPolarHBondContact OE2-CZ 3.43Å; F232-E234 PolarHBondContact O-N 3.47Å; F232-E236 HydrophobicContact CB-CB 4.35Å; F232-E236 HydrophobicContact CD1-CB 4.16Å; F232-E236 HydrophobicContact CD1-CG 3.67Å; F232-E236 WeakPolarHBondContact CD1-OE1 3.33Å; F232-E236 WeakPolarHBondContact CD1-OE2 3.3Å; F232-E236 HydrophobicContact CE1-CG 4.32Å; F232-E236 WeakPolarHBondContact CE1-OE1 3.3Å; F232-L237 HydrophobicContact CB-CB 4.22Å; F232-L240 HydrophobicContact CD1-CD1 3.69Å; F232-L240 HydrophobicContact CE1-CD1 3.6Å; F232-L240 HydrophobicContact CG-CD1 4.43Å; F232-L240 HydrophobicContact CZ-CD1 4.23Å
233T64.1Low62.8Low88 Ų88125.9 Ų125.954%0.5460%0.598SS.*  trans-54.5145.5174.4-61.30000106.6N231 N235 E236 L237N231-T233 PolarHBondContact O-N 3.4Å; T233-N235 HydrophobicContact CG2-CB 4.25Å; T233-N235 CarbonylContact O-C 3.58Å; T233-N235 PolarHBondContact O-N 3.01Å; T233-E236 WeakPolarHBondContact O-CA 3.49Å; T233-E236 WeakPolarHBondContact O-CB 3.31Å; T233-E236 PolarHBondContact O-N 3.3Å; T233-L237 PolarHBondContact O-N 3.32Å
234E71.1Confident64.8Low163 Ų163120 Ų12076%0.76258%0.582SS**Hα-helixtrans-47.5-33.4-179.4-175.4177.6173.200112.3F232 R238F232-E234 PolarHBondContact O-N 3.47Å; E234-R238 VanDerWaalsContact O-CB 3.27Å; E234-R238 WeakPolarHBondContact O-CB 3.45Å; E234-R238 PolarHBondContact O-N 3.02Å
235N76.3Confident66.7Low117 Ų117118.9 Ų118.963%0.62658%0.577SS**Hα-helixtrans-64.3-44.5172-63.4-33.6000114.2T233 R238 T239T233-N235 HydrophobicContact CG2-CB 4.25Å; T233-N235 CarbonylContact O-C 3.58Å; T233-N235 PolarHBondContact O-N 3.01Å; N235-R238 PolarHBondContact O-N 2.88Å; N235-T239 WeakPolarHBondContact O-CG2 3.49Å; N235-T239 PolarHBondContact O-N 3.22Å; N235-T239 PolarHBondContact O-OG1 2.83Å
236E79.1Confident68.8Low91 Ų91116 Ų11643%0.42557%0.566SS.*Hα-helixtrans-68.9-42-179.2-161.9-178.9177.100111.3F232 T233 R238 T239 L240F232-E236 HydrophobicContact CB-CB 4.35Å; F232-E236 HydrophobicContact CD1-CB 4.16Å; F232-E236 HydrophobicContact CD1-CG 3.67Å; F232-E236 WeakPolarHBondContact CD1-OE1 3.33Å; F232-E236 WeakPolarHBondContact CD1-OE2 3.3Å; F232-E236 HydrophobicContact CE1-CG 4.32Å; F232-E236 WeakPolarHBondContact CE1-OE1 3.3Å; T233-E236 WeakPolarHBondContact O-CA 3.49Å; T233-E236 WeakPolarHBondContact O-CB 3.31Å; T233-E236 PolarHBondContact O-N 3.3Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 3.36Å; E236-T239 VanDerWaalsContact C-OG1 3.32Å; E236-T239 WeakPolarHBondContact CA-OG1 3.34Å; E236-T239 PolarHBondContact O-N 2.98Å; E236-T239 PolarHBondContact O-OG1 2.82Å; E236-L240 VanDerWaalsContact O-CG 3.31Å; E236-L240 WeakPolarHBondContact O-CG 3.47Å; E236-L240 PolarHBondContact O-N 2.79Å
237L80Confident70.6Confident104 Ų104117.7 Ų117.755%0.54557%0.568SS.*Hα-helixtrans-60-44.4172.5-178.564.8000110.9F232 T233 L240 E241F232-L237 HydrophobicContact CB-CB 4.22Å; T233-L237 PolarHBondContact O-N 3.32Å; L237-L240 PolarHBondContact O-N 3.39Å; L237-E241 WeakPolarHBondContact O-CB 3.46Å; L237-E241 PolarHBondContact O-N 3.45Å
238R78.8Confident72.4Confident167 Ų167116.5 Ų116.563%0.6357%0.565SS**Hα-helixtrans-63.2-40.4176-173-176.2-177.9117.32.8112E234 N235 E236 E241 I242E234-R238 VanDerWaalsContact O-CB 3.27Å; E234-R238 WeakPolarHBondContact O-CB 3.45Å; E234-R238 PolarHBondContact O-N 3.02Å; N235-R238 PolarHBondContact O-N 2.88Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 3.36Å; R238-E241 PolarHBondContact O-N 2.93Å; R238-I242 HydrophobicContact CG-CD1 4.07Å; R238-I242 WeakPolarHBondContact O-CD1 3.28Å; R238-I242 VanDerWaalsContact O-CG1 3.24Å; R238-I242 WeakPolarHBondContact O-CG1 3.28Å; R238-I242 PolarHBondContact O-N 3.36Å
239T80.3Confident74.2Confident80 Ų80114.5 Ų114.549%0.49156%0.556SS.*Hα-helixtrans-65.9-40.7176.146.50000112.1N235 E236 I242 E243N235-T239 WeakPolarHBondContact O-CG2 3.49Å; N235-T239 PolarHBondContact O-N 3.22Å; N235-T239 PolarHBondContact O-OG1 2.83Å; E236-T239 VanDerWaalsContact C-OG1 3.32Å; E236-T239 WeakPolarHBondContact CA-OG1 3.34Å; E236-T239 PolarHBondContact O-N 2.98Å; E236-T239 PolarHBondContact O-OG1 2.82Å; T239-I242 PolarHBondContact O-N 2.88Å; T239-E243 WeakPolarHBondContact O-CB 3.19Å; T239-E243 PolarHBondContact O-N 2.93Å
240L83.3Confident75.7Confident71 Ų71113.5 Ų113.537%0.37255%0.551SS.*Hα-helixtrans-65.8-38.6176.2-71171.8000111.8F232 E236 L237 E243 N244F232-L240 HydrophobicContact CD1-CD1 3.69Å; F232-L240 HydrophobicContact CE1-CD1 3.6Å; F232-L240 HydrophobicContact CG-CD1 4.43Å; F232-L240 HydrophobicContact CZ-CD1 4.23Å; E236-L240 VanDerWaalsContact O-CG 3.31Å; E236-L240 WeakPolarHBondContact O-CG 3.47Å; E236-L240 PolarHBondContact O-N 2.79Å; L237-L240 PolarHBondContact O-N 3.39Å; L240-E243 PolarHBondContact O-N 3.28Å; L240-N244 VanDerWaalsContact O-CB 3.23Å; L240-N244 WeakPolarHBondContact O-CB 3.35Å; L240-N244 PolarHBondContact O-N 2.86Å
241E82.8Confident76.9Confident141 Ų141113 Ų11366%0.65955%0.547SS*.Hα-helixtrans-63.9-43.9175-172176.9-165.700111.5L237 R238 N244 Q245L237-E241 WeakPolarHBondContact O-CB 3.46Å; L237-E241 PolarHBondContact O-N 3.45Å; R238-E241 PolarHBondContact O-N 2.93Å; E241-N244 PolarHBondContact O-N 3.41Å; E241-Q245 WeakPolarHBondContact O-CB 3.43Å; E241-Q245 PolarHBondContact O-N 3.07Å
242I83.8Confident78.4Confident78 Ų78109 Ų10940%0.453%0.527SS..Hα-helixtrans-63.6-45.2175.3-68.3165.3000110.9R238 T239 N244 Q245 I246R238-I242 HydrophobicContact CG-CD1 4.07Å; R238-I242 WeakPolarHBondContact O-CD1 3.28Å; R238-I242 VanDerWaalsContact O-CG1 3.24Å; R238-I242 WeakPolarHBondContact O-CG1 3.28Å; R238-I242 PolarHBondContact O-N 3.36Å; T239-I242 PolarHBondContact O-N 2.88Å; I242-N244 PolarHBondContact O-N 3.29Å; I242-Q245 PolarHBondContact O-N 2.95Å; I242-I246 HydrophobicContact CG2-CD1 3.77Å; I242-I246 HydrophobicContact CG2-CG1 4.42Å; I242-I246 VanDerWaalsContact O-CG1 3.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.32Å; I242-I246 PolarHBondContact O-N 2.79Å
243E81.1Confident79.4Confident126 Ų126110.9 Ų110.959%0.58954%0.537SS*.Hα-helixtrans-61.8-44.1178.1-175.1178.4173.200111.4T239 L240 Q245 I246 L247T239-E243 WeakPolarHBondContact O-CB 3.19Å; T239-E243 PolarHBondContact O-N 2.93Å; L240-E243 PolarHBondContact O-N 3.28Å; E243-Q245 VanDerWaalsContact C-N 3.32Å; E243-Q245 PolarHBondContact O-N 3.3Å; E243-I246 PolarHBondContact O-N 2.89Å; E243-L247 VanDerWaalsContact O-CB 3.32Å; E243-L247 WeakPolarHBondContact O-CB 3.26Å; E243-L247 PolarHBondContact O-N 3.4Å
244N84.4Confident80.1Confident109 Ų109110.7 Ų110.758%0.58353%0.53SS*.Hα-helixtrans-61.7-41.1176.1-163.9-31.1000111.3L240 E241 I242 L247 Y248L240-N244 VanDerWaalsContact O-CB 3.23Å; L240-N244 WeakPolarHBondContact O-CB 3.35Å; L240-N244 PolarHBondContact O-N 2.86Å; E241-N244 PolarHBondContact O-N 3.41Å; I242-N244 PolarHBondContact O-N 3.29Å; N244-L247 PolarHBondContact O-N 3.16Å; N244-Y248 VanDerWaalsContact O-CB 3.28Å; N244-Y248 WeakPolarHBondContact O-CB 3.11Å; N244-Y248 PolarHBondContact O-N 2.84Å
245Q81.6Confident80.2Confident118 Ų118106.7 Ų106.755%0.55151%0.51SS*.Hα-helixtrans-63.6-44.7175.4-172.9178.418.400112.4E241 I242 E243 Y248 Q249E241-Q245 WeakPolarHBondContact O-CB 3.43Å; E241-Q245 PolarHBondContact O-N 3.07Å; I242-Q245 PolarHBondContact O-N 2.95Å; E243-Q245 VanDerWaalsContact C-N 3.32Å; E243-Q245 PolarHBondContact O-N 3.3Å; Q245-Y248 PolarHBondContact O-N 3.44Å; Q245-Q249 WeakPolarHBondContact O-CB 3.44Å; Q245-Q249 WeakPolarHBondContact O-CG 3.44Å; Q245-Q249 PolarHBondContact O-N 3.38Å
246I84Confident80.4Confident101 Ų101105.1 Ų105.152%0.51850%0.502SS..Hα-helixtrans-63.1-45.4177.6-69167.1000110.1I242 E243 Y248 Q249 H250I242-I246 HydrophobicContact CG2-CD1 3.77Å; I242-I246 HydrophobicContact CG2-CG1 4.42Å; I242-I246 VanDerWaalsContact O-CG1 3.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.32Å; I242-I246 PolarHBondContact O-N 2.79Å; E243-I246 PolarHBondContact O-N 2.89Å; I246-Y248 VanDerWaalsContact C-N 3.33Å; I246-Y248 PolarHBondContact O-N 2.86Å; I246-Q249 PolarHBondContact O-N 2.7Å; I246-H250 WeakPolarHBondContact O-CB 3.48Å; I246-H250 PolarHBondContact O-N 3.12Å
247L80.2Confident80.3Confident113 Ų113105.5 Ų105.559%0.59250%0.503SS*.Hα-helixtrans-63.2-41.3178.9-173.162000111.4E243 N244 H250 F251E243-L247 VanDerWaalsContact O-CB 3.32Å; E243-L247 WeakPolarHBondContact O-CB 3.26Å; E243-L247 PolarHBondContact O-N 3.4Å; N244-L247 PolarHBondContact O-N 3.16Å; L247-H250 PolarHBondContact O-N 2.89Å; L247-F251 WeakPolarHBondContact O-CB 3.43Å; L247-F251 PolarHBondContact O-N 3.39Å
248Y82.3Confident79.9Confident160 Ų160102.4 Ų102.463%0.62749%0.487SS*.Hα-helixtrans-64.1-41.3175.2-173-93.4000112.3N244 Q245 I246 F251 T252N244-Y248 VanDerWaalsContact O-CB 3.28Å; N244-Y248 WeakPolarHBondContact O-CB 3.11Å; N244-Y248 PolarHBondContact O-N 2.84Å; Q245-Y248 PolarHBondContact O-N 3.44Å; I246-Y248 VanDerWaalsContact C-N 3.33Å; I246-Y248 PolarHBondContact O-N 2.86Å; Y248-F251 PolarHBondContact O-N 2.88Å; Y248-T252 WeakPolarHBondContact O-CB 3.33Å; Y248-T252 PolarHBondContact O-N 3.42Å; Y248-T252 PolarHBondContact O-OG1 2.89Å
249Q80.9Confident79.6Confident112 Ų11298.6 Ų98.652%0.52348%0.477SS..Hα-helixtrans-62.7-46.2174.5-77.6178.9-9.200111.4Q245 I246 F251 T252 Q253Q245-Q249 WeakPolarHBondContact O-CB 3.44Å; Q245-Q249 WeakPolarHBondContact O-CG 3.44Å; Q245-Q249 PolarHBondContact O-N 3.38Å; I246-Q249 PolarHBondContact O-N 2.7Å; Q249-F251 PolarHBondContact O-N 3.35Å; Q249-T252 PolarHBondContact O-N 3.21Å; Q249-Q253 PolarHBondContact O-N 2.79Å
250H78.3Confident79.3Confident112 Ų112101 Ų10152%0.51948%0.482SS..Hα-helixtrans-59-47.4176.6-175.2-83.9000111.4I246 L247 T252 Q253 E254I246-H250 WeakPolarHBondContact O-CB 3.48Å; I246-H250 PolarHBondContact O-N 3.12Å; L247-H250 PolarHBondContact O-N 2.89Å; H250-T252 VanDerWaalsContact C-N 3.3Å; H250-T252 PolarHBondContact O-N 3.46Å; H250-Q253 PolarHBondContact O-N 3.3Å; H250-E254 WeakPolarHBondContact O-CB 3.26Å; H250-E254 PolarHBondContact O-N 3.48Å
251F78.9Confident78.6Confident117 Ų117100.6 Ų100.651%0.51348%0.482SS..Hα-helixtrans-62.9-37.5177-174.7-104.4000112.5L247 Y248 Q249 K255L247-F251 WeakPolarHBondContact O-CB 3.43Å; L247-F251 PolarHBondContact O-N 3.39Å; Y248-F251 PolarHBondContact O-N 2.88Å; Q249-F251 PolarHBondContact O-N 3.35Å; F251-K255 VanDerWaalsContact O-CB 3.28Å; F251-K255 WeakPolarHBondContact O-CB 3.49Å; F251-K255 PolarHBondContact O-N 2.79Å
252T77.7Confident77.8Confident44 Ų4495.1 Ų95.127%0.2746%0.461SS..Hα-helixtrans-67.5-43176.9-57.40000111.3Y248 Q249 H250 K255 D256Y248-T252 WeakPolarHBondContact O-CB 3.33Å; Y248-T252 PolarHBondContact O-N 3.42Å; Y248-T252 PolarHBondContact O-OG1 2.89Å; Q249-T252 PolarHBondContact O-N 3.21Å; H250-T252 VanDerWaalsContact C-N 3.3Å; H250-T252 PolarHBondContact O-N 3.46Å; T252-K255 WeakPolarHBondContact O-CB 3.44Å; T252-K255 PolarHBondContact O-N 3.27Å; T252-D256 VanDerWaalsContact O-CG 3.31Å; T252-D256 PolarHBondContact O-N 3.4Å
253Q78.5Confident77.3Confident117 Ų11798.6 Ų98.655%0.54747%0.474SS..Hα-helixtrans-61.7-48.8175.5-178.6-178.4-18.200111.1Q249 H250 K255 D256 E257Q249-Q253 PolarHBondContact O-N 2.79Å; H250-Q253 PolarHBondContact O-N 3.3Å; Q253-K255 VanDerWaalsContact C-N 3.3Å; Q253-K255 PolarHBondContact O-N 3.13Å; Q253-D256 PolarHBondContact O-N 3.43Å; Q253-E257 PolarHBondContact NE2-OE1 3.48Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.03Å
254E78.1Confident76.9Confident83 Ų8397.9 Ų97.939%0.38847%0.468SS..Hα-helixtrans-58.7-43.7177.1-171.9-177.1172.800110.7H250 D256 E257 L258H250-E254 WeakPolarHBondContact O-CB 3.26Å; H250-E254 PolarHBondContact O-N 3.48Å; E254-D256 VanDerWaalsContact C-N 3.29Å; E254-D256 PolarHBondContact O-N 3.46Å; E254-E257 PolarHBondContact O-N 2.86Å; E254-L258 WeakPolarHBondContact O-CB 3.33Å; E254-L258 WeakPolarHBondContact O-CG 3.47Å; E254-L258 PolarHBondContact O-N 2.93Å
255K74.9Confident76Confident79 Ų7994.4 Ų94.434%0.34345%0.449SS..Hα-helixtrans-58.9-40.4174.8-170.3-160.766.162.20112F251 T252 Q253 L258 H259F251-K255 VanDerWaalsContact O-CB 3.28Å; F251-K255 WeakPolarHBondContact O-CB 3.49Å; F251-K255 PolarHBondContact O-N 2.79Å; T252-K255 WeakPolarHBondContact O-CB 3.44Å; T252-K255 PolarHBondContact O-N 3.27Å; Q253-K255 VanDerWaalsContact C-N 3.3Å; Q253-K255 PolarHBondContact O-N 3.13Å; K255-L258 WeakPolarHBondContact O-CB 3.42Å; K255-L258 PolarHBondContact O-N 2.79Å; K255-H259 PolarHBondContact NZ-CD2 3.2Å; K255-H259 PolarHBondContact NZ-NE2 3.35Å; K255-H259 VanDerWaalsContact NZ-NE2 3.16Å; K255-H259 PolarHBondContact O-CD2 3.01Å; K255-H259 PolarHBondContact O-N 2.88Å
256D78.8Confident75.4Confident84 Ų8492.8 Ų92.845%0.44945%0.452SS..Hα-helixtrans-72.4-38.3-178.9-71.8-13000112.1T252 Q253 E254 L258 H259 Q260T252-D256 VanDerWaalsContact O-CG 3.31Å; T252-D256 PolarHBondContact O-N 3.4Å; Q253-D256 PolarHBondContact O-N 3.43Å; E254-D256 VanDerWaalsContact C-N 3.29Å; E254-D256 PolarHBondContact O-N 3.46Å; D256-L258 VanDerWaalsContact C-N 3.33Å; D256-H259 PolarHBondContact O-N 3.48Å; D256-Q260 PolarHBondContact O-N 3.31Å
257E76.8Confident74.5Confident99 Ų9992.1 Ų92.146%0.46345%0.446SS..Hα-helixtrans-59.5-44.5169-70.4178.2-165.200110.9Q253 E254 H259 Q260 V261Q253-E257 PolarHBondContact NE2-OE1 3.48Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.03Å; E254-E257 PolarHBondContact O-N 2.86Å; E257-H259 PolarHBondContact O-N 3.41Å; E257-Q260 WeakPolarHBondContact O-CB 3.26Å; E257-Q260 PolarHBondContact O-N 3.05Å; E257-Q260 VanDerWaalsContact O-N 3.11Å; E257-V261 WeakPolarHBondContact O-CG2 3.47Å; E257-V261 PolarHBondContact O-N 2.9Å
258L72.6Confident73.9Confident40 Ų4090.2 Ų90.221%0.20944%0.436CS..Hα-helixtrans-61.7-41.2175.4-71.8179.3000113T186 E254 K255 D256 Q260 V261 A262T186-L258 HydrophobicContact CG2-CD2 3.13Å; E254-L258 WeakPolarHBondContact O-CB 3.33Å; E254-L258 WeakPolarHBondContact O-CG 3.47Å; E254-L258 PolarHBondContact O-N 2.93Å; K255-L258 WeakPolarHBondContact O-CB 3.42Å; K255-L258 PolarHBondContact O-N 2.79Å; D256-L258 VanDerWaalsContact C-N 3.33Å; L258-Q260 VanDerWaalsContact C-N 3.31Å; L258-V261 PolarHBondContact O-N 3.43Å; L258-A262 WeakPolarHBondContact O-CB 3.29Å; L258-A262 PolarHBondContact O-N 2.94Å
259H73.1Confident73Confident87 Ų8784.3 Ų84.340%0.40342%0.423SS..Hα-helixtrans-64.5-37.5173.3-79.2-66000112.1K255 D256 E257 A262 K263K255-H259 PolarHBondContact NZ-CD2 3.2Å; K255-H259 PolarHBondContact NZ-NE2 3.35Å; K255-H259 VanDerWaalsContact NZ-NE2 3.16Å; K255-H259 PolarHBondContact O-CD2 3.01Å; K255-H259 PolarHBondContact O-N 2.88Å; D256-H259 PolarHBondContact O-N 3.48Å; E257-H259 PolarHBondContact O-N 3.41Å; H259-A262 PolarHBondContact O-N 2.9Å; H259-K263 WeakPolarHBondContact O-CB 3.3Å; H259-K263 PolarHBondContact O-N 3.32Å
260Q72.7Confident72.3Confident129 Ų12985.1 Ų85.160%0.60343%0.427SS*.Hα-helixtrans-63.9-45.6175.6-169-177.255.400110.7D256 E257 L258 K263 K264D256-Q260 PolarHBondContact O-N 3.31Å; E257-Q260 WeakPolarHBondContact O-CB 3.26Å; E257-Q260 PolarHBondContact O-N 3.05Å; E257-Q260 VanDerWaalsContact O-N 3.11Å; L258-Q260 VanDerWaalsContact C-N 3.31Å; Q260-K263 WeakPolarHBondContact O-CB 3.48Å; Q260-K263 PolarHBondContact O-N 2.85Å; Q260-K264 WeakPolarHBondContact O-CG 3.42Å; Q260-K264 PolarHBondContact O-N 2.96Å
261V69.2Low71.9Confident63 Ų6384.8 Ų84.838%0.38243%0.428SS..Hα-helixtrans-61.1-46.2175.1173.40000110.9E257 L258 K263 K264 I265E257-V261 WeakPolarHBondContact O-CG2 3.47Å; E257-V261 PolarHBondContact O-N 2.9Å; L258-V261 PolarHBondContact O-N 3.43Å; V261-K263 VanDerWaalsContact C-N 3.3Å; V261-K263 PolarHBondContact O-N 3.23Å; V261-K264 CarbonylContact O-C 3.5Å; V261-K264 WeakPolarHBondContact O-CB 3.42Å; V261-K264 PolarHBondContact O-N 2.76Å; V261-K264 VanDerWaalsContact O-N 3.1Å; V261-I265 HydrophobicContact CG1-CD1 3.85Å; V261-I265 HydrophobicContact CG1-CG1 4.41Å; V261-I265 WeakPolarHBondContact O-CG1 3.49Å; V261-I265 PolarHBondContact O-N 3.29Å
262A66.4Low71.3Confident26 Ų2680.9 Ų80.922%0.21541%0.413CS..Hα-helixtrans-59.9-39.9176.300000112.3V188 L258 H259 I265 S266V188-A262 HydrophobicContact CG1-CB 3.89Å; V188-A262 HydrophobicContact CG2-CB 4.38Å; L258-A262 WeakPolarHBondContact O-CB 3.29Å; L258-A262 PolarHBondContact O-N 2.94Å; H259-A262 PolarHBondContact O-N 2.9Å; A262-I265 PolarHBondContact O-N 2.97Å; A262-S266 WeakPolarHBondContact O-CB 3.38Å; A262-S266 PolarHBondContact O-N 2.89Å
263K72.3Confident70.7Confident152 Ų15282.9 Ų82.966%0.66142%0.419SS*.Hα-helixtrans-63.4-43.3173.9-175.5178.9-179.8179.70111.2H259 Q260 V261 S266 E267H259-K263 WeakPolarHBondContact O-CB 3.3Å; H259-K263 PolarHBondContact O-N 3.32Å; Q260-K263 WeakPolarHBondContact O-CB 3.48Å; Q260-K263 PolarHBondContact O-N 2.85Å; V261-K263 VanDerWaalsContact C-N 3.3Å; V261-K263 PolarHBondContact O-N 3.23Å; K263-S266 WeakPolarHBondContact O-CB 3.32Å; K263-S266 PolarHBondContact O-N 3.34Å; K263-E267 WeakPolarHBondContact O-CB 3.34Å; K263-E267 PolarHBondContact O-N 3.05Å
264K73.9Confident70.2Confident110 Ų11079.3 Ų79.348%0.47841%0.405SS..Hα-helixtrans-63.6-40.6175.4-68.6-58179.7-172.90112.5Q260 V261 S266 E267 I268Q260-K264 WeakPolarHBondContact O-CG 3.42Å; Q260-K264 PolarHBondContact O-N 2.96Å; V261-K264 CarbonylContact O-C 3.5Å; V261-K264 WeakPolarHBondContact O-CB 3.42Å; V261-K264 PolarHBondContact O-N 2.76Å; V261-K264 VanDerWaalsContact O-N 3.1Å; K264-S266 VanDerWaalsContact C-N 3.35Å; K264-E267 WeakPolarHBondContact CD-OE2 3.25Å; K264-E267 IonicContact NZ-OE2 3.79Å; K264-E267 PolarHBondContact NZ-OE2 3.41Å; K264-E267 WeakPolarHBondContact O-CB 3.42Å; K264-E267 PolarHBondContact O-N 2.94Å; K264-I268 WeakPolarHBondContact O-CD1 3.41Å; K264-I268 VanDerWaalsContact O-CG1 3.23Å; K264-I268 WeakPolarHBondContact O-CG1 3.39Å; K264-I268 PolarHBondContact O-N 2.89Å
265I65.8Low69.8Low36 Ų3679.6 Ų79.619%0.18541%0.409CS..Hα-helixtrans-63.6-41.8173.7-67.6166.5000110.8V181 V261 A262 E267 I268 G269V181-I265 HydrophobicContact CG1-CG1 4.39Å; V261-I265 HydrophobicContact CG1-CD1 3.85Å; V261-I265 HydrophobicContact CG1-CG1 4.41Å; V261-I265 WeakPolarHBondContact O-CG1 3.49Å; V261-I265 PolarHBondContact O-N 3.29Å; A262-I265 PolarHBondContact O-N 2.97Å; I265-E267 VanDerWaalsContact C-N 3.34Å; I265-I268 PolarHBondContact O-N 2.98Å; I265-G269 PolarHBondContact O-N 2.87Å
266S68.1Low69.4Low85 Ų8576.2 Ų76.259%0.59440%0.395SS*.Hα-helixtrans-64.1-38.6174.6-173.30000112.3A262 K263 K264 G269 H270A262-S266 WeakPolarHBondContact O-CB 3.38Å; A262-S266 PolarHBondContact O-N 2.89Å; K263-S266 WeakPolarHBondContact O-CB 3.32Å; K263-S266 PolarHBondContact O-N 3.34Å; K264-S266 VanDerWaalsContact C-N 3.35Å; S266-G269 PolarHBondContact O-N 3.38Å; S266-H270 PolarHBondContact O-N 3.26Å
267E65.4Low69Low86 Ų8678.4 Ų78.440%0.40240%0.403SS..Hα-helixtrans-65.8-42.3176.4-172.1176.7-173.800110.9K263 K264 I265 G269 H270 L271K263-E267 WeakPolarHBondContact O-CB 3.34Å; K263-E267 PolarHBondContact O-N 3.05Å; K264-E267 WeakPolarHBondContact CD-OE2 3.25Å; K264-E267 IonicContact NZ-OE2 3.79Å; K264-E267 PolarHBondContact NZ-OE2 3.41Å; K264-E267 WeakPolarHBondContact O-CB 3.42Å; K264-E267 PolarHBondContact O-N 2.94Å; I265-E267 VanDerWaalsContact C-N 3.34Å; E267-G269 VanDerWaalsContact C-N 3.32Å; E267-G269 PolarHBondContact O-N 3.38Å; E267-H270 PolarHBondContact O-N 3.11Å; E267-L271 HydrophobicContact CG-CD1 4.49Å; E267-L271 PolarHBondContact O-N 2.92Å
268I66.7Low68.8Low74 Ų7478.6 Ų78.638%0.37940%0.403SS..Hα-helixtrans-61.3-41.8170.8-67.9162.4000110.5K264 I265 H270 L271 N272K264-I268 WeakPolarHBondContact O-CD1 3.41Å; K264-I268 VanDerWaalsContact O-CG1 3.23Å; K264-I268 WeakPolarHBondContact O-CG1 3.39Å; K264-I268 PolarHBondContact O-N 2.89Å; I265-I268 PolarHBondContact O-N 2.98Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.47Å; I268-L271 PolarHBondContact O-N 3.48Å; I268-N272 VanDerWaalsContact O-CB 3.28Å; I268-N272 WeakPolarHBondContact O-CB 3.43Å; I268-N272 PolarHBondContact O-N 2.92Å; I268-N272 PolarHBondContact O-ND2 3.35Å
269G64.4Low68.5Low35 Ų3579 Ų7936%0.36141%0.405SS..Hα-helixtrans-59.1-41.717500000112.6I265 S266 E267 Q273I265-G269 PolarHBondContact O-N 2.87Å; S266-G269 PolarHBondContact O-N 3.38Å; E267-G269 VanDerWaalsContact C-N 3.32Å; E267-G269 PolarHBondContact O-N 3.38Å; G269-Q273 PolarHBondContact O-N 3.36Å; G269-Q273 VanDerWaalsContact O-N 3.13Å
270H65.5Low68.3Low130 Ų13076.3 Ų76.360%0.60239%0.394SS*.Hα-helixtrans-67-49.7175.3-179.160.1000112.2S266 E267 I268 N272 Q273 T274S266-H270 PolarHBondContact O-N 3.26Å; E267-H270 PolarHBondContact O-N 3.11Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.47Å; H270-N272 PolarHBondContact O-N 2.98Å; H270-Q273 WeakPolarHBondContact O-CB 3.44Å; H270-Q273 PolarHBondContact O-N 3.47Å; H270-T274 PolarHBondContact O-N 3.33Å; H270-T274 PolarHBondContact O-OG1 2.98Å
271L69.8Low68.4Low105 Ų10575.5 Ų75.555%0.5539%0.39SS..Hα-helixtrans-56.8-38.2175.4-89.7157000112.2E267 I268 T274 L275E267-L271 HydrophobicContact CG-CD1 4.49Å; E267-L271 PolarHBondContact O-N 2.92Å; I268-L271 PolarHBondContact O-N 3.48Å; L271-T274 PolarHBondContact O-N 3.39Å; L271-L275 VanDerWaalsContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CB 3.49Å; L271-L275 PolarHBondContact O-N 3.42Å
272N66.1Low68.4Low34 Ų3478.3 Ų78.318%0.18240%0.399CS..Hα-helixtrans-66.6-39.4176.3-77.5-17.1000112.3L174 V178 I268 H270 T274 S276L174-N272 HydrophobicContact CD2-CB 4.09Å; V178-N272 VanDerWaalsContact CG2-ND2 3.3Å; V178-N272 WeakPolarHBondContact CG2-ND2 3.45Å; I268-N272 VanDerWaalsContact O-CB 3.28Å; I268-N272 WeakPolarHBondContact O-CB 3.43Å; I268-N272 PolarHBondContact O-N 2.92Å; I268-N272 PolarHBondContact O-ND2 3.35Å; H270-N272 PolarHBondContact O-N 2.98Å; N272-T274 VanDerWaalsContact C-N 3.34Å; N272-S276 VanDerWaalsContact O-CB 3.32Å; N272-S276 WeakPolarHBondContact O-CB 3.15Å; N272-S276 PolarHBondContact O-N 3.39Å; N272-S276 PolarHBondContact O-OG 3.33Å
273Q65.7Low68.8Low87 Ų8777.6 Ų77.641%0.40739%0.391SS..Hα-helixtrans-60.9-47.1173.6-175.366.421.800110.3L72 G269 H270 S276 E277L72-Q273 PolarHBondContact O-NE2 3.35Å; G269-Q273 PolarHBondContact O-N 3.36Å; G269-Q273 VanDerWaalsContact O-N 3.13Å; H270-Q273 WeakPolarHBondContact O-CB 3.44Å; H270-Q273 PolarHBondContact O-N 3.47Å; Q273-S276 PolarHBondContact O-N 2.96Å; Q273-E277 PolarHBondContact O-N 3.38Å
274T68.9Low68.9Low41 Ų4174.4 Ų74.425%0.25238%0.379SS..Hα-helixtrans-64.7-45.5178.4-57.70000112.5H270 L271 N272 S276 E277 H278H270-T274 PolarHBondContact O-N 3.33Å; H270-T274 PolarHBondContact O-OG1 2.98Å; L271-T274 PolarHBondContact O-N 3.39Å; N272-T274 VanDerWaalsContact C-N 3.34Å; T274-S276 PolarHBondContact O-N 3.49Å; T274-E277 WeakPolarHBondContact O-CB 3.31Å; T274-E277 PolarHBondContact O-N 3.02Å; T274-H278 PolarHBondContact O-CD2 2.88Å; T274-H278 PolarHBondContact O-N 3.5Å
275L69.5Low68.9Low90 Ų9072 Ų7247%0.47137%0.373SS..Hα-helixtrans-58.3-41.4176.1174.661.5000111L271 H278 L279L271-L275 VanDerWaalsContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CB 3.49Å; L271-L275 PolarHBondContact O-N 3.42Å; L275-H278 PolarHBondContact O-N 2.86Å; L275-L279 WeakPolarHBondContact O-CB 3.41Å; L275-L279 PolarHBondContact O-N 2.9Å
276S65.8Low69.5Low8 Ų873.6 Ų73.66%0.05639%0.385CS..Hα-helixtrans-74.6-30.7-178.1-50.80000112.9L174 N272 Q273 T274 M280L174-S276 VanDerWaalsContact CD1-OG 3.26Å; L174-S276 WeakPolarHBondContact CD1-OG 3.3Å; N272-S276 VanDerWaalsContact O-CB 3.32Å; N272-S276 WeakPolarHBondContact O-CB 3.15Å; N272-S276 PolarHBondContact O-N 3.39Å; N272-S276 PolarHBondContact O-OG 3.33Å; Q273-S276 PolarHBondContact O-N 2.96Å; T274-S276 PolarHBondContact O-N 3.49Å; S276-M280 WeakPolarHBondContact O-CB 3.34Å; S276-M280 PolarHBondContact O-N 2.92Å
277E70.3Confident70Confident129 Ų12972.7 Ų72.760%0.60337%0.371SS*.Hα-helixtrans-62.2-50.5168.3-179.5172-164.200110.8Q273 T274 L279 M280 E281Q273-E277 PolarHBondContact O-N 3.38Å; T274-E277 WeakPolarHBondContact O-CB 3.31Å; T274-E277 PolarHBondContact O-N 3.02Å; E277-L279 VanDerWaalsContact C-N 3.31Å; E277-L279 PolarHBondContact O-N 3.02Å; E277-M280 WeakPolarHBondContact O-CB 3.49Å; E277-M280 PolarHBondContact O-N 3.49Å; E277-E281 PolarHBondContact O-N 3.24Å
278H72.1Confident70.8Confident103 Ų10374.4 Ų74.448%0.47738%0.377SS..Hα-helixtrans-63.3-33.5176.1-72.1-56.3000113.3T274 L275 E281 Q282T274-H278 PolarHBondContact O-CD2 2.88Å; T274-H278 PolarHBondContact O-N 3.5Å; L275-H278 PolarHBondContact O-N 2.86Å; H278-E281 IonicContact ND1-OE2 3.54Å; H278-E281 WeakPolarHBondContact O-CB 3.48Å; H278-E281 PolarHBondContact O-N 3.18Å; H278-Q282 WeakPolarHBondContact O-CB 3.18Å; H278-Q282 PolarHBondContact O-N 2.85Å
279L67Low71.4Confident48 Ų4876.3 Ų76.325%0.25139%0.387SS..Hα-helixtrans-70.2-38.8175.7-164.9161.9000111F170 L275 E277 E281 Q282 L283F170-L279 HydrophobicContact CD1-CD1 3.9Å; F170-L279 HydrophobicContact CD2-CD1 4.45Å; F170-L279 HydrophobicContact CE1-CD1 3.54Å; F170-L279 HydrophobicContact CE2-CD1 4.14Å; F170-L279 HydrophobicContact CG-CD1 4.35Å; F170-L279 HydrophobicContact CZ-CD1 3.68Å; L275-L279 WeakPolarHBondContact O-CB 3.41Å; L275-L279 PolarHBondContact O-N 2.9Å; E277-L279 VanDerWaalsContact C-N 3.31Å; E277-L279 PolarHBondContact O-N 3.02Å; L279-E281 VanDerWaalsContact C-N 3.31Å; L279-E281 PolarHBondContact O-N 2.82Å; L279-Q282 CarbonylContact O-C 3.56Å; L279-Q282 WeakPolarHBondContact O-CB 3.35Å; L279-Q282 PolarHBondContact O-N 3.42Å; L279-Q282 VanDerWaalsContact O-N 3.16Å; L279-L283 WeakPolarHBondContact O-CB 3.26Å; L279-L283 PolarHBondContact O-N 3.27Å
280M68.8Low72.2Confident32 Ų3277 Ų7716%0.15839%0.389CS..Hα-helixtrans-59.6-4417317762.5-167.500111L167 S276 E277 L283 E284L167-M280 HydrophobicContact CD1-SD 3.94Å; L167-M280 HydrophobicContact CD2-SD 4.2Å; S276-M280 WeakPolarHBondContact O-CB 3.34Å; S276-M280 PolarHBondContact O-N 2.92Å; E277-M280 WeakPolarHBondContact O-CB 3.49Å; E277-M280 PolarHBondContact O-N 3.49Å; M280-L283 PolarHBondContact O-N 2.75Å; M280-E284 PolarHBondContact O-N 3.32Å; M280-E284 VanDerWaalsContact O-N 3.12Å
281E74.1Confident73.1Confident112 Ų11275.5 Ų75.552%0.52339%0.386SS..Hα-helixtrans-59.7-47171.3-175-178.1-172.300111.2E277 H278 L279 L283 E284 T285E277-E281 PolarHBondContact O-N 3.24Å; H278-E281 IonicContact ND1-OE2 3.54Å; H278-E281 WeakPolarHBondContact O-CB 3.48Å; H278-E281 PolarHBondContact O-N 3.18Å; L279-E281 VanDerWaalsContact C-N 3.31Å; L279-E281 PolarHBondContact O-N 2.82Å; E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 2.97Å; E281-E284 WeakPolarHBondContact O-CB 3.45Å; E281-E284 PolarHBondContact O-N 3.44Å; E281-E284 VanDerWaalsContact O-N 3.13Å; E281-T285 WeakPolarHBondContact O-CG2 3.4Å; E281-T285 PolarHBondContact O-N 3.08Å
282Q70.8Confident73.7Confident122 Ų12274.1 Ų74.157%0.5739%0.385SS*.Hα-helixtrans-60.5-36.2177.6-172.2178.5-0.900112.1H278 L279 T285 T286H278-Q282 WeakPolarHBondContact O-CB 3.18Å; H278-Q282 PolarHBondContact O-N 2.85Å; L279-Q282 CarbonylContact O-C 3.56Å; L279-Q282 WeakPolarHBondContact O-CB 3.35Å; L279-Q282 PolarHBondContact O-N 3.42Å; L279-Q282 VanDerWaalsContact O-N 3.16Å; Q282-T285 WeakPolarHBondContact CA-OG1 3.43Å; Q282-T285 PolarHBondContact O-N 3.1Å; Q282-T285 PolarHBondContact O-OG1 3.44Å; Q282-T286 WeakPolarHBondContact O-CB 3.46Å; Q282-T286 PolarHBondContact O-N 2.73Å; Q282-T286 PolarHBondContact O-OG1 3.47Å
283L73.2Confident74.7Confident10 Ų1075.9 Ų75.95%0.05240%0.4CS..Hα-helixtrans-67.4-39.9176.9-175.1146.1000111.5R163 R166 L279 M280 E281 T286 E287R163-L283 HydrophobicContact CB-CD2 4.17Å; R163-L283 HydrophobicContact CG-CD1 4.36Å; R163-L283 HydrophobicContact CG-CD2 3.47Å; R163-L283 VanDerWaalsContact CG-CD2 3.47Å; R166-L283 HydrophobicContact CB-CD1 4.31Å; L279-L283 WeakPolarHBondContact O-CB 3.26Å; L279-L283 PolarHBondContact O-N 3.27Å; M280-L283 PolarHBondContact O-N 2.75Å; E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 2.97Å; L283-T286 PolarHBondContact O-N 3.3Å; L283-E287 PolarHBondContact O-N 2.99Å
284E74.7Confident75.9Confident85 Ų8575.8 Ų75.840%0.39741%0.405SS..Hα-helixtrans-61-45.1171.1-174.9-171.8159.200111M280 E281 T286 E287 K288M280-E284 PolarHBondContact O-N 3.32Å; M280-E284 VanDerWaalsContact O-N 3.12Å; E281-E284 WeakPolarHBondContact O-CB 3.45Å; E281-E284 PolarHBondContact O-N 3.44Å; E281-E284 VanDerWaalsContact O-N 3.13Å; E284-T286 VanDerWaalsContact C-N 3.29Å; E284-T286 PolarHBondContact O-N 3.31Å; E284-E287 PolarHBondContact O-N 2.99Å; E284-K288 WeakPolarHBondContact O-CG 3.47Å; E284-K288 PolarHBondContact O-N 2.89Å; E284-K288 VanDerWaalsContact OE1-CE 3.25Å; E284-K288 WeakPolarHBondContact OE1-CE 3.28Å; E284-K288 IonicContact OE1-NZ 2.87Å; E284-K288 PolarHBondContact OE1-NZ 2.83Å
285T75.3Confident76.8Confident60 Ų6076.9 Ų76.937%0.36841%0.412SS..Hα-helixtrans-63.5-36.417667.10000112.3E281 Q282 K288 I289E281-T285 WeakPolarHBondContact O-CG2 3.4Å; E281-T285 PolarHBondContact O-N 3.08Å; Q282-T285 WeakPolarHBondContact CA-OG1 3.43Å; Q282-T285 PolarHBondContact O-N 3.1Å; Q282-T285 PolarHBondContact O-OG1 3.44Å; T285-K288 PolarHBondContact O-N 3.26Å; T285-I289 WeakPolarHBondContact O-CB 3.06Å; T285-I289 WeakPolarHBondContact O-CD1 3.41Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.82Å
286T78.3Confident77.8Confident69 Ų6974.6 Ų74.642%0.42341%0.406SS..Hα-helixtrans-68.5-39.8179.4-57.90000111.1Q282 L283 E284 I289 A290Q282-T286 WeakPolarHBondContact O-CB 3.46Å; Q282-T286 PolarHBondContact O-N 2.73Å; Q282-T286 PolarHBondContact O-OG1 3.47Å; L283-T286 PolarHBondContact O-N 3.3Å; E284-T286 VanDerWaalsContact C-N 3.29Å; E284-T286 PolarHBondContact O-N 3.31Å; T286-I289 PolarHBondContact O-N 2.69Å; T286-A290 WeakPolarHBondContact O-CB 3.49Å; T286-A290 PolarHBondContact O-N 2.84Å
287E78.1Confident79Confident67 Ų6777.8 Ų77.831%0.31343%0.425SS..Hα-helixtrans-63-45.9173.9-173.7169.1-162.700110.9L283 E284 I289 A290 D291L283-E287 PolarHBondContact O-N 2.99Å; E284-E287 PolarHBondContact O-N 2.99Å; E287-I289 VanDerWaalsContact C-N 3.31Å; E287-I289 PolarHBondContact O-N 3.3Å; E287-A290 WeakPolarHBondContact O-CB 3.32Å; E287-A290 PolarHBondContact O-N 3.44Å; E287-A290 VanDerWaalsContact O-N 3.12Å; E287-D291 PolarHBondContact O-N 2.95Å
288K81.2Confident80.1Confident122 Ų12275.2 Ų75.253%0.5341%0.413SS..Hα-helixtrans-59.2-40.3173.6-71.1175.2-175168.10112.6E284 T285 S292E284-K288 WeakPolarHBondContact O-CG 3.47Å; E284-K288 PolarHBondContact O-N 2.89Å; E284-K288 VanDerWaalsContact OE1-CE 3.25Å; E284-K288 WeakPolarHBondContact OE1-CE 3.28Å; E284-K288 IonicContact OE1-NZ 2.87Å; E284-K288 PolarHBondContact OE1-NZ 2.83Å; T285-K288 PolarHBondContact O-N 3.26Å; K288-S292 VanDerWaalsContact O-CB 3.22Å; K288-S292 WeakPolarHBondContact O-CB 3.45Å; K288-S292 PolarHBondContact O-N 3.06Å
289I80.3Confident81Confident114 Ų11477.6 Ų77.659%0.58542%0.419SS*.Hα-helixtrans-66.4-41.3175.9-69.7162.7000110.5T285 T286 E287 S292 S293T285-I289 WeakPolarHBondContact O-CB 3.06Å; T285-I289 WeakPolarHBondContact O-CD1 3.41Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.82Å; T286-I289 PolarHBondContact O-N 2.69Å; E287-I289 VanDerWaalsContact C-N 3.31Å; E287-I289 PolarHBondContact O-N 3.3Å; I289-S292 PolarHBondContact O-N 3.23Å; I289-S293 VanDerWaalsContact O-CB 3.29Å; I289-S293 WeakPolarHBondContact O-CB 3.4Å; I289-S293 PolarHBondContact O-N 3.19Å
290A80.4Confident82.3Confident49 Ų4980.4 Ų80.441%0.40543%0.433SS..Hα-helixtrans-62.4-46.8176.600000111.3T286 E287 S293 V294T286-A290 WeakPolarHBondContact O-CB 3.49Å; T286-A290 PolarHBondContact O-N 2.84Å; E287-A290 WeakPolarHBondContact O-CB 3.32Å; E287-A290 PolarHBondContact O-N 3.44Å; E287-A290 VanDerWaalsContact O-N 3.12Å; A290-S293 WeakPolarHBondContact O-CB 3.22Å; A290-S293 PolarHBondContact O-N 3.29Å; A290-V294 WeakPolarHBondContact O-CG2 3.49Å; A290-V294 PolarHBondContact O-N 3.28Å
291D84.3Confident83.5Confident98 Ų9885.3 Ų85.352%0.52445%0.45SS..Hα-helixtrans-62.8-43.5175.7-74.7-14000111.8E287 S293 V294 T295E287-D291 PolarHBondContact O-N 2.95Å; D291-S293 VanDerWaalsContact C-N 3.29Å; D291-S293 PolarHBondContact O-N 3.39Å; D291-V294 PolarHBondContact O-N 3.43Å; D291-T295 VanDerWaalsContact O-CB 3.31Å; D291-T295 WeakPolarHBondContact O-CB 3.41Å; D291-T295 PolarHBondContact O-N 3.19Å; D291-T295 PolarHBondContact O-OG1 3.19Å
292S83.9Confident84.4Confident77 Ų7784.3 Ų84.354%0.53845%0.445SS..Hα-helixtrans-62.8-37174.3-175.40000111.6K288 I289 T295 A296K288-S292 VanDerWaalsContact O-CB 3.22Å; K288-S292 WeakPolarHBondContact O-CB 3.45Å; K288-S292 PolarHBondContact O-N 3.06Å; I289-S292 PolarHBondContact O-N 3.23Å; S292-T295 PolarHBondContact O-N 3.28Å; S292-A296 WeakPolarHBondContact O-CB 3.42Å; S292-A296 PolarHBondContact O-N 2.63Å
293S86.3Confident85.4Confident70 Ų7080.1 Ų80.149%0.4944%0.435SS..Hα-helixtrans-67-46.5176.9-1760000110.5I289 A290 D291 T295 A296 T297I289-S293 VanDerWaalsContact O-CB 3.29Å; I289-S293 WeakPolarHBondContact O-CB 3.4Å; I289-S293 PolarHBondContact O-N 3.19Å; A290-S293 WeakPolarHBondContact O-CB 3.22Å; A290-S293 PolarHBondContact O-N 3.29Å; D291-S293 VanDerWaalsContact C-N 3.29Å; D291-S293 PolarHBondContact O-N 3.39Å; S293-T295 VanDerWaalsContact C-N 3.32Å; S293-T295 PolarHBondContact O-N 2.93Å; S293-A296 PolarHBondContact O-N 3.23Å; S293-T297 VanDerWaalsContact O-CG2 3.32Å; S293-T297 WeakPolarHBondContact O-CG2 3.47Å; S293-T297 PolarHBondContact O-N 2.93Å; S293-T297 PolarHBondContact O-OG1 3.29Å
294V89.7Confident86.4Confident86 Ų8684.4 Ų84.452%0.52146%0.458SS..Hα-helixtrans-60-46175.1172.50000110.1A290 D291 A296 T297 E298A290-V294 WeakPolarHBondContact O-CG2 3.49Å; A290-V294 PolarHBondContact O-N 3.28Å; D291-V294 PolarHBondContact O-N 3.43Å; V294-A296 PolarHBondContact O-N 2.98Å; V294-T297 WeakPolarHBondContact CA-OG1 3.44Å; V294-T297 PolarHBondContact O-N 3.21Å; V294-T297 VanDerWaalsContact O-N 3.17Å; V294-T297 PolarHBondContact O-OG1 3.32Å; V294-E298 PolarHBondContact O-N 2.86Å
295T89.2Confident87.3Confident63 Ų6384.2 Ų84.239%0.38746%0.457SS..Hα-helixtrans-61.9-42.7177.5-54.50000111.5D291 S292 S293 T297 E298 Y299D291-T295 VanDerWaalsContact O-CB 3.31Å; D291-T295 WeakPolarHBondContact O-CB 3.41Å; D291-T295 PolarHBondContact O-N 3.19Å; D291-T295 PolarHBondContact O-OG1 3.19Å; S292-T295 PolarHBondContact O-N 3.28Å; S293-T295 VanDerWaalsContact C-N 3.32Å; S293-T295 PolarHBondContact O-N 2.93Å; T295-T297 PolarHBondContact O-N 2.94Å; T295-E298 PolarHBondContact O-N 3.41Å; T295-Y299 HydrophobicContact CG2-CD2 3.93Å; T295-Y299 HydrophobicContact CG2-CE2 3.42Å; T295-Y299 VanDerWaalsContact CG2-CE2 3.42Å; T295-Y299 VanDerWaalsContact O-CD2 3.31Å; T295-Y299 WeakPolarHBondContact O-CD2 3.21Å; T295-Y299 PolarHBondContact O-N 2.87Å
296A89.5Confident88Confident42 Ų4287.3 Ų87.335%0.34747%0.471SS..Hα-helixtrans-63.1-40.8174.700000111.7S292 S293 V294 E298 Y299 I300S292-A296 WeakPolarHBondContact O-CB 3.42Å; S292-A296 PolarHBondContact O-N 2.63Å; S293-A296 PolarHBondContact O-N 3.23Å; V294-A296 PolarHBondContact O-N 2.98Å; A296-E298 VanDerWaalsContact C-N 3.32Å; A296-E298 PolarHBondContact O-N 3.49Å; A296-Y299 PolarHBondContact O-N 3.47Å; A296-I300 VanDerWaalsContact O-CG1 3.28Å; A296-I300 WeakPolarHBondContact O-CG1 3.43Å; A296-I300 PolarHBondContact O-N 3.33Å
297T92.1Very high88.6Confident75 Ų7588.9 Ų88.946%0.4648%0.476SS..Hα-helixtrans-63.8-37.817460.70000112.3S293 V294 T295 I300 R301S293-T297 VanDerWaalsContact O-CG2 3.32Å; S293-T297 WeakPolarHBondContact O-CG2 3.47Å; S293-T297 PolarHBondContact O-N 2.93Å; S293-T297 PolarHBondContact O-OG1 3.29Å; V294-T297 WeakPolarHBondContact CA-OG1 3.44Å; V294-T297 PolarHBondContact O-N 3.21Å; V294-T297 VanDerWaalsContact O-N 3.17Å; V294-T297 PolarHBondContact O-OG1 3.32Å; T295-T297 PolarHBondContact O-N 2.94Å; T297-I300 PolarHBondContact O-N 3.43Å; T297-R301 WeakPolarHBondContact O-CB 3.33Å; T297-R301 PolarHBondContact O-N 3.4Å
298E92.9Very high89.1Confident75 Ų7592.6 Ų92.635%0.3549%0.487SS..Hα-helixtrans-66.6-40.7173.7-77.2-58.3134.700112.1V294 T295 A296 R301 Q302V294-E298 PolarHBondContact O-N 2.86Å; T295-E298 PolarHBondContact O-N 3.41Å; A296-E298 VanDerWaalsContact C-N 3.32Å; A296-E298 PolarHBondContact O-N 3.49Å; E298-R301 PolarHBondContact O-N 2.79Å; E298-R301 IonicContact OE1-NE 3.31Å; E298-R301 IonicContact OE2-CZ 3.1Å; E298-R301 VanDerWaalsContact OE2-CZ 3.31Å; E298-R301 IonicContact OE2-NE 2.89Å; E298-R301 PolarHBondContact OE2-NE 3.41Å; E298-R301 IonicContact OE2-NH2 2.93Å; E298-R301 PolarHBondContact OE2-NH2 3.28Å; E298-Q302 WeakPolarHBondContact O-CB 3.46Å; E298-Q302 VanDerWaalsContact O-CG 3.26Å; E298-Q302 WeakPolarHBondContact O-CG 3.42Å; E298-Q302 PolarHBondContact O-N 2.92Å
299Y92Very high89.4Confident154 Ų15492 Ų9260%0.60449%0.486SS*.Hα-helixtrans-63.6-39.6173.7-73.1-44.4000112.4T295 A296 Q302 G303T295-Y299 HydrophobicContact CG2-CD2 3.93Å; T295-Y299 HydrophobicContact CG2-CE2 3.42Å; T295-Y299 VanDerWaalsContact CG2-CE2 3.42Å; T295-Y299 VanDerWaalsContact O-CD2 3.31Å; T295-Y299 WeakPolarHBondContact O-CD2 3.21Å; T295-Y299 PolarHBondContact O-N 2.87Å; A296-Y299 PolarHBondContact O-N 3.47Å; Y299-Q302 PolarHBondContact O-N 3.16Å; Y299-G303 PolarHBondContact O-N 2.89Å
300I93.8Very high89.5Confident107 Ų10789.1 Ų89.155%0.54948%0.479SS..Hα-helixtrans-63.6-45.1174.2-68.9165.6000110.2A296 T297 Q302 G303 N304A296-I300 VanDerWaalsContact O-CG1 3.28Å; A296-I300 WeakPolarHBondContact O-CG1 3.43Å; A296-I300 PolarHBondContact O-N 3.33Å; T297-I300 PolarHBondContact O-N 3.43Å; I300-Q302 PolarHBondContact O-N 2.91Å; I300-G303 PolarHBondContact O-N 2.84Å; I300-N304 WeakPolarHBondContact O-CB 3.28Å; I300-N304 VanDerWaalsContact O-CG 3.26Å; I300-N304 PolarHBondContact O-N 3.16Å; I300-N304 PolarHBondContact O-ND2 2.94Å
301R92.8Very high89.7Confident135 Ų13592 Ų9251%0.50949%0.487SS..Hα-helixtrans-60.9-45.9177.4-171.5-171.166.573.61.5111.7T297 E298 N304 E305T297-R301 WeakPolarHBondContact O-CB 3.33Å; T297-R301 PolarHBondContact O-N 3.4Å; E298-R301 PolarHBondContact O-N 2.79Å; E298-R301 IonicContact OE1-NE 3.31Å; E298-R301 IonicContact OE2-CZ 3.1Å; E298-R301 VanDerWaalsContact OE2-CZ 3.31Å; E298-R301 IonicContact OE2-NE 2.89Å; E298-R301 PolarHBondContact OE2-NE 3.41Å; E298-R301 IonicContact OE2-NH2 2.93Å; E298-R301 PolarHBondContact OE2-NH2 3.28Å; R301-N304 PolarHBondContact O-N 2.93Å; R301-E305 PolarHBondContact O-N 3.29Å; R301-E305 VanDerWaalsContact O-N 3.08Å
302Q93.1Very high89.5Confident90 Ų9091.6 Ų91.642%0.42148%0.484SS..Hα-helixtrans-63.2-44.4176-72.4172.747.400111.5E298 Y299 I300 N304 E305 L306E298-Q302 WeakPolarHBondContact O-CB 3.46Å; E298-Q302 VanDerWaalsContact O-CG 3.26Å; E298-Q302 WeakPolarHBondContact O-CG 3.42Å; E298-Q302 PolarHBondContact O-N 2.92Å; Y299-Q302 PolarHBondContact O-N 3.16Å; I300-Q302 PolarHBondContact O-N 2.91Å; Q302-N304 VanDerWaalsContact C-N 3.31Å; Q302-N304 PolarHBondContact O-N 3.47Å; Q302-E305 PolarHBondContact O-N 3.47Å; Q302-L306 WeakPolarHBondContact O-CG 3.35Å; Q302-L306 PolarHBondContact O-N 3.44Å
303G92.5Very high89.3Confident35 Ų3590 Ų9036%0.36147%0.474SS..Hα-helixtrans-59-40.8175.300000112.5Y299 I300 L306 L307Y299-G303 PolarHBondContact O-N 2.89Å; I300-G303 PolarHBondContact O-N 2.84Å; G303-L306 PolarHBondContact O-N 3.15Å; G303-L307 WeakPolarHBondContact O-CB 3.42Å; G303-L307 PolarHBondContact O-N 3.5Å
304N94.5Very high89.1Confident99 Ų9993.2 Ų93.253%0.52948%0.479SS..Hα-helixtrans-65.3-39.3175.7-74.1-19.7000112.6I300 R301 Q302 L307 R308I300-N304 WeakPolarHBondContact O-CB 3.28Å; I300-N304 VanDerWaalsContact O-CG 3.26Å; I300-N304 PolarHBondContact O-N 3.16Å; I300-N304 PolarHBondContact O-ND2 2.94Å; R301-N304 PolarHBondContact O-N 2.93Å; Q302-N304 VanDerWaalsContact C-N 3.31Å; Q302-N304 PolarHBondContact O-N 3.47Å; N304-L307 PolarHBondContact O-N 3.01Å; N304-R308 WeakPolarHBondContact O-CB 3.43Å; N304-R308 PolarHBondContact O-N 3.32Å
305E93.1Very high88.4Confident82 Ų8291.9 Ų91.938%0.38348%0.477SS..Hα-helixtrans-66.6-44.5175.8-167.762.2-135.900111.2R301 Q302 L307 R308 E309R301-E305 PolarHBondContact O-N 3.29Å; R301-E305 VanDerWaalsContact O-N 3.08Å; Q302-E305 PolarHBondContact O-N 3.47Å; E305-L307 VanDerWaalsContact C-N 3.3Å; E305-L307 PolarHBondContact O-N 2.91Å; E305-R308 PolarHBondContact O-N 3.39Å; E305-R308 VanDerWaalsContact O-N 3.16Å; E305-R308 IonicContact OE1-CZ 3.91Å; E305-R308 IonicContact OE1-NE 2.7Å; E305-R308 PolarHBondContact OE1-NE 3.49Å; E305-R308 IonicContact OE1-NH2 3.7Å; E305-R308 PolarHBondContact OE1-NH2 3.37Å; E305-R308 IonicContact OE2-CZ 2.88Å; E305-R308 IonicContact OE2-NE 2.89Å; E305-R308 IonicContact OE2-NH2 3.29Å; E305-R308 PolarHBondContact OE2-NH2 2.85Å; E305-E309 WeakPolarHBondContact O-CB 3.44Å; E305-E309 PolarHBondContact O-N 3.26Å
306L89.5Confident88Confident125 Ų12592.8 Ų92.865%0.65448%0.482SS*.Hα-helixtrans-61.7-38.7175.4-69173.8000111.9Q302 G303 E309 A310Q302-L306 WeakPolarHBondContact O-CG 3.35Å; Q302-L306 PolarHBondContact O-N 3.44Å; G303-L306 PolarHBondContact O-N 3.15Å; L306-E309 PolarHBondContact O-N 3.28Å; L306-A310 VanDerWaalsContact O-CB 3.28Å; L306-A310 WeakPolarHBondContact O-CB 3.39Å; L306-A310 PolarHBondContact O-N 3.06Å
307L90.8Very high87.7Confident102 Ų10295 Ų9553%0.53449%0.491SS..Hα-helixtrans-64.5-42.4174.6-177.262.8000111.1G303 N304 E305 A310 I311G303-L307 WeakPolarHBondContact O-CB 3.42Å; G303-L307 PolarHBondContact O-N 3.5Å; N304-L307 PolarHBondContact O-N 3.01Å; E305-L307 VanDerWaalsContact C-N 3.3Å; E305-L307 PolarHBondContact O-N 2.91Å; L307-A310 PolarHBondContact O-N 3.31Å; L307-I311 HydrophobicContact CD1-CD1 4.37Å; L307-I311 HydrophobicContact CG-CD1 4.06Å; L307-I311 VanDerWaalsContact O-CG1 3.25Å; L307-I311 WeakPolarHBondContact O-CG1 3.37Å; L307-I311 PolarHBondContact O-N 2.93Å
308R89Confident87.4Confident144 Ų14497.2 Ų97.254%0.54350%0.496SS..Hα-helixtrans-63.5-43.7176.6-171.9166.772.3158.20.1111.6N304 E305 I311 N312N304-R308 WeakPolarHBondContact O-CB 3.43Å; N304-R308 PolarHBondContact O-N 3.32Å; E305-R308 PolarHBondContact O-N 3.39Å; E305-R308 VanDerWaalsContact O-N 3.16Å; E305-R308 IonicContact OE1-CZ 3.91Å; E305-R308 IonicContact OE1-NE 2.7Å; E305-R308 PolarHBondContact OE1-NE 3.49Å; E305-R308 IonicContact OE1-NH2 3.7Å; E305-R308 PolarHBondContact OE1-NH2 3.37Å; E305-R308 IonicContact OE2-CZ 2.88Å; E305-R308 IonicContact OE2-NE 2.89Å; E305-R308 IonicContact OE2-NH2 3.29Å; E305-R308 PolarHBondContact OE2-NH2 2.85Å; R308-I311 PolarHBondContact O-N 2.72Å; R308-N312 PolarHBondContact O-N 3.35Å; R308-N312 PolarHBondContact O-ND2 3.23Å
309E87.8Confident87.2Confident111 Ų111100.1 Ų100.152%0.51951%0.508SS..Hα-helixtrans-64.1-39.9174.8-168.758.5-141.500111.5E305 L306 I311 N312 S313E305-E309 WeakPolarHBondContact O-CB 3.44Å; E305-E309 PolarHBondContact O-N 3.26Å; L306-E309 PolarHBondContact O-N 3.28Å; E309-I311 PolarHBondContact O-N 2.97Å; E309-N312 PolarHBondContact O-N 3.28Å; E309-S313 WeakPolarHBondContact O-CB 3.48Å; E309-S313 PolarHBondContact O-N 2.92Å; E309-S313 PolarHBondContact O-OG 2.94Å
310A83.3Confident87Confident53 Ų53100 Ų10044%0.43851%0.507SS..Hα-helixtrans-64.1-39175.200000112.4L306 L307 S313 K314L306-A310 VanDerWaalsContact O-CB 3.28Å; L306-A310 WeakPolarHBondContact O-CB 3.39Å; L306-A310 PolarHBondContact O-N 3.06Å; L307-A310 PolarHBondContact O-N 3.31Å; A310-S313 VanDerWaalsContact CA-OG 3.28Å; A310-S313 WeakPolarHBondContact CA-OG 3.47Å; A310-S313 PolarHBondContact O-OG 3.44Å; A310-K314 WeakPolarHBondContact O-CB 3.48Å; A310-K314 PolarHBondContact O-N 3.24Å
311I83.8Confident86.8Confident109 Ų109101.1 Ų101.156%0.55951%0.511SS*.Hα-helixtrans-66.5-46.1175.9-69.2164.1000110.7L307 R308 E309 K314L307-I311 HydrophobicContact CD1-CD1 4.37Å; L307-I311 HydrophobicContact CG-CD1 4.06Å; L307-I311 VanDerWaalsContact O-CG1 3.25Å; L307-I311 WeakPolarHBondContact O-CG1 3.37Å; L307-I311 PolarHBondContact O-N 2.93Å; R308-I311 PolarHBondContact O-N 2.72Å; E309-I311 PolarHBondContact O-N 2.97Å; I311-K314 PolarHBondContact O-N 3.12Å
312N80.8Confident86.7Confident89 Ų8999.4 Ų99.448%0.47651%0.512SS..Hα-helixtrans-67.2-42.9178.8-70.2-22.4000112R308 E309 K314 A315 T316R308-N312 PolarHBondContact O-N 3.35Å; R308-N312 PolarHBondContact O-ND2 3.23Å; E309-N312 PolarHBondContact O-N 3.28Å; N312-K314 VanDerWaalsContact C-N 3.3Å; N312-K314 PolarHBondContact O-N 3.41Å; N312-A315 PolarHBondContact O-N 2.91Å; N312-T316 PolarHBondContact O-N 3.37Å; N312-T316 PolarHBondContact O-OG1 2.96Å
313S79.4Confident86.7Confident45 Ų4599.6 Ų99.632%0.31551%0.511SS..Hα-helixtrans-65.2-32.1177.761.40000112.3E309 A310 A315 T316 V317E309-S313 WeakPolarHBondContact O-CB 3.48Å; E309-S313 PolarHBondContact O-N 2.92Å; E309-S313 PolarHBondContact O-OG 2.94Å; A310-S313 VanDerWaalsContact CA-OG 3.28Å; A310-S313 WeakPolarHBondContact CA-OG 3.47Å; A310-S313 PolarHBondContact O-OG 3.44Å; S313-A315 VanDerWaalsContact C-N 3.29Å; S313-A315 PolarHBondContact O-N 2.91Å; S313-T316 CarbonylContact O-C 3.55Å; S313-T316 WeakPolarHBondContact O-CB 3.46Å; S313-T316 PolarHBondContact O-N 3.4Å; S313-T316 VanDerWaalsContact O-N 3.13Å; S313-V317 WeakPolarHBondContact O-CB 3.26Å; S313-V317 VanDerWaalsContact O-CG2 3.29Å; S313-V317 WeakPolarHBondContact O-CG2 3.44Å; S313-V317 PolarHBondContact O-N 3.23Å
314K81.2Confident86.8Confident137 Ų137102.2 Ų102.260%0.59652%0.516SS*.Hα-helixtrans-57-42.1173.3-175.4178.7177.5-179.40111.9A310 I311 N312 V317 Q318A310-K314 WeakPolarHBondContact O-CB 3.48Å; A310-K314 PolarHBondContact O-N 3.24Å; I311-K314 PolarHBondContact O-N 3.12Å; N312-K314 VanDerWaalsContact C-N 3.3Å; N312-K314 PolarHBondContact O-N 3.41Å; K314-V317 PolarHBondContact O-N 2.88Å; K314-Q318 VanDerWaalsContact O-CG 3.3Å; K314-Q318 WeakPolarHBondContact O-CG 3.3Å; K314-Q318 PolarHBondContact O-N 2.9Å
315A75.7Confident86.8Confident58 Ų58102.8 Ų102.848%0.47952%0.519SS..Hα-helixtrans-65.5-43175.900000111.4N312 S313 V317 Q318 F319N312-A315 PolarHBondContact O-N 2.91Å; S313-A315 VanDerWaalsContact C-N 3.29Å; S313-A315 PolarHBondContact O-N 2.91Å; A315-V317 PolarHBondContact O-N 3.48Å; A315-Q318 PolarHBondContact O-N 2.89Å; A315-F319 PolarHBondContact O-N 2.95Å
316T81.4Confident86.8Confident81 Ų81103.5 Ų103.550%0.49752%0.524SS..Hα-helixtrans-61.7-42.4176.3-54.30000112.2N312 S313 F319 W320N312-T316 PolarHBondContact O-N 3.37Å; N312-T316 PolarHBondContact O-OG1 2.96Å; S313-T316 CarbonylContact O-C 3.55Å; S313-T316 WeakPolarHBondContact O-CB 3.46Å; S313-T316 PolarHBondContact O-N 3.4Å; S313-T316 VanDerWaalsContact O-N 3.13Å; T316-F319 PolarHBondContact O-N 3.28Å; T316-W320 WeakPolarHBondContact O-CB 3.5Å; T316-W320 PolarHBondContact O-N 3.21Å
317V82.5Confident87.1Confident89 Ų89101.3 Ų101.354%0.53951%0.512SS..Hα-helixtrans-64.8-41.4176.9171.10000111S313 K314 A315 W320 M321S313-V317 WeakPolarHBondContact O-CB 3.26Å; S313-V317 VanDerWaalsContact O-CG2 3.29Å; S313-V317 WeakPolarHBondContact O-CG2 3.44Å; S313-V317 PolarHBondContact O-N 3.23Å; K314-V317 PolarHBondContact O-N 2.88Å; A315-V317 PolarHBondContact O-N 3.48Å; V317-W320 PolarHBondContact O-N 3.47Å; V317-M321 HydrophobicContact CG1-CG 4.44Å; V317-M321 VanDerWaalsContact O-CG 3.31Å; V317-M321 WeakPolarHBondContact O-CG 3.28Å; V317-M321 PolarHBondContact O-N 3.39Å
318Q85Confident87.2Confident122 Ų122101.2 Ų101.257%0.5751%0.512SS*.Hα-helixtrans-61.3-45.5175.6-75.5176-24.200112K314 A315 M321 L322K314-Q318 VanDerWaalsContact O-CG 3.3Å; K314-Q318 WeakPolarHBondContact O-CG 3.3Å; K314-Q318 PolarHBondContact O-N 2.9Å; A315-Q318 PolarHBondContact O-N 2.89Å; Q318-M321 PolarHBondContact O-N 3.45Å; Q318-L322 PolarHBondContact O-N 3.09Å; Q318-L322 VanDerWaalsContact O-N 3.11Å
319F88.4Confident87.4Confident136 Ų13698.4 Ų98.460%0.59651%0.511SS*.Hα-helixtrans-61.6-44.6175.9-178.3-94.4000111.8A315 T316 M321 L322 F323A315-F319 PolarHBondContact O-N 2.95Å; T316-F319 PolarHBondContact O-N 3.28Å; F319-M321 PolarHBondContact O-N 3.17Å; F319-L322 PolarHBondContact O-N 2.95Å; F319-F323 WeakPolarHBondContact O-CB 3.47Å; F319-F323 PolarHBondContact O-N 3.41Å
320W88.6Confident87.7Confident151 Ų15198.9 Ų98.957%0.57251%0.511SS*.Hα-helixtrans-61.5-42.2177.1-96.995.8000113T316 V317 L322 F323 I324T316-W320 WeakPolarHBondContact O-CB 3.5Å; T316-W320 PolarHBondContact O-N 3.21Å; V317-W320 PolarHBondContact O-N 3.47Å; W320-L322 VanDerWaalsContact C-N 3.33Å; W320-L322 PolarHBondContact O-N 3.17Å; W320-F323 HydrophobicContact CE3-CD1 4.49Å; W320-F323 HydrophobicContact CZ3-CD1 4.45Å; W320-F323 PolarHBondContact O-N 3.45Å; W320-I324 HydrophobicContact CE3-CD1 4.18Å; W320-I324 HydrophobicContact CE3-CG1 4.33Å; W320-I324 WeakPolarHBondContact O-CB 3.48Å; W320-I324 VanDerWaalsContact O-CG1 3.3Å; W320-I324 WeakPolarHBondContact O-CG1 3.49Å; W320-I324 PolarHBondContact O-N 2.98Å
321M89.1Confident88.2Confident131 Ų13199.5 Ų99.565%0.64551%0.512SS*.Hα-helixtrans-60.8-43.3175.4-75-70.1-73.500111.6V317 Q318 F319 I324 L325V317-M321 HydrophobicContact CG1-CG 4.44Å; V317-M321 VanDerWaalsContact O-CG 3.31Å; V317-M321 WeakPolarHBondContact O-CG 3.28Å; V317-M321 PolarHBondContact O-N 3.39Å; Q318-M321 PolarHBondContact O-N 3.45Å; F319-M321 PolarHBondContact O-N 3.17Å; M321-I324 PolarHBondContact O-N 2.88Å; M321-L325 WeakPolarHBondContact O-CB 3.39Å; M321-L325 PolarHBondContact O-N 3.27Å
322L91.7Very high88.4Confident99 Ų9999.3 Ų99.352%0.51851%0.512SS..Hα-helixtrans-67.2-39.4178-170.6138.3000111.9Q318 F319 W320 L325 I326Q318-L322 PolarHBondContact O-N 3.09Å; Q318-L322 VanDerWaalsContact O-N 3.11Å; F319-L322 PolarHBondContact O-N 2.95Å; W320-L322 VanDerWaalsContact C-N 3.33Å; W320-L322 PolarHBondContact O-N 3.17Å; L322-L325 WeakPolarHBondContact O-CB 3.33Å; L322-L325 PolarHBondContact O-N 3.4Å; L322-I326 HydrophobicContact CD2-CD1 3.72Å; L322-I326 PolarHBondContact O-N 3.41Å
323F93.6Very high88.7Confident93 Ų93100.5 Ų100.541%0.40851%0.514SS..Hα-helixtrans-62.9-45.5175.6-176.5-109.4000112.1F319 W320 L325 I326 I327F319-F323 WeakPolarHBondContact O-CB 3.47Å; F319-F323 PolarHBondContact O-N 3.41Å; W320-F323 HydrophobicContact CE3-CD1 4.49Å; W320-F323 HydrophobicContact CZ3-CD1 4.45Å; W320-F323 PolarHBondContact O-N 3.45Å; F323-L325 VanDerWaalsContact C-N 3.31Å; F323-L325 PolarHBondContact O-N 3.16Å; F323-I326 PolarHBondContact O-N 3.1Å; F323-I327 HydrophobicContact CD1-CD1 3.66Å; F323-I327 HydrophobicContact CE1-CD1 3.21Å; F323-I327 HydrophobicContact CE1-CG1 4.38Å; F323-I327 HydrophobicContact CE2-CD1 4.18Å; F323-I327 HydrophobicContact CG-CD1 4.32Å; F323-I327 HydrophobicContact CZ-CD1 3.51Å; F323-I327 HydrophobicContact CZ-CG1 4.38Å; F323-I327 WeakPolarHBondContact O-CG1 3.28Å; F323-I327 PolarHBondContact O-N 3.28Å
324I93.6Very high89.2Confident90 Ų90103.1 Ų103.146%0.46252%0.52SS..Hα-helixtrans-60.8-41.9174.6-70.9165.8000110.7W320 M321 I326 I327 L328W320-I324 HydrophobicContact CE3-CD1 4.18Å; W320-I324 HydrophobicContact CE3-CG1 4.33Å; W320-I324 WeakPolarHBondContact O-CB 3.48Å; W320-I324 VanDerWaalsContact O-CG1 3.3Å; W320-I324 WeakPolarHBondContact O-CG1 3.49Å; W320-I324 PolarHBondContact O-N 2.98Å; M321-I324 PolarHBondContact O-N 2.88Å; I324-I326 VanDerWaalsContact C-N 3.35Å; I324-I326 PolarHBondContact O-N 2.83Å; I324-I327 PolarHBondContact O-N 2.89Å; I324-L328 WeakPolarHBondContact O-CB 3.33Å; I324-L328 PolarHBondContact O-N 3.05Å
325L94Very high89.5Confident112 Ų112102.2 Ų102.259%0.58652%0.521SS*.Hα-helixtrans-60.9-43.3177.4-169.5102.5000111.7M321 L322 F323 L328 T329M321-L325 WeakPolarHBondContact O-CB 3.39Å; M321-L325 PolarHBondContact O-N 3.27Å; L322-L325 WeakPolarHBondContact O-CB 3.33Å; L322-L325 PolarHBondContact O-N 3.4Å; F323-L325 VanDerWaalsContact C-N 3.31Å; F323-L325 PolarHBondContact O-N 3.16Å; L325-L328 PolarHBondContact O-N 3.37Å; L325-T329 WeakPolarHBondContact O-CB 3.34Å; L325-T329 PolarHBondContact O-N 3.45Å; L325-T329 PolarHBondContact O-OG1 2.7Å
326I94.4Very high90Very high97 Ų97105.2 Ų105.250%0.49753%0.529SS..Hα-helixtrans-61.8-48.2176-76.4171.8000110.7L322 F323 I324 L328 T329 F330L322-I326 HydrophobicContact CD2-CD1 3.72Å; L322-I326 PolarHBondContact O-N 3.41Å; F323-I326 PolarHBondContact O-N 3.1Å; I324-I326 VanDerWaalsContact C-N 3.35Å; I324-I326 PolarHBondContact O-N 2.83Å; I326-L328 VanDerWaalsContact C-N 3.35Å; I326-L328 PolarHBondContact O-N 3.42Å; I326-T329 PolarHBondContact O-N 2.89Å; I326-F330 WeakPolarHBondContact O-CB 3.5Å; I326-F330 PolarHBondContact O-N 2.66Å
327I94.4Very high90.1Very high78 Ų78110.5 Ų110.540%0.454%0.54SS..Hα-helixtrans-60.7-46.3178.6-70169.7000110.5F323 I324 T329 F330 S331F323-I327 HydrophobicContact CD1-CD1 3.66Å; F323-I327 HydrophobicContact CE1-CD1 3.21Å; F323-I327 HydrophobicContact CE1-CG1 4.38Å; F323-I327 HydrophobicContact CE2-CD1 4.18Å; F323-I327 HydrophobicContact CG-CD1 4.32Å; F323-I327 HydrophobicContact CZ-CD1 3.51Å; F323-I327 HydrophobicContact CZ-CG1 4.38Å; F323-I327 WeakPolarHBondContact O-CG1 3.28Å; F323-I327 PolarHBondContact O-N 3.28Å; I324-I327 PolarHBondContact O-N 2.89Å; I327-T329 VanDerWaalsContact C-N 3.31Å; I327-T329 PolarHBondContact O-N 3.13Å; I327-F330 PolarHBondContact O-N 3.09Å; I327-F330 VanDerWaalsContact O-N 3.15Å; I327-S331 WeakPolarHBondContact O-CB 3.4Å; I327-S331 PolarHBondContact O-N 3.04Å; I327-S331 PolarHBondContact O-OG 3.49Å
328L94Very high90.2Very high101 Ų101114.4 Ų114.453%0.52955%0.55SS.*Hα-helixtrans-60.5-42.6178.6-178.366.1000111.5I324 L325 I326 F330 S331 L332I324-L328 WeakPolarHBondContact O-CB 3.33Å; I324-L328 PolarHBondContact O-N 3.05Å; L325-L328 PolarHBondContact O-N 3.37Å; I326-L328 VanDerWaalsContact C-N 3.35Å; I326-L328 PolarHBondContact O-N 3.42Å; L328-F330 VanDerWaalsContact C-N 3.31Å; L328-F330 PolarHBondContact O-N 3.03Å; L328-S331 PolarHBondContact O-N 3.44Å; L328-L332 HydrophobicContact CD1-CD1 4.46Å; L328-L332 HydrophobicContact CG-CD1 4.16Å; L328-L332 WeakPolarHBondContact O-CB 3.26Å; L328-L332 WeakPolarHBondContact O-CG 3.17Å; L328-L332 PolarHBondContact O-N 2.9Å
329T93.8Very high89.7Confident85 Ų85117.9 Ų117.952%0.52156%0.56SS.*Hα-helixtrans-61.4-42.8176-54.70000110.7L325 I326 I327 L332 H333L325-T329 WeakPolarHBondContact O-CB 3.34Å; L325-T329 PolarHBondContact O-N 3.45Å; L325-T329 PolarHBondContact O-OG1 2.7Å; I326-T329 PolarHBondContact O-N 2.89Å; I327-T329 VanDerWaalsContact C-N 3.31Å; I327-T329 PolarHBondContact O-N 3.13Å; T329-L332 PolarHBondContact O-N 3.17Å; T329-H333 WeakPolarHBondContact O-CB 3.42Å; T329-H333 PolarHBondContact O-N 3.29Å
330F93.8Very high88.6Confident120 Ų120119.7 Ų119.753%0.52659%0.585SS.*Hα-helixtrans-70.4-39.4179.5-152.1-119.6000112.2I326 I327 L328 H333 F334I326-F330 WeakPolarHBondContact O-CB 3.5Å; I326-F330 PolarHBondContact O-N 2.66Å; I327-F330 PolarHBondContact O-N 3.09Å; I327-F330 VanDerWaalsContact O-N 3.15Å; L328-F330 VanDerWaalsContact C-N 3.31Å; L328-F330 PolarHBondContact O-N 3.03Å; F330-H333 PolarHBondContact O-N 3.07Å; F330-F334 AromaticContact CD1-CD2 3.7Å; F330-F334 HydrophobicContact CD1-CD2 3.7Å; F330-F334 AromaticContact CD1-CE2 3.23Å; F330-F334 HydrophobicContact CD1-CE2 3.23Å; F330-F334 HydrophobicContact CD1-CZ 4.1Å; F330-F334 AromaticContact CE1-CD2 3.87Å; F330-F334 HydrophobicContact CE1-CD2 3.87Å; F330-F334 AromaticContact CE1-CE2 2.93Å; F330-F334 HydrophobicContact CE1-CE2 2.93Å; F330-F334 AromaticContact CE1-CZ 3.38Å; F330-F334 HydrophobicContact CE1-CZ 3.38Å; F330-F334 HydrophobicContact CE2-CE2 4.44Å; F330-F334 HydrophobicContact CE2-CZ 4.49Å; F330-F334 HydrophobicContact CG-CD2 4.32Å; F330-F334 HydrophobicContact CG-CE2 4.15Å; F330-F334 AromaticContact CZ-CE2 3.6Å; F330-F334 HydrophobicContact CZ-CE2 3.6Å; F330-F334 AromaticContact CZ-CZ 3.58Å; F330-F334 HydrophobicContact CZ-CZ 3.58Å; F330-F334 WeakPolarHBondContact O-CD2 3.44Å; F330-F334 PolarHBondContact O-N 3.3Å
331S93.2Very high88.6Confident67 Ų67118.1 Ų118.147%0.46959%0.586SS.*Hα-helixtrans-61.2-43.7172.6-66.30000111.7I327 L328 F334 L335I327-S331 WeakPolarHBondContact O-CB 3.4Å; I327-S331 PolarHBondContact O-N 3.04Å; I327-S331 PolarHBondContact O-OG 3.49Å; L328-S331 PolarHBondContact O-N 3.44Å; S331-F334 PolarHBondContact O-N 2.61Å; S331-L335 WeakPolarHBondContact O-CB 3.35Å; S331-L335 PolarHBondContact O-N 3.16Å
332L87.6Confident88.5Confident104 Ų104117.4 Ų117.455%0.54558%0.582SS.*Hα-helixtrans-65.1-41.9174.9-77.9163.8000111.8L328 T329 F334 L335 D336L328-L332 HydrophobicContact CD1-CD1 4.46Å; L328-L332 HydrophobicContact CG-CD1 4.16Å; L328-L332 WeakPolarHBondContact O-CB 3.26Å; L328-L332 WeakPolarHBondContact O-CG 3.17Å; L328-L332 PolarHBondContact O-N 2.9Å; T329-L332 PolarHBondContact O-N 3.17Å; L332-F334 PolarHBondContact O-N 3.19Å; L332-L335 PolarHBondContact O-N 3.33Å; L332-D336 WeakPolarHBondContact O-CB 3.33Å; L332-D336 PolarHBondContact O-N 2.92Å
333H88.3Confident88.4Confident115 Ų115118.4 Ų118.453%0.53259%0.586SS.*Hα-helixtrans-61.7-43176.6-176.563.9000112.1T329 F330 W337T329-H333 WeakPolarHBondContact O-CB 3.42Å; T329-H333 PolarHBondContact O-N 3.29Å; F330-H333 PolarHBondContact O-N 3.07Å; H333-W337 WeakPolarHBondContact O-CB 3.37Å; H333-W337 PolarHBondContact O-N 3.13Å
334F89.3Confident88.1Confident99 Ų99119.9 Ų119.943%0.43460%0.596SS.*Hα-helixtrans-70.3-33.7174.2-78.5-52.1000113.4F330 S331 L332 W337 F338F330-F334 AromaticContact CD1-CD2 3.7Å; F330-F334 HydrophobicContact CD1-CD2 3.7Å; F330-F334 AromaticContact CD1-CE2 3.23Å; F330-F334 HydrophobicContact CD1-CE2 3.23Å; F330-F334 HydrophobicContact CD1-CZ 4.1Å; F330-F334 AromaticContact CE1-CD2 3.87Å; F330-F334 HydrophobicContact CE1-CD2 3.87Å; F330-F334 AromaticContact CE1-CE2 2.93Å; F330-F334 HydrophobicContact CE1-CE2 2.93Å; F330-F334 AromaticContact CE1-CZ 3.38Å; F330-F334 HydrophobicContact CE1-CZ 3.38Å; F330-F334 HydrophobicContact CE2-CE2 4.44Å; F330-F334 HydrophobicContact CE2-CZ 4.49Å; F330-F334 HydrophobicContact CG-CD2 4.32Å; F330-F334 HydrophobicContact CG-CE2 4.15Å; F330-F334 AromaticContact CZ-CE2 3.6Å; F330-F334 HydrophobicContact CZ-CE2 3.6Å; F330-F334 AromaticContact CZ-CZ 3.58Å; F330-F334 HydrophobicContact CZ-CZ 3.58Å; F330-F334 WeakPolarHBondContact O-CD2 3.44Å; F330-F334 PolarHBondContact O-N 3.3Å; S331-F334 PolarHBondContact O-N 2.61Å; L332-F334 PolarHBondContact O-N 3.19Å; F334-W337 HydrophobicContact CD1-CE3 4.13Å; F334-W337 PolarHBondContact O-N 3.33Å; F334-F338 WeakPolarHBondContact O-CB 3.4Å; F334-F338 PolarHBondContact O-N 3.11Å
335L87.5Confident87.7Confident118 Ų118121.8 Ų121.862%0.61861%0.605SS**Hα-helixtrans-64.7-44.2176.1-161.281.4000110.7S331 L332 W337 F338 Y339S331-L335 WeakPolarHBondContact O-CB 3.35Å; S331-L335 PolarHBondContact O-N 3.16Å; L332-L335 PolarHBondContact O-N 3.33Å; L335-W337 VanDerWaalsContact C-N 3.35Å; L335-F338 PolarHBondContact O-N 2.87Å; L335-Y339 WeakPolarHBondContact O-CB 3.43Å; L335-Y339 PolarHBondContact O-N 2.68Å
336D85.6Confident87.3Confident122 Ų122122.5 Ų122.565%0.65261%0.606SS**Hα-helixtrans-63.7-40.7175-166.148.8000111.2L332L332-D336 WeakPolarHBondContact O-CB 3.33Å; L332-D336 PolarHBondContact O-N 2.92Å
337W84.6Confident86.8Confident191 Ų191124.3 Ų124.372%0.72361%0.614SS**Hα-helixtrans-71.2-32.3177.1-172.958.3000113.7H333 F334 L335H333-W337 WeakPolarHBondContact O-CB 3.37Å; H333-W337 PolarHBondContact O-N 3.13Å; F334-W337 HydrophobicContact CD1-CE3 4.13Å; F334-W337 PolarHBondContact O-N 3.33Å; L335-W337 VanDerWaalsContact C-N 3.35Å
338F84.6Confident86.2Confident171 Ų171127.8 Ų127.875%0.7563%0.63SS**Hα-helixtrans-85.3-24.2-178.5-165.7-91.6000112.9F334 L335 P340F334-F338 WeakPolarHBondContact O-CB 3.4Å; F334-F338 PolarHBondContact O-N 3.11Å; L335-F338 PolarHBondContact O-N 2.87Å; F338-P340 VanDerWaalsContact O-CD 3.26Å; F338-P340 WeakPolarHBondContact O-CD 3.49Å
339Y74.6Confident85.6Confident195 Ų195130.1 Ų130.177%0.76564%0.639SS**  trans-118.664.3-179.9-131-87.9000111.3L335L335-Y339 WeakPolarHBondContact O-CB 3.43Å; L335-Y339 PolarHBondContact O-N 2.68Å
340P64Low84.8Confident174 Ų174134.2 Ų134.2100%1.1365%0.649SS**  trans-68.10-178.729.8-36000114.3F338F338-P340 VanDerWaalsContact O-CD 3.26Å; F338-P340 WeakPolarHBondContact O-CD 3.49Å

Retrieved 340 of 340 residues in 95.8 ms (Link to these results)