A0A087Y4E3_POEFO Loading...

Prenyl (decaprenyl) diphosphate synthase, subunit 2

AlphaFold DB , UniProt , Accession A0A087Y4E3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 385 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M29.9Very low26.9Very low220 Ų220142.2 Ų142.2100%1.08482%0.815SS**  01060-172.9166.1-176.900107.3
2F26.6Very low26.6Very low175 Ų175150.3 Ų150.377%0.76882%0.823SS**  trans63.2134.1160.9-68.8-64.4000118.3
3L26.7Very low26.3Very low158 Ų158148.6 Ų148.683%0.82782%0.819SS**  cis-156.6150.916.2-94.4144.1000110.3
4A28.8Very low26Very low88 Ų88144.8 Ų144.873%0.72781%0.808SS**  trans-105158.6162.700000109.8
5P31.3Very low25.9Very low130 Ų130141.9 Ų141.984%0.84480%0.796SS**  trans-119.9134.2149.231.9-18.8000111.2
6G26.2Very low26.1Very low78 Ų78135.6 Ų135.680%0.80476%0.764SS**  trans-80.3168.117600000113.6
7S25.7Very low26.3Very low114 Ų114130.2 Ų130.280%0.79773%0.734SS**  trans-151.3125144.651.60000109
8S28.1Very low26.7Very low106 Ų106128.4 Ų128.474%0.74171%0.714SS**  trans-74.4132.2174.160.40000110.1
9L24.6Very low27Very low154 Ų154124.8 Ų124.881%0.80671%0.709SS**  trans-124.978.3164.4-94.6156000109R11L9-R11 VanDerWaalsContact C-N 3.27Å; L9-R11 PolarHBondContact O-N 3.37Å
10T25.1Very low27.5Very low119 Ų119123.5 Ų123.573%0.7370%0.699SS**  trans-67.390153.829.70000107.6W12T10-W12 PolarHBondContact O-N 2.92Å
11R22.5Very low28.1Very low222 Ų222123.2 Ų123.284%0.83869%0.687SS**  trans-86.2107.4175.7-154.9174.7-172.2-175.81.8109.1L9 V13L9-R11 VanDerWaalsContact C-N 3.27Å; L9-R11 PolarHBondContact O-N 3.37Å; R11-V13 PolarHBondContact O-N 3.42Å
12W23.4Very low28.3Very low240 Ų240113.7 Ų113.791%0.90965%0.645SS**  trans-56117.8173.3-69.466.2000110.4T10T10-W12 PolarHBondContact O-N 2.92Å
13V22.8Very low28.6Very low128 Ų128110.2 Ų110.278%0.77663%0.634SS**  trans-99106.6168.1177.60000107R11 V15R11-V13 PolarHBondContact O-N 3.42Å; V13-V15 PolarHBondContact O-N 2.92Å
14S22.1Very low29Very low95 Ų95107 Ų10766%0.66462%0.624SS**  trans-69.4112.9173.658.80000109.6S16S14-S16 PolarHBondContact O-N 3.24Å
15V24.8Very low29.2Very low102 Ų102106 Ų10662%0.61861%0.606SS**  trans-74.9110.6177.1171.30000108.8V13 V17V13-V15 PolarHBondContact O-N 2.92Å; V15-V17 HydrophobicContact CG1-CG2 3.55Å
16S28.5Very low29.6Very low41 Ų41104.4 Ų104.429%0.28759%0.586SS.*  trans-92.3114.7174.8-170.10000107.9S14 Q329S14-S16 PolarHBondContact O-N 3.24Å; S16-Q329 PolarHBondContact OG-NE2 3.2Å
17V30.7Very low29.7Very low43 Ų43106.8 Ų106.826%0.26159%0.591SS.*  trans-132.7102.6-178.7168.10000108V15 L20V15-V17 HydrophobicContact CG1-CG2 3.55Å; V17-L20 HydrophobicContact CB-CD1 4.42Å; V17-L20 HydrophobicContact CG1-CD1 3.08Å; V17-L20 HydrophobicContact CG1-CD2 4.49Å; V17-L20 HydrophobicContact CG1-CG 3.49Å; V17-L20 VanDerWaalsContact CG1-CG 3.49Å
18R33.1Very low30.2Very low99 Ų99105.5 Ų105.537%0.37458%0.582SS.*  trans-132.7131.5173.8-76.8-176.3150.9-148.4-35.1108.3N328 Q329R18-N328 PolarHBondContact NH1-O 3.27Å; R18-N328 PolarHBondContact NH2-O 2.71Å; R18-Q329 VanDerWaalsContact NH2-CA 3.31Å
19G33Very low30.6Very low59 Ų59103.3 Ų103.361%0.60857%0.567SS**SBendtrans70.246179.400000114.6R21G19-R21 PolarHBondContact O-N 3.47Å
20L36.4Very low31.1Very low98 Ų98104 Ų10451%0.51357%0.566SS.*  trans-70.397.5173.7-85.4171.1000111V17 G22V17-L20 HydrophobicContact CB-CD1 4.42Å; V17-L20 HydrophobicContact CG1-CD1 3.08Å; V17-L20 HydrophobicContact CG1-CD2 4.49Å; V17-L20 HydrophobicContact CG1-CG 3.49Å; V17-L20 VanDerWaalsContact CG1-CG 3.49Å; L20-G22 PolarHBondContact O-N 2.9Å
21R39.8Very low32Very low119 Ų119100.1 Ų100.145%0.44954%0.543SS..  trans-8320.9151.8-68.2-169-176.6-1767.7112.9G19 N216G19-R21 PolarHBondContact O-N 3.47Å; R21-N216 PolarHBondContact NH1-OD1 2.87Å; R21-N216 PolarHBondContact NH2-OD1 3.21Å
22G33.1Very low33.3Very low19 Ų1991.7 Ų91.720%0.19652%0.518CS..  trans-116.385.2176.300000110.7L20 S24L20-G22 PolarHBondContact O-N 2.9Å; G22-S24 VanDerWaalsContact C-N 3.3Å; G22-S24 PolarHBondContact O-N 3.01Å; G22-S24 VanDerWaalsContact O-N 3.1Å
23L34Very low35Very low103 Ų10384.3 Ų84.354%0.53950%0.503SS..  trans-77.989.2162.2-67.2162.9000107.8L25L23-L25 HydrophobicContact CB-CD2 3.83Å; L23-L25 HydrophobicContact CB-CG 3.68Å; L23-L25 HydrophobicContact CD1-CD2 4.02Å; L23-L25 HydrophobicContact CD2-CD2 4.1Å; L23-L25 HydrophobicContact CG-CD2 4.21Å; L23-L25 PolarHBondContact O-N 3.31Å
24S34.2Very low37.1Very low90 Ų9081.6 Ų81.663%0.62948%0.484SS*.  trans-67.992.6146.7174.90000105.6G22 F26G22-S24 VanDerWaalsContact C-N 3.3Å; G22-S24 PolarHBondContact O-N 3.01Å; G22-S24 VanDerWaalsContact O-N 3.1Å; S24-F26 PolarHBondContact O-N 3.39Å; S24-F26 VanDerWaalsContact O-N 3.15Å
25L34.4Very low39.4Very low66 Ų6678.7 Ų78.735%0.34646%0.459SS..  trans-70.5-3.7-162.4-90.5173.2000115.6L23 S281L23-L25 HydrophobicContact CB-CD2 3.83Å; L23-L25 HydrophobicContact CB-CG 3.68Å; L23-L25 HydrophobicContact CD1-CD2 4.02Å; L23-L25 HydrophobicContact CD2-CD2 4.1Å; L23-L25 HydrophobicContact CG-CD2 4.21Å; L23-L25 PolarHBondContact O-N 3.31Å; L25-S281 VanDerWaalsContact CD2-OG 3.24Å; L25-S281 WeakPolarHBondContact CD2-OG 3.45Å
26F40.2Very low41.6Very low97 Ų9775.4 Ų75.443%0.42544%0.44SS..  trans-142.6105.1-167.9-55-70.8000112.7S24 N94S24-F26 PolarHBondContact O-N 3.39Å; S24-F26 VanDerWaalsContact O-N 3.15Å; F26-N94 WeakPolarHBondContact CE1-ND2 3.17Å; F26-N94 HydrophobicContact CE2-CB 4.01Å; F26-N94 WeakPolarHBondContact CE2-ND2 3.41Å; F26-N94 HydrophobicContact CZ-CB 4.35Å; F26-N94 WeakPolarHBondContact CZ-ND2 3.41Å
27S26.9Very low43.9Very low128 Ų12879.9 Ų79.990%0.89546%0.455SS*.  trans-129.9132.1158.1-1800000108.5
28S36.8Very low46.2Very low88 Ų8879 Ų7962%0.61545%0.449SS*.  trans-87.4156.4-15957.80000113.9
29S36.7Very low48.3Very low60 Ų6074.8 Ų74.842%0.4244%0.435SS..SBend-162.915580.143.10000112.9R290S29-R290 PolarHBondContact OG-NH2 2.77Å
30E33.8Very low50.3Low169 Ų16974.5 Ų74.579%0.7942%0.423SS*.SBendtrans81-60.5-177.2-72.6-174.5165.700118.9S32 S33E30-S32 PolarHBondContact O-N 3.44Å; E30-S33 PolarHBondContact O-N 3.48Å; E30-S33 PolarHBondContact O-OG 2.81Å; E30-S33 VanDerWaalsContact O-OG 3.04Å
31S44.3Very low52.4Low37 Ų3773 Ų7326%0.25942%0.416SS..Hα-helixtrans-70.2-19.4178.7920000113.5S33 W35 K288S31-S33 VanDerWaalsContact C-N 3.32Å; S31-S33 PolarHBondContact O-N 3.16Å; S31-W35 PolarHBondContact O-N 2.62Å; S31-K288 PolarHBondContact OG-NZ 3.34Å
32S51.2Low54.4Low45 Ų4567.4 Ų67.432%0.31540%0.395SS..Hα-helixtrans-65.1-35.9179.664.40000111.4E30 N34 W35 S36E30-S32 PolarHBondContact O-N 3.44Å; S32-N34 PolarHBondContact O-N 3.15Å; S32-W35 PolarHBondContact O-N 3.44Å; S32-S36 WeakPolarHBondContact O-CB 3.48Å; S32-S36 PolarHBondContact O-N 3.33Å; S32-S36 PolarHBondContact O-OG 3.12Å
33S57.5Low56.6Low84 Ų8469.2 Ų69.259%0.58740%0.398SS*.Hα-helixtrans-67.7-36.2-17765.50000112.8E30 S31 K37E30-S33 PolarHBondContact O-N 3.48Å; E30-S33 PolarHBondContact O-OG 2.81Å; E30-S33 VanDerWaalsContact O-OG 3.04Å; S31-S33 VanDerWaalsContact C-N 3.32Å; S31-S33 PolarHBondContact O-N 3.16Å; S33-K37 WeakPolarHBondContact O-CB 3.43Å; S33-K37 PolarHBondContact O-N 3.2Å
34N67.5Low58.9Low71 Ų7171 Ų7138%0.3840%0.402SS..Hα-helixtrans-71.8-46.5178.5-161.9-5.5000111.1S32 K37 V38S32-N34 PolarHBondContact O-N 3.15Å; N34-K37 PolarHBondContact O-N 3.19Å; N34-V38 WeakPolarHBondContact O-CG2 3.26Å; N34-V38 PolarHBondContact O-N 2.78Å
35W71.1Confident61.2Low35 Ų3568.2 Ų68.213%0.13338%0.379CS..Hα-helixtrans-61.1-48.4177.1-177.9-96.3000112.3S31 S32 K37 V38 V39 N94 M97 I378 A381 V382S31-W35 PolarHBondContact O-N 2.62Å; S32-W35 PolarHBondContact O-N 3.44Å; W35-K37 VanDerWaalsContact C-N 3.26Å; W35-K37 PolarHBondContact O-N 3.44Å; W35-V38 PolarHBondContact O-N 2.96Å; W35-V39 HydrophobicContact CD2-CG2 4.43Å; W35-V39 HydrophobicContact CZ2-CG2 4.18Å; W35-V39 WeakPolarHBondContact O-CG2 3.47Å; W35-V39 PolarHBondContact O-N 2.97Å; W35-N94 PolarHBondContact NE1-OD1 3.46Å; W35-M97 HydrophobicContact CH2-SD 4.47Å; W35-M97 HydrophobicContact CZ2-CE 3.76Å; W35-M97 HydrophobicContact CZ2-CG 4.42Å; W35-M97 HydrophobicContact CZ2-SD 3.99Å; W35-I378 HydrophobicContact CH2-CG2 3.71Å; W35-I378 HydrophobicContact CZ3-CG2 4.14Å; W35-A381 HydrophobicContact CE3-CB 3.71Å; W35-A381 HydrophobicContact CZ3-CB 3.87Å; W35-V382 HydrophobicContact CH2-CG2 3.99Å; W35-V382 HydrophobicContact CZ3-CG2 3.81Å
36S70.2Confident63.5Low32 Ų3265.1 Ų65.122%0.22436%0.363CS..Hα-helixtrans-57.4-40.1177-57.70000112.2S32 S40 N93S32-S36 WeakPolarHBondContact O-CB 3.48Å; S32-S36 PolarHBondContact O-N 3.33Å; S32-S36 PolarHBondContact O-OG 3.12Å; S36-S40 VanDerWaalsContact O-CB 3.29Å; S36-S40 WeakPolarHBondContact O-CB 3.43Å; S36-S40 PolarHBondContact O-N 3.44Å; S36-N93 VanDerWaalsContact CB-OD1 3.31Å; S36-N93 WeakPolarHBondContact CB-OD1 3.44Å; S36-N93 PolarHBondContact OG-OD1 3.03Å
37K76.8Confident64.6Low136 Ų13662.3 Ų62.359%0.59136%0.362SS*.Hα-helixtrans-65.3-48177-175.4179.7178.4-176.80111.5S33 N34 W35 V39 S40 D41S33-K37 WeakPolarHBondContact O-CB 3.43Å; S33-K37 PolarHBondContact O-N 3.2Å; N34-K37 PolarHBondContact O-N 3.19Å; W35-K37 VanDerWaalsContact C-N 3.26Å; W35-K37 PolarHBondContact O-N 3.44Å; K37-V39 VanDerWaalsContact C-N 3.31Å; K37-V39 PolarHBondContact O-N 3.4Å; K37-S40 PolarHBondContact O-N 2.93Å; K37-D41 WeakPolarHBondContact O-CB 3.5Å; K37-D41 PolarHBondContact O-N 2.85Å
38V80.3Confident66.1Low23 Ų2363 Ų6314%0.13935%0.346CS..Hα-helixtrans-57.9-44.9178.4170.60000111N34 W35 A42 N377 I378N34-V38 WeakPolarHBondContact O-CG2 3.26Å; N34-V38 PolarHBondContact O-N 2.78Å; W35-V38 PolarHBondContact O-N 2.96Å; V38-A42 VanDerWaalsContact O-CB 3.3Å; V38-A42 WeakPolarHBondContact O-CB 3.45Å; V38-A42 PolarHBondContact O-N 3.46Å; V38-N377 HydrophobicContact CG1-CB 4.25Å; V38-I378 HydrophobicContact CG1-CB 4.4Å; V38-I378 HydrophobicContact CG1-CG1 3.54Å
39V76Confident66.8Low12 Ų1262 Ų627%0.07334%0.337CS..Hα-helixtrans-65.2-47.4177.5174.20000111.2W35 K37 D41 A42 E43 L100W35-V39 HydrophobicContact CD2-CG2 4.43Å; W35-V39 HydrophobicContact CZ2-CG2 4.18Å; W35-V39 WeakPolarHBondContact O-CG2 3.47Å; W35-V39 PolarHBondContact O-N 2.97Å; K37-V39 VanDerWaalsContact C-N 3.31Å; K37-V39 PolarHBondContact O-N 3.4Å; V39-D41 VanDerWaalsContact C-N 3.34Å; V39-D41 PolarHBondContact O-N 2.81Å; V39-A42 WeakPolarHBondContact O-CB 3.41Å; V39-A42 PolarHBondContact O-N 2.96Å; V39-A42 VanDerWaalsContact O-N 3.13Å; V39-E43 WeakPolarHBondContact O-CG 3.29Å; V39-E43 PolarHBondContact O-N 3.18Å; V39-L100 HydrophobicContact CG1-CD2 3.92Å
40S76.1Confident67.5Low53 Ų5359.2 Ų59.237%0.37132%0.318SS..Hα-helixtrans-62.6-38.4-179.7-176.70000113.1S36 K37 A42S36-S40 VanDerWaalsContact O-CB 3.29Å; S36-S40 WeakPolarHBondContact O-CB 3.43Å; S36-S40 PolarHBondContact O-N 3.44Å; K37-S40 PolarHBondContact O-N 2.93Å; S40-A42 VanDerWaalsContact C-N 3.34Å
41D79.8Confident68.1Low67 Ų6753.7 Ų53.736%0.35830%0.297SS..Hα-helixtrans-69.4-36175.4-71.3-24.4000111.2K37 V39 K44K37-D41 WeakPolarHBondContact O-CB 3.5Å; K37-D41 PolarHBondContact O-N 2.85Å; V39-D41 VanDerWaalsContact C-N 3.34Å; V39-D41 PolarHBondContact O-N 2.81Å; D41-K44 PolarHBondContact O-N 3.14Å; D41-K44 IonicContact OD1-NZ 3.53Å; D41-K44 PolarHBondContact OD1-NZ 3.35Å
42A81.3Confident68.3Low1 Ų157.2 Ų57.21%0.00831%0.308CS..Hα-helixtrans-68.5-34.8176.200000113.3V38 V39 S40 K44 I45 L100 L104 A374 I378V38-A42 VanDerWaalsContact O-CB 3.3Å; V38-A42 WeakPolarHBondContact O-CB 3.45Å; V38-A42 PolarHBondContact O-N 3.46Å; V39-A42 WeakPolarHBondContact O-CB 3.41Å; V39-A42 PolarHBondContact O-N 2.96Å; V39-A42 VanDerWaalsContact O-N 3.13Å; S40-A42 VanDerWaalsContact C-N 3.34Å; A42-K44 VanDerWaalsContact C-N 3.28Å; A42-K44 PolarHBondContact O-N 3.31Å; A42-I45 WeakPolarHBondContact O-CB 3.23Å; A42-I45 PolarHBondContact O-N 2.81Å; A42-L100 HydrophobicContact CB-CD2 4.2Å; A42-L104 HydrophobicContact CB-CD1 3.85Å; A42-L104 HydrophobicContact CB-CD2 4.38Å; A42-A374 HydrophobicContact CB-CB 4.1Å; A42-I378 HydrophobicContact CB-CD1 4.16Å
43E79.8Confident68.3Low56 Ų5656.3 Ų56.326%0.26230%0.299SS..Hα-helixtrans-61.7-34.6174.5-72.9-179.3147.700112.6V39 I45 V46 T50 L100V39-E43 WeakPolarHBondContact O-CG 3.29Å; V39-E43 PolarHBondContact O-N 3.18Å; E43-I45 VanDerWaalsContact C-N 3.26Å; E43-I45 PolarHBondContact O-N 2.7Å; E43-V46 VanDerWaalsContact O-CG2 3.24Å; E43-V46 WeakPolarHBondContact O-CG2 3.45Å; E43-T50 PolarHBondContact OE1-OG1 3.42Å; E43-L100 HydrophobicContact CG-CD1 4.08Å; E43-L100 HydrophobicContact CG-CD2 3.82Å
44K81.6Confident67.9Low141 Ų14153.4 Ų53.461%0.61328%0.279SS*.Hα-helixtrans-64.8-31.7177.5-64.2167.9-165.6159.40112.2D41 A42 V46 G47D41-K44 PolarHBondContact O-N 3.14Å; D41-K44 IonicContact OD1-NZ 3.53Å; D41-K44 PolarHBondContact OD1-NZ 3.35Å; A42-K44 VanDerWaalsContact C-N 3.28Å; A42-K44 PolarHBondContact O-N 3.31Å; K44-V46 PolarHBondContact O-N 3.29Å; K44-G47 PolarHBondContact O-N 3.03Å
45I84Confident66.9Low32 Ų3254.1 Ų54.116%0.16428%0.283CS..Hα-helixtrans-70.1-31.7-174.6-66169.5000112A42 E43 G47 L104 K107 E370 A371 A374A42-I45 WeakPolarHBondContact O-CB 3.23Å; A42-I45 PolarHBondContact O-N 2.81Å; E43-I45 VanDerWaalsContact C-N 3.26Å; E43-I45 PolarHBondContact O-N 2.7Å; I45-G47 PolarHBondContact O-N 3.37Å; I45-L104 HydrophobicContact CB-CD2 4.23Å; I45-L104 HydrophobicContact CG2-CD2 4.12Å; I45-K107 HydrophobicContact CG2-CD 3.86Å; I45-K107 WeakPolarHBondContact O-CD 3.45Å; I45-K107 WeakPolarHBondContact O-CE 3.19Å; I45-K107 PolarHBondContact O-NZ 3.46Å; I45-E370 HydrophobicContact CD1-CB 4.3Å; I45-E370 HydrophobicContact CG2-CB 4.4Å; I45-A371 HydrophobicContact CG2-CB 4.02Å; I45-A374 HydrophobicContact CD1-CB 3.62Å
46V81.4Confident66.2Low0 Ų060.7 Ų60.70%031%0.307CS..THydrogen-bonded Turntrans-83.22.3-177.3-62.60000113.5E43 K44 Y48 L100 L103 L104 I127 R132E43-V46 VanDerWaalsContact O-CG2 3.24Å; E43-V46 WeakPolarHBondContact O-CG2 3.45Å; K44-V46 PolarHBondContact O-N 3.29Å; V46-Y48 PolarHBondContact O-N 2.91Å; V46-Y48 VanDerWaalsContact O-N 3.17Å; V46-L100 HydrophobicContact CG1-CD1 4.3Å; V46-L100 HydrophobicContact CG2-CD1 3.98Å; V46-L103 HydrophobicContact CB-CB 4.17Å; V46-L103 HydrophobicContact CB-CD1 4.45Å; V46-L103 HydrophobicContact CG1-CB 3.71Å; V46-L103 HydrophobicContact CG2-CD1 4.26Å; V46-L104 HydrophobicContact CG1-CD2 3.75Å; V46-L104 HydrophobicContact CG1-CG 3.95Å; V46-I127 HydrophobicContact CB-CD1 4.12Å; V46-I127 HydrophobicContact CG1-CD1 4.19Å; V46-R132 PolarHBondContact O-NH2 3.36Å
47G62.9Low65.3Low39 Ų3960.6 Ų60.640%0.40231%0.307SS..SBendtrans75.2-2.3166.300000115.6K44 I45K44-G47 PolarHBondContact O-N 3.03Å; I45-G47 PolarHBondContact O-N 3.37Å
48Y58.4Low64Low142 Ų14256.9 Ų56.956%0.55729%0.293SS*.SBendtrans-152.7140.2170.3-128.3-98.1000108.6V46 T50 F52V46-Y48 PolarHBondContact O-N 2.91Å; V46-Y48 VanDerWaalsContact O-N 3.17Å; Y48-T50 PolarHBondContact O-N 3.15Å; Y48-F52 HydrophobicContact CD1-CB 4.26Å; Y48-F52 HydrophobicContact CE1-CB 4.37Å; Y48-F52 HydrophobicContact CE1-CD2 4.23Å; Y48-F52 HydrophobicContact CE1-CG 4.3Å
49P51.7Low62.6Low66 Ų6661.5 Ų61.543%0.42932%0.316SS..  trans-69.7123.9177.728.6-32.5000109.2S51 F52P49-S51 WeakPolarHBondContact CB-OG 3.4Å; P49-S51 PolarHBondContact O-N 3.47Å; P49-F52 PolarHBondContact O-N 3.37Å
50T51.6Low61.9Low3 Ų362.4 Ų62.42%0.01832%0.323CS..THydrogen-bonded Turntrans-23.3-39.6148.728.60000112.9E43 Y48 F52 M53 Q96 L100 L103E43-T50 PolarHBondContact OE1-OG1 3.42Å; Y48-T50 PolarHBondContact O-N 3.15Å; T50-F52 PolarHBondContact O-N 2.94Å; T50-M53 WeakPolarHBondContact O-CB 3.29Å; T50-M53 PolarHBondContact O-N 3.3Å; T50-Q96 HydrophobicContact CG2-CB 3.87Å; T50-Q96 VanDerWaalsContact CG2-OE1 3.23Å; T50-Q96 PolarHBondContact O-NE2 3.3Å; T50-Q96 PolarHBondContact O-OE1 2.96Å; T50-L100 HydrophobicContact CG2-CB 4.15Å; T50-L103 HydrophobicContact CG2-CD1 4.5Å
51S46.4Very low61.1Low52 Ų5265.8 Ų65.836%0.36434%0.337SS..Hα-helixtrans-46.5-29.5172.9-36.30000116.3P49 M53 S54 L55P49-S51 WeakPolarHBondContact CB-OG 3.4Å; P49-S51 PolarHBondContact O-N 3.47Å; S51-M53 VanDerWaalsContact C-N 3.28Å; S51-M53 PolarHBondContact O-N 3.06Å; S51-S54 PolarHBondContact O-N 3.31Å; S51-L55 WeakPolarHBondContact O-CB 3.45Å; S51-L55 PolarHBondContact O-N 2.88Å
52F49.1Very low60.1Low111 Ų11167 Ų6749%0.48734%0.34SS..Hα-helixtrans-67.3-29.7177.2-161.7-97000112.4Y48 P49 T50 L55 R56Y48-F52 HydrophobicContact CD1-CB 4.26Å; Y48-F52 HydrophobicContact CE1-CB 4.37Å; Y48-F52 HydrophobicContact CE1-CD2 4.23Å; Y48-F52 HydrophobicContact CE1-CG 4.3Å; P49-F52 PolarHBondContact O-N 3.37Å; T50-F52 PolarHBondContact O-N 2.94Å; F52-L55 PolarHBondContact O-N 3.32Å; F52-R56 WeakPolarHBondContact O-CB 3.5Å; F52-R56 PolarHBondContact O-N 3.08Å
53M50.8Low59.2Low26 Ų2668 Ų6813%0.12835%0.346CS..Hα-helixtrans-73.5-41.5175.7-50171.818.700111.5T50 S51 L55 R56 C57 E136 E139T50-M53 WeakPolarHBondContact O-CB 3.29Å; T50-M53 PolarHBondContact O-N 3.3Å; S51-M53 VanDerWaalsContact C-N 3.28Å; S51-M53 PolarHBondContact O-N 3.06Å; M53-L55 VanDerWaalsContact C-N 3.28Å; M53-L55 PolarHBondContact O-N 3.44Å; M53-R56 PolarHBondContact O-N 2.82Å; M53-C57 WeakPolarHBondContact O-CB 3.18Å; M53-C57 PolarHBondContact O-N 2.84Å; M53-E136 HydrophobicContact CB-CG 4.18Å; M53-E136 VanDerWaalsContact CE-CA 3.41Å; M53-E136 HydrophobicContact CE-CB 4.07Å; M53-E136 HydrophobicContact CE-CG 3.64Å; M53-E136 HydrophobicContact CG-CG 3.45Å; M53-E136 VanDerWaalsContact CG-CG 3.45Å; M53-E136 HydrophobicContact SD-CB 4.33Å; M53-E136 HydrophobicContact SD-CG 3.32Å; M53-E136 WeakPolarHBondContact SD-CG 3.31Å; M53-E139 HydrophobicContact CE-CB 3.9Å
54S50Low58.4Low24 Ų2467.7 Ų67.717%0.16835%0.35CS..Hα-helixtrans-62.1-40.9172.3-77.20000109.9S51 L58 Q96S51-S54 PolarHBondContact O-N 3.31Å; S54-L58 WeakPolarHBondContact O-CB 3.47Å; S54-L58 VanDerWaalsContact O-CD1 3.28Å; S54-L58 WeakPolarHBondContact O-CD1 3.43Å; S54-L58 WeakPolarHBondContact O-CG 3.48Å; S54-L58 PolarHBondContact O-N 3.36Å; S54-Q96 PolarHBondContact OG-NE2 2.99Å
55L46Very low57.5Low85 Ų8564.8 Ų64.845%0.44534%0.34SS..Hα-helixtrans-65-49.6174.7-92.5149.9000112.4S51 F52 M53 C57 L58 L59S51-L55 WeakPolarHBondContact O-CB 3.45Å; S51-L55 PolarHBondContact O-N 2.88Å; F52-L55 PolarHBondContact O-N 3.32Å; M53-L55 VanDerWaalsContact C-N 3.28Å; M53-L55 PolarHBondContact O-N 3.44Å; L55-C57 VanDerWaalsContact C-N 3.3Å; L55-C57 PolarHBondContact O-N 3.23Å; L55-L58 PolarHBondContact O-N 3.27Å; L55-L59 HydrophobicContact CB-CD1 4.26Å; L55-L59 HydrophobicContact CD2-CD1 3.59Å; L55-L59 HydrophobicContact CD2-CG 4.14Å; L55-L59 WeakPolarHBondContact O-CA 3.46Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 WeakPolarHBondContact O-CD1 3.46Å; L55-L59 WeakPolarHBondContact O-CG 3.13Å; L55-L59 PolarHBondContact O-N 3.34Å
56R55.6Low56.7Low173 Ų17364.6 Ų64.665%0.65334%0.341SS*.Hα-helixtrans-63.4-37.6179.6-164.7178.9112.7155.32.2112.1F52 M53 S60F52-R56 WeakPolarHBondContact O-CB 3.5Å; F52-R56 PolarHBondContact O-N 3.08Å; M53-R56 PolarHBondContact O-N 2.82Å; R56-S60 PolarHBondContact O-N 2.81Å
57C51.8Low56Low31 Ų3166.9 Ų66.921%0.20936%0.36CS..Hα-helixtrans-66.9-51.4173.6-165.60000110.9M53 L55 L59 S60 L63M53-C57 WeakPolarHBondContact O-CB 3.18Å; M53-C57 PolarHBondContact O-N 2.84Å; L55-C57 VanDerWaalsContact C-N 3.3Å; L55-C57 PolarHBondContact O-N 3.23Å; C57-L59 VanDerWaalsContact C-N 3.32Å; C57-L59 PolarHBondContact O-N 2.67Å; C57-S60 PolarHBondContact O-N 3.33Å; C57-S60 PolarHBondContact O-OG 2.83Å; C57-L63 WeakPolarHBondContact O-CB 3.45Å
58L50.6Low56.3Low58 Ų5869.9 Ų69.930%0.30436%0.364SS..Hα-helixtrans-63.9-31.7179.3-75.7165.2000114S54 L55 L63 F87S54-L58 WeakPolarHBondContact O-CB 3.47Å; S54-L58 VanDerWaalsContact O-CD1 3.28Å; S54-L58 WeakPolarHBondContact O-CD1 3.43Å; S54-L58 WeakPolarHBondContact O-CG 3.48Å; S54-L58 PolarHBondContact O-N 3.36Å; L55-L58 PolarHBondContact O-N 3.27Å; L58-L63 HydrophobicContact CD2-CD2 3.98Å; L58-L63 HydrophobicContact CG-CD2 4.39Å; L58-F87 HydrophobicContact CD2-CB 4.15Å
59L48.9Very low56.9Low120 Ų12066.5 Ų66.563%0.62835%0.354SS*.THydrogen-bonded Turntrans-91.2-0.5-178.7-65.1172.4000113L55 C57L55-L59 HydrophobicContact CB-CD1 4.26Å; L55-L59 HydrophobicContact CD2-CD1 3.59Å; L55-L59 HydrophobicContact CD2-CG 4.14Å; L55-L59 WeakPolarHBondContact O-CA 3.46Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 WeakPolarHBondContact O-CD1 3.46Å; L55-L59 WeakPolarHBondContact O-CG 3.13Å; L55-L59 PolarHBondContact O-N 3.34Å; C57-L59 VanDerWaalsContact C-N 3.32Å; C57-L59 PolarHBondContact O-N 2.67Å
60S63.1Low58Low30 Ų3064 Ų6421%0.2134%0.337CS..SBendtrans-64.5139.7167.165.90000109.2R56 C57 E62 L63 S64R56-S60 PolarHBondContact O-N 2.81Å; C57-S60 PolarHBondContact O-N 3.33Å; C57-S60 PolarHBondContact O-OG 2.83Å; S60-E62 WeakPolarHBondContact CB-OE2 3.48Å; S60-E62 PolarHBondContact O-N 3.43Å; S60-E62 VanDerWaalsContact O-N 3.13Å; S60-L63 PolarHBondContact O-N 3.48Å; S60-L63 WeakPolarHBondContact OG-CB 3.35Å; S60-L63 PolarHBondContact OG-N 3.04Å; S60-S64 PolarHBondContact O-N 2.94Å; S60-S64 PolarHBondContact O-OG 3.11Å; S60-S64 VanDerWaalsContact O-OG 3.07Å
61D58.8Low59.2Low124 Ų12472.7 Ų72.766%0.66337%0.369SS*.Hα-helixtrans-57.1-30.1179.2-70.8-32.2000110.5S64 N65D61-S64 WeakPolarHBondContact O-CB 3.3Å; D61-N65 VanDerWaalsContact O-CG 3.26Å; D61-N65 PolarHBondContact O-N 2.97Å; D61-N65 PolarHBondContact O-ND2 2.97Å; D61-N65 VanDerWaalsContact O-ND2 3.1Å
62E58.3Low60.9Low92 Ų9276.5 Ų76.543%0.4338%0.379SS..Hα-helixtrans-73.7-43.3179.6-59.978.6-17000113S60 S64 N65 V66 F180S60-E62 WeakPolarHBondContact CB-OE2 3.48Å; S60-E62 PolarHBondContact O-N 3.43Å; S60-E62 VanDerWaalsContact O-N 3.13Å; E62-S64 VanDerWaalsContact C-N 3.27Å; E62-S64 PolarHBondContact O-N 2.86Å; E62-N65 WeakPolarHBondContact O-CB 3.44Å; E62-N65 PolarHBondContact O-N 3.4Å; E62-V66 PolarHBondContact O-N 3.09Å; E62-F180 HydrophobicContact CB-CE1 3.75Å; E62-F180 HydrophobicContact CB-CE2 3.9Å; E62-F180 HydrophobicContact CB-CZ 3.26Å; E62-F180 HydrophobicContact CG-CE2 3.91Å; E62-F180 HydrophobicContact CG-CZ 3.61Å
63L62Low62.4Low24 Ų2471.2 Ų71.213%0.12636%0.356CS..Hα-helixtrans-71.2-28.3174.5-130.592.1000111.7C57 L58 S60 N65 V66 A67 L181C57-L63 WeakPolarHBondContact O-CB 3.45Å; L58-L63 HydrophobicContact CD2-CD2 3.98Å; L58-L63 HydrophobicContact CG-CD2 4.39Å; S60-L63 PolarHBondContact O-N 3.48Å; S60-L63 WeakPolarHBondContact OG-CB 3.35Å; S60-L63 PolarHBondContact OG-N 3.04Å; L63-N65 VanDerWaalsContact C-N 3.32Å; L63-V66 PolarHBondContact O-N 3.29Å; L63-A67 VanDerWaalsContact O-CB 3.26Å; L63-A67 WeakPolarHBondContact O-CB 3.32Å; L63-A67 PolarHBondContact O-N 3.48Å; L63-L181 HydrophobicContact CD1-CD2 3.91Å
64S63.6Low64Low49 Ų4975.1 Ų75.134%0.34338%0.381SS..Hα-helixtrans-62.1-41.1170-62.10000111S60 D61 E62 A67 M68S60-S64 PolarHBondContact O-N 2.94Å; S60-S64 PolarHBondContact O-OG 3.11Å; S60-S64 VanDerWaalsContact O-OG 3.07Å; D61-S64 WeakPolarHBondContact O-CB 3.3Å; E62-S64 VanDerWaalsContact C-N 3.27Å; E62-S64 PolarHBondContact O-N 2.86Å; S64-A67 PolarHBondContact O-N 2.96Å; S64-M68 WeakPolarHBondContact O-CG 3.48Å; S64-M68 PolarHBondContact O-N 3.49Å
65N62.9Low65.4Low79 Ų7977.6 Ų77.642%0.42241%0.411SS..Hα-helixtrans-64.3-43.4172.6-69.7-35.6000112.3D61 E62 L63 M68 H69D61-N65 VanDerWaalsContact O-CG 3.26Å; D61-N65 PolarHBondContact O-N 2.97Å; D61-N65 PolarHBondContact O-ND2 2.97Å; D61-N65 VanDerWaalsContact O-ND2 3.1Å; E62-N65 WeakPolarHBondContact O-CB 3.44Å; E62-N65 PolarHBondContact O-N 3.4Å; L63-N65 VanDerWaalsContact C-N 3.32Å; N65-M68 PolarHBondContact O-N 3.35Å; N65-M68 WeakPolarHBondContact OD1-CE 3.27Å; N65-H69 PolarHBondContact O-CD2 3.45Å; N65-H69 PolarHBondContact O-N 2.96Å; N65-H69 VanDerWaalsContact O-N 3.1Å
66V66.2Low67.3Low29 Ų2974.3 Ų74.318%0.17639%0.394CS..Hα-helixtrans-59.3-48.1172.61720000110.9E62 L63 M68 H69 V70 M173 S177E62-V66 PolarHBondContact O-N 3.09Å; L63-V66 PolarHBondContact O-N 3.29Å; V66-M68 VanDerWaalsContact C-N 3.33Å; V66-M68 PolarHBondContact O-N 3.05Å; V66-H69 PolarHBondContact O-N 3.47Å; V66-H69 VanDerWaalsContact O-N 3.1Å; V66-V70 HydrophobicContact CG1-CG2 4.19Å; V66-V70 VanDerWaalsContact O-CG2 3.3Å; V66-V70 WeakPolarHBondContact O-CG2 3.46Å; V66-V70 PolarHBondContact O-N 3.32Å; V66-M173 HydrophobicContact CG2-CE 4.49Å; V66-S177 WeakPolarHBondContact CG1-OG 3.44Å; V66-S177 VanDerWaalsContact CG2-OG 3.27Å; V66-S177 WeakPolarHBondContact CG2-OG 3.4Å
67A67.8Low68.7Low48 Ų4871.5 Ų71.540%0.39739%0.389SS..Hα-helixtrans-61.9-39.318000000112L63 S64 H69 V70 R71L63-A67 VanDerWaalsContact O-CB 3.26Å; L63-A67 WeakPolarHBondContact O-CB 3.32Å; L63-A67 PolarHBondContact O-N 3.48Å; S64-A67 PolarHBondContact O-N 2.96Å; A67-H69 VanDerWaalsContact C-N 3.33Å; A67-H69 PolarHBondContact O-N 3.18Å; A67-V70 PolarHBondContact O-N 3.33Å; A67-R71 PolarHBondContact O-N 3.26Å
68M69.2Low70.3Confident101 Ų10170 Ų7050%0.49838%0.379SS..Hα-helixtrans-60.9-41.4172.7-77.1-163.2-64.800112.2S64 N65 V66 R71S64-M68 WeakPolarHBondContact O-CG 3.48Å; S64-M68 PolarHBondContact O-N 3.49Å; N65-M68 PolarHBondContact O-N 3.35Å; N65-M68 WeakPolarHBondContact OD1-CE 3.27Å; V66-M68 VanDerWaalsContact C-N 3.33Å; V66-M68 PolarHBondContact O-N 3.05Å; M68-R71 WeakPolarHBondContact O-CB 3.28Å; M68-R71 PolarHBondContact O-N 3.14Å
69H70.3Confident71.9Confident72 Ų7268.3 Ų68.333%0.33337%0.371SS..Hα-helixtrans-70.2-38.5177.2-70.4-43.5000112.5N65 V66 A67 R71 K72 F169 M173N65-H69 PolarHBondContact O-CD2 3.45Å; N65-H69 PolarHBondContact O-N 2.96Å; N65-H69 VanDerWaalsContact O-N 3.1Å; V66-H69 PolarHBondContact O-N 3.47Å; V66-H69 VanDerWaalsContact O-N 3.1Å; A67-H69 VanDerWaalsContact C-N 3.33Å; A67-H69 PolarHBondContact O-N 3.18Å; H69-R71 PolarHBondContact O-N 3.12Å; H69-K72 WeakPolarHBondContact O-CB 3.33Å; H69-K72 PolarHBondContact O-N 3.41Å; H69-F169 HydrophobicContact CB-CE1 4.23Å; H69-F169 HydrophobicContact CB-CZ 3.92Å; H69-M173 HydrophobicContact CB-CE 3.64Å; H69-M173 HydrophobicContact CB-CG 4.19Å; H69-M173 HydrophobicContact CB-SD 3.79Å
70V74.8Confident73.5Confident12 Ų1262.8 Ų62.87%0.07334%0.342CS..Hα-helixtrans-61.2-29.9175.7172.10000112.1V66 A67 K72 L73 L80 L81 A84V66-V70 HydrophobicContact CG1-CG2 4.19Å; V66-V70 VanDerWaalsContact O-CG2 3.3Å; V66-V70 WeakPolarHBondContact O-CG2 3.46Å; V66-V70 PolarHBondContact O-N 3.32Å; A67-V70 PolarHBondContact O-N 3.33Å; V70-K72 PolarHBondContact O-N 3.05Å; V70-L73 WeakPolarHBondContact O-CB 3.08Å; V70-L73 PolarHBondContact O-N 3.29Å; V70-L80 HydrophobicContact CG2-CD2 3.85Å; V70-L80 HydrophobicContact CG2-CG 4.07Å; V70-L81 HydrophobicContact CG1-CD2 3.79Å; V70-A84 HydrophobicContact CG1-CB 3.63Å
71R77.6Confident74.2Confident186 Ų18662.6 Ų62.670%0.70234%0.339SS*.G310 helixtrans-58.3-29.2173.4-70.6177.7-174178.72.6113.2A67 M68 H69 L73 V74A67-R71 PolarHBondContact O-N 3.26Å; M68-R71 WeakPolarHBondContact O-CB 3.28Å; M68-R71 PolarHBondContact O-N 3.14Å; H69-R71 PolarHBondContact O-N 3.12Å; R71-L73 PolarHBondContact O-N 2.94Å; R71-V74 VanDerWaalsContact O-CB 3.29Å; R71-V74 WeakPolarHBondContact O-CB 3.32Å; R71-V74 VanDerWaalsContact O-CG2 3.23Å; R71-V74 WeakPolarHBondContact O-CG2 3.48Å; R71-V74 PolarHBondContact O-N 3.5Å; R71-V74 VanDerWaalsContact O-N 3.13Å
72K80.6Confident75Confident132 Ų13259.8 Ų59.857%0.57432%0.323SS*.G310 helixtrans-66.8-19.3176.3-64.1-173.9174.9-176.30113H69 V70 V74 F169H69-K72 WeakPolarHBondContact O-CB 3.33Å; H69-K72 PolarHBondContact O-N 3.41Å; V70-K72 PolarHBondContact O-N 3.05Å; K72-V74 VanDerWaalsContact C-N 3.32Å; K72-F169 HydrophobicContact CB-CE1 4.11Å; K72-F169 HydrophobicContact CD-CE1 4.11Å; K72-F169 HydrophobicContact CD-CZ 4.18Å
73L81.4Confident75.7Confident0 Ų056.7 Ų56.70%031%0.311CS..G310 helixtrans-83.6-10.8177-56.7175.9000112.1V70 R71 G75 T76 H78 L80 L81 D166 F169V70-L73 WeakPolarHBondContact O-CB 3.08Å; V70-L73 PolarHBondContact O-N 3.29Å; R71-L73 PolarHBondContact O-N 2.94Å; L73-G75 PolarHBondContact O-N 3.17Å; L73-T76 VanDerWaalsContact O-CB 3.31Å; L73-T76 WeakPolarHBondContact O-CB 3.45Å; L73-T76 WeakPolarHBondContact O-CG2 3.42Å; L73-T76 PolarHBondContact O-N 2.89Å; L73-T76 PolarHBondContact O-OG1 3.28Å; L73-H78 HydrophobicContact CD1-CB 4.28Å; L73-H78 HydrophobicContact CD2-CB 4.5Å; L73-L80 HydrophobicContact CD1-CB 4.17Å; L73-L80 HydrophobicContact CD1-CD2 3.92Å; L73-L80 HydrophobicContact CD1-CG 4.43Å; L73-L81 HydrophobicContact CB-CD1 4.15Å; L73-L81 HydrophobicContact CB-CD2 3.95Å; L73-L81 HydrophobicContact CB-CG 3.86Å; L73-L81 WeakPolarHBondContact O-CD1 3.41Å; L73-D166 WeakPolarHBondContact CD2-O 3.25Å; L73-F169 HydrophobicContact CD2-CD1 3.97Å
74V83.8Confident76.2Confident108 Ų10856.7 Ų56.766%0.65531%0.314SS*.THydrogen-bonded Turntrans-57.5124.6-179.31740000109.8R71 K72 L81R71-V74 VanDerWaalsContact O-CB 3.29Å; R71-V74 WeakPolarHBondContact O-CB 3.32Å; R71-V74 VanDerWaalsContact O-CG2 3.23Å; R71-V74 WeakPolarHBondContact O-CG2 3.48Å; R71-V74 PolarHBondContact O-N 3.5Å; R71-V74 VanDerWaalsContact O-N 3.13Å; K72-V74 VanDerWaalsContact C-N 3.32Å; V74-L81 HydrophobicContact CG2-CD2 4.22Å
75G80.7Confident76.4Confident77 Ų7761.8 Ų61.879%0.79433%0.326SS*.THydrogen-bonded Turntrans100.8-10-173.500000114L73L73-G75 PolarHBondContact O-N 3.17Å
76T86Confident76.5Confident15 Ų1558.9 Ų58.99%0.09232%0.315CS..SBendtrans-93.8169168.273.60000111.4L73 H78 L81 D161 D166 M167L73-T76 VanDerWaalsContact O-CB 3.31Å; L73-T76 WeakPolarHBondContact O-CB 3.45Å; L73-T76 WeakPolarHBondContact O-CG2 3.42Å; L73-T76 PolarHBondContact O-N 2.89Å; L73-T76 PolarHBondContact O-OG1 3.28Å; T76-H78 VanDerWaalsContact C-N 3.34Å; T76-H78 WeakPolarHBondContact OG1-CB 3.48Å; T76-H78 PolarHBondContact OG1-N 3.1Å; T76-L81 WeakPolarHBondContact O-CD1 3.49Å; T76-D161 CarbonylContact C-O 3.44Å; T76-D161 WeakPolarHBondContact CA-O 3.04Å; T76-D161 WeakPolarHBondContact CB-O 3.34Å; T76-D166 HydrophobicContact CG2-CB 3.77Å; T76-M167 HydrophobicContact CG2-SD 4.48Å
77Q83.3Confident76.2Confident114 Ų11459.5 Ų59.553%0.53332%0.315SS..  trans-96.922.6168.1-58.9-15748.600112.5P79 S160 D161Q77-P79 WeakPolarHBondContact O-CD 3.37Å; Q77-S160 PolarHBondContact NE2-O 3.45Å; Q77-D161 PolarHBondContact N-O 2.76Å
78H87.1Confident75.6Confident1 Ų161.6 Ų61.61%0.00532%0.323CS..  trans-61.9124.6179.2-165.1-79.3000111L73 T76 L80 L81 G150 M167 G170 N171L73-H78 HydrophobicContact CD1-CB 4.28Å; L73-H78 HydrophobicContact CD2-CB 4.5Å; T76-H78 VanDerWaalsContact C-N 3.34Å; T76-H78 WeakPolarHBondContact OG1-CB 3.48Å; T76-H78 PolarHBondContact OG1-N 3.1Å; H78-L80 WeakPolarHBondContact ND1-CB 3.34Å; H78-L80 PolarHBondContact ND1-N 3.44Å; H78-L80 PolarHBondContact O-N 2.71Å; H78-L81 WeakPolarHBondContact O-CB 3.4Å; H78-L81 PolarHBondContact O-N 3.09Å; H78-G150 PolarHBondContact CE1-O 2.91Å; H78-M167 HydrophobicContact CB-CE 4.14Å; H78-M167 HydrophobicContact CB-SD 3.96Å; H78-G170 PolarHBondContact CE1-O 3.4Å; H78-G170 WeakPolarHBondContact NE2-CA 3.48Å; H78-N171 PolarHBondContact NE2-N 3.35Å; H78-N171 VanDerWaalsContact NE2-N 3.16Å; H78-N171 PolarHBondContact NE2-OD1 3.45Å
79P84.3Confident74.7Confident21 Ų2165.9 Ų65.914%0.13634%0.335CS..THydrogen-bonded Turntrans-59.8-24.8-174.1-25.934.4000115.1Q77 L81 N82 T83 V152Q77-P79 WeakPolarHBondContact O-CD 3.37Å; P79-L81 PolarHBondContact O-N 3.32Å; P79-N82 WeakPolarHBondContact O-CB 3.27Å; P79-N82 PolarHBondContact O-N 3.4Å; P79-T83 PolarHBondContact O-N 2.92Å; P79-T83 VanDerWaalsContact O-N 3.14Å; P79-T83 PolarHBondContact O-OG1 2.97Å; P79-V152 HydrophobicContact CG-CG1 3.67Å
80L82.4Confident73.7Confident5 Ų564.8 Ų64.83%0.02633%0.332CS..Hα-helixtrans-54.4-32172.9-170.760.5000112.5V70 L73 H78 T83 A84 V147 M173 A174V70-L80 HydrophobicContact CG2-CD2 3.85Å; V70-L80 HydrophobicContact CG2-CG 4.07Å; L73-L80 HydrophobicContact CD1-CB 4.17Å; L73-L80 HydrophobicContact CD1-CD2 3.92Å; L73-L80 HydrophobicContact CD1-CG 4.43Å; H78-L80 WeakPolarHBondContact ND1-CB 3.34Å; H78-L80 PolarHBondContact ND1-N 3.44Å; H78-L80 PolarHBondContact O-N 2.71Å; L80-T83 PolarHBondContact O-N 3.46Å; L80-A84 VanDerWaalsContact O-CB 3.25Å; L80-A84 WeakPolarHBondContact O-CB 3.2Å; L80-A84 PolarHBondContact O-N 3.35Å; L80-V147 HydrophobicContact CD1-CG1 3.87Å; L80-V147 HydrophobicContact CD1-CG2 4.44Å; L80-M173 HydrophobicContact CD2-CB 3.72Å; L80-A174 HydrophobicContact CD1-CB 4.42Å; L80-A174 HydrophobicContact CD2-CB 4.42Å
81L77.7Confident72.1Confident26 Ų2668.9 Ų68.914%0.13636%0.36CS..Hα-helixtrans-65-38.8174.6-76.7175.8000112.8V70 L73 V74 T76 H78 P79 T83 A84 R85V70-L81 HydrophobicContact CG1-CD2 3.79Å; L73-L81 HydrophobicContact CB-CD1 4.15Å; L73-L81 HydrophobicContact CB-CD2 3.95Å; L73-L81 HydrophobicContact CB-CG 3.86Å; L73-L81 WeakPolarHBondContact O-CD1 3.41Å; V74-L81 HydrophobicContact CG2-CD2 4.22Å; T76-L81 WeakPolarHBondContact O-CD1 3.49Å; H78-L81 WeakPolarHBondContact O-CB 3.4Å; H78-L81 PolarHBondContact O-N 3.09Å; P79-L81 PolarHBondContact O-N 3.32Å; L81-T83 VanDerWaalsContact C-N 3.35Å; L81-A84 PolarHBondContact O-N 2.92Å; L81-R85 WeakPolarHBondContact O-CB 3.27Å; L81-R85 WeakPolarHBondContact O-CG 3.33Å; L81-R85 PolarHBondContact O-N 2.92Å
82N75.3Confident70.4Confident64 Ų6468.8 Ų68.834%0.34237%0.365SS..Hα-helixtrans-68.2-41.5178.2-67.6-26.1000110.3P79 R85 G86P79-N82 WeakPolarHBondContact O-CB 3.27Å; P79-N82 PolarHBondContact O-N 3.4Å; N82-R85 PolarHBondContact O-N 3.28Å; N82-G86 PolarHBondContact O-N 2.69Å
83T73.1Confident68.7Low27 Ų2764.6 Ų64.617%0.16635%0.349CS..Hα-helixtrans-59.9-47.8173.4-48.80000110.1P79 L80 L81 R85 G86 F87 L146 V147P79-T83 PolarHBondContact O-N 2.92Å; P79-T83 VanDerWaalsContact O-N 3.14Å; P79-T83 PolarHBondContact O-OG1 2.97Å; L80-T83 PolarHBondContact O-N 3.46Å; L81-T83 VanDerWaalsContact C-N 3.35Å; T83-R85 PolarHBondContact O-N 3.49Å; T83-G86 PolarHBondContact O-N 3.28Å; T83-F87 HydrophobicContact CG2-CE2 3.81Å; T83-F87 HydrophobicContact CG2-CZ 4.06Å; T83-F87 WeakPolarHBondContact O-CD2 3.32Å; T83-F87 WeakPolarHBondContact O-CE2 3.27Å; T83-F87 PolarHBondContact O-N 2.91Å; T83-L146 HydrophobicContact CG2-CB 4.18Å; T83-V147 HydrophobicContact CG2-CG2 3.78Å
84A71.4Confident67.2Low24 Ų2466 Ų6620%0.19836%0.357CS..Hα-helixtrans-58.5-46.1175.700000113.6V70 L80 L81 G86 F87 V88V70-A84 HydrophobicContact CG1-CB 3.63Å; L80-A84 VanDerWaalsContact O-CB 3.25Å; L80-A84 WeakPolarHBondContact O-CB 3.2Å; L80-A84 PolarHBondContact O-N 3.35Å; L81-A84 PolarHBondContact O-N 2.92Å; A84-G86 VanDerWaalsContact C-N 3.28Å; A84-G86 PolarHBondContact O-N 3.25Å; A84-F87 PolarHBondContact O-N 3.22Å; A84-V88 PolarHBondContact O-N 3.44Å
85R69.3Low65.7Low157 Ų15762.7 Ų62.759%0.59234%0.335SS*.Hα-helixtrans-63.4-35.4176.9-76.917267.8177.42.8111.9L81 N82 T83 F87 V88 Y89L81-R85 WeakPolarHBondContact O-CB 3.27Å; L81-R85 WeakPolarHBondContact O-CG 3.33Å; L81-R85 PolarHBondContact O-N 2.92Å; N82-R85 PolarHBondContact O-N 3.28Å; T83-R85 PolarHBondContact O-N 3.49Å; R85-F87 VanDerWaalsContact C-N 3.29Å; R85-F87 PolarHBondContact O-N 2.92Å; R85-V88 PolarHBondContact O-N 3.4Å; R85-Y89 PolarHBondContact O-N 3.28Å
86G63.6Low64.8Low18 Ų1859.7 Ų59.719%0.18630%0.3CS..Hα-helixtrans-50.3-50.4170.500000111.2N82 T83 A84 V88 D90 L95N82-G86 PolarHBondContact O-N 2.69Å; T83-G86 PolarHBondContact O-N 3.28Å; A84-G86 VanDerWaalsContact C-N 3.28Å; A84-G86 PolarHBondContact O-N 3.25Å; G86-V88 PolarHBondContact O-N 3.47Å; G86-D90 WeakPolarHBondContact O-CB 3.31Å; G86-D90 PolarHBondContact O-N 3.12Å; G86-L95 WeakPolarHBondContact O-CD1 3.32Å
87F60.4Low64.4Low42 Ų4259.8 Ų59.818%0.18430%0.3CS..Hα-helixtrans-64.1-35.7179.8-55.3-75.9000114.4L58 T83 A84 R85 L95 T143L58-F87 HydrophobicContact CD2-CB 4.15Å; T83-F87 HydrophobicContact CG2-CE2 3.81Å; T83-F87 HydrophobicContact CG2-CZ 4.06Å; T83-F87 WeakPolarHBondContact O-CD2 3.32Å; T83-F87 WeakPolarHBondContact O-CE2 3.27Å; T83-F87 PolarHBondContact O-N 2.91Å; A84-F87 PolarHBondContact O-N 3.22Å; R85-F87 VanDerWaalsContact C-N 3.29Å; R85-F87 PolarHBondContact O-N 2.92Å; F87-L95 HydrophobicContact CD1-CD1 4.04Å; F87-L95 HydrophobicContact CD1-CD2 3.41Å; F87-L95 VanDerWaalsContact CD1-CD2 3.41Å; F87-L95 HydrophobicContact CD1-CG 4.26Å; F87-L95 HydrophobicContact CE1-CD2 3.89Å; F87-L95 HydrophobicContact CG-CD1 4.44Å; F87-L95 HydrophobicContact CG-CD2 4.41Å; F87-T143 HydrophobicContact CE1-CG2 3.33Å; F87-T143 HydrophobicContact CZ-CG2 3.27Å
88V55.8Low64.7Low92 Ų9255.4 Ų55.456%0.55828%0.279SS*.Hα-helixtrans-90.5-45.6-170.4179.20000112.3A84 R85 G86A84-V88 PolarHBondContact O-N 3.44Å; R85-V88 PolarHBondContact O-N 3.4Å; G86-V88 PolarHBondContact O-N 3.47Å
89Y49Very low64.8Low190 Ų19055.4 Ų55.475%0.74528%0.278SS*.Hα-helixtrans-98-26.9-172.1-82.9-84.6000113.4R85 S91R85-Y89 PolarHBondContact O-N 3.28Å; Y89-S91 PolarHBondContact O-N 2.86Å
90D49.2Very low65Low50 Ų5054.5 Ų54.527%0.26727%0.272SS..  trans-91.428.7-177-131.32.7000112.6G86 K92 N93G86-D90 WeakPolarHBondContact O-CB 3.31Å; G86-D90 PolarHBondContact O-N 3.12Å; D90-K92 PolarHBondContact O-N 2.93Å; D90-N93 CarbonylContact O-C 3.41Å; D90-N93 PolarHBondContact O-N 3.01Å; D90-N93 WeakPolarHBondContact OD1-CB 3.45Å
91S41.7Very low65.5Low97 Ų9754.2 Ų54.268%0.67827%0.271SS*.THydrogen-bonded Turntrans-59.4-6.6171.457.30000114Y89Y89-S91 PolarHBondContact O-N 2.86Å
92K42.1Very low66.4Low184 Ų18453 Ų5380%0.827%0.265SS*.THydrogen-bonded Turntrans-104.6-12.8174.1-69.5-174.7178.6-179.30114.2D90D90-K92 PolarHBondContact O-N 2.93Å
93N45.2Very low67.3Low44 Ų4450.2 Ų50.224%0.23525%0.25CC..THydrogen-bonded Turntrans-141.9125.6179-68.4-45000112.4S36 D90 L95S36-N93 VanDerWaalsContact CB-OD1 3.31Å; S36-N93 WeakPolarHBondContact CB-OD1 3.44Å; S36-N93 PolarHBondContact OG-OD1 3.03Å; D90-N93 CarbonylContact O-C 3.41Å; D90-N93 PolarHBondContact O-N 3.01Å; D90-N93 WeakPolarHBondContact OD1-CB 3.45Å; N93-L95 PolarHBondContact O-N 3.37Å; N93-L95 VanDerWaalsContact O-N 3.15Å
94N50.7Low68.3Low30 Ų3048.9 Ų48.916%0.1624%0.242CC..THydrogen-bonded Turntrans74.4-2.4148.7-66.8-28.5000120.4F26 W35 Q96F26-N94 WeakPolarHBondContact CE1-ND2 3.17Å; F26-N94 HydrophobicContact CE2-CB 4.01Å; F26-N94 WeakPolarHBondContact CE2-ND2 3.41Å; F26-N94 HydrophobicContact CZ-CB 4.35Å; F26-N94 WeakPolarHBondContact CZ-ND2 3.41Å; W35-N94 PolarHBondContact NE1-OD1 3.46Å; N94-Q96 PolarHBondContact O-N 3.48Å; N94-Q96 VanDerWaalsContact O-N 3.16Å
95L50.3Low69.5Low39 Ų3947.8 Ų47.820%0.20423%0.232CC..THydrogen-bonded Turntrans-71.8-12.6-174.9-146.2112.6000115.3G86 F87 N93 E139G86-L95 WeakPolarHBondContact O-CD1 3.32Å; F87-L95 HydrophobicContact CD1-CD1 4.04Å; F87-L95 HydrophobicContact CD1-CD2 3.41Å; F87-L95 VanDerWaalsContact CD1-CD2 3.41Å; F87-L95 HydrophobicContact CD1-CG 4.26Å; F87-L95 HydrophobicContact CE1-CD2 3.89Å; F87-L95 HydrophobicContact CG-CD1 4.44Å; F87-L95 HydrophobicContact CG-CD2 4.41Å; N93-L95 PolarHBondContact O-N 3.37Å; N93-L95 VanDerWaalsContact O-N 3.15Å; L95-E139 VanDerWaalsContact O-CD 3.3Å; L95-E139 VanDerWaalsContact O-OE1 3.09Å
96Q63.2Low70.8Confident13 Ų1340.3 Ų40.36%0.06120%0.204CC..THydrogen-bonded Turntrans-136.831.7-177.8-53.7-163.53.300114.7T50 S54 N94 R98 G99 L100 E139T50-Q96 HydrophobicContact CG2-CB 3.87Å; T50-Q96 VanDerWaalsContact CG2-OE1 3.23Å; T50-Q96 PolarHBondContact O-NE2 3.3Å; T50-Q96 PolarHBondContact O-OE1 2.96Å; S54-Q96 PolarHBondContact OG-NE2 2.99Å; N94-Q96 PolarHBondContact O-N 3.48Å; N94-Q96 VanDerWaalsContact O-N 3.16Å; Q96-R98 PolarHBondContact O-N 3.4Å; Q96-G99 PolarHBondContact O-N 3.38Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 PolarHBondContact O-N 3.2Å; Q96-E139 VanDerWaalsContact CA-OE2 3.31Å; Q96-E139 WeakPolarHBondContact CA-OE2 3.31Å; Q96-E139 HydrophobicContact CB-CG 4.26Å; Q96-E139 HydrophobicContact CG-CG 4.03Å
97M77.6Confident72.2Confident18 Ų1842.2 Ų42.29%0.08921%0.207CC..Hα-helixtrans-58.2-36.1-177.5-166.3-147.2-56.500111.3W35 I101 H277W35-M97 HydrophobicContact CH2-SD 4.47Å; W35-M97 HydrophobicContact CZ2-CE 3.76Å; W35-M97 HydrophobicContact CZ2-CG 4.42Å; W35-M97 HydrophobicContact CZ2-SD 3.99Å; M97-I101 HydrophobicContact CG-CG1 4.48Å; M97-I101 WeakPolarHBondContact O-CB 3.48Å; M97-I101 WeakPolarHBondContact O-CG1 3.44Å; M97-I101 PolarHBondContact O-N 3.4Å; M97-H277 WeakPolarHBondContact CE-NE2 3.48Å
98R88.4Confident73.9Confident22 Ų2240.4 Ų40.48%0.08320%0.2CC..Hα-helixtrans-70.6-48.7-178.3-66.4172.5176.169.72.5110.9Q96 L100 I101 V102 T138 E139 H142 L245Q96-R98 PolarHBondContact O-N 3.4Å; R98-L100 VanDerWaalsContact C-N 3.33Å; R98-L100 PolarHBondContact O-N 3.13Å; R98-I101 PolarHBondContact O-N 3.46Å; R98-V102 WeakPolarHBondContact O-CG2 3.37Å; R98-V102 PolarHBondContact O-N 3.41Å; R98-T138 HydrophobicContact CB-CG2 3.84Å; R98-E139 WeakPolarHBondContact CB-OE2 3.4Å; R98-E139 PolarHBondContact N-OE2 3.06Å; R98-H142 PolarHBondContact NH1-CD2 2.88Å; R98-H142 PolarHBondContact NH1-CE1 2.99Å; R98-H142 VanDerWaalsContact NH1-CE1 3.29Å; R98-H142 PolarHBondContact NH1-NE2 3.42Å; R98-H142 PolarHBondContact NH2-CE1 2.93Å; R98-H142 VanDerWaalsContact NH2-CE1 3.33Å; R98-L245 HydrophobicContact CB-CD1 4.11Å; R98-L245 HydrophobicContact CG-CD1 4.22Å
99G89Confident75.8Confident0 Ų036.4 Ų36.40%018%0.177CC..Hα-helixtrans-55.9-47173.400000112.1Q96 I101 V102 L103 E139Q96-G99 PolarHBondContact O-N 3.38Å; G99-I101 PolarHBondContact O-N 3.36Å; G99-V102 WeakPolarHBondContact O-CB 3.24Å; G99-V102 PolarHBondContact O-N 3.17Å; G99-L103 VanDerWaalsContact O-CG 3.31Å; G99-L103 WeakPolarHBondContact O-CG 3.34Å; G99-L103 PolarHBondContact O-N 3.44Å; G99-E139 PolarHBondContact N-OE2 3.48Å; G99-E139 VanDerWaalsContact N-OE2 3.12Å
100L89.2Confident77.8Confident2 Ų228 Ų281%0.0115%0.149CC..Hα-helixtrans-58.7-45.9178179.459.2000112.6V39 A42 E43 V46 T50 Q96 R98 V102 L103 L104V39-L100 HydrophobicContact CG1-CD2 3.92Å; A42-L100 HydrophobicContact CB-CD2 4.2Å; E43-L100 HydrophobicContact CG-CD1 4.08Å; E43-L100 HydrophobicContact CG-CD2 3.82Å; V46-L100 HydrophobicContact CG1-CD1 4.3Å; V46-L100 HydrophobicContact CG2-CD1 3.98Å; T50-L100 HydrophobicContact CG2-CB 4.15Å; Q96-L100 VanDerWaalsContact O-CB 3.31Å; Q96-L100 WeakPolarHBondContact O-CB 3.3Å; Q96-L100 PolarHBondContact O-N 3.2Å; R98-L100 VanDerWaalsContact C-N 3.33Å; R98-L100 PolarHBondContact O-N 3.13Å; L100-V102 VanDerWaalsContact C-N 3.34Å; L100-V102 PolarHBondContact O-N 3.18Å; L100-L103 PolarHBondContact O-N 3.27Å; L100-L104 HydrophobicContact CD1-CD1 4.04Å; L100-L104 HydrophobicContact CD1-CG 4.06Å; L100-L104 HydrophobicContact CG-CD1 3.86Å; L100-L104 HydrophobicContact CG-CG 4.36Å; L100-L104 WeakPolarHBondContact O-CB 3.43Å; L100-L104 VanDerWaalsContact O-CG 3.31Å; L100-L104 WeakPolarHBondContact O-CG 3.4Å; L100-L104 PolarHBondContact O-N 2.91Å
101I94.1Very high79.7Confident0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-61.9-43.3177.6-70-64.6000111.1M97 R98 G99 L103 L104 L105 L245 Y269 L273 L375 I378M97-I101 HydrophobicContact CG-CG1 4.48Å; M97-I101 WeakPolarHBondContact O-CB 3.48Å; M97-I101 WeakPolarHBondContact O-CG1 3.44Å; M97-I101 PolarHBondContact O-N 3.4Å; R98-I101 PolarHBondContact O-N 3.46Å; G99-I101 PolarHBondContact O-N 3.36Å; I101-L103 VanDerWaalsContact C-N 3.32Å; I101-L103 PolarHBondContact O-N 2.87Å; I101-L104 PolarHBondContact O-N 2.95Å; I101-L105 VanDerWaalsContact O-CB 3.27Å; I101-L105 WeakPolarHBondContact O-CB 3.5Å; I101-L105 PolarHBondContact O-N 3.06Å; I101-L245 HydrophobicContact CB-CD1 4.08Å; I101-L245 HydrophobicContact CG2-CD1 3.89Å; I101-L245 HydrophobicContact CG2-CD2 4.47Å; I101-Y269 HydrophobicContact CG2-CD1 4.38Å; I101-Y269 HydrophobicContact CG2-CE1 3.79Å; I101-L273 HydrophobicContact CD1-CD2 3.57Å; I101-L273 HydrophobicContact CG1-CD2 3.84Å; I101-L273 HydrophobicContact CG2-CD2 4.2Å; I101-L375 HydrophobicContact CD1-CD2 3.66Å; I101-L375 HydrophobicContact CG2-CD2 4.32Å; I101-I378 HydrophobicContact CD1-CD1 3.7Å; I101-I378 HydrophobicContact CD1-CG2 4.06Å
102V95.6Very high81.8Confident0 Ų025.2 Ų25.20%013%0.131CC..Hα-helixtrans-59.5-43.3175.9170.70000111R98 G99 L100 S106 A135 L245 A252R98-V102 WeakPolarHBondContact O-CG2 3.37Å; R98-V102 PolarHBondContact O-N 3.41Å; G99-V102 WeakPolarHBondContact O-CB 3.24Å; G99-V102 PolarHBondContact O-N 3.17Å; L100-V102 VanDerWaalsContact C-N 3.34Å; L100-V102 PolarHBondContact O-N 3.18Å; V102-S106 WeakPolarHBondContact O-CB 3.41Å; V102-S106 PolarHBondContact O-N 3.26Å; V102-S106 PolarHBondContact O-OG 3Å; V102-A135 HydrophobicContact CB-CB 4.2Å; V102-A135 HydrophobicContact CG1-CB 4.03Å; V102-L245 HydrophobicContact CG2-CD1 4.48Å; V102-A252 HydrophobicContact CG1-CB 3.99Å
103L93.9Very high83.4Confident5 Ų526.3 Ų26.33%0.02614%0.139CC..Hα-helixtrans-67.5-45.3178.5-68.3175.6000112.9V46 T50 G99 L100 I101 L105 S106 K107 I127 R132 A135V46-L103 HydrophobicContact CB-CB 4.17Å; V46-L103 HydrophobicContact CB-CD1 4.45Å; V46-L103 HydrophobicContact CG1-CB 3.71Å; V46-L103 HydrophobicContact CG2-CD1 4.26Å; T50-L103 HydrophobicContact CG2-CD1 4.5Å; G99-L103 VanDerWaalsContact O-CG 3.31Å; G99-L103 WeakPolarHBondContact O-CG 3.34Å; G99-L103 PolarHBondContact O-N 3.44Å; L100-L103 PolarHBondContact O-N 3.27Å; I101-L103 VanDerWaalsContact C-N 3.32Å; I101-L103 PolarHBondContact O-N 2.87Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 3.2Å; L103-S106 WeakPolarHBondContact O-CB 3.46Å; L103-S106 PolarHBondContact O-N 3.3Å; L103-K107 WeakPolarHBondContact O-CB 3.44Å; L103-K107 PolarHBondContact O-N 2.94Å; L103-I127 HydrophobicContact CB-CD1 4.09Å; L103-I127 HydrophobicContact CD2-CD1 4.17Å; L103-I127 HydrophobicContact CD2-CG2 4.1Å; L103-I127 WeakPolarHBondContact O-CD1 3.29Å; L103-R132 HydrophobicContact CD2-CB 4.29Å; L103-R132 HydrophobicContact CD2-CG 3.77Å; L103-A135 HydrophobicContact CD1-CB 4.39Å; L103-A135 HydrophobicContact CD2-CB 3.85Å; L103-A135 HydrophobicContact CG-CB 3.77Å
104L94.9Very high84.8Confident0 Ų028.1 Ų28.10%016%0.16CC..Hα-helixtrans-62.1-42.9177.2-73.9167000111.1A42 I45 V46 L100 I101 S106 K107 A108 A371 A374 L375 I378A42-L104 HydrophobicContact CB-CD1 3.85Å; A42-L104 HydrophobicContact CB-CD2 4.38Å; I45-L104 HydrophobicContact CB-CD2 4.23Å; I45-L104 HydrophobicContact CG2-CD2 4.12Å; V46-L104 HydrophobicContact CG1-CD2 3.75Å; V46-L104 HydrophobicContact CG1-CG 3.95Å; L100-L104 HydrophobicContact CD1-CD1 4.04Å; L100-L104 HydrophobicContact CD1-CG 4.06Å; L100-L104 HydrophobicContact CG-CD1 3.86Å; L100-L104 HydrophobicContact CG-CG 4.36Å; L100-L104 WeakPolarHBondContact O-CB 3.43Å; L100-L104 VanDerWaalsContact O-CG 3.31Å; L100-L104 WeakPolarHBondContact O-CG 3.4Å; L100-L104 PolarHBondContact O-N 2.91Å; I101-L104 PolarHBondContact O-N 2.95Å; L104-S106 VanDerWaalsContact C-N 3.35Å; L104-K107 PolarHBondContact O-N 3.36Å; L104-A108 VanDerWaalsContact O-CB 3.29Å; L104-A108 WeakPolarHBondContact O-CB 3.44Å; L104-A108 PolarHBondContact O-N 2.84Å; L104-A371 HydrophobicContact CD2-CB 4.36Å; L104-A374 HydrophobicContact CD2-CB 4.12Å; L104-L375 HydrophobicContact CB-CD1 4.09Å; L104-L375 HydrophobicContact CB-CD2 3.66Å; L104-L375 HydrophobicContact CB-CG 3.82Å; L104-L375 HydrophobicContact CD1-CD2 4.02Å; L104-L375 HydrophobicContact CD1-CG 4.43Å; L104-I378 HydrophobicContact CD1-CD1 3.78Å
105L96.6Very high85.7Confident0 Ų027.5 Ų27.50%016%0.159CC..Hα-helixtrans-65.3-42.1178.4-170.369.8000111.2I101 L103 K107 A108 A109 C249 M253 A266 Y269 I363 F366 L375I101-L105 VanDerWaalsContact O-CB 3.27Å; I101-L105 WeakPolarHBondContact O-CB 3.5Å; I101-L105 PolarHBondContact O-N 3.06Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 3.2Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 2.95Å; L105-A108 PolarHBondContact O-N 3.48Å; L105-A109 WeakPolarHBondContact O-CB 3.43Å; L105-A109 PolarHBondContact O-N 2.92Å; L105-C249 HydrophobicContact CD2-CB 3.44Å; L105-C249 VanDerWaalsContact CD2-CB 3.44Å; L105-M253 HydrophobicContact CG-CE 4.25Å; L105-A266 HydrophobicContact CD2-CB 3.59Å; L105-A266 HydrophobicContact CG-CB 4.49Å; L105-Y269 HydrophobicContact CD1-CD1 4.45Å; L105-I363 HydrophobicContact CD1-CD1 3.42Å; L105-I363 VanDerWaalsContact CD1-CD1 3.42Å; L105-F366 HydrophobicContact CD1-CE1 4.47Å; L105-F366 HydrophobicContact CD1-CE2 4.36Å; L105-F366 HydrophobicContact CD1-CZ 4.23Å; L105-L375 HydrophobicContact CB-CD1 4.25Å; L105-L375 HydrophobicContact CD1-CD1 4.04Å
106S95.6Very high86.6Confident1 Ų128.7 Ų28.71%0.00717%0.17CC..Hα-helixtrans-56.8-46.1173.3-61.60000111.7V102 L103 L104 G110 Q131V102-S106 WeakPolarHBondContact O-CB 3.41Å; V102-S106 PolarHBondContact O-N 3.26Å; V102-S106 PolarHBondContact O-OG 3Å; L103-S106 WeakPolarHBondContact O-CB 3.46Å; L103-S106 PolarHBondContact O-N 3.3Å; L104-S106 VanDerWaalsContact C-N 3.35Å; S106-G110 PolarHBondContact O-N 3.38Å; S106-Q131 VanDerWaalsContact CB-CD 3.47Å; S106-Q131 PolarHBondContact OG-NE2 3.06Å
107K94.5Very high86.7Confident57 Ų5735.3 Ų35.325%0.24820%0.201CC..Hα-helixtrans-69.3-38.3178.6-167.5179174.8110.60112.8I45 L103 L104 L105 G110 S125 I127 A371I45-K107 HydrophobicContact CG2-CD 3.86Å; I45-K107 WeakPolarHBondContact O-CD 3.45Å; I45-K107 WeakPolarHBondContact O-CE 3.19Å; I45-K107 PolarHBondContact O-NZ 3.46Å; L103-K107 WeakPolarHBondContact O-CB 3.44Å; L103-K107 PolarHBondContact O-N 2.94Å; L104-K107 PolarHBondContact O-N 3.36Å; L105-K107 VanDerWaalsContact C-N 3.32Å; L105-K107 PolarHBondContact O-N 2.95Å; K107-G110 PolarHBondContact O-N 2.96Å; K107-S125 PolarHBondContact NZ-O 3.41Å; K107-I127 HydrophobicContact CB-CD1 4.01Å; K107-I127 HydrophobicContact CB-CG1 3.82Å; K107-I127 HydrophobicContact CG-CG1 4.31Å; K107-A371 HydrophobicContact CB-CB 3.92Å; K107-A371 HydrophobicContact CD-CB 4.07Å; K107-A371 HydrophobicContact CG-CB 4.02Å
108A95.9Very high86Confident4 Ų440.6 Ų40.63%0.03323%0.229CC..Hα-helixtrans-67.5-37.517900000111.9L104 L105 A371 R372 L375L104-A108 VanDerWaalsContact O-CB 3.29Å; L104-A108 WeakPolarHBondContact O-CB 3.44Å; L104-A108 PolarHBondContact O-N 2.84Å; L105-A108 PolarHBondContact O-N 3.48Å; A108-A371 HydrophobicContact CB-CB 3.97Å; A108-R372 HydrophobicContact CB-CB 4.19Å; A108-L375 HydrophobicContact CB-CD1 4.14Å
109A95.1Very high85.1Confident9 Ų943 Ų437%0.07424%0.244CC..Hα-helixtrans-70.6-33.3175.700000113.1L105 M253 F366L105-A109 WeakPolarHBondContact O-CB 3.43Å; L105-A109 PolarHBondContact O-N 2.92Å; A109-M253 HydrophobicContact CB-CE 3.67Å; A109-M253 HydrophobicContact CB-SD 3.5Å; A109-M253 WeakPolarHBondContact CB-SD 3.49Å; A109-F366 HydrophobicContact CB-CD1 3.72Å; A109-F366 HydrophobicContact CB-CE1 3.77Å
110G91.4Very high84.1Confident14 Ų1445.8 Ų45.814%0.14426%0.26CS..  trans64.8-166.5-176.500000112.8S106 K107 H258S106-G110 PolarHBondContact O-N 3.38Å; K107-G110 PolarHBondContact O-N 2.96Å; G110-H258 PolarHBondContact O-CE1 3.49Å; G110-H258 PolarHBondContact O-NE2 3.3Å
111P89.3Confident83Confident72 Ų7253.4 Ų53.447%0.46829%0.293SS..SBendtrans-70.1142.3177.229.4-33.5000111.2T120 M123P111-T120 HydrophobicContact CB-CG2 4.16Å; P111-M123 HydrophobicContact CB-SD 4.23Å
112S85.5Confident82.2Confident16 Ų1658.2 Ų58.211%0.11232%0.319CS..  trans-69.8146.9171.3172.40000110.8A114 A115 A256 K257S112-A114 PolarHBondContact O-N 3.5Å; S112-A114 PolarHBondContact OG-N 3.29Å; S112-A114 VanDerWaalsContact OG-N 3.15Å; S112-A115 VanDerWaalsContact O-CB 3.23Å; S112-A115 WeakPolarHBondContact O-CB 3.21Å; S112-A115 PolarHBondContact O-N 3.05Å; S112-A256 WeakPolarHBondContact CB-O 3.42Å; S112-K257 WeakPolarHBondContact CB-O 3.22Å; S112-K257 PolarHBondContact OG-O 3.22Å
113H76.7Confident81.5Confident207 Ų20760.1 Ų60.196%0.95833%0.329SS*.THydrogen-bonded Turntrans-60.5-22.9170.8-71.1-66.3000113.1
114A72.6Confident80.9Confident82 Ų8264 Ų6468%0.67835%0.352SS*.THydrogen-bonded Turntrans-90.6-2.3175.900000113.2S112 S116S112-A114 PolarHBondContact O-N 3.5Å; S112-A114 PolarHBondContact OG-N 3.29Å; S112-A114 VanDerWaalsContact OG-N 3.15Å; A114-S116 PolarHBondContact O-N 2.94Å
115A71.1Confident80.3Confident17 Ų1766.7 Ų66.714%0.1437%0.371CS..SBendtrans-71.9127.5178.500000110S112 L119 T120S112-A115 VanDerWaalsContact O-CB 3.23Å; S112-A115 WeakPolarHBondContact O-CB 3.21Å; S112-A115 PolarHBondContact O-N 3.05Å; A115-L119 HydrophobicContact CB-CD1 4.44Å; A115-T120 HydrophobicContact CB-CG2 4.48Å
116S67.9Low79.7Confident64 Ų6468.2 Ų68.245%0.44839%0.386SS..  trans-60.4145.8172.7174.40000110.8A114 L118 L119 T120A114-S116 PolarHBondContact O-N 2.94Å; S116-L118 PolarHBondContact O-N 3.36Å; S116-L118 PolarHBondContact OG-N 3.42Å; S116-L119 WeakPolarHBondContact O-CB 3.18Å; S116-L119 PolarHBondContact O-N 2.96Å; S116-T120 PolarHBondContact O-N 2.91Å
117E66.2Low79.5Confident152 Ų15268.1 Ų68.171%0.7139%0.386SS*.Hα-helixtrans-50.4-31.6173.6-71.4-172.8167.700112.4T120 K121E117-T120 WeakPolarHBondContact CA-OG1 3.5Å; E117-T120 PolarHBondContact O-N 3.46Å; E117-T120 PolarHBondContact O-OG1 2.9Å; E117-K121 PolarHBondContact O-N 3.49Å
118L62.1Low79.3Confident129 Ų12965.9 Ų65.968%0.67538%0.376SS*.Hα-helixtrans-62-42.5175.9-76.1161.7000112.7S116 T120 K121S116-L118 PolarHBondContact O-N 3.36Å; S116-L118 PolarHBondContact OG-N 3.42Å; L118-T120 VanDerWaalsContact C-N 3.31Å; L118-T120 PolarHBondContact O-N 3.45Å; L118-K121 PolarHBondContact O-N 2.98Å
119L69.3Low79Confident73 Ų7368.5 Ų68.538%0.38239%0.393SS..Hα-helixtrans-64.7-40.6177.1-70.2171.2000110.4A115 S116 K121 D122 Y128A115-L119 HydrophobicContact CB-CD1 4.44Å; S116-L119 WeakPolarHBondContact O-CB 3.18Å; S116-L119 PolarHBondContact O-N 2.96Å; L119-K121 PolarHBondContact O-N 3.04Å; L119-D122 PolarHBondContact O-N 3.5Å; L119-Y128 HydrophobicContact CB-CE1 3.84Å; L119-Y128 WeakPolarHBondContact O-CE1 3.48Å
120T68.1Low78.9Confident57 Ų5769.7 Ų69.735%0.3540%0.4SS..Hα-helixtrans-65.3-24.8-175.463.20000113.9P111 A115 S116 E117 L118 D122P111-T120 HydrophobicContact CB-CG2 4.16Å; A115-T120 HydrophobicContact CB-CG2 4.48Å; S116-T120 PolarHBondContact O-N 2.91Å; E117-T120 WeakPolarHBondContact CA-OG1 3.5Å; E117-T120 PolarHBondContact O-N 3.46Å; E117-T120 PolarHBondContact O-OG1 2.9Å; L118-T120 VanDerWaalsContact C-N 3.31Å; L118-T120 PolarHBondContact O-N 3.45Å; T120-D122 VanDerWaalsContact C-N 3.31Å; T120-D122 PolarHBondContact O-N 3.4Å
121K67Low79Confident162 Ų16269 Ų6970%0.70439%0.394SS*.Hα-helixtrans-70.9-23.1179.2-76.3178.3179.2174.20113.8E117 L118 L119E117-K121 PolarHBondContact O-N 3.49Å; L118-K121 PolarHBondContact O-N 2.98Å; L119-K121 PolarHBondContact O-N 3.04Å
122D77.3Confident79.1Confident102 Ų10267.7 Ų67.755%0.54538%0.379SS..THydrogen-bonded Turntrans-90.5-1-175.8-65.5-20000113.2L119 T120 V124 P129L119-D122 PolarHBondContact O-N 3.5Å; T120-D122 VanDerWaalsContact C-N 3.31Å; T120-D122 PolarHBondContact O-N 3.4Å; D122-V124 PolarHBondContact O-N 2.92Å; D122-P129 HydrophobicContact CB-CG 4.3Å; D122-P129 WeakPolarHBondContact O-CD 3.48Å; D122-P129 WeakPolarHBondContact O-CG 3.43Å
123M81.4Confident79.3Confident40 Ų4070 Ų7020%0.19739%0.391CS..  trans-73.4129-176.2-63.217875.600111.5P111 G126 I127 Y128P111-M123 HydrophobicContact CB-SD 4.23Å; M123-G126 WeakPolarHBondContact CE-O 3.4Å; M123-I127 WeakPolarHBondContact CA-O 3.45Å; M123-Y128 HydrophobicContact CE-CD2 4.25Å; M123-Y128 HydrophobicContact CE-CE1 4.42Å; M123-Y128 HydrophobicContact CE-CE2 3.92Å; M123-Y128 HydrophobicContact CG-CD1 3.47Å; M123-Y128 VanDerWaalsContact CG-CD1 3.47Å; M123-Y128 HydrophobicContact CG-CE1 3.42Å; M123-Y128 VanDerWaalsContact CG-CE1 3.42Å; M123-Y128 HydrophobicContact CG-CE2 4.49Å; M123-Y128 HydrophobicContact CG-CG 4.06Å; M123-Y128 HydrophobicContact SD-CD1 4.16Å; M123-Y128 HydrophobicContact SD-CE1 3.56Å; M123-Y128 VanDerWaalsContact SD-CE1 3.56Å; M123-Y128 HydrophobicContact SD-CE2 4.02Å
124V79.6Confident80.2Confident87 Ų8760.2 Ų60.253%0.52735%0.345SS..BIsolated β-bridgetrans-108.8117173.5-179.80000109.1D122 G126 I127 R132D122-V124 PolarHBondContact O-N 2.92Å; V124-G126 PolarHBondContact O-N 3.39Å; V124-I127 PolarHBondContact N-O 3.1Å; V124-I127 PolarHBondContact O-N 3.31Å; V124-R132 PolarHBondContact O-NH2 2.95Å
125S82.3Confident81.1Confident56 Ų5656.3 Ų56.339%0.39231%0.313SS..THydrogen-bonded Turntrans57.832.8-174.5-61.30000113.9K107K107-S125 PolarHBondContact NZ-O 3.41Å
126G85.9Confident81.9Confident31 Ų3157.8 Ų57.832%0.3232%0.317SS..THydrogen-bonded Turntrans79.920.3178.400000114.7M123 V124M123-G126 WeakPolarHBondContact CE-O 3.4Å; V124-G126 PolarHBondContact O-N 3.39Å
127I90.3Very high83Confident0 Ų055 Ų550%030%0.297CS..BIsolated β-bridgetrans-131.6135.9179.1-54.2175.3000109V46 L103 K107 M123 V124 Q131 R132V46-I127 HydrophobicContact CB-CD1 4.12Å; V46-I127 HydrophobicContact CG1-CD1 4.19Å; L103-I127 HydrophobicContact CB-CD1 4.09Å; L103-I127 HydrophobicContact CD2-CD1 4.17Å; L103-I127 HydrophobicContact CD2-CG2 4.1Å; L103-I127 WeakPolarHBondContact O-CD1 3.29Å; K107-I127 HydrophobicContact CB-CD1 4.01Å; K107-I127 HydrophobicContact CB-CG1 3.82Å; K107-I127 HydrophobicContact CG-CG1 4.31Å; M123-I127 WeakPolarHBondContact CA-O 3.45Å; V124-I127 PolarHBondContact N-O 3.1Å; V124-I127 PolarHBondContact O-N 3.31Å; I127-Q131 HydrophobicContact CG2-CB 3.88Å; I127-R132 HydrophobicContact CG2-CG 3.84Å
128Y90.8Very high84.3Confident9 Ų947.8 Ų47.84%0.03526%0.263CS..  trans-71.6147.3177-65.1-77.2000111.9L119 M123 S130 Q131 R132 A256L119-Y128 HydrophobicContact CB-CE1 3.84Å; L119-Y128 WeakPolarHBondContact O-CE1 3.48Å; M123-Y128 HydrophobicContact CE-CD2 4.25Å; M123-Y128 HydrophobicContact CE-CE1 4.42Å; M123-Y128 HydrophobicContact CE-CE2 3.92Å; M123-Y128 HydrophobicContact CG-CD1 3.47Å; M123-Y128 VanDerWaalsContact CG-CD1 3.47Å; M123-Y128 HydrophobicContact CG-CE1 3.42Å; M123-Y128 VanDerWaalsContact CG-CE1 3.42Å; M123-Y128 HydrophobicContact CG-CE2 4.49Å; M123-Y128 HydrophobicContact CG-CG 4.06Å; M123-Y128 HydrophobicContact SD-CD1 4.16Å; M123-Y128 HydrophobicContact SD-CE1 3.56Å; M123-Y128 VanDerWaalsContact SD-CE1 3.56Å; M123-Y128 HydrophobicContact SD-CE2 4.02Å; Y128-S130 VanDerWaalsContact C-N 3.26Å; Y128-S130 PolarHBondContact O-N 2.87Å; Y128-Q131 VanDerWaalsContact CD2-OE1 3.3Å; Y128-Q131 VanDerWaalsContact N-OE1 3.08Å; Y128-Q131 WeakPolarHBondContact O-CB 3.27Å; Y128-Q131 PolarHBondContact O-N 3.08Å; Y128-Q131 VanDerWaalsContact O-N 3.08Å; Y128-R132 PolarHBondContact O-N 3.41Å; Y128-R132 VanDerWaalsContact O-N 3.15Å; Y128-A256 HydrophobicContact CD2-CB 3.83Å; Y128-A256 HydrophobicContact CE2-CB 3.62Å
129P89.4Confident85.5Confident59 Ų5942.1 Ų42.138%0.38323%0.233SC..Hα-helixtrans-55.7-39.9175.3-26.635.4000113D122 Q131 R132 N133D122-P129 HydrophobicContact CB-CG 4.3Å; D122-P129 WeakPolarHBondContact O-CD 3.48Å; D122-P129 WeakPolarHBondContact O-CG 3.43Å; P129-Q131 VanDerWaalsContact C-N 3.32Å; P129-Q131 PolarHBondContact O-N 3.46Å; P129-R132 WeakPolarHBondContact O-CB 3.48Å; P129-R132 PolarHBondContact O-N 3.16Å; P129-R132 VanDerWaalsContact O-N 3.14Å; P129-N133 PolarHBondContact O-N 3.48Å; P129-N133 PolarHBondContact O-OD1 3.43Å
130S92.5Very high86.3Confident34 Ų3440.4 Ų40.424%0.23822%0.224CC..Hα-helixtrans-61.9-36.6176.7570000113.1Y128 N133 L134 L192 L255Y128-S130 VanDerWaalsContact C-N 3.26Å; Y128-S130 PolarHBondContact O-N 2.87Å; S130-N133 PolarHBondContact O-N 3.49Å; S130-L134 WeakPolarHBondContact O-CB 3.48Å; S130-L134 PolarHBondContact O-N 3.39Å; S130-L192 WeakPolarHBondContact O-CD2 3.39Å; S130-L255 WeakPolarHBondContact O-CD1 3.16Å
131Q94.1Very high87.4Confident1 Ų137.9 Ų37.91%0.00521%0.209CC..Hα-helixtrans-70.1-34175.2-69.7173.6-41.600112S106 I127 Y128 P129 L134 A135 A252 L255S106-Q131 VanDerWaalsContact CB-CD 3.47Å; S106-Q131 PolarHBondContact OG-NE2 3.06Å; I127-Q131 HydrophobicContact CG2-CB 3.88Å; Y128-Q131 VanDerWaalsContact CD2-OE1 3.3Å; Y128-Q131 VanDerWaalsContact N-OE1 3.08Å; Y128-Q131 WeakPolarHBondContact O-CB 3.27Å; Y128-Q131 PolarHBondContact O-N 3.08Å; Y128-Q131 VanDerWaalsContact O-N 3.08Å; P129-Q131 VanDerWaalsContact C-N 3.32Å; P129-Q131 PolarHBondContact O-N 3.46Å; Q131-L134 PolarHBondContact O-N 3.39Å; Q131-A135 PolarHBondContact O-N 3.22Å; Q131-A252 PolarHBondContact NE2-O 3.04Å; Q131-L255 HydrophobicContact CG-CB 4.19Å; Q131-L255 HydrophobicContact CG-CD1 4.42Å
132R90.9Very high88.4Confident44 Ų4431.2 Ų31.217%0.16618%0.18CC..Hα-helixtrans-66.2-46.2172.3-65.7-176.4173.7-84.7-0.2111.2V46 L103 V124 I127 Y128 P129 L134 A135 E136V46-R132 PolarHBondContact O-NH2 3.36Å; L103-R132 HydrophobicContact CD2-CB 4.29Å; L103-R132 HydrophobicContact CD2-CG 3.77Å; V124-R132 PolarHBondContact O-NH2 2.95Å; I127-R132 HydrophobicContact CG2-CG 3.84Å; Y128-R132 PolarHBondContact O-N 3.41Å; Y128-R132 VanDerWaalsContact O-N 3.15Å; P129-R132 WeakPolarHBondContact O-CB 3.48Å; P129-R132 PolarHBondContact O-N 3.16Å; P129-R132 VanDerWaalsContact O-N 3.14Å; R132-L134 VanDerWaalsContact C-N 3.28Å; R132-L134 PolarHBondContact O-N 2.9Å; R132-A135 WeakPolarHBondContact O-CB 3.43Å; R132-A135 PolarHBondContact O-N 2.95Å; R132-A135 VanDerWaalsContact O-N 3.11Å; R132-E136 PolarHBondContact O-N 3.4Å
133N90.7Very high88.8Confident65 Ų6527 Ų2735%0.34816%0.158SC..Hα-helixtrans-59.6-39.3174-67.93.5000111.4P129 S130 E136 I137 L192P129-N133 PolarHBondContact O-N 3.48Å; P129-N133 PolarHBondContact O-OD1 3.43Å; S130-N133 PolarHBondContact O-N 3.49Å; N133-E136 WeakPolarHBondContact O-CB 3.17Å; N133-E136 PolarHBondContact O-N 3.43Å; N133-I137 VanDerWaalsContact O-CD1 3.31Å; N133-I137 WeakPolarHBondContact O-CD1 3.46Å; N133-I137 VanDerWaalsContact O-CG1 3.25Å; N133-I137 WeakPolarHBondContact O-CG1 3.47Å; N133-I137 PolarHBondContact O-N 2.9Å; N133-L192 HydrophobicContact CB-CD2 3.75Å
134L94.9Very high89Confident0 Ų025.2 Ų25.20%015%0.149CC..Hα-helixtrans-64-40174.4179.465.6000112.7S130 Q131 R132 E136 I137 T138 L192 V197 I201 A251 A252 L255S130-L134 WeakPolarHBondContact O-CB 3.48Å; S130-L134 PolarHBondContact O-N 3.39Å; Q131-L134 PolarHBondContact O-N 3.39Å; R132-L134 VanDerWaalsContact C-N 3.28Å; R132-L134 PolarHBondContact O-N 2.9Å; L134-E136 VanDerWaalsContact C-N 3.27Å; L134-E136 PolarHBondContact O-N 3.42Å; L134-I137 PolarHBondContact O-N 3.33Å; L134-T138 WeakPolarHBondContact O-CB 2.81Å; L134-T138 PolarHBondContact O-N 2.85Å; L134-T138 PolarHBondContact O-OG1 3.09Å; L134-L192 HydrophobicContact CB-CD1 4.3Å; L134-L192 HydrophobicContact CD1-CD1 4.2Å; L134-V197 HydrophobicContact CD1-CG1 4.14Å; L134-I201 HydrophobicContact CD1-CD1 4.12Å; L134-I201 HydrophobicContact CD1-CG1 4.03Å; L134-A251 HydrophobicContact CD1-CB 4.33Å; L134-A251 HydrophobicContact CD2-CB 3.61Å; L134-A252 HydrophobicContact CD2-CB 4.03Å; L134-A252 VanDerWaalsContact CD2-N 3.34Å; L134-L255 HydrophobicContact CB-CD1 3.81Å; L134-L255 HydrophobicContact CD2-CD1 3.69Å; L134-L255 HydrophobicContact CG-CD1 4.31Å
135A92.1Very high89.5Confident0 Ų022.3 Ų22.30%013%0.129CC..Hα-helixtrans-61.2-39.4173.500000111.1V102 L103 Q131 R132 T138 E139V102-A135 HydrophobicContact CB-CB 4.2Å; V102-A135 HydrophobicContact CG1-CB 4.03Å; L103-A135 HydrophobicContact CD1-CB 4.39Å; L103-A135 HydrophobicContact CD2-CB 3.85Å; L103-A135 HydrophobicContact CG-CB 3.77Å; Q131-A135 PolarHBondContact O-N 3.22Å; R132-A135 WeakPolarHBondContact O-CB 3.43Å; R132-A135 PolarHBondContact O-N 2.95Å; R132-A135 VanDerWaalsContact O-N 3.11Å; A135-T138 PolarHBondContact O-N 3.21Å; A135-E139 PolarHBondContact O-N 3.33Å
136E86.2Confident89.6Confident49 Ų4922.7 Ų22.723%0.22913%0.127CC..Hα-helixtrans-60.6-53.4173-74179.6-16500113.4M53 R132 N133 L134 T138 E139 L140M53-E136 HydrophobicContact CB-CG 4.18Å; M53-E136 VanDerWaalsContact CE-CA 3.41Å; M53-E136 HydrophobicContact CE-CB 4.07Å; M53-E136 HydrophobicContact CE-CG 3.64Å; M53-E136 HydrophobicContact CG-CG 3.45Å; M53-E136 VanDerWaalsContact CG-CG 3.45Å; M53-E136 HydrophobicContact SD-CB 4.33Å; M53-E136 HydrophobicContact SD-CG 3.32Å; M53-E136 WeakPolarHBondContact SD-CG 3.31Å; R132-E136 PolarHBondContact O-N 3.4Å; N133-E136 WeakPolarHBondContact O-CB 3.17Å; N133-E136 PolarHBondContact O-N 3.43Å; L134-E136 VanDerWaalsContact C-N 3.27Å; L134-E136 PolarHBondContact O-N 3.42Å; E136-T138 VanDerWaalsContact C-N 3.26Å; E136-T138 PolarHBondContact O-N 3.08Å; E136-E139 PolarHBondContact O-N 2.76Å; E136-L140 WeakPolarHBondContact O-CG 3.45Å; E136-L140 PolarHBondContact O-N 3.21Å
137I91.3Very high89.5Confident6 Ų621.5 Ų21.53%0.03111%0.113CC..Hα-helixtrans-56-44.6176.8-71.3157.3000110.9N133 L134 E139 L140 I141 A185 G188 L189 L192N133-I137 VanDerWaalsContact O-CD1 3.31Å; N133-I137 WeakPolarHBondContact O-CD1 3.46Å; N133-I137 VanDerWaalsContact O-CG1 3.25Å; N133-I137 WeakPolarHBondContact O-CG1 3.47Å; N133-I137 PolarHBondContact O-N 2.9Å; L134-I137 PolarHBondContact O-N 3.33Å; I137-E139 VanDerWaalsContact C-N 3.29Å; I137-E139 PolarHBondContact O-N 2.96Å; I137-L140 PolarHBondContact O-N 3.04Å; I137-I141 HydrophobicContact CG2-CD1 3.77Å; I137-I141 HydrophobicContact CG2-CG1 4.46Å; I137-I141 VanDerWaalsContact O-CG1 3.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.37Å; I137-I141 PolarHBondContact O-N 3.38Å; I137-A185 HydrophobicContact CG2-CB 4.34Å; I137-G188 WeakPolarHBondContact CD1-O 3.32Å; I137-L189 HydrophobicContact CD1-CD2 4.22Å; I137-L189 HydrophobicContact CD1-CG 4.26Å; I137-L189 HydrophobicContact CG2-CD1 4.15Å; I137-L189 HydrophobicContact CG2-CD2 3.7Å; I137-L189 HydrophobicContact CG2-CG 3.58Å; I137-L192 HydrophobicContact CD1-CD1 3.79Å; I137-L192 HydrophobicContact CD1-CD2 4.5Å; I137-L192 HydrophobicContact CD1-CG 4.07Å
138T93.5Very high89.5Confident0 Ų024 Ų240%013%0.125CC..Hα-helixtrans-59.3-43.5-179.1-610000111R98 L134 A135 E136 H142 L244 S248R98-T138 HydrophobicContact CB-CG2 3.84Å; L134-T138 WeakPolarHBondContact O-CB 2.81Å; L134-T138 PolarHBondContact O-N 2.85Å; L134-T138 PolarHBondContact O-OG1 3.09Å; A135-T138 PolarHBondContact O-N 3.21Å; E136-T138 VanDerWaalsContact C-N 3.26Å; E136-T138 PolarHBondContact O-N 3.08Å; T138-H142 PolarHBondContact O-N 3.27Å; T138-H142 VanDerWaalsContact O-N 3.09Å; T138-L244 HydrophobicContact CG2-CD1 4.42Å; T138-L244 HydrophobicContact CG2-CD2 4.43Å; T138-L244 HydrophobicContact CG2-CG 4.09Å; T138-S248 VanDerWaalsContact CG2-OG 3.28Å; T138-S248 WeakPolarHBondContact CG2-OG 2.92Å; T138-S248 VanDerWaalsContact OG1-CB 3.32Å; T138-S248 WeakPolarHBondContact OG1-CB 3.43Å; T138-S248 PolarHBondContact OG1-OG 3.41Å
139E87Confident89.2Confident10 Ų1026.6 Ų26.65%0.04714%0.135CC..Hα-helixtrans-73.3-36.8179.5-154.661.2-124.700112.1M53 L95 Q96 R98 G99 A135 E136 I137 I141 H142 T143M53-E139 HydrophobicContact CE-CB 3.9Å; L95-E139 VanDerWaalsContact O-CD 3.3Å; L95-E139 VanDerWaalsContact O-OE1 3.09Å; Q96-E139 VanDerWaalsContact CA-OE2 3.31Å; Q96-E139 WeakPolarHBondContact CA-OE2 3.31Å; Q96-E139 HydrophobicContact CB-CG 4.26Å; Q96-E139 HydrophobicContact CG-CG 4.03Å; R98-E139 WeakPolarHBondContact CB-OE2 3.4Å; R98-E139 PolarHBondContact N-OE2 3.06Å; G99-E139 PolarHBondContact N-OE2 3.48Å; G99-E139 VanDerWaalsContact N-OE2 3.12Å; A135-E139 PolarHBondContact O-N 3.33Å; E136-E139 PolarHBondContact O-N 2.76Å; I137-E139 VanDerWaalsContact C-N 3.29Å; I137-E139 PolarHBondContact O-N 2.96Å; E139-I141 PolarHBondContact O-N 3.31Å; E139-H142 PolarHBondContact O-N 3.42Å; E139-H142 IonicContact OE1-CD2 2.84Å; E139-T143 VanDerWaalsContact O-CB 3.24Å; E139-T143 WeakPolarHBondContact O-CB 3.42Å; E139-T143 PolarHBondContact O-N 3.25Å; E139-T143 PolarHBondContact O-OG1 2.95Å
140L86.3Confident88.8Confident37 Ų3723.9 Ų23.919%0.19412%0.117CC..Hα-helixtrans-60.5-44.1173.8-74.8171.8000112E136 I137 T143 A144 L181 A185E136-L140 WeakPolarHBondContact O-CG 3.45Å; E136-L140 PolarHBondContact O-N 3.21Å; I137-L140 PolarHBondContact O-N 3.04Å; L140-T143 WeakPolarHBondContact O-CB 3.34Å; L140-T143 PolarHBondContact O-N 3.14Å; L140-A144 WeakPolarHBondContact O-CB 3.31Å; L140-A144 PolarHBondContact O-N 2.91Å; L140-L181 HydrophobicContact CD2-CD2 3.83Å; L140-A185 HydrophobicContact CB-CB 4.07Å
141I91.9Very high88.6Confident4 Ų425.3 Ų25.32%0.02112%0.122CC..Hα-helixtrans-63.3-46176.2-66.6166.9000110.4I137 E139 T143 A144 F145 L182 A185 L189 I201 I205 L208 L244I137-I141 HydrophobicContact CG2-CD1 3.77Å; I137-I141 HydrophobicContact CG2-CG1 4.46Å; I137-I141 VanDerWaalsContact O-CG1 3.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.37Å; I137-I141 PolarHBondContact O-N 3.38Å; E139-I141 PolarHBondContact O-N 3.31Å; I141-T143 PolarHBondContact O-N 3.15Å; I141-A144 PolarHBondContact O-N 2.64Å; I141-F145 WeakPolarHBondContact O-CB 3.37Å; I141-F145 PolarHBondContact O-N 3.48Å; I141-L182 HydrophobicContact CG1-CD1 4.29Å; I141-A185 HydrophobicContact CD1-CB 4.25Å; I141-A185 HydrophobicContact CG1-CB 3.57Å; I141-L189 HydrophobicContact CD1-CD1 4.47Å; I141-I201 HydrophobicContact CD1-CG2 3.29Å; I141-I205 HydrophobicContact CD1-CD1 4Å; I141-I205 HydrophobicContact CD1-CG1 4.24Å; I141-I205 HydrophobicContact CG1-CD1 4.44Å; I141-I205 HydrophobicContact CG2-CG1 3.87Å; I141-L208 HydrophobicContact CG2-CD1 4.31Å; I141-L244 HydrophobicContact CB-CD1 4.37Å; I141-L244 HydrophobicContact CB-CD2 4.23Å; I141-L244 HydrophobicContact CD1-CD1 4.39Å; I141-L244 HydrophobicContact CG2-CD1 4.01Å; I141-L244 HydrophobicContact CG2-CD2 3.9Å
142H88.4Confident88.2Confident22 Ų2226.7 Ų26.710%0.10213%0.13CC..Hα-helixtrans-60.5-40.4177.4-175.752000111.6R98 T138 E139 F145 L146 L244R98-H142 PolarHBondContact NH1-CD2 2.88Å; R98-H142 PolarHBondContact NH1-CE1 2.99Å; R98-H142 VanDerWaalsContact NH1-CE1 3.29Å; R98-H142 PolarHBondContact NH1-NE2 3.42Å; R98-H142 PolarHBondContact NH2-CE1 2.93Å; R98-H142 VanDerWaalsContact NH2-CE1 3.33Å; T138-H142 PolarHBondContact O-N 3.27Å; T138-H142 VanDerWaalsContact O-N 3.09Å; E139-H142 PolarHBondContact O-N 3.42Å; E139-H142 IonicContact OE1-CD2 2.84Å; H142-F145 WeakPolarHBondContact O-CB 3.1Å; H142-F145 PolarHBondContact O-N 3.44Å; H142-L146 WeakPolarHBondContact O-CG 3.38Å; H142-L146 PolarHBondContact O-N 3.33Å; H142-L244 HydrophobicContact CB-CD2 3.9Å
143T84.3Confident88Confident13 Ų1328.6 Ų28.68%0.0814%0.144CC..Hα-helixtrans-63.5-48.3178.2-60.80000111.7F87 E139 L140 I141 F145 L146 V147 L181F87-T143 HydrophobicContact CE1-CG2 3.33Å; F87-T143 HydrophobicContact CZ-CG2 3.27Å; E139-T143 VanDerWaalsContact O-CB 3.24Å; E139-T143 WeakPolarHBondContact O-CB 3.42Å; E139-T143 PolarHBondContact O-N 3.25Å; E139-T143 PolarHBondContact O-OG1 2.95Å; L140-T143 WeakPolarHBondContact O-CB 3.34Å; L140-T143 PolarHBondContact O-N 3.14Å; I141-T143 PolarHBondContact O-N 3.15Å; T143-F145 VanDerWaalsContact C-N 3.26Å; T143-F145 PolarHBondContact O-N 3.28Å; T143-L146 PolarHBondContact O-N 3.5Å; T143-V147 WeakPolarHBondContact O-CG2 3.37Å; T143-V147 PolarHBondContact O-N 3.34Å; T143-L181 HydrophobicContact CG2-CD1 3.62Å
144A87.2Confident87.8Confident2 Ų228.2 Ų28.22%0.01714%0.142CC..Hα-helixtrans-54.4-46.2174.800000111L140 I141 L146 V147 H148 G178 L181 L182L140-A144 WeakPolarHBondContact O-CB 3.31Å; L140-A144 PolarHBondContact O-N 2.91Å; I141-A144 PolarHBondContact O-N 2.64Å; A144-L146 PolarHBondContact O-N 2.81Å; A144-V147 PolarHBondContact O-N 3.3Å; A144-H148 PolarHBondContact O-N 3.43Å; A144-G178 WeakPolarHBondContact CB-O 3.44Å; A144-L181 HydrophobicContact CB-CB 3.75Å; A144-L181 HydrophobicContact CB-CD1 4.49Å; A144-L182 HydrophobicContact CB-CB 4.24Å
145F89.1Confident87.4Confident26 Ų2637.7 Ų37.711%0.11418%0.183CC..Hα-helixtrans-60.4-44.2177.6178.7-105.5000112.8I141 H142 T143 H148 R149 L208 I212I141-F145 WeakPolarHBondContact O-CB 3.37Å; I141-F145 PolarHBondContact O-N 3.48Å; H142-F145 WeakPolarHBondContact O-CB 3.1Å; H142-F145 PolarHBondContact O-N 3.44Å; T143-F145 VanDerWaalsContact C-N 3.26Å; T143-F145 PolarHBondContact O-N 3.28Å; F145-H148 PolarHBondContact O-N 3.24Å; F145-R149 HydrophobicContact CE1-CG 4.41Å; F145-R149 HydrophobicContact CZ-CG 4.38Å; F145-R149 WeakPolarHBondContact O-CG 3.34Å; F145-R149 PolarHBondContact O-N 2.96Å; F145-L208 HydrophobicContact CD2-CB 4.18Å; F145-L208 HydrophobicContact CE1-CD2 4.46Å; F145-L208 HydrophobicContact CE2-CB 3.94Å; F145-L208 HydrophobicContact CE2-CD2 4.48Å; F145-L208 HydrophobicContact CZ-CD2 4.28Å; F145-I212 HydrophobicContact CE2-CD1 3.97Å; F145-I212 HydrophobicContact CE2-CG1 3.47Å; F145-I212 VanDerWaalsContact CE2-CG1 3.47Å; F145-I212 HydrophobicContact CZ-CD1 3.62Å; F145-I212 HydrophobicContact CZ-CG1 3.64Å
146L84.4Confident87Confident64 Ų6443.8 Ų43.834%0.33521%0.211SC..Hα-helixtrans-63.4-42.2176.1-69.8-179.5000112.3T83 H142 T143 A144 R149 G150T83-L146 HydrophobicContact CG2-CB 4.18Å; H142-L146 WeakPolarHBondContact O-CG 3.38Å; H142-L146 PolarHBondContact O-N 3.33Å; T143-L146 PolarHBondContact O-N 3.5Å; A144-L146 PolarHBondContact O-N 2.81Å; L146-R149 PolarHBondContact O-N 2.75Å; L146-G150 PolarHBondContact O-N 3.19Å
147V84.6Confident87.1Confident6 Ų645.1 Ų45.14%0.03621%0.214CC..Hα-helixtrans-61.4-47.8177.5168.80000110.7L80 T83 T143 A144 R149 G150 A174 L181L80-V147 HydrophobicContact CD1-CG1 3.87Å; L80-V147 HydrophobicContact CD1-CG2 4.44Å; T83-V147 HydrophobicContact CG2-CG2 3.78Å; T143-V147 WeakPolarHBondContact O-CG2 3.37Å; T143-V147 PolarHBondContact O-N 3.34Å; A144-V147 PolarHBondContact O-N 3.3Å; V147-R149 PolarHBondContact O-N 3.24Å; V147-G150 WeakPolarHBondContact O-CA 3.3Å; V147-G150 PolarHBondContact O-N 3.04Å; V147-A174 HydrophobicContact CG1-CB 4.49Å; V147-A174 VanDerWaalsContact CG1-O 3.24Å; V147-A174 WeakPolarHBondContact CG1-O 3.44Å; V147-L181 HydrophobicContact CG2-CD1 4.35Å
148H89.3Confident86.7Confident53 Ų5347.4 Ų47.425%0.24523%0.228CC..Hα-helixtrans-63.2-36.8176.6-76.1162.9000113.2A144 F145 G150 I151 A174 V175 G178 D179A144-H148 PolarHBondContact O-N 3.43Å; F145-H148 PolarHBondContact O-N 3.24Å; H148-G150 PolarHBondContact O-N 2.9Å; H148-G150 VanDerWaalsContact O-N 3.17Å; H148-I151 WeakPolarHBondContact O-CD1 3.41Å; H148-I151 VanDerWaalsContact O-CG1 3.25Å; H148-I151 WeakPolarHBondContact O-CG1 3.36Å; H148-I151 PolarHBondContact O-N 2.86Å; H148-A174 PolarHBondContact CD2-O 2.79Å; H148-V175 PolarHBondContact NE2-O 2.89Å; H148-V175 VanDerWaalsContact NE2-O 3.14Å; H148-G178 WeakPolarHBondContact NE2-CA 3.38Å; H148-D179 IonicContact CE1-OD1 3.16Å; H148-D179 PolarHBondContact CE1-OD1 3.35Å; H148-D179 PolarHBondContact NE2-N 2.54Å; H148-D179 IonicContact NE2-OD1 2.95Å; H148-D179 PolarHBondContact NE2-OD1 2.75Å
149R84.4Confident86.3Confident63 Ų6353.2 Ų53.224%0.23826%0.264CS..Hα-helixtrans-64.1-17.7173.8-73.3-173.185.2-162.810.8113.3F145 L146 V147 I151 I212 E215F145-R149 HydrophobicContact CE1-CG 4.41Å; F145-R149 HydrophobicContact CZ-CG 4.38Å; F145-R149 WeakPolarHBondContact O-CG 3.34Å; F145-R149 PolarHBondContact O-N 2.96Å; L146-R149 PolarHBondContact O-N 2.75Å; V147-R149 PolarHBondContact O-N 3.24Å; R149-I151 PolarHBondContact O-N 2.78Å; R149-I212 HydrophobicContact CG-CD1 4.32Å; R149-E215 IonicContact CZ-OE2 3.67Å; R149-E215 IonicContact NH2-OE1 3.85Å; R149-E215 PolarHBondContact NH2-OE1 3.14Å; R149-E215 IonicContact NH2-OE2 3.27Å; R149-E215 PolarHBondContact NH2-OE2 3.08Å
150G82Confident86.2Confident2 Ų256 Ų562%0.02129%0.285CS..THydrogen-bonded Turntrans-75.1-0.317600000115.5H78 L146 V147 H148H78-G150 PolarHBondContact CE1-O 2.91Å; L146-G150 PolarHBondContact O-N 3.19Å; V147-G150 WeakPolarHBondContact O-CA 3.3Å; V147-G150 PolarHBondContact O-N 3.04Å; H148-G150 PolarHBondContact O-N 2.9Å; H148-G150 VanDerWaalsContact O-N 3.17Å
151I88.3Confident86.1Confident64 Ų6456 Ų5633%0.32829%0.285SS..  trans-69.1128.3175.3-64.8166.2000110.1H148 R149 N171 A174 V175H148-I151 WeakPolarHBondContact O-CD1 3.41Å; H148-I151 VanDerWaalsContact O-CG1 3.25Å; H148-I151 WeakPolarHBondContact O-CG1 3.36Å; H148-I151 PolarHBondContact O-N 2.86Å; R149-I151 PolarHBondContact O-N 2.78Å; I151-N171 WeakPolarHBondContact CA-OD1 3.38Å; I151-A174 HydrophobicContact CG1-CB 3.82Å; I151-V175 HydrophobicContact CD1-CG2 3.5Å; I151-V175 VanDerWaalsContact CD1-CG2 3.5Å; I151-V175 HydrophobicContact CG1-CG2 4.24Å
152V85.4Confident85.9Confident31 Ų3156.3 Ų56.319%0.18829%0.289CS..  trans-93144-179-60.50000112.6P79 L154 M167 N171P79-V152 HydrophobicContact CG-CG1 3.67Å; V152-L154 HydrophobicContact CG2-CD2 3.68Å; V152-L154 HydrophobicContact CG2-CG 4.39Å; V152-L154 PolarHBondContact O-N 3.05Å; V152-M167 HydrophobicContact CB-CE 4.47Å; V152-M167 HydrophobicContact CG1-CE 4.03Å; V152-M167 HydrophobicContact CG2-CE 3.96Å; V152-N171 VanDerWaalsContact CG2-OD1 3.27Å; V152-N171 WeakPolarHBondContact CG2-OD1 3.33Å; V152-N171 PolarHBondContact N-OD1 3.09Å; V152-N171 PolarHBondContact O-ND2 2.94Å
153N85.8Confident86.1Confident84 Ų8458.8 Ų58.845%0.44931%0.307SS..  trans-78.4101.4168.8-177.67.9000110K155 E156N153-K155 PolarHBondContact O-N 3.16Å; N153-K155 VanDerWaalsContact O-N 3.11Å; N153-K155 WeakPolarHBondContact OD1-CB 3.37Å; N153-K155 PolarHBondContact OD1-N 3.09Å; N153-K155 VanDerWaalsContact OD1-N 3.16Å; N153-E156 PolarHBondContact ND2-OE1 2.97Å; N153-E156 PolarHBondContact O-N 3.43Å; N153-E156 VanDerWaalsContact O-N 3.08Å
154L88.2Confident86.5Confident57 Ų5761.5 Ų61.530%0.29832%0.321SS..G310 helixtrans-65.9-13.6-177.8-61.5174000113.9V152 E156 W157 L164 M167 E168V152-L154 HydrophobicContact CG2-CD2 3.68Å; V152-L154 HydrophobicContact CG2-CG 4.39Å; V152-L154 PolarHBondContact O-N 3.05Å; L154-E156 VanDerWaalsContact C-N 3.29Å; L154-W157 WeakPolarHBondContact O-CB 3.47Å; L154-L164 HydrophobicContact CD2-CD1 4.14Å; L154-M167 HydrophobicContact CD2-CB 3.88Å; L154-E168 HydrophobicContact CD1-CG 3.58Å
155K86.7Confident86.7Confident198 Ų19869.3 Ų69.386%0.86135%0.354SS*.G310 helixtrans-71.1-25.7173-63.7-178179.2178.80112.9N153N153-K155 PolarHBondContact O-N 3.16Å; N153-K155 VanDerWaalsContact O-N 3.11Å; N153-K155 WeakPolarHBondContact OD1-CB 3.37Å; N153-K155 PolarHBondContact OD1-N 3.09Å; N153-K155 VanDerWaalsContact OD1-N 3.16Å
156E82.6Confident86.8Confident129 Ų12970.8 Ų70.860%0.60336%0.363SS*.G310 helixtrans-101.36.5-179.8-68.9171.8-139.100112.3N153 L154N153-E156 PolarHBondContact ND2-OE1 2.97Å; N153-E156 PolarHBondContact O-N 3.43Å; N153-E156 VanDerWaalsContact O-N 3.08Å; L154-E156 VanDerWaalsContact C-N 3.29Å
157W88.4Confident87.1Confident76 Ų7668 Ų6829%0.28835%0.348SS..  trans-64.8147-177.8170.184.4000112.6L154 V159 G162 L164L154-W157 WeakPolarHBondContact O-CB 3.47Å; W157-V159 HydrophobicContact CH2-CG2 3.97Å; W157-G162 VanDerWaalsContact CE2-O 3.3Å; W157-G162 WeakPolarHBondContact CZ2-O 3.28Å; W157-G162 PolarHBondContact NE1-O 3.01Å; W157-L164 HydrophobicContact CD2-CD1 4.11Å; W157-L164 HydrophobicContact CE3-CD1 4.37Å; W157-L164 HydrophobicContact CG-CD1 4.31Å; W157-L164 HydrophobicContact CH2-CB 4.25Å; W157-L164 HydrophobicContact CZ2-CB 4.09Å
158T82.4Confident87.5Confident54 Ų5472.1 Ų72.133%0.33137%0.367SS..  trans-130.8157.317667.70000111.4S160 D161T158-S160 PolarHBondContact O-N 3.11Å; T158-S160 VanDerWaalsContact O-N 3.08Å; T158-S160 PolarHBondContact OG1-OG 3.21Å; T158-D161 WeakPolarHBondContact CA-OD2 3.47Å; T158-D161 PolarHBondContact N-OD2 3.26Å; T158-D161 WeakPolarHBondContact O-CB 3.36Å; T158-D161 PolarHBondContact O-N 2.98Å; T158-D161 PolarHBondContact OG1-OD2 3.38Å
159V84.9Confident87.6Confident122 Ų12272.2 Ų72.274%0.73937%0.367SS*.G310 helixtrans-58.2-27.1177.8-178.20000112.4W157 D161 G162W157-V159 HydrophobicContact CH2-CG2 3.97Å; V159-D161 PolarHBondContact O-N 3.45Å; V159-G162 PolarHBondContact O-N 3.22Å
160S85.1Confident87.8Confident70 Ų7069.2 Ų69.249%0.4936%0.356SS..G310 helixtrans-67.9-15.8175.137.80000114.6Q77 T158 G162Q77-S160 PolarHBondContact NE2-O 3.45Å; T158-S160 PolarHBondContact O-N 3.11Å; T158-S160 VanDerWaalsContact O-N 3.08Å; T158-S160 PolarHBondContact OG1-OG 3.21Å; S160-G162 VanDerWaalsContact C-N 3.32Å
161D83.7Confident88.3Confident36 Ų3670.2 Ų70.219%0.19336%0.361CS..G310 helixtrans-81.4-16.2177.1-56.4-48.6000112.1T76 Q77 T158 V159 M167T76-D161 CarbonylContact C-O 3.44Å; T76-D161 WeakPolarHBondContact CA-O 3.04Å; T76-D161 WeakPolarHBondContact CB-O 3.34Å; Q77-D161 PolarHBondContact N-O 2.76Å; T158-D161 WeakPolarHBondContact CA-OD2 3.47Å; T158-D161 PolarHBondContact N-OD2 3.26Å; T158-D161 WeakPolarHBondContact O-CB 3.36Å; T158-D161 PolarHBondContact O-N 2.98Å; T158-D161 PolarHBondContact OG1-OD2 3.38Å; V159-D161 PolarHBondContact O-N 3.45Å; D161-M167 HydrophobicContact CB-CE 4.03Å; D161-M167 HydrophobicContact CB-SD 4.39Å; D161-M167 VanDerWaalsContact O-SD 3.37Å
162G89.2Confident88.4Confident11 Ų1173.7 Ų73.711%0.11337%0.374CS..  trans111.5172.7-175.600000112.3W157 V159 S160 L164W157-G162 VanDerWaalsContact CE2-O 3.3Å; W157-G162 WeakPolarHBondContact CZ2-O 3.28Å; W157-G162 PolarHBondContact NE1-O 3.01Å; V159-G162 PolarHBondContact O-N 3.22Å; S160-G162 VanDerWaalsContact C-N 3.32Å; G162-L164 PolarHBondContact O-N 3.44Å
163P92.4Very high88.5Confident74 Ų7473 Ų7348%0.48137%0.368SS..  trans-57.6135.5-174.8-23.935000112.4K165 D166 M167P163-K165 PolarHBondContact O-N 3.28Å; P163-K165 VanDerWaalsContact O-N 3.15Å; P163-D166 HydrophobicContact CB-CB 4.42Å; P163-D166 VanDerWaalsContact CG-OD2 3.32Å; P163-D166 WeakPolarHBondContact CG-OD2 3.45Å; P163-D166 WeakPolarHBondContact O-CB 3.34Å; P163-D166 PolarHBondContact O-N 3.17Å; P163-M167 PolarHBondContact O-N 3.27Å; P163-M167 VanDerWaalsContact O-N 3.08Å
164L91.6Very high88.7Confident70 Ų7069 Ų6937%0.36635%0.347SS..Hα-helixtrans-52.6-42.2-177.2179.862.7000112.7L154 W157 G162 D166 M167 E168L154-L164 HydrophobicContact CD2-CD1 4.14Å; W157-L164 HydrophobicContact CD2-CD1 4.11Å; W157-L164 HydrophobicContact CE3-CD1 4.37Å; W157-L164 HydrophobicContact CG-CD1 4.31Å; W157-L164 HydrophobicContact CH2-CB 4.25Å; W157-L164 HydrophobicContact CZ2-CB 4.09Å; G162-L164 PolarHBondContact O-N 3.44Å; L164-D166 VanDerWaalsContact C-N 3.28Å; L164-D166 PolarHBondContact O-N 3.45Å; L164-M167 PolarHBondContact O-N 3.45Å; L164-M167 VanDerWaalsContact O-N 3.14Å; L164-E168 HydrophobicContact CD1-CG 4.43Å; L164-E168 HydrophobicContact CG-CG 4.46Å; L164-E168 WeakPolarHBondContact O-CG 3.44Å; L164-E168 PolarHBondContact O-N 2.9Å
165K91.9Very high88.8Confident166 Ų16669 Ų6972%0.72235%0.35SS*.Hα-helixtrans-60-36.7177.7-68.5-173.9177.7-178.10112.9P163 F169P163-K165 PolarHBondContact O-N 3.28Å; P163-K165 VanDerWaalsContact O-N 3.15Å; K165-F169 VanDerWaalsContact O-CB 3.27Å; K165-F169 WeakPolarHBondContact O-CB 3.29Å; K165-F169 PolarHBondContact O-N 3.13Å
166D91.1Very high88.9Confident57 Ų5764 Ų6431%0.30533%0.331SS..Hα-helixtrans-74.8-34.6178.7-61.1-22.6000110.4L73 T76 P163 L164 F169 G170L73-D166 WeakPolarHBondContact CD2-O 3.25Å; T76-D166 HydrophobicContact CG2-CB 3.77Å; P163-D166 HydrophobicContact CB-CB 4.42Å; P163-D166 VanDerWaalsContact CG-OD2 3.32Å; P163-D166 WeakPolarHBondContact CG-OD2 3.45Å; P163-D166 WeakPolarHBondContact O-CB 3.34Å; P163-D166 PolarHBondContact O-N 3.17Å; L164-D166 VanDerWaalsContact C-N 3.28Å; L164-D166 PolarHBondContact O-N 3.45Å; D166-F169 PolarHBondContact O-N 2.95Å; D166-G170 PolarHBondContact O-N 3Å
167M91.8Very high89Confident4 Ų458.1 Ų58.12%0.0231%0.305CS..Hα-helixtrans-67.6-42.4173.9-59.1-58.8-69.700112.2T76 H78 V152 L154 D161 P163 L164 F169 G170 N171T76-M167 HydrophobicContact CG2-SD 4.48Å; H78-M167 HydrophobicContact CB-CE 4.14Å; H78-M167 HydrophobicContact CB-SD 3.96Å; V152-M167 HydrophobicContact CB-CE 4.47Å; V152-M167 HydrophobicContact CG1-CE 4.03Å; V152-M167 HydrophobicContact CG2-CE 3.96Å; L154-M167 HydrophobicContact CD2-CB 3.88Å; D161-M167 HydrophobicContact CB-CE 4.03Å; D161-M167 HydrophobicContact CB-SD 4.39Å; D161-M167 VanDerWaalsContact O-SD 3.37Å; P163-M167 PolarHBondContact O-N 3.27Å; P163-M167 VanDerWaalsContact O-N 3.08Å; L164-M167 PolarHBondContact O-N 3.45Å; L164-M167 VanDerWaalsContact O-N 3.14Å; M167-F169 VanDerWaalsContact C-N 3.35Å; M167-G170 PolarHBondContact O-N 3.13Å; M167-N171 PolarHBondContact O-N 3.49Å
168E92.3Very high89Confident93 Ų9354.5 Ų54.544%0.43529%0.291SS..Hα-helixtrans-60.7-44.2171.9-74.1173.5156.500111.7L154 L164 G170 N171 K172L154-E168 HydrophobicContact CD1-CG 3.58Å; L164-E168 HydrophobicContact CD1-CG 4.43Å; L164-E168 HydrophobicContact CG-CG 4.46Å; L164-E168 WeakPolarHBondContact O-CG 3.44Å; L164-E168 PolarHBondContact O-N 2.9Å; E168-G170 VanDerWaalsContact C-N 3.32Å; E168-G170 PolarHBondContact O-N 2.74Å; E168-N171 PolarHBondContact O-N 3.29Å; E168-K172 PolarHBondContact O-N 2.89Å
169F90.4Very high89.4Confident56 Ų5655.7 Ų55.725%0.24630%0.296CS..Hα-helixtrans-61.4-42.8175179.3-101.3000111.4H69 K72 L73 K165 D166 M167 N171 K172 M173H69-F169 HydrophobicContact CB-CE1 4.23Å; H69-F169 HydrophobicContact CB-CZ 3.92Å; K72-F169 HydrophobicContact CB-CE1 4.11Å; K72-F169 HydrophobicContact CD-CE1 4.11Å; K72-F169 HydrophobicContact CD-CZ 4.18Å; L73-F169 HydrophobicContact CD2-CD1 3.97Å; K165-F169 VanDerWaalsContact O-CB 3.27Å; K165-F169 WeakPolarHBondContact O-CB 3.29Å; K165-F169 PolarHBondContact O-N 3.13Å; D166-F169 PolarHBondContact O-N 2.95Å; M167-F169 VanDerWaalsContact C-N 3.35Å; F169-N171 VanDerWaalsContact C-N 3.35Å; F169-N171 PolarHBondContact O-N 3.19Å; F169-K172 WeakPolarHBondContact O-CB 3.28Å; F169-K172 PolarHBondContact O-N 2.95Å; F169-M173 HydrophobicContact CD1-CG 4.22Å; F169-M173 HydrophobicContact CE1-CG 3.71Å; F169-M173 HydrophobicContact CE1-SD 4.49Å; F169-M173 HydrophobicContact CE2-CG 4.21Å; F169-M173 HydrophobicContact CE2-SD 4.26Å; F169-M173 HydrophobicContact CZ-CG 3.7Å; F169-M173 HydrophobicContact CZ-SD 3.9Å; F169-M173 WeakPolarHBondContact O-CG 3.37Å; F169-M173 PolarHBondContact O-N 3.12Å
170G89.4Confident89.5Confident0 Ų053 Ų530%027%0.274CS..Hα-helixtrans-60.6-41.9175.800000112.8H78 D166 M167 E168 M173 A174H78-G170 PolarHBondContact CE1-O 3.4Å; H78-G170 WeakPolarHBondContact NE2-CA 3.48Å; D166-G170 PolarHBondContact O-N 3Å; M167-G170 PolarHBondContact O-N 3.13Å; E168-G170 VanDerWaalsContact C-N 3.32Å; E168-G170 PolarHBondContact O-N 2.74Å; G170-M173 PolarHBondContact O-N 3.46Å; G170-A174 WeakPolarHBondContact O-CB 3.34Å; G170-A174 PolarHBondContact O-N 2.98Å
171N92.3Very high89.5Confident23 Ų2350 Ų5012%0.12325%0.252CS..Hα-helixtrans-60.8-45.7174.2-86.3-5.4000111.6H78 I151 V152 M167 E168 F169 M173 A174 V175H78-N171 PolarHBondContact NE2-N 3.35Å; H78-N171 VanDerWaalsContact NE2-N 3.16Å; H78-N171 PolarHBondContact NE2-OD1 3.45Å; I151-N171 WeakPolarHBondContact CA-OD1 3.38Å; V152-N171 VanDerWaalsContact CG2-OD1 3.27Å; V152-N171 WeakPolarHBondContact CG2-OD1 3.33Å; V152-N171 PolarHBondContact N-OD1 3.09Å; V152-N171 PolarHBondContact O-ND2 2.94Å; M167-N171 PolarHBondContact O-N 3.49Å; E168-N171 PolarHBondContact O-N 3.29Å; F169-N171 VanDerWaalsContact C-N 3.35Å; F169-N171 PolarHBondContact O-N 3.19Å; N171-M173 VanDerWaalsContact C-N 3.31Å; N171-M173 PolarHBondContact O-N 3.37Å; N171-A174 PolarHBondContact O-N 3.06Å; N171-V175 WeakPolarHBondContact O-CG2 3.34Å; N171-V175 PolarHBondContact O-N 3.13Å
172K91.5Very high89.8Confident137 Ų13750.5 Ų50.560%0.59626%0.255SS*.Hα-helixtrans-59.5-43.7176.8-175.9175.5-178.9177.10111.5E168 F169 L176E168-K172 PolarHBondContact O-N 2.89Å; F169-K172 WeakPolarHBondContact O-CB 3.28Å; F169-K172 PolarHBondContact O-N 2.95Å; K172-L176 HydrophobicContact CG-CD1 4.01Å; K172-L176 WeakPolarHBondContact O-CG 3.32Å; K172-L176 PolarHBondContact O-N 3.29Å; K172-L176 VanDerWaalsContact O-N 3.15Å
173M87.8Confident89.9Confident15 Ų1552.5 Ų52.57%0.07427%0.27CS..Hα-helixtrans-66.3-41.2177.3-69.8-52.3-49.700112.1V66 H69 L80 F169 G170 N171 V175 L176 S177V66-M173 HydrophobicContact CG2-CE 4.49Å; H69-M173 HydrophobicContact CB-CE 3.64Å; H69-M173 HydrophobicContact CB-CG 4.19Å; H69-M173 HydrophobicContact CB-SD 3.79Å; L80-M173 HydrophobicContact CD2-CB 3.72Å; F169-M173 HydrophobicContact CD1-CG 4.22Å; F169-M173 HydrophobicContact CE1-CG 3.71Å; F169-M173 HydrophobicContact CE1-SD 4.49Å; F169-M173 HydrophobicContact CE2-CG 4.21Å; F169-M173 HydrophobicContact CE2-SD 4.26Å; F169-M173 HydrophobicContact CZ-CG 3.7Å; F169-M173 HydrophobicContact CZ-SD 3.9Å; F169-M173 WeakPolarHBondContact O-CG 3.37Å; F169-M173 PolarHBondContact O-N 3.12Å; G170-M173 PolarHBondContact O-N 3.46Å; N171-M173 VanDerWaalsContact C-N 3.31Å; N171-M173 PolarHBondContact O-N 3.37Å; M173-V175 PolarHBondContact O-N 3.31Å; M173-L176 PolarHBondContact O-N 3.49Å; M173-S177 WeakPolarHBondContact O-CB 3.42Å; M173-S177 PolarHBondContact O-N 2.93Å; M173-S177 PolarHBondContact O-OG 3.01Å
174A88.3Confident89.6Confident0 Ų052.2 Ų52.20%026%0.264CS..Hα-helixtrans-59.9-45.1177.500000111.8L80 V147 H148 I151 G170 N171 G178L80-A174 HydrophobicContact CD1-CB 4.42Å; L80-A174 HydrophobicContact CD2-CB 4.42Å; V147-A174 HydrophobicContact CG1-CB 4.49Å; V147-A174 VanDerWaalsContact CG1-O 3.24Å; V147-A174 WeakPolarHBondContact CG1-O 3.44Å; H148-A174 PolarHBondContact CD2-O 2.79Å; I151-A174 HydrophobicContact CG1-CB 3.82Å; G170-A174 WeakPolarHBondContact O-CB 3.34Å; G170-A174 PolarHBondContact O-N 2.98Å; N171-A174 PolarHBondContact O-N 3.06Å; A174-G178 PolarHBondContact O-N 3.38Å; A174-G178 VanDerWaalsContact O-N 3.11Å
175V91.8Very high89.6Confident59 Ų5948.9 Ų48.936%0.35825%0.247SC..Hα-helixtrans-60-56.5176.1175.10000110.9H148 I151 N171 M173 S177 G178 D179H148-V175 PolarHBondContact NE2-O 2.89Å; H148-V175 VanDerWaalsContact NE2-O 3.14Å; I151-V175 HydrophobicContact CD1-CG2 3.5Å; I151-V175 VanDerWaalsContact CD1-CG2 3.5Å; I151-V175 HydrophobicContact CG1-CG2 4.24Å; N171-V175 WeakPolarHBondContact O-CG2 3.34Å; N171-V175 PolarHBondContact O-N 3.13Å; M173-V175 PolarHBondContact O-N 3.31Å; V175-S177 PolarHBondContact O-N 2.93Å; V175-G178 PolarHBondContact O-N 3.21Å; V175-D179 VanDerWaalsContact O-CG 3.23Å; V175-D179 PolarHBondContact O-N 3.42Å
176L88.4Confident89.7Confident91 Ų9143.8 Ų43.848%0.47623%0.232SC..Hα-helixtrans-63.8-40.8-174.1-67.6173.5000112.9K172 M173 D179 F180K172-L176 HydrophobicContact CG-CD1 4.01Å; K172-L176 WeakPolarHBondContact O-CG 3.32Å; K172-L176 PolarHBondContact O-N 3.29Å; K172-L176 VanDerWaalsContact O-N 3.15Å; M173-L176 PolarHBondContact O-N 3.49Å; L176-D179 PolarHBondContact O-N 2.89Å; L176-F180 WeakPolarHBondContact O-CB 3.48Å; L176-F180 PolarHBondContact O-N 2.72Å
177S84.7Confident89.7Confident7 Ų744.7 Ų44.75%0.04924%0.24CC..Hα-helixtrans-68.9-38.5179-63.80000112.2V66 M173 V175 L181V66-S177 WeakPolarHBondContact CG1-OG 3.44Å; V66-S177 VanDerWaalsContact CG2-OG 3.27Å; V66-S177 WeakPolarHBondContact CG2-OG 3.4Å; M173-S177 WeakPolarHBondContact O-CB 3.42Å; M173-S177 PolarHBondContact O-N 2.93Å; M173-S177 PolarHBondContact O-OG 3.01Å; V175-S177 PolarHBondContact O-N 2.93Å; S177-L181 VanDerWaalsContact O-CG 3.31Å; S177-L181 WeakPolarHBondContact O-CG 3.31Å; S177-L181 PolarHBondContact O-N 3.3Å; S177-L181 VanDerWaalsContact O-N 3.13Å
178G87.3Confident89.6Confident0 Ų045.2 Ų45.20%025%0.246CC..Hα-helixtrans-65.8-42.8174.300000112A144 H148 A174 V175 F180 L181 L182A144-G178 WeakPolarHBondContact CB-O 3.44Å; H148-G178 WeakPolarHBondContact NE2-CA 3.38Å; A174-G178 PolarHBondContact O-N 3.38Å; A174-G178 VanDerWaalsContact O-N 3.11Å; V175-G178 PolarHBondContact O-N 3.21Å; G178-F180 VanDerWaalsContact C-N 3.35Å; G178-F180 PolarHBondContact O-N 2.89Å; G178-L181 PolarHBondContact O-N 3.06Å; G178-L182 WeakPolarHBondContact O-CB 3.35Å; G178-L182 PolarHBondContact O-N 2.93Å
179D91.3Very high89.8Confident79 Ų7940.9 Ų40.942%0.42223%0.226SC..Hα-helixtrans-63.2-41.6178.3-67.2-7.8000111.6H148 V175 L176 L182 A183H148-D179 IonicContact CE1-OD1 3.16Å; H148-D179 PolarHBondContact CE1-OD1 3.35Å; H148-D179 PolarHBondContact NE2-N 2.54Å; H148-D179 IonicContact NE2-OD1 2.95Å; H148-D179 PolarHBondContact NE2-OD1 2.75Å; V175-D179 VanDerWaalsContact O-CG 3.23Å; V175-D179 PolarHBondContact O-N 3.42Å; L176-D179 PolarHBondContact O-N 2.89Å; D179-L182 PolarHBondContact O-N 3.21Å; D179-A183 WeakPolarHBondContact O-CB 3.38Å; D179-A183 PolarHBondContact O-N 3Å
180F86.6Confident90Very high64 Ų6441.2 Ų41.228%0.28124%0.239SC..Hα-helixtrans-60.6-48.1176.1175.7-100000112.4E62 L176 G178 L182 A183 N184E62-F180 HydrophobicContact CB-CE1 3.75Å; E62-F180 HydrophobicContact CB-CE2 3.9Å; E62-F180 HydrophobicContact CB-CZ 3.26Å; E62-F180 HydrophobicContact CG-CE2 3.91Å; E62-F180 HydrophobicContact CG-CZ 3.61Å; L176-F180 WeakPolarHBondContact O-CB 3.48Å; L176-F180 PolarHBondContact O-N 2.72Å; G178-F180 VanDerWaalsContact C-N 3.35Å; G178-F180 PolarHBondContact O-N 2.89Å; F180-L182 VanDerWaalsContact C-N 3.32Å; F180-L182 PolarHBondContact O-N 3.22Å; F180-A183 PolarHBondContact O-N 3.21Å; F180-N184 WeakPolarHBondContact CE1-ND2 3.38Å; F180-N184 WeakPolarHBondContact CZ-ND2 3.25Å; F180-N184 PolarHBondContact O-N 3.17Å; F180-N184 PolarHBondContact O-ND2 3.46Å
181L85.4Confident90.2Very high8 Ų847.3 Ų47.34%0.04227%0.267CS..Hα-helixtrans-62.2-41.4177.7-72.9170.9000111.7L63 L140 T143 A144 V147 S177 G178 N184 A185L63-L181 HydrophobicContact CD1-CD2 3.91Å; L140-L181 HydrophobicContact CD2-CD2 3.83Å; T143-L181 HydrophobicContact CG2-CD1 3.62Å; A144-L181 HydrophobicContact CB-CB 3.75Å; A144-L181 HydrophobicContact CB-CD1 4.49Å; V147-L181 HydrophobicContact CG2-CD1 4.35Å; S177-L181 VanDerWaalsContact O-CG 3.31Å; S177-L181 WeakPolarHBondContact O-CG 3.31Å; S177-L181 PolarHBondContact O-N 3.3Å; S177-L181 VanDerWaalsContact O-N 3.13Å; G178-L181 PolarHBondContact O-N 3.06Å; L181-N184 PolarHBondContact O-N 2.94Å; L181-A185 PolarHBondContact O-N 3Å
182L91.5Very high90.3Very high47 Ų4747.1 Ų47.125%0.24627%0.266CS..Hα-helixtrans-66.5-40.5177.8-171.461.3000111.7I141 A144 G178 D179 F180 N184 A185 C186 I205I141-L182 HydrophobicContact CG1-CD1 4.29Å; A144-L182 HydrophobicContact CB-CB 4.24Å; G178-L182 WeakPolarHBondContact O-CB 3.35Å; G178-L182 PolarHBondContact O-N 2.93Å; D179-L182 PolarHBondContact O-N 3.21Å; F180-L182 VanDerWaalsContact C-N 3.32Å; F180-L182 PolarHBondContact O-N 3.22Å; L182-N184 PolarHBondContact O-N 3.39Å; L182-A185 PolarHBondContact O-N 3.12Å; L182-C186 PolarHBondContact O-N 3.34Å; L182-C186 PolarHBondContact O-SG 3.47Å; L182-I205 HydrophobicContact CD1-CD1 3.91Å; L182-I205 HydrophobicContact CD1-CG1 4.41Å
183A90.8Very high90.5Very high52 Ų5247.7 Ų47.743%0.4328%0.275SS..Hα-helixtrans-60.3-45.1175.400000111.6D179 F180 A185 C186 T187D179-A183 WeakPolarHBondContact O-CB 3.38Å; D179-A183 PolarHBondContact O-N 3Å; F180-A183 PolarHBondContact O-N 3.21Å; A183-A185 VanDerWaalsContact C-N 3.35Å; A183-A185 PolarHBondContact O-N 3.11Å; A183-C186 WeakPolarHBondContact O-CB 3.43Å; A183-C186 PolarHBondContact O-N 3.44Å; A183-T187 PolarHBondContact O-N 2.9Å; A183-T187 PolarHBondContact O-OG1 3.45Å
184N85.5Confident90.9Very high68 Ų6847.8 Ų47.836%0.36428%0.276SS..Hα-helixtrans-63.3-39.9175.5-73.5-27000112.5F180 L181 L182 C186 T187 G188F180-N184 WeakPolarHBondContact CE1-ND2 3.38Å; F180-N184 WeakPolarHBondContact CZ-ND2 3.25Å; F180-N184 PolarHBondContact O-N 3.17Å; F180-N184 PolarHBondContact O-ND2 3.46Å; L181-N184 PolarHBondContact O-N 2.94Å; L182-N184 PolarHBondContact O-N 3.39Å; N184-C186 VanDerWaalsContact C-N 3.34Å; N184-C186 PolarHBondContact O-N 3.36Å; N184-T187 PolarHBondContact O-N 2.91Å; N184-G188 PolarHBondContact O-N 3.16Å
185A91.1Very high91.4Very high0 Ų053.9 Ų53.90%031%0.314CS..Hα-helixtrans-62.6-40.6174.500000112I137 L140 I141 L181 L182 A183 G188 L189I137-A185 HydrophobicContact CG2-CB 4.34Å; L140-A185 HydrophobicContact CB-CB 4.07Å; I141-A185 HydrophobicContact CD1-CB 4.25Å; I141-A185 HydrophobicContact CG1-CB 3.57Å; L181-A185 PolarHBondContact O-N 3Å; L182-A185 PolarHBondContact O-N 3.12Å; A183-A185 VanDerWaalsContact C-N 3.35Å; A183-A185 PolarHBondContact O-N 3.11Å; A185-G188 PolarHBondContact O-N 2.9Å; A185-L189 WeakPolarHBondContact O-CG 3.47Å; A185-L189 PolarHBondContact O-N 3.24Å
186C94.2Very high91.7Very high60 Ų6054.9 Ų54.941%0.40531%0.313SS..Hα-helixtrans-64.1-41.3175.4-71.30000112.5L182 A183 N184 L189 A190L182-C186 PolarHBondContact O-N 3.34Å; L182-C186 PolarHBondContact O-SG 3.47Å; A183-C186 WeakPolarHBondContact O-CB 3.43Å; A183-C186 PolarHBondContact O-N 3.44Å; N184-C186 VanDerWaalsContact C-N 3.34Å; N184-C186 PolarHBondContact O-N 3.36Å; C186-L189 WeakPolarHBondContact O-CB 3.4Å; C186-L189 PolarHBondContact O-N 2.97Å; C186-A190 PolarHBondContact O-N 2.79Å; C186-A190 VanDerWaalsContact O-N 3.08Å
187T91.8Very high92.2Very high76 Ų7650.6 Ų50.647%0.46629%0.291SS..Hα-helixtrans-60.5-48.7173.2-58.10000110.8A183 N184 L189 A190 E191A183-T187 PolarHBondContact O-N 2.9Å; A183-T187 PolarHBondContact O-OG1 3.45Å; N184-T187 PolarHBondContact O-N 2.91Å; T187-L189 VanDerWaalsContact C-N 3.31Å; T187-L189 PolarHBondContact O-N 2.93Å; T187-A190 WeakPolarHBondContact O-CB 3.24Å; T187-A190 PolarHBondContact O-N 2.91Å; T187-A190 VanDerWaalsContact O-N 3.14Å; T187-E191 WeakPolarHBondContact O-CG 3.43Å; T187-E191 PolarHBondContact O-N 2.98Å; T187-E191 VanDerWaalsContact O-N 3.09Å
188G90.4Very high92.8Very high14 Ų1452.5 Ų52.514%0.14430%0.302CS..Hα-helixtrans-60.7-37.2176.600000113.2I137 N184 A185 E191 L192I137-G188 WeakPolarHBondContact CD1-O 3.32Å; N184-G188 PolarHBondContact O-N 3.16Å; A185-G188 PolarHBondContact O-N 2.9Å; G188-E191 PolarHBondContact O-N 3.15Å; G188-L192 PolarHBondContact O-N 2.78Å
189L94.6Very high93.3Very high3 Ų357.8 Ų57.82%0.01633%0.327CS..Hα-helixtrans-61.6-42.6174.2-80.2170.1000112.4I137 I141 A185 C186 T187 E191 L192 V197 V198 I201I137-L189 HydrophobicContact CD1-CD2 4.22Å; I137-L189 HydrophobicContact CD1-CG 4.26Å; I137-L189 HydrophobicContact CG2-CD1 4.15Å; I137-L189 HydrophobicContact CG2-CD2 3.7Å; I137-L189 HydrophobicContact CG2-CG 3.58Å; I141-L189 HydrophobicContact CD1-CD1 4.47Å; A185-L189 WeakPolarHBondContact O-CG 3.47Å; A185-L189 PolarHBondContact O-N 3.24Å; C186-L189 WeakPolarHBondContact O-CB 3.4Å; C186-L189 PolarHBondContact O-N 2.97Å; T187-L189 VanDerWaalsContact C-N 3.31Å; T187-L189 PolarHBondContact O-N 2.93Å; L189-E191 VanDerWaalsContact C-N 3.32Å; L189-L192 HydrophobicContact CD2-CD1 4.25Å; L189-L192 WeakPolarHBondContact O-CB 3.4Å; L189-L192 PolarHBondContact O-N 2.75Å; L189-V197 HydrophobicContact CD2-CG1 4.45Å; L189-V198 HydrophobicContact CB-CG2 4.44Å; L189-I201 HydrophobicContact CD1-CB 3.99Å; L189-I201 HydrophobicContact CD1-CG2 3.66Å; L189-I201 HydrophobicContact CD2-CB 3.76Å; L189-I201 HydrophobicContact CD2-CG1 3.81Å; L189-I201 HydrophobicContact CD2-CG2 3.94Å; L189-I201 HydrophobicContact CG-CG2 4.38Å
190A95.8Very high93.7Very high63 Ų6354.6 Ų54.652%0.52131%0.31SS..Hα-helixtrans-64.4-38.7177.500000111.5C186 T187 L192 N193C186-A190 PolarHBondContact O-N 2.79Å; C186-A190 VanDerWaalsContact O-N 3.08Å; T187-A190 WeakPolarHBondContact O-CB 3.24Å; T187-A190 PolarHBondContact O-N 2.91Å; T187-A190 VanDerWaalsContact O-N 3.14Å; A190-L192 PolarHBondContact O-N 2.81Å; A190-N193 PolarHBondContact O-N 3.47Å
191E93.9Very high94.2Very high127 Ų12751.6 Ų51.659%0.59330%0.296SS*.Hα-helixtrans-64.3-21.3177.2-68.9172.8175.100113.6T187 G188 L189 N193T187-E191 WeakPolarHBondContact O-CG 3.43Å; T187-E191 PolarHBondContact O-N 2.98Å; T187-E191 VanDerWaalsContact O-N 3.09Å; G188-E191 PolarHBondContact O-N 3.15Å; L189-E191 VanDerWaalsContact C-N 3.32Å; E191-N193 PolarHBondContact O-N 2.93Å; E191-N193 PolarHBondContact O-ND2 3.43Å
192L93.6Very high94.8Very high19 Ų1953.8 Ų53.810%0.09931%0.313CS..THydrogen-bonded Turntrans-66.9-18.4173.1-63.6180000113.1S130 N133 L134 I137 G188 L189 A190 D194 V197 L255S130-L192 WeakPolarHBondContact O-CD2 3.39Å; N133-L192 HydrophobicContact CB-CD2 3.75Å; L134-L192 HydrophobicContact CB-CD1 4.3Å; L134-L192 HydrophobicContact CD1-CD1 4.2Å; I137-L192 HydrophobicContact CD1-CD1 3.79Å; I137-L192 HydrophobicContact CD1-CD2 4.5Å; I137-L192 HydrophobicContact CD1-CG 4.07Å; G188-L192 PolarHBondContact O-N 2.78Å; L189-L192 HydrophobicContact CD2-CD1 4.25Å; L189-L192 WeakPolarHBondContact O-CB 3.4Å; L189-L192 PolarHBondContact O-N 2.75Å; A190-L192 PolarHBondContact O-N 2.81Å; L192-D194 PolarHBondContact O-N 3.4Å; L192-D194 VanDerWaalsContact O-N 3.13Å; L192-V197 HydrophobicContact CD1-CG1 3.79Å; L192-L255 HydrophobicContact CD1-CD1 4.37Å
193N95.3Very high95.2Very high149 Ų14953.5 Ų53.580%0.79731%0.314SS*.  trans52.931.1177.8-66.7-68.3000114.8A190 E191A190-N193 PolarHBondContact O-N 3.47Å; E191-N193 PolarHBondContact O-N 2.93Å; E191-N193 PolarHBondContact O-ND2 3.43Å
194D97.1Very high95.5Very high18 Ų1851 Ų5110%0.09629%0.294CS..  trans-126.1103.8174.1-169-55.1000109.4L192 K196 V197 V198 L255 K257L192-D194 PolarHBondContact O-N 3.4Å; L192-D194 VanDerWaalsContact O-N 3.13Å; D194-K196 PolarHBondContact O-N 3.46Å; D194-K196 WeakPolarHBondContact OD1-CB 3.33Å; D194-K196 PolarHBondContact OD1-N 2.78Å; D194-K196 VanDerWaalsContact OD1-N 3.11Å; D194-V197 HydrophobicContact CB-CB 4.08Å; D194-V197 HydrophobicContact CB-CG2 3.89Å; D194-V197 WeakPolarHBondContact O-CB 3.37Å; D194-V197 PolarHBondContact O-N 3.47Å; D194-V197 VanDerWaalsContact O-N 3.09Å; D194-V197 PolarHBondContact OD1-N 3.26Å; D194-V197 VanDerWaalsContact OD1-N 3.16Å; D194-V198 PolarHBondContact O-N 3.47Å; D194-L255 HydrophobicContact CB-CD2 4.16Å; D194-K257 IonicContact OD2-NZ 3.41Å; D194-K257 PolarHBondContact OD2-NZ 3.45Å
195T97.8Very high96.1Very high127 Ų12749.3 Ų49.378%0.77928%0.284SS*.Hα-helixtrans-61.9-28.4-175.353.10000112.8V198 E199T195-V198 PolarHBondContact O-N 3Å; T195-E199 WeakPolarHBondContact O-CB 3.23Å; T195-E199 PolarHBondContact O-N 2.6Å
196K98.3Very high96.3Very high81 Ų8152 Ų5235%0.35231%0.307SS..Hα-helixtrans-72.2-37.3177.5-170.764.5-168.1169.70111.3D194 E199 L200 Q254D194-K196 PolarHBondContact O-N 3.46Å; D194-K196 WeakPolarHBondContact OD1-CB 3.33Å; D194-K196 PolarHBondContact OD1-N 2.78Å; D194-K196 VanDerWaalsContact OD1-N 3.11Å; K196-E199 WeakPolarHBondContact CD-OE2 3.24Å; K196-E199 IonicContact NZ-OE1 3.65Å; K196-E199 PolarHBondContact NZ-OE1 2.85Å; K196-E199 IonicContact NZ-OE2 2.67Å; K196-E199 PolarHBondContact NZ-OE2 2.94Å; K196-E199 PolarHBondContact O-N 3.09Å; K196-L200 VanDerWaalsContact O-CG 3.3Å; K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.47Å; K196-Q254 HydrophobicContact CB-CG 4.38Å; K196-Q254 HydrophobicContact CG-CG 4.45Å
197V98.4Very high96.5Very high0 Ų050.4 Ų50.40%029%0.294CS..Hα-helixtrans-64.1-43.8172.6172.20000110.8L134 L189 L192 D194 E199 L200 I201 A251 Q254 L255L134-V197 HydrophobicContact CD1-CG1 4.14Å; L189-V197 HydrophobicContact CD2-CG1 4.45Å; L192-V197 HydrophobicContact CD1-CG1 3.79Å; D194-V197 HydrophobicContact CB-CB 4.08Å; D194-V197 HydrophobicContact CB-CG2 3.89Å; D194-V197 WeakPolarHBondContact O-CB 3.37Å; D194-V197 PolarHBondContact O-N 3.47Å; D194-V197 VanDerWaalsContact O-N 3.09Å; D194-V197 PolarHBondContact OD1-N 3.26Å; D194-V197 VanDerWaalsContact OD1-N 3.16Å; V197-E199 PolarHBondContact O-N 2.84Å; V197-L200 PolarHBondContact O-N 2.81Å; V197-I201 HydrophobicContact CG1-CG1 4.4Å; V197-I201 WeakPolarHBondContact O-CG1 3.17Å; V197-I201 PolarHBondContact O-N 3.41Å; V197-A251 HydrophobicContact CB-CB 4.49Å; V197-A251 HydrophobicContact CG1-CB 3.99Å; V197-A251 HydrophobicContact CG2-CB 4.19Å; V197-Q254 HydrophobicContact CG2-CB 4.24Å; V197-Q254 HydrophobicContact CG2-CG 3.78Å; V197-L255 HydrophobicContact CG2-CD2 3.79Å; V197-L255 HydrophobicContact CG2-CG 3.81Å
198V98.4Very high96.5Very high48 Ų4847 Ų4729%0.29127%0.273SS..Hα-helixtrans-57.2-49.2174.7177.40000110.6L189 D194 T195 L200 I201 S202L189-V198 HydrophobicContact CB-CG2 4.44Å; D194-V198 PolarHBondContact O-N 3.47Å; T195-V198 PolarHBondContact O-N 3Å; V198-L200 PolarHBondContact O-N 3.12Å; V198-I201 PolarHBondContact O-N 3.28Å; V198-S202 VanDerWaalsContact O-CB 3.28Å; V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 2.97Å; V198-S202 PolarHBondContact O-OG 3.48Å
199E98.4Very high96.6Very high110 Ų11050.9 Ų50.951%0.51429%0.294SS..Hα-helixtrans-58.1-45.6177.4-171.1-162.114500112.5T195 K196 V197 S203T195-E199 WeakPolarHBondContact O-CB 3.23Å; T195-E199 PolarHBondContact O-N 2.6Å; K196-E199 WeakPolarHBondContact CD-OE2 3.24Å; K196-E199 IonicContact NZ-OE1 3.65Å; K196-E199 PolarHBondContact NZ-OE1 2.85Å; K196-E199 IonicContact NZ-OE2 2.67Å; K196-E199 PolarHBondContact NZ-OE2 2.94Å; K196-E199 PolarHBondContact O-N 3.09Å; V197-E199 PolarHBondContact O-N 2.84Å; E199-S203 VanDerWaalsContact O-CB 3.32Å; E199-S203 WeakPolarHBondContact O-CB 3.41Å; E199-S203 PolarHBondContact O-N 3.34Å; E199-S203 PolarHBondContact O-OG 3.48Å; E199-S203 VanDerWaalsContact O-OG 3.12Å
200L98.5Very high96.4Very high13 Ų1354.8 Ų54.87%0.06831%0.312CS..Hα-helixtrans-59.9-49.2178-75.3172.9000111.2K196 V197 V198 S203 A204 K247 Q250 A251K196-L200 VanDerWaalsContact O-CG 3.3Å; K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.47Å; V197-L200 PolarHBondContact O-N 2.81Å; V198-L200 PolarHBondContact O-N 3.12Å; L200-S203 PolarHBondContact O-N 3.46Å; L200-S203 PolarHBondContact O-OG 2.99Å; L200-A204 PolarHBondContact O-N 3.24Å; L200-K247 WeakPolarHBondContact O-CD 3.49Å; L200-Q250 HydrophobicContact CD1-CB 4.46Å; L200-Q250 HydrophobicContact CD1-CG 4.11Å; L200-A251 HydrophobicContact CD1-CB 4.13Å
201I98.4Very high96Very high0 Ų051.8 Ų51.80%029%0.287CS..Hα-helixtrans-74.9-38.8-176.2-57.1-56.1000111.9L134 I141 L189 V197 V198 S203 A204 I205 S248 A251L134-I201 HydrophobicContact CD1-CD1 4.12Å; L134-I201 HydrophobicContact CD1-CG1 4.03Å; I141-I201 HydrophobicContact CD1-CG2 3.29Å; L189-I201 HydrophobicContact CD1-CB 3.99Å; L189-I201 HydrophobicContact CD1-CG2 3.66Å; L189-I201 HydrophobicContact CD2-CB 3.76Å; L189-I201 HydrophobicContact CD2-CG1 3.81Å; L189-I201 HydrophobicContact CD2-CG2 3.94Å; L189-I201 HydrophobicContact CG-CG2 4.38Å; V197-I201 HydrophobicContact CG1-CG1 4.4Å; V197-I201 WeakPolarHBondContact O-CG1 3.17Å; V197-I201 PolarHBondContact O-N 3.41Å; V198-I201 PolarHBondContact O-N 3.28Å; I201-S203 VanDerWaalsContact C-N 3.31Å; I201-S203 PolarHBondContact O-N 3.43Å; I201-A204 WeakPolarHBondContact O-CA 3.23Å; I201-A204 VanDerWaalsContact O-CB 3.31Å; I201-A204 WeakPolarHBondContact O-CB 3.46Å; I201-A204 PolarHBondContact O-N 3.2Å; I201-I205 WeakPolarHBondContact O-CG1 3.22Å; I201-I205 PolarHBondContact O-N 2.95Å; I201-S248 WeakPolarHBondContact CD1-OG 3.35Å; I201-A251 HydrophobicContact CD1-CB 4.23Å
202S97.9Very high95.5Very high55 Ų5547.1 Ų47.139%0.38527%0.266SS..Hα-helixtrans-60.3-40.9173.2-64.30000112V198 A204 I205 A206V198-S202 VanDerWaalsContact O-CB 3.28Å; V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 2.97Å; V198-S202 PolarHBondContact O-OG 3.48Å; S202-A204 VanDerWaalsContact C-N 3.29Å; S202-A204 PolarHBondContact O-N 3.06Å; S202-I205 PolarHBondContact O-N 3.43Å; S202-A206 PolarHBondContact O-N 3.41Å; S202-A206 VanDerWaalsContact O-N 3.11Å
203S98.4Very high95Very high40 Ų4054.1 Ų54.128%0.2829%0.292SS..Hα-helixtrans-67.5-29.717471.50000112.5E199 L200 I201 A206 D207 K247E199-S203 VanDerWaalsContact O-CB 3.32Å; E199-S203 WeakPolarHBondContact O-CB 3.41Å; E199-S203 PolarHBondContact O-N 3.34Å; E199-S203 PolarHBondContact O-OG 3.48Å; E199-S203 VanDerWaalsContact O-OG 3.12Å; L200-S203 PolarHBondContact O-N 3.46Å; L200-S203 PolarHBondContact O-OG 2.99Å; I201-S203 VanDerWaalsContact C-N 3.31Å; I201-S203 PolarHBondContact O-N 3.43Å; S203-A206 PolarHBondContact O-N 3.14Å; S203-D207 PolarHBondContact O-N 3.44Å; S203-K247 PolarHBondContact O-NZ 3.3Å; S203-K247 PolarHBondContact OG-NZ 2.99Å
204A98.1Very high94.3Very high0 Ų049.9 Ų49.90%027%0.266CS..Hα-helixtrans-67.6-37.5173.200000112.3L200 I201 S202 A206 D207 L208 L244 K247L200-A204 PolarHBondContact O-N 3.24Å; I201-A204 WeakPolarHBondContact O-CA 3.23Å; I201-A204 VanDerWaalsContact O-CB 3.31Å; I201-A204 WeakPolarHBondContact O-CB 3.46Å; I201-A204 PolarHBondContact O-N 3.2Å; S202-A204 VanDerWaalsContact C-N 3.29Å; S202-A204 PolarHBondContact O-N 3.06Å; A204-A206 VanDerWaalsContact C-N 3.34Å; A204-D207 PolarHBondContact O-N 3.04Å; A204-L208 WeakPolarHBondContact O-CG 3.41Å; A204-L208 PolarHBondContact O-N 2.98Å; A204-L244 HydrophobicContact CB-CD1 4.18Å; A204-K247 HydrophobicContact CB-CB 4.07Å; A204-K247 HydrophobicContact CB-CD 3.6Å; A204-K247 HydrophobicContact CB-CG 4.41Å
205I96.9Very high93.2Very high32 Ų3250.2 Ų50.216%0.16427%0.267CS..Hα-helixtrans-62.3-44.6173.6-65.2161.6000110I141 L182 I201 S202 L208 V209I141-I205 HydrophobicContact CD1-CD1 4Å; I141-I205 HydrophobicContact CD1-CG1 4.24Å; I141-I205 HydrophobicContact CG1-CD1 4.44Å; I141-I205 HydrophobicContact CG2-CG1 3.87Å; L182-I205 HydrophobicContact CD1-CD1 3.91Å; L182-I205 HydrophobicContact CD1-CG1 4.41Å; I201-I205 WeakPolarHBondContact O-CG1 3.22Å; I201-I205 PolarHBondContact O-N 2.95Å; S202-I205 PolarHBondContact O-N 3.43Å; I205-L208 PolarHBondContact O-N 3.03Å; I205-V209 WeakPolarHBondContact O-CG2 3.32Å; I205-V209 PolarHBondContact O-N 2.85Å; I205-V209 VanDerWaalsContact O-N 3.14Å
206A96.9Very high91.9Very high57 Ų5746.1 Ų46.147%0.47124%0.24SC..Hα-helixtrans-59.6-46.3175.900000112S202 S203 A204 L208 V209 Q210S202-A206 PolarHBondContact O-N 3.41Å; S202-A206 VanDerWaalsContact O-N 3.11Å; S203-A206 PolarHBondContact O-N 3.14Å; A204-A206 VanDerWaalsContact C-N 3.34Å; A206-L208 VanDerWaalsContact C-N 3.35Å; A206-L208 PolarHBondContact O-N 2.94Å; A206-V209 PolarHBondContact O-N 3.46Å; A206-Q210 WeakPolarHBondContact O-CB 3.23Å; A206-Q210 PolarHBondContact O-N 2.79Å
207D96.6Very high90.3Very high26 Ų2647.4 Ų47.414%0.13924%0.243CC..Hα-helixtrans-57.5-45.1176.6-67.4-11.9000112S203 A204 V209 Q210 G211 L239 A243 K247S203-D207 PolarHBondContact O-N 3.44Å; A204-D207 PolarHBondContact O-N 3.04Å; D207-V209 PolarHBondContact O-N 3.07Å; D207-Q210 PolarHBondContact O-N 2.84Å; D207-G211 PolarHBondContact O-N 3Å; D207-L239 CarbonylContact C-O 3.51Å; D207-L239 HydrophobicContact CB-CD2 3.66Å; D207-L239 WeakPolarHBondContact O-CB 3.27Å; D207-A243 HydrophobicContact CB-CB 3.57Å; D207-A243 WeakPolarHBondContact OD2-CB 3.49Å; D207-K247 IonicContact OD1-NZ 2.83Å; D207-K247 VanDerWaalsContact OD2-CE 3.23Å; D207-K247 WeakPolarHBondContact OD2-CE 3.46Å; D207-K247 IonicContact OD2-NZ 2.84Å; D207-K247 PolarHBondContact OD2-NZ 3.32Å
208L92.9Very high88.4Confident6 Ų650.7 Ų50.73%0.03126%0.256CS..Hα-helixtrans-59-46.8178.1-71.4170.9000111.6I141 F145 A204 I205 A206 G211 I212 L239 L244I141-L208 HydrophobicContact CG2-CD1 4.31Å; F145-L208 HydrophobicContact CD2-CB 4.18Å; F145-L208 HydrophobicContact CE1-CD2 4.46Å; F145-L208 HydrophobicContact CE2-CB 3.94Å; F145-L208 HydrophobicContact CE2-CD2 4.48Å; F145-L208 HydrophobicContact CZ-CD2 4.28Å; A204-L208 WeakPolarHBondContact O-CG 3.41Å; A204-L208 PolarHBondContact O-N 2.98Å; I205-L208 PolarHBondContact O-N 3.03Å; A206-L208 VanDerWaalsContact C-N 3.35Å; A206-L208 PolarHBondContact O-N 2.94Å; L208-G211 PolarHBondContact O-N 2.97Å; L208-I212 WeakPolarHBondContact O-CG1 3.49Å; L208-I212 PolarHBondContact O-N 3.19Å; L208-I212 VanDerWaalsContact O-N 3.15Å; L208-L239 VanDerWaalsContact CA-O 3.27Å; L208-L239 WeakPolarHBondContact CA-O 3.25Å; L208-L239 PolarHBondContact N-O 2.86Å; L208-L244 HydrophobicContact CD1-CB 4.12Å; L208-L244 HydrophobicContact CD1-CD2 4.13Å
209V91.4Very high86.4Confident95 Ų9552.3 Ų52.358%0.57626%0.263SS*.Hα-helixtrans-65.1-43.7179.7175.20000110.7I205 A206 D207 G211 I212 Y213I205-V209 WeakPolarHBondContact O-CG2 3.32Å; I205-V209 PolarHBondContact O-N 2.85Å; I205-V209 VanDerWaalsContact O-N 3.14Å; A206-V209 PolarHBondContact O-N 3.46Å; D207-V209 PolarHBondContact O-N 3.07Å; V209-G211 VanDerWaalsContact C-N 3.34Å; V209-G211 PolarHBondContact O-N 3.34Å; V209-I212 PolarHBondContact O-N 2.72Å; V209-Y213 PolarHBondContact O-N 3.37Å; V209-Y213 VanDerWaalsContact O-N 3.07Å
210Q90.8Very high84.1Confident84 Ų8452.8 Ų52.839%0.39327%0.273SS..Hα-helixtrans-61.1-43.2176.2-175175.76.100111.6A206 D207 I212 Y213 Y214 L239A206-Q210 WeakPolarHBondContact O-CB 3.23Å; A206-Q210 PolarHBondContact O-N 2.79Å; D207-Q210 PolarHBondContact O-N 2.84Å; Q210-I212 VanDerWaalsContact C-N 3.29Å; Q210-I212 PolarHBondContact O-N 3.01Å; Q210-Y213 WeakPolarHBondContact O-CB 3.19Å; Q210-Y213 PolarHBondContact O-N 3.31Å; Q210-Y213 VanDerWaalsContact O-N 3.09Å; Q210-Y214 HydrophobicContact CG-CD2 4.11Å; Q210-Y214 HydrophobicContact CG-CE2 3.5Å; Q210-Y214 VanDerWaalsContact CG-CE2 3.5Å; Q210-Y214 PolarHBondContact NE2-OH 3.32Å; Q210-Y214 WeakPolarHBondContact O-CD2 3.4Å; Q210-Y214 PolarHBondContact O-N 3.27Å; Q210-Y214 VanDerWaalsContact O-N 3.08Å; Q210-L239 HydrophobicContact CG-CD1 4.32Å
211G88.7Confident81.7Confident0 Ų055.4 Ų55.40%029%0.285CS..Hα-helixtrans-59.2-37.6176.200000113.2D207 L208 V209 E215D207-G211 PolarHBondContact O-N 3Å; L208-G211 PolarHBondContact O-N 2.97Å; V209-G211 VanDerWaalsContact C-N 3.34Å; V209-G211 PolarHBondContact O-N 3.34Å; G211-E215 PolarHBondContact O-N 3.24Å
212I82.6Confident79.2Confident29 Ų2958.9 Ų58.915%0.14930%0.304CS..Hα-helixtrans-69.2-37.7174.4-67.1-58.9000111.9F145 R149 L208 V209 Q210 Y214 E215 N216F145-I212 HydrophobicContact CE2-CD1 3.97Å; F145-I212 HydrophobicContact CE2-CG1 3.47Å; F145-I212 VanDerWaalsContact CE2-CG1 3.47Å; F145-I212 HydrophobicContact CZ-CD1 3.62Å; F145-I212 HydrophobicContact CZ-CG1 3.64Å; R149-I212 HydrophobicContact CG-CD1 4.32Å; L208-I212 WeakPolarHBondContact O-CG1 3.49Å; L208-I212 PolarHBondContact O-N 3.19Å; L208-I212 VanDerWaalsContact O-N 3.15Å; V209-I212 PolarHBondContact O-N 2.72Å; Q210-I212 VanDerWaalsContact C-N 3.29Å; Q210-I212 PolarHBondContact O-N 3.01Å; I212-Y214 VanDerWaalsContact C-N 3.32Å; I212-Y214 PolarHBondContact O-N 3.33Å; I212-E215 PolarHBondContact O-N 3.09Å; I212-N216 PolarHBondContact O-N 2.61Å; I212-N216 PolarHBondContact O-ND2 2.96Å; I212-N216 PolarHBondContact O-OD1 3.47Å
213Y83.3Confident76.6Confident166 Ų16658.3 Ų58.365%0.65131%0.307SS*.Hα-helixtrans-60.2-46.1176.4-166.2-94.8000111V209 Q210 N216 Y217V209-Y213 PolarHBondContact O-N 3.37Å; V209-Y213 VanDerWaalsContact O-N 3.07Å; Q210-Y213 WeakPolarHBondContact O-CB 3.19Å; Q210-Y213 PolarHBondContact O-N 3.31Å; Q210-Y213 VanDerWaalsContact O-N 3.09Å; Y213-N216 PolarHBondContact O-N 3.32Å; Y213-Y217 PolarHBondContact O-N 3.33Å
214Y80.2Confident73.8Confident61 Ų6165 Ų6524%0.23934%0.338CS..Hα-helixtrans-62-44.6174.4-64.2-39.6000112.5Q210 I212 N216 Y217 Y218 L239Q210-Y214 HydrophobicContact CG-CD2 4.11Å; Q210-Y214 HydrophobicContact CG-CE2 3.5Å; Q210-Y214 VanDerWaalsContact CG-CE2 3.5Å; Q210-Y214 PolarHBondContact NE2-OH 3.32Å; Q210-Y214 WeakPolarHBondContact O-CD2 3.4Å; Q210-Y214 PolarHBondContact O-N 3.27Å; Q210-Y214 VanDerWaalsContact O-N 3.08Å; I212-Y214 VanDerWaalsContact C-N 3.32Å; I212-Y214 PolarHBondContact O-N 3.33Å; Y214-N216 PolarHBondContact O-N 2.88Å; Y214-Y217 PolarHBondContact O-N 3.35Å; Y214-Y218 WeakPolarHBondContact O-CD2 3.46Å; Y214-Y218 PolarHBondContact O-N 3.32Å; Y214-L239 HydrophobicContact CD2-CD1 3.91Å; Y214-L239 HydrophobicContact CE2-CD1 3.74Å
215E74.2Confident71Confident25 Ų2566.3 Ų66.312%0.11735%0.352CS..Hα-helixtrans-55.4-39.2175.1-172.7176.5-157.900112.3R149 G211 I212 N219 S300R149-E215 IonicContact CZ-OE2 3.67Å; R149-E215 IonicContact NH2-OE1 3.85Å; R149-E215 PolarHBondContact NH2-OE1 3.14Å; R149-E215 IonicContact NH2-OE2 3.27Å; R149-E215 PolarHBondContact NH2-OE2 3.08Å; G211-E215 PolarHBondContact O-N 3.24Å; I212-E215 PolarHBondContact O-N 3.09Å; E215-N219 PolarHBondContact O-ND2 3.26Å; E215-S300 PolarHBondContact OE1-OG 2.73Å
216N70.7Confident68.3Low40 Ų4073.3 Ų73.321%0.21439%0.389CS..Hα-helixtrans-76-39.4-178.5-62.9-17.9000112.5R21 I212 Y213 Y214 N219 V220R21-N216 PolarHBondContact NH1-OD1 2.87Å; R21-N216 PolarHBondContact NH2-OD1 3.21Å; I212-N216 PolarHBondContact O-N 2.61Å; I212-N216 PolarHBondContact O-ND2 2.96Å; I212-N216 PolarHBondContact O-OD1 3.47Å; Y213-N216 PolarHBondContact O-N 3.32Å; Y214-N216 PolarHBondContact O-N 2.88Å; N216-N219 PolarHBondContact O-N 3.11Å; N216-V220 WeakPolarHBondContact O-CG2 3.2Å; N216-V220 PolarHBondContact O-N 2.94Å
217Y65.4Low65.6Low109 Ų10973.7 Ų73.743%0.42740%0.399SS..Hα-helixtrans-60.1-48.2179.5-174-106.5000111.8Y213 Y214 N219 V220 E221Y213-Y217 PolarHBondContact O-N 3.33Å; Y214-Y217 PolarHBondContact O-N 3.35Å; Y217-N219 PolarHBondContact O-N 2.89Å; Y217-V220 PolarHBondContact O-N 3.19Å; Y217-V220 VanDerWaalsContact O-N 3.1Å; Y217-E221 HydrophobicContact CE2-CG 4.22Å; Y217-E221 WeakPolarHBondContact CE2-OE1 3.31Å; Y217-E221 VanDerWaalsContact CZ-OE2 3.31Å; Y217-E221 PolarHBondContact O-N 3.33Å; Y217-E221 PolarHBondContact OH-OE1 2.88Å; Y217-E221 PolarHBondContact OH-OE2 3.29Å
218Y58.6Low63.3Low69 Ų6979.3 Ų79.327%0.27143%0.434SS..Hα-helixtrans-66.4-21.8179-69-63.4000114.5Y214 D229 T231Y214-Y218 WeakPolarHBondContact O-CD2 3.46Å; Y214-Y218 PolarHBondContact O-N 3.32Å; Y218-D229 PolarHBondContact OH-O 2.67Å; Y218-T231 PolarHBondContact OH-N 3.37Å
219N55.8Low61.1Low82 Ų8283.8 Ų83.844%0.43946%0.458SS..Hα-helixtrans-82.1-21.2175.9-76.3-45.3000112.8E215 N216 Y217E215-N219 PolarHBondContact O-ND2 3.26Å; N216-N219 PolarHBondContact O-N 3.11Å; Y217-N219 PolarHBondContact O-N 2.89Å
220V49.5Very low59.2Low119 Ų11984.7 Ų84.772%0.72146%0.464SS*.Hα-helixtrans-94.5-34-176.9175.60000111.7N216 Y217 D222N216-V220 WeakPolarHBondContact O-CG2 3.2Å; N216-V220 PolarHBondContact O-N 2.94Å; Y217-V220 PolarHBondContact O-N 3.19Å; Y217-V220 VanDerWaalsContact O-N 3.1Å; V220-D222 VanDerWaalsContact C-N 3.28Å; V220-D222 PolarHBondContact O-N 3.31Å
221E47.6Very low57.8Low68 Ų6882 Ų8232%0.31845%0.453SS..  trans-88.540.1-179.8-68.8-164.5172.300114.9Y217 G223Y217-E221 HydrophobicContact CE2-CG 4.22Å; Y217-E221 WeakPolarHBondContact CE2-OE1 3.31Å; Y217-E221 VanDerWaalsContact CZ-OE2 3.31Å; Y217-E221 PolarHBondContact O-N 3.33Å; Y217-E221 PolarHBondContact OH-OE1 2.88Å; Y217-E221 PolarHBondContact OH-OE2 3.29Å; E221-G223 PolarHBondContact O-N 2.82Å
222D47.2Very low57.5Low74 Ų7485.1 Ų85.140%0.39647%0.473SS..SBendtrans-70.47.1153.3-147.737.9000111.2V220 H317V220-D222 VanDerWaalsContact C-N 3.28Å; V220-D222 PolarHBondContact O-N 3.31Å; D222-H317 IonicContact OD1-CD2 2.78Å; D222-H317 IonicContact OD1-CE1 2.86Å; D222-H317 IonicContact OD1-NE2 2.95Å; D222-H317 PolarHBondContact OD1-NE2 2.99Å
223G41.9Very low57.8Low43 Ų4384.2 Ų84.244%0.44347%0.468SS..SBendtrans-132.9114.616600000111.7E221E221-G223 PolarHBondContact O-N 2.82Å
224L40.7Very low58.2Low181 Ų18179.5 Ų79.595%0.94845%0.452SS*.  trans75.228.5150.3-51.4170.3000119.9
225G39.8Very low58.8Low27 Ų2780.3 Ų80.328%0.27846%0.46SS..  trans-92.5102.9163.200000112.6
226D39.6Very low59.5Low178 Ų17880.2 Ų80.295%0.95246%0.46SS*.  trans-88.182.9160.7-176.830.1000107.3
227G39.7Very low60.5Low65 Ų6578.5 Ų78.567%0.6745%0.451SS*.  trans-167.2106.5-170.900000111.2D229G227-D229 PolarHBondContact O-N 3.49Å
228V48.2Very low61.9Low145 Ų14574.3 Ų74.388%0.87944%0.435SS*.  trans-57.5101.7170.8175.30000109.2
229D46.7Very low63.6Low99 Ų9972.2 Ų72.253%0.52943%0.428SS..  trans-148.277.6147.7-157.9-4.6000108.8Y218 G227 T231Y218-D229 PolarHBondContact OH-O 2.67Å; G227-D229 PolarHBondContact O-N 3.49Å; D229-T231 PolarHBondContact O-N 3.19Å; D229-T231 VanDerWaalsContact O-N 3.11Å
230T52.4Low65.3Low115 Ų11569.1 Ų69.171%0.70641%0.413SS*.  trans-80.575.4170.1500000107.9P232T230-P232 VanDerWaalsContact O-CD 3.28Å; T230-P232 WeakPolarHBondContact O-CD 3.48Å; T230-P232 VanDerWaalsContact O-N 3.15Å
231T60.6Low67.2Low28 Ų2865 Ų6517%0.17239%0.386CS..  trans-57.3122.6166.8-63.90000107Y218 D229 D235Y218-T231 PolarHBondContact OH-N 3.37Å; D229-T231 PolarHBondContact O-N 3.19Å; D229-T231 VanDerWaalsContact O-N 3.11Å; T231-D235 HydrophobicContact CG2-CB 3.61Å
232P81.8Confident69.5Low64 Ų6461.7 Ų61.742%0.41637%0.371SS..  trans-52.2144178-26.433.9000110.9T230 E234 D235 Q236T230-P232 VanDerWaalsContact O-CD 3.28Å; T230-P232 WeakPolarHBondContact O-CD 3.48Å; T230-P232 VanDerWaalsContact O-N 3.15Å; P232-E234 PolarHBondContact O-N 3.15Å; P232-E234 VanDerWaalsContact O-N 3.09Å; P232-D235 WeakPolarHBondContact CD-OD2 3.28Å; P232-D235 PolarHBondContact O-N 3.38Å; P232-Q236 PolarHBondContact O-N 3.41Å
233W89.6Confident71.9Confident11 Ų1158.2 Ų58.24%0.04235%0.352CS..Hα-helixtrans-51.2-38.1178.5174.588.8000112.1D235 Q236 A237 K278 L279 S300 A302 V305 F306 L351W233-D235 PolarHBondContact O-N 3.19Å; W233-Q236 PolarHBondContact O-N 3.09Å; W233-A237 HydrophobicContact CD2-CB 4.22Å; W233-A237 HydrophobicContact CE3-CB 4.21Å; W233-A237 HydrophobicContact CH2-CB 3.66Å; W233-A237 HydrophobicContact CZ2-CB 3.75Å; W233-A237 HydrophobicContact CZ3-CB 3.93Å; W233-A237 WeakPolarHBondContact O-CB 3.43Å; W233-A237 PolarHBondContact O-N 3.34Å; W233-K278 HydrophobicContact CH2-CB 4.45Å; W233-K278 HydrophobicContact CH2-CG 4.15Å; W233-K278 HydrophobicContact CZ2-CG 3.89Å; W233-L279 HydrophobicContact CE3-CD2 4.34Å; W233-L279 HydrophobicContact CH2-CD1 4.21Å; W233-L279 HydrophobicContact CH2-CD2 3.5Å; W233-L279 VanDerWaalsContact CH2-CD2 3.5Å; W233-L279 HydrophobicContact CH2-CG 3.45Å; W233-L279 VanDerWaalsContact CH2-CG 3.45Å; W233-L279 HydrophobicContact CZ2-CD2 3.98Å; W233-L279 HydrophobicContact CZ2-CG 4.27Å; W233-L279 HydrophobicContact CZ3-CD1 4.09Å; W233-L279 HydrophobicContact CZ3-CD2 3.67Å; W233-L279 HydrophobicContact CZ3-CG 3.78Å; W233-S300 PolarHBondContact NE1-O 2.94Å; W233-A302 HydrophobicContact CD2-CB 3.84Å; W233-A302 HydrophobicContact CE3-CB 4.41Å; W233-A302 HydrophobicContact CG-CB 4.34Å; W233-A302 HydrophobicContact CH2-CB 4.32Å; W233-A302 HydrophobicContact CZ2-CB 3.64Å; W233-V305 HydrophobicContact CB-CG1 4.19Å; W233-F306 HydrophobicContact CB-CE1 4.07Å; W233-F306 HydrophobicContact CB-CZ 4.45Å; W233-F306 HydrophobicContact CD2-CZ 4.45Å; W233-F306 HydrophobicContact CE3-CZ 4.35Å; W233-F306 HydrophobicContact CG-CE1 4.48Å; W233-F306 HydrophobicContact CG-CZ 4.49Å; W233-L351 HydrophobicContact CE3-CD2 4.11Å; W233-L351 HydrophobicContact CZ3-CD2 4.14Å
234E92.4Very high74.5Confident66 Ų6656.1 Ų56.131%0.30833%0.331SS..Hα-helixtrans-61.3-40.6178.7-68.5-175.3121.600113P232 A237 F238 L351 H355P232-E234 PolarHBondContact O-N 3.15Å; P232-E234 VanDerWaalsContact O-N 3.09Å; E234-A237 PolarHBondContact O-N 3.07Å; E234-F238 VanDerWaalsContact O-CB 3.22Å; E234-F238 WeakPolarHBondContact O-CB 3.42Å; E234-F238 PolarHBondContact O-N 3.15Å; E234-L351 HydrophobicContact CG-CD2 4Å; E234-L351 WeakPolarHBondContact OE1-CD1 3.17Å; E234-H355 IonicContact OE1-CE1 3.33Å; E234-H355 PolarHBondContact OE1-CE1 3.22Å; E234-H355 IonicContact OE1-NE2 3.65Å; E234-H355 PolarHBondContact OE1-NE2 2.87Å; E234-H355 VanDerWaalsContact OE1-NE2 3.09Å
235D91.4Very high77.2Confident78 Ų7847.8 Ų47.842%0.41729%0.287SS..Hα-helixtrans-69.2-45.5-178.6-71.2-27.3000110.2T231 P232 W233 A237 F238 L239T231-D235 HydrophobicContact CG2-CB 3.61Å; P232-D235 WeakPolarHBondContact CD-OD2 3.28Å; P232-D235 PolarHBondContact O-N 3.38Å; W233-D235 PolarHBondContact O-N 3.19Å; D235-A237 PolarHBondContact O-N 2.93Å; D235-F238 PolarHBondContact O-N 3.38Å; D235-L239 WeakPolarHBondContact O-CG 3.49Å; D235-L239 PolarHBondContact O-N 3.23Å
236Q89.7Confident80Confident24 Ų2446.5 Ų46.511%0.11227%0.274CS..Hα-helixtrans-63.2-42.8175.2-173.3-175.5-3.800111.8P232 W233 F238 L239 S240P232-Q236 PolarHBondContact O-N 3.41Å; W233-Q236 PolarHBondContact O-N 3.09Å; Q236-F238 VanDerWaalsContact C-N 3.32Å; Q236-L239 PolarHBondContact O-N 3.27Å; Q236-S240 WeakPolarHBondContact O-CB 3.44Å; Q236-S240 PolarHBondContact O-N 2.75Å; Q236-S240 PolarHBondContact O-OG 3.05Å
237A91.8Very high82.8Confident4 Ų439.2 Ų39.23%0.03323%0.233CC..Hα-helixtrans-65.2-37.4176.400000111.5W233 E234 D235 H241 G242 L275W233-A237 HydrophobicContact CD2-CB 4.22Å; W233-A237 HydrophobicContact CE3-CB 4.21Å; W233-A237 HydrophobicContact CH2-CB 3.66Å; W233-A237 HydrophobicContact CZ2-CB 3.75Å; W233-A237 HydrophobicContact CZ3-CB 3.93Å; W233-A237 WeakPolarHBondContact O-CB 3.43Å; W233-A237 PolarHBondContact O-N 3.34Å; E234-A237 PolarHBondContact O-N 3.07Å; D235-A237 PolarHBondContact O-N 2.93Å; A237-H241 WeakPolarHBondContact O-CA 3.27Å; A237-H241 WeakPolarHBondContact O-CB 3.36Å; A237-H241 PolarHBondContact O-N 3.11Å; A237-G242 PolarHBondContact O-N 3.01Å; A237-L275 HydrophobicContact CB-CD2 3.75Å
238F95.7Very high85.7Confident21 Ų2136.1 Ų36.19%0.09220%0.202CC..Iπ-helixtrans-63.7-51.7175.6178.3-105.4000110.7E234 D235 Q236 S240 G242 A243 A246 Y267 K271 L275E234-F238 VanDerWaalsContact O-CB 3.22Å; E234-F238 WeakPolarHBondContact O-CB 3.42Å; E234-F238 PolarHBondContact O-N 3.15Å; D235-F238 PolarHBondContact O-N 3.38Å; Q236-F238 VanDerWaalsContact C-N 3.32Å; F238-S240 PolarHBondContact O-N 3.46Å; F238-G242 CarbonylContact O-C 3.5Å; F238-G242 WeakPolarHBondContact O-CA 3.42Å; F238-G242 PolarHBondContact O-N 2.91Å; F238-A243 HydrophobicContact CE1-CB 4.05Å; F238-A243 HydrophobicContact CZ-CB 4.05Å; F238-A243 PolarHBondContact O-N 2.83Å; F238-A246 HydrophobicContact CE2-CB 3.89Å; F238-A246 HydrophobicContact CZ-CB 4.27Å; F238-Y267 HydrophobicContact CZ-CE2 4.12Å; F238-Y267 AromaticContact CZ-CZ 3.88Å; F238-Y267 WeakPolarHBondContact CZ-OH 3.49Å; F238-K271 HydrophobicContact CD2-CB 4.46Å; F238-K271 HydrophobicContact CD2-CD 4.15Å; F238-K271 HydrophobicContact CD2-CG 3.78Å; F238-K271 HydrophobicContact CE2-CB 3.99Å; F238-K271 HydrophobicContact CE2-CD 3.99Å; F238-K271 HydrophobicContact CE2-CG 3.73Å; F238-L275 HydrophobicContact CB-CD2 4.22Å
239L94.5Very high88.1Confident24 Ų2429.2 Ų29.213%0.12616%0.16CC..Iπ-helixtrans-58.3-49.9179-68.8177.7000111.7D207 L208 Q210 Y214 D235 Q236D207-L239 CarbonylContact C-O 3.51Å; D207-L239 HydrophobicContact CB-CD2 3.66Å; D207-L239 WeakPolarHBondContact O-CB 3.27Å; L208-L239 VanDerWaalsContact CA-O 3.27Å; L208-L239 WeakPolarHBondContact CA-O 3.25Å; L208-L239 PolarHBondContact N-O 2.86Å; Q210-L239 HydrophobicContact CG-CD1 4.32Å; Y214-L239 HydrophobicContact CD2-CD1 3.91Å; Y214-L239 HydrophobicContact CE2-CD1 3.74Å; D235-L239 WeakPolarHBondContact O-CG 3.49Å; D235-L239 PolarHBondContact O-N 3.23Å; Q236-L239 PolarHBondContact O-N 3.27Å
240S90.6Very high90.5Very high17 Ų1726.5 Ų26.512%0.11914%0.144CC..Iπ-helixtrans-80.3-17.1-17461.60000115.6Q236 F238Q236-S240 WeakPolarHBondContact O-CB 3.44Å; Q236-S240 PolarHBondContact O-N 2.75Å; Q236-S240 PolarHBondContact O-OG 3.05Å; F238-S240 PolarHBondContact O-N 3.46Å
241H90.4Very high92.7Very high32 Ų3221 Ų2115%0.14811%0.11CC..Iπ-helixtrans-134.9-39.1-172.9-164.180.9000114.8A237 S274 H277A237-H241 WeakPolarHBondContact O-CA 3.27Å; A237-H241 WeakPolarHBondContact O-CB 3.36Å; A237-H241 PolarHBondContact O-N 3.11Å; H241-S274 PolarHBondContact CD2-O 3.41Å; H241-H277 AromaticContact CE1-ND1 3.97Å; H241-H277 AromaticContact NE2-ND1 3.32Å; H241-H277 PolarHBondContact NE2-ND1 3.35Å
242G94.1Very high94.5Very high0 Ų019.7 Ų19.70%010%0.102CC..Iπ-helixtrans-98.5-28.1-167.100000116.3A237 F238 L244 L245 A246 S274A237-G242 PolarHBondContact O-N 3.01Å; F238-G242 CarbonylContact O-C 3.5Å; F238-G242 WeakPolarHBondContact O-CA 3.42Å; F238-G242 PolarHBondContact O-N 2.91Å; G242-L244 VanDerWaalsContact C-N 3.33Å; G242-L244 PolarHBondContact O-N 3.08Å; G242-L245 PolarHBondContact O-N 2.96Å; G242-A246 WeakPolarHBondContact O-CB 3.37Å; G242-A246 PolarHBondContact O-N 3Å; G242-S274 WeakPolarHBondContact CA-OG 3.41Å
243A97.7Very high95.3Very high0 Ų016.6 Ų16.60%08%0.082CC..Hα-helixtrans-55.9-45.6-172.700000112.8D207 F238 A246 K247D207-A243 HydrophobicContact CB-CB 3.57Å; D207-A243 WeakPolarHBondContact OD2-CB 3.49Å; F238-A243 HydrophobicContact CE1-CB 4.05Å; F238-A243 HydrophobicContact CZ-CB 4.05Å; F238-A243 PolarHBondContact O-N 2.83Å; A243-A246 PolarHBondContact O-N 2.85Å; A243-K247 WeakPolarHBondContact O-CB 3.49Å; A243-K247 WeakPolarHBondContact O-CG 3.31Å; A243-K247 PolarHBondContact O-N 2.91Å
244L97.6Very high95.6Very high0 Ų017.8 Ų17.80%09%0.088CC..Hα-helixtrans-59-51178.1-17659.8000112.2T138 I141 H142 A204 L208 G242 A246 S248T138-L244 HydrophobicContact CG2-CD1 4.42Å; T138-L244 HydrophobicContact CG2-CD2 4.43Å; T138-L244 HydrophobicContact CG2-CG 4.09Å; I141-L244 HydrophobicContact CB-CD1 4.37Å; I141-L244 HydrophobicContact CB-CD2 4.23Å; I141-L244 HydrophobicContact CD1-CD1 4.39Å; I141-L244 HydrophobicContact CG2-CD1 4.01Å; I141-L244 HydrophobicContact CG2-CD2 3.9Å; H142-L244 HydrophobicContact CB-CD2 3.9Å; A204-L244 HydrophobicContact CB-CD1 4.18Å; L208-L244 HydrophobicContact CD1-CB 4.12Å; L208-L244 HydrophobicContact CD1-CD2 4.13Å; G242-L244 VanDerWaalsContact C-N 3.33Å; G242-L244 PolarHBondContact O-N 3.08Å; L244-A246 PolarHBondContact O-N 3.34Å; L244-S248 VanDerWaalsContact O-CB 3.25Å; L244-S248 WeakPolarHBondContact O-CB 3.48Å; L244-S248 PolarHBondContact O-N 3.39Å; L244-S248 PolarHBondContact O-OG 3.32Å
245L97.6Very high95.8Very high5 Ų515.3 Ų15.33%0.0268%0.077CC..Hα-helixtrans-65.8-43.5-178.3-177.358.2000111.6R98 I101 V102 G242 S248 C249 L273R98-L245 HydrophobicContact CB-CD1 4.11Å; R98-L245 HydrophobicContact CG-CD1 4.22Å; I101-L245 HydrophobicContact CB-CD1 4.08Å; I101-L245 HydrophobicContact CG2-CD1 3.89Å; I101-L245 HydrophobicContact CG2-CD2 4.47Å; V102-L245 HydrophobicContact CG2-CD1 4.48Å; G242-L245 PolarHBondContact O-N 2.96Å; L245-S248 PolarHBondContact O-N 3.42Å; L245-C249 WeakPolarHBondContact O-CB 3.28Å; L245-C249 PolarHBondContact O-N 3.49Å; L245-C249 PolarHBondContact O-SG 3.27Å; L245-L273 HydrophobicContact CD2-CD2 4.31Å
246A98.6Very high95.9Very high0 Ų011.7 Ų11.70%06%0.058CC..Hα-helixtrans-59.8-49.717900000111.8F238 G242 A243 L244 C249 Q250 Y267 K271F238-A246 HydrophobicContact CE2-CB 3.89Å; F238-A246 HydrophobicContact CZ-CB 4.27Å; G242-A246 WeakPolarHBondContact O-CB 3.37Å; G242-A246 PolarHBondContact O-N 3Å; A243-A246 PolarHBondContact O-N 2.85Å; L244-A246 PolarHBondContact O-N 3.34Å; A246-C249 PolarHBondContact O-N 2.78Å; A246-Q250 PolarHBondContact O-N 2.77Å; A246-Q250 VanDerWaalsContact O-N 3.08Å; A246-Y267 HydrophobicContact CB-CD2 3.72Å; A246-Y267 HydrophobicContact CB-CE2 3.67Å; A246-Y267 HydrophobicContact CB-CG 4.38Å; A246-Y267 WeakPolarHBondContact O-CA 3.34Å; A246-K271 HydrophobicContact CB-CB 3.94Å
247K98.8Very high96.2Very high25 Ų2515 Ų1511%0.1097%0.072CC..Hα-helixtrans-71.7-32.7-179-69174.9171.4-1750112.2L200 S203 A204 D207 A243 Q250 A251 Y267L200-K247 WeakPolarHBondContact O-CD 3.49Å; S203-K247 PolarHBondContact O-NZ 3.3Å; S203-K247 PolarHBondContact OG-NZ 2.99Å; A204-K247 HydrophobicContact CB-CB 4.07Å; A204-K247 HydrophobicContact CB-CD 3.6Å; A204-K247 HydrophobicContact CB-CG 4.41Å; D207-K247 IonicContact OD1-NZ 2.83Å; D207-K247 VanDerWaalsContact OD2-CE 3.23Å; D207-K247 WeakPolarHBondContact OD2-CE 3.46Å; D207-K247 IonicContact OD2-NZ 2.84Å; D207-K247 PolarHBondContact OD2-NZ 3.32Å; A243-K247 WeakPolarHBondContact O-CB 3.49Å; A243-K247 WeakPolarHBondContact O-CG 3.31Å; A243-K247 PolarHBondContact O-N 2.91Å; K247-Q250 WeakPolarHBondContact O-CB 3.24Å; K247-Q250 PolarHBondContact O-N 3.32Å; K247-A251 VanDerWaalsContact O-CB 3.28Å; K247-A251 WeakPolarHBondContact O-CB 3.44Å; K247-A251 PolarHBondContact O-N 2.95Å; K247-Y267 HydrophobicContact CG-CD2 4.47Å; K247-Y267 HydrophobicContact CG-CE2 4.2Å
248S98.6Very high96.3Very high0 Ų016.2 Ų16.20%08%0.077CC..Hα-helixtrans-66.4-40171.4-67.40000112.8T138 I201 L244 L245 Q250 A251 A252T138-S248 VanDerWaalsContact CG2-OG 3.28Å; T138-S248 WeakPolarHBondContact CG2-OG 2.92Å; T138-S248 VanDerWaalsContact OG1-CB 3.32Å; T138-S248 WeakPolarHBondContact OG1-CB 3.43Å; T138-S248 PolarHBondContact OG1-OG 3.41Å; I201-S248 WeakPolarHBondContact CD1-OG 3.35Å; L244-S248 VanDerWaalsContact O-CB 3.25Å; L244-S248 WeakPolarHBondContact O-CB 3.48Å; L244-S248 PolarHBondContact O-N 3.39Å; L244-S248 PolarHBondContact O-OG 3.32Å; L245-S248 PolarHBondContact O-N 3.42Å; S248-Q250 VanDerWaalsContact C-N 3.33Å; S248-Q250 PolarHBondContact O-N 3Å; S248-A251 PolarHBondContact O-N 2.74Å; S248-A252 PolarHBondContact O-N 3.41Å
249C98.6Very high96.3Very high0 Ų020.2 Ų20.20%010%0.099CC..Hα-helixtrans-61.4-44173.6-70.30000111.2L105 L245 A246 A252 M253 A266L105-C249 HydrophobicContact CD2-CB 3.44Å; L105-C249 VanDerWaalsContact CD2-CB 3.44Å; L245-C249 WeakPolarHBondContact O-CB 3.28Å; L245-C249 PolarHBondContact O-N 3.49Å; L245-C249 PolarHBondContact O-SG 3.27Å; A246-C249 PolarHBondContact O-N 2.78Å; C249-A252 PolarHBondContact O-N 3.14Å; C249-M253 PolarHBondContact O-N 3.39Å; C249-A266 HydrophobicContact CB-CB 4.27Å; C249-A266 WeakPolarHBondContact CB-O 3.35Å; C249-A266 WeakPolarHBondContact O-CB 3.28Å
250Q98.8Very high96.4Very high42 Ų4229.6 Ų29.620%0.19613%0.133CC..Hα-helixtrans-60.8-47.4174.2-169.9179.63.800112.3L200 A246 K247 S248 A252 M253 Q254 Q263L200-Q250 HydrophobicContact CD1-CB 4.46Å; L200-Q250 HydrophobicContact CD1-CG 4.11Å; A246-Q250 PolarHBondContact O-N 2.77Å; A246-Q250 VanDerWaalsContact O-N 3.08Å; K247-Q250 WeakPolarHBondContact O-CB 3.24Å; K247-Q250 PolarHBondContact O-N 3.32Å; S248-Q250 VanDerWaalsContact C-N 3.33Å; S248-Q250 PolarHBondContact O-N 3Å; Q250-A252 VanDerWaalsContact C-N 3.27Å; Q250-A252 PolarHBondContact O-N 3.32Å; Q250-M253 WeakPolarHBondContact O-CB 3.43Å; Q250-M253 PolarHBondContact O-N 3.33Å; Q250-M253 VanDerWaalsContact O-N 3.16Å; Q250-Q254 PolarHBondContact O-N 3.14Å; Q250-Q263 HydrophobicContact CG-CB 4.09Å
251A98.6Very high96.8Very high0 Ų033 Ų330%015%0.147CC..Hα-helixtrans-62.1-34.4179.800000112.2L134 V197 L200 I201 K247 S248 M253 Q254 L255L134-A251 HydrophobicContact CD1-CB 4.33Å; L134-A251 HydrophobicContact CD2-CB 3.61Å; V197-A251 HydrophobicContact CB-CB 4.49Å; V197-A251 HydrophobicContact CG1-CB 3.99Å; V197-A251 HydrophobicContact CG2-CB 4.19Å; L200-A251 HydrophobicContact CD1-CB 4.13Å; I201-A251 HydrophobicContact CD1-CB 4.23Å; K247-A251 VanDerWaalsContact O-CB 3.28Å; K247-A251 WeakPolarHBondContact O-CB 3.44Å; K247-A251 PolarHBondContact O-N 2.95Å; S248-A251 PolarHBondContact O-N 2.74Å; A251-M253 VanDerWaalsContact C-N 3.31Å; A251-M253 PolarHBondContact O-N 3.45Å; A251-Q254 WeakPolarHBondContact O-CB 3.22Å; A251-Q254 PolarHBondContact O-N 3.26Å; A251-L255 WeakPolarHBondContact O-CG 3.24Å; A251-L255 PolarHBondContact O-N 2.98Å
252A98Very high97.1Very high0 Ų032.2 Ų32.20%015%0.146CC..Hα-helixtrans-62.6-38175.600000112.6V102 Q131 L134 S248 C249 Q250 A256V102-A252 HydrophobicContact CG1-CB 3.99Å; Q131-A252 PolarHBondContact NE2-O 3.04Å; L134-A252 HydrophobicContact CD2-CB 4.03Å; L134-A252 VanDerWaalsContact CD2-N 3.34Å; S248-A252 PolarHBondContact O-N 3.41Å; C249-A252 PolarHBondContact O-N 3.14Å; Q250-A252 VanDerWaalsContact C-N 3.27Å; Q250-A252 PolarHBondContact O-N 3.32Å; A252-A256 PolarHBondContact O-N 3.45Å
253M97.8Very high97.3Very high0 Ų033.3 Ų33.30%015%0.151CC..Hα-helixtrans-70.5-39.2174.5-65.2-55.498.500111.7L105 A109 C249 Q250 A251 A256 K257 H258 Q263 A266 F366L105-M253 HydrophobicContact CG-CE 4.25Å; A109-M253 HydrophobicContact CB-CE 3.67Å; A109-M253 HydrophobicContact CB-SD 3.5Å; A109-M253 WeakPolarHBondContact CB-SD 3.49Å; C249-M253 PolarHBondContact O-N 3.39Å; Q250-M253 WeakPolarHBondContact O-CB 3.43Å; Q250-M253 PolarHBondContact O-N 3.33Å; Q250-M253 VanDerWaalsContact O-N 3.16Å; A251-M253 VanDerWaalsContact C-N 3.31Å; A251-M253 PolarHBondContact O-N 3.45Å; M253-A256 CarbonylContact O-C 3.57Å; M253-A256 PolarHBondContact O-N 2.84Å; M253-K257 PolarHBondContact O-N 3.11Å; M253-H258 HydrophobicContact CB-CB 4.14Å; M253-H258 PolarHBondContact O-N 3.32Å; M253-H258 HydrophobicContact SD-CB 4.48Å; M253-Q263 HydrophobicContact CB-CB 4.31Å; M253-Q263 HydrophobicContact CB-CG 3.63Å; M253-A266 HydrophobicContact CG-CB 3.42Å; M253-A266 VanDerWaalsContact CG-CB 3.42Å; M253-F366 HydrophobicContact SD-CE1 3.8Å; M253-F366 HydrophobicContact SD-CZ 4.39Å
254Q97.4Very high97.4Very high35 Ų3538.9 Ų38.916%0.16417%0.172CC..Hα-helixtrans-60.4-43.3174.5172.764.316.400112K196 V197 Q250 A251 A256 K257K196-Q254 HydrophobicContact CB-CG 4.38Å; K196-Q254 HydrophobicContact CG-CG 4.45Å; V197-Q254 HydrophobicContact CG2-CB 4.24Å; V197-Q254 HydrophobicContact CG2-CG 3.78Å; Q250-Q254 PolarHBondContact O-N 3.14Å; A251-Q254 WeakPolarHBondContact O-CB 3.22Å; A251-Q254 PolarHBondContact O-N 3.26Å; Q254-A256 VanDerWaalsContact C-N 3.29Å; Q254-A256 PolarHBondContact O-N 2.97Å; Q254-K257 PolarHBondContact O-N 3.07Å; Q254-K257 VanDerWaalsContact O-N 3.1Å
255L95.6Very high97.4Very high15 Ų1540 Ų408%0.07918%0.178CC..Hα-helixtrans-61.7-37.2177-74.3172.9000112.6S130 Q131 L134 L192 D194 V197 A251 K257S130-L255 WeakPolarHBondContact O-CD1 3.16Å; Q131-L255 HydrophobicContact CG-CB 4.19Å; Q131-L255 HydrophobicContact CG-CD1 4.42Å; L134-L255 HydrophobicContact CB-CD1 3.81Å; L134-L255 HydrophobicContact CD2-CD1 3.69Å; L134-L255 HydrophobicContact CG-CD1 4.31Å; L192-L255 HydrophobicContact CD1-CD1 4.37Å; D194-L255 HydrophobicContact CB-CD2 4.16Å; V197-L255 HydrophobicContact CG2-CD2 3.79Å; V197-L255 HydrophobicContact CG2-CG 3.81Å; A251-L255 WeakPolarHBondContact O-CG 3.24Å; A251-L255 PolarHBondContact O-N 2.98Å; L255-K257 VanDerWaalsContact C-N 3.26Å; L255-K257 PolarHBondContact O-N 3.3Å
256A94.1Very high97.5Very high1 Ų139.8 Ų39.81%0.00818%0.177CC..THydrogen-bonded Turntrans-83.84.7177.100000114.1S112 Y128 A252 M253 Q254 H258S112-A256 WeakPolarHBondContact CB-O 3.42Å; Y128-A256 HydrophobicContact CD2-CB 3.83Å; Y128-A256 HydrophobicContact CE2-CB 3.62Å; A252-A256 PolarHBondContact O-N 3.45Å; M253-A256 CarbonylContact O-C 3.57Å; M253-A256 PolarHBondContact O-N 2.84Å; Q254-A256 VanDerWaalsContact C-N 3.29Å; Q254-A256 PolarHBondContact O-N 2.97Å; A256-H258 PolarHBondContact O-N 3.07Å
257K94.7Very high97.5Very high95 Ų9542.3 Ų42.341%0.41319%0.187SC..THydrogen-bonded Turntrans56.735.9179.9-49.7-59.5174-165.80113.1S112 D194 M253 Q254 L255S112-K257 WeakPolarHBondContact CB-O 3.22Å; S112-K257 PolarHBondContact OG-O 3.22Å; D194-K257 IonicContact OD2-NZ 3.41Å; D194-K257 PolarHBondContact OD2-NZ 3.45Å; M253-K257 PolarHBondContact O-N 3.11Å; Q254-K257 PolarHBondContact O-N 3.07Å; Q254-K257 VanDerWaalsContact O-N 3.1Å; L255-K257 VanDerWaalsContact C-N 3.26Å; L255-K257 PolarHBondContact O-N 3.3Å
258H95.4Very high97.5Very high28 Ų2843.1 Ų43.113%0.1319%0.192CC..  trans-72.2155.5167.1-77.3-70.2000110.6G110 M253 A256 A262 Q263G110-H258 PolarHBondContact O-CE1 3.49Å; G110-H258 PolarHBondContact O-NE2 3.3Å; M253-H258 HydrophobicContact CB-CB 4.14Å; M253-H258 PolarHBondContact O-N 3.32Å; M253-H258 HydrophobicContact SD-CB 4.48Å; A256-H258 PolarHBondContact O-N 3.07Å; H258-A262 HydrophobicContact CB-CB 3.88Å; H258-Q263 PolarHBondContact O-NE2 3.25Å
259D95.7Very high97.5Very high105 Ų10543.1 Ų43.156%0.56119%0.192SC*.  trans-66.4172.8-178.870.621.9000113E261 A262 Q263D259-E261 PolarHBondContact O-N 2.97Å; D259-E261 PolarHBondContact OD1-N 3.5Å; D259-A262 PolarHBondContact O-N 3.37Å; D259-A262 WeakPolarHBondContact OD1-CB 3.07Å; D259-A262 PolarHBondContact OD1-N 2.91Å; D259-Q263 VanDerWaalsContact O-CG 3.27Å; D259-Q263 WeakPolarHBondContact O-CG 3.09Å; D259-Q263 PolarHBondContact O-N 2.84Å; D259-Q263 VanDerWaalsContact O-N 3.09Å
260R96.8Very high97.5Very high222 Ų22243.1 Ų43.184%0.83819%0.192SC*.Hα-helixtrans-63.5-27.8-178.3-70.2-171.9179.8-175.11113R264R260-R264 WeakPolarHBondContact O-CB 3.49Å; R260-R264 PolarHBondContact O-N 3.36Å
261E97.4Very high97.4Very high87 Ų8743.9 Ų43.941%0.40720%0.195SC..Hα-helixtrans-76.5-45.2-177.4-178.255-16000110.7D259 Q263 R264 L265D259-E261 PolarHBondContact O-N 2.97Å; D259-E261 PolarHBondContact OD1-N 3.5Å; E261-Q263 VanDerWaalsContact C-N 3.3Å; E261-Q263 PolarHBondContact O-N 3.18Å; E261-R264 WeakPolarHBondContact O-CB 3.07Å; E261-R264 PolarHBondContact O-N 3.22Å; E261-R264 VanDerWaalsContact O-N 3.11Å; E261-R264 IonicContact OE1-CZ 2.77Å; E261-R264 IonicContact OE1-NE 3.34Å; E261-R264 PolarHBondContact OE1-NE 2.99Å; E261-R264 IonicContact OE1-NH2 3.22Å; E261-R264 PolarHBondContact OE1-NH2 3.32Å; E261-R264 IonicContact OE2-CZ 3.16Å; E261-R264 IonicContact OE2-NE 2.84Å; E261-R264 PolarHBondContact OE2-NE 3.35Å; E261-R264 IonicContact OE2-NH2 2.62Å; E261-L265 HydrophobicContact CG-CD1 4.04Å; E261-L265 WeakPolarHBondContact O-CG 3.08Å; E261-L265 PolarHBondContact O-N 3.01Å
262A97.5Very high97.4Very high16 Ų1644.9 Ų44.913%0.13220%0.199CC..Hα-helixtrans-58.6-41.9171.200000111.7H258 D259 R264 L265 A266H258-A262 HydrophobicContact CB-CB 3.88Å; D259-A262 PolarHBondContact O-N 3.37Å; D259-A262 WeakPolarHBondContact OD1-CB 3.07Å; D259-A262 PolarHBondContact OD1-N 2.91Å; A262-R264 PolarHBondContact O-N 3.14Å; A262-L265 PolarHBondContact O-N 3.34Å; A262-A266 VanDerWaalsContact O-CB 3.28Å; A262-A266 WeakPolarHBondContact O-CB 3.28Å; A262-A266 PolarHBondContact O-N 3.49Å
263Q98.5Very high97.3Very high23 Ų2345 Ų4511%0.10720%0.2CC..Hα-helixtrans-59.5-43.9172.9-71.218038.500112.3Q250 M253 H258 D259 E261 Y267Q250-Q263 HydrophobicContact CG-CB 4.09Å; M253-Q263 HydrophobicContact CB-CB 4.31Å; M253-Q263 HydrophobicContact CB-CG 3.63Å; H258-Q263 PolarHBondContact O-NE2 3.25Å; D259-Q263 VanDerWaalsContact O-CG 3.27Å; D259-Q263 WeakPolarHBondContact O-CG 3.09Å; D259-Q263 PolarHBondContact O-N 2.84Å; D259-Q263 VanDerWaalsContact O-N 3.09Å; E261-Q263 VanDerWaalsContact C-N 3.3Å; E261-Q263 PolarHBondContact O-N 3.18Å; Q263-Y267 PolarHBondContact O-N 2.98Å
264R98.7Very high97.2Very high117 Ų11745.2 Ų45.244%0.44220%0.202SC..Hα-helixtrans-65.7-43.7178.3-171.8-169.774.682.75.4111.9R260 E261 A262 Y267 L268R260-R264 WeakPolarHBondContact O-CB 3.49Å; R260-R264 PolarHBondContact O-N 3.36Å; E261-R264 WeakPolarHBondContact O-CB 3.07Å; E261-R264 PolarHBondContact O-N 3.22Å; E261-R264 VanDerWaalsContact O-N 3.11Å; E261-R264 IonicContact OE1-CZ 2.77Å; E261-R264 IonicContact OE1-NE 3.34Å; E261-R264 PolarHBondContact OE1-NE 2.99Å; E261-R264 IonicContact OE1-NH2 3.22Å; E261-R264 PolarHBondContact OE1-NH2 3.32Å; E261-R264 IonicContact OE2-CZ 3.16Å; E261-R264 IonicContact OE2-NE 2.84Å; E261-R264 PolarHBondContact OE2-NE 3.35Å; E261-R264 IonicContact OE2-NH2 2.62Å; A262-R264 PolarHBondContact O-N 3.14Å; R264-Y267 WeakPolarHBondContact O-CB 3.48Å; R264-Y267 PolarHBondContact O-N 3.47Å; R264-L268 WeakPolarHBondContact O-CG 3.41Å; R264-L268 PolarHBondContact O-N 2.99Å
265L98.6Very high97.1Very high25 Ų2543.7 Ų43.713%0.13119%0.194CC..Hα-helixtrans-65.4-40.9178.2-69.7164.4000111.4E261 A262 Y267 L268 Y269 A365 F366E261-L265 HydrophobicContact CG-CD1 4.04Å; E261-L265 WeakPolarHBondContact O-CG 3.08Å; E261-L265 PolarHBondContact O-N 3.01Å; A262-L265 PolarHBondContact O-N 3.34Å; L265-Y267 PolarHBondContact O-N 2.87Å; L265-L268 PolarHBondContact O-N 3.43Å; L265-Y269 PolarHBondContact O-N 3.36Å; L265-A365 HydrophobicContact CD1-CB 3.6Å; L265-A365 HydrophobicContact CD2-CB 4.47Å; L265-F366 HydrophobicContact CB-CE2 3.84Å; L265-F366 HydrophobicContact CB-CZ 4.26Å
266A98.7Very high97Very high0 Ų043 Ų430%019%0.191CC..Hα-helixtrans-59.3-45.2172.100000112.5L105 C249 M253 A262 Y269 G270 F366L105-A266 HydrophobicContact CD2-CB 3.59Å; L105-A266 HydrophobicContact CG-CB 4.49Å; C249-A266 HydrophobicContact CB-CB 4.27Å; C249-A266 WeakPolarHBondContact CB-O 3.35Å; C249-A266 WeakPolarHBondContact O-CB 3.28Å; M253-A266 HydrophobicContact CG-CB 3.42Å; M253-A266 VanDerWaalsContact CG-CB 3.42Å; A262-A266 VanDerWaalsContact O-CB 3.28Å; A262-A266 WeakPolarHBondContact O-CB 3.28Å; A262-A266 PolarHBondContact O-N 3.49Å; A266-Y269 PolarHBondContact O-N 3.47Å; A266-G270 PolarHBondContact O-N 3.04Å; A266-G270 VanDerWaalsContact O-N 3.1Å; A266-F366 HydrophobicContact CB-CZ 4.16Å
267Y98.8Very high96.8Very high53 Ų5344 Ų4421%0.20820%0.195CC..Hα-helixtrans-57.7-48.4173.6172.6-91.5000111.7F238 A246 K247 Q263 R264 L265 Y269 G270 K271F238-Y267 HydrophobicContact CZ-CE2 4.12Å; F238-Y267 AromaticContact CZ-CZ 3.88Å; F238-Y267 WeakPolarHBondContact CZ-OH 3.49Å; A246-Y267 HydrophobicContact CB-CD2 3.72Å; A246-Y267 HydrophobicContact CB-CE2 3.67Å; A246-Y267 HydrophobicContact CB-CG 4.38Å; A246-Y267 WeakPolarHBondContact O-CA 3.34Å; K247-Y267 HydrophobicContact CG-CD2 4.47Å; K247-Y267 HydrophobicContact CG-CE2 4.2Å; Q263-Y267 PolarHBondContact O-N 2.98Å; R264-Y267 WeakPolarHBondContact O-CB 3.48Å; R264-Y267 PolarHBondContact O-N 3.47Å; L265-Y267 PolarHBondContact O-N 2.87Å; Y267-Y269 PolarHBondContact O-N 3.07Å; Y267-G270 PolarHBondContact O-N 2.96Å; Y267-K271 HydrophobicContact CE1-CB 4.44Å; Y267-K271 HydrophobicContact CE1-CD 4.02Å; Y267-K271 WeakPolarHBondContact O-CB 3.31Å; Y267-K271 PolarHBondContact O-N 3.28Å
268L98.8Very high96.6Very high42 Ų4240.9 Ų40.922%0.2218%0.182CC..Hα-helixtrans-63.3-41.4-179.3-74.1178.9000112.3R264 L265 K271 H272 A362R264-L268 WeakPolarHBondContact O-CG 3.41Å; R264-L268 PolarHBondContact O-N 2.99Å; L265-L268 PolarHBondContact O-N 3.43Å; L268-K271 PolarHBondContact O-N 2.97Å; L268-H272 WeakPolarHBondContact O-CB 3.12Å; L268-H272 PolarHBondContact O-CD2 3.17Å; L268-H272 PolarHBondContact O-N 3.1Å; L268-A362 HydrophobicContact CB-CB 4.14Å
269Y98.6Very high96.5Very high0 Ų039.6 Ų39.60%018%0.176CC..Hα-helixtrans-57-53.4174177.8-95.8000111I101 L105 L265 A266 Y267 K271 H272 L273 A359 I363 L375 A379I101-Y269 HydrophobicContact CG2-CD1 4.38Å; I101-Y269 HydrophobicContact CG2-CE1 3.79Å; L105-Y269 HydrophobicContact CD1-CD1 4.45Å; L265-Y269 PolarHBondContact O-N 3.36Å; A266-Y269 PolarHBondContact O-N 3.47Å; Y267-Y269 PolarHBondContact O-N 3.07Å; Y269-K271 PolarHBondContact O-N 3.18Å; Y269-H272 PolarHBondContact O-N 2.93Å; Y269-L273 HydrophobicContact CE1-CD2 3.79Å; Y269-L273 WeakPolarHBondContact O-CB 3.5Å; Y269-L273 PolarHBondContact O-N 3.41Å; Y269-A359 HydrophobicContact CD2-CB 4.1Å; Y269-A359 VanDerWaalsContact CD2-O 3.32Å; Y269-A359 WeakPolarHBondContact CD2-O 3.21Å; Y269-A359 HydrophobicContact CE2-CB 4.22Å; Y269-I363 HydrophobicContact CD2-CB 3.7Å; Y269-I363 HydrophobicContact CD2-CD1 4.46Å; Y269-I363 HydrophobicContact CD2-CG1 4.34Å; Y269-I363 HydrophobicContact CD2-CG2 4.3Å; Y269-I363 HydrophobicContact CE2-CB 3.93Å; Y269-I363 HydrophobicContact CE2-CG1 4.32Å; Y269-I363 HydrophobicContact CE2-CG2 4.18Å; Y269-L375 HydrophobicContact CE1-CD2 3.68Å; Y269-L375 HydrophobicContact CE2-CB 4.26Å; Y269-L375 WeakPolarHBondContact OH-CA 3.38Å; Y269-L375 WeakPolarHBondContact OH-CB 3.27Å; Y269-L375 VanDerWaalsContact OH-CD2 3.27Å; Y269-L375 WeakPolarHBondContact OH-CD2 3.34Å; Y269-L375 PolarHBondContact OH-O 3.31Å; Y269-L375 VanDerWaalsContact OH-O 3.09Å; Y269-A379 HydrophobicContact CE2-CB 4.43Å
270G98.1Very high96.2Very high0 Ų035.7 Ų35.70%016%0.155CC..Hα-helixtrans-62.3-39179.400000113.3A266 Y267 S274A266-G270 PolarHBondContact O-N 3.04Å; A266-G270 VanDerWaalsContact O-N 3.1Å; Y267-G270 PolarHBondContact O-N 2.96Å; G270-S274 WeakPolarHBondContact O-CB 3.42Å; G270-S274 PolarHBondContact O-N 3.06Å; G270-S274 VanDerWaalsContact O-N 3.13Å; G270-S274 PolarHBondContact O-OG 3.47Å
271K98.3Very high95.7Very high58 Ų5826.4 Ų26.425%0.25212%0.124SC..Hα-helixtrans-61.3-53.6175.8172.8172.6-179.1175.60111.4F238 A246 Y267 L268 Y269 S274 L275F238-K271 HydrophobicContact CD2-CB 4.46Å; F238-K271 HydrophobicContact CD2-CD 4.15Å; F238-K271 HydrophobicContact CD2-CG 3.78Å; F238-K271 HydrophobicContact CE2-CB 3.99Å; F238-K271 HydrophobicContact CE2-CD 3.99Å; F238-K271 HydrophobicContact CE2-CG 3.73Å; A246-K271 HydrophobicContact CB-CB 3.94Å; Y267-K271 HydrophobicContact CE1-CB 4.44Å; Y267-K271 HydrophobicContact CE1-CD 4.02Å; Y267-K271 WeakPolarHBondContact O-CB 3.31Å; Y267-K271 PolarHBondContact O-N 3.28Å; L268-K271 PolarHBondContact O-N 2.97Å; Y269-K271 PolarHBondContact O-N 3.18Å; K271-S274 PolarHBondContact O-OG 2.81Å; K271-L275 HydrophobicContact CG-CD1 4.04Å; K271-L275 WeakPolarHBondContact O-CG 3.45Å; K271-L275 PolarHBondContact O-N 3.35Å; K271-L275 VanDerWaalsContact O-N 3.13Å
272H98.1Very high95.3Very high20 Ų2022.7 Ų22.79%0.09311%0.107CC..Hα-helixtrans-72.3-38.1-175.2-74-56.5000112.2L268 Y269 S274 L275 G276 H355 R358 A359L268-H272 WeakPolarHBondContact O-CB 3.12Å; L268-H272 PolarHBondContact O-CD2 3.17Å; L268-H272 PolarHBondContact O-N 3.1Å; Y269-H272 PolarHBondContact O-N 2.93Å; H272-S274 PolarHBondContact O-N 3.44Å; H272-L275 PolarHBondContact O-N 3.18Å; H272-G276 PolarHBondContact O-N 3.36Å; H272-H355 HydrophobicContact CB-CB 4.43Å; H272-H355 WeakPolarHBondContact CB-O 3.32Å; H272-H355 AromaticContact CE1-ND1 3.76Å; H272-H355 AromaticContact ND1-CE1 3.81Å; H272-H355 AromaticContact ND1-CG 3.95Å; H272-H355 AromaticContact ND1-ND1 3.06Å; H272-H355 PolarHBondContact ND1-ND1 2.97Å; H272-H355 WeakPolarHBondContact O-CB 3.31Å; H272-R358 HydrophobicContact CB-CB 4.15Å; H272-R358 VanDerWaalsContact CD2-CB 3.48Å; H272-R358 WeakPolarHBondContact CD2-CB 3.09Å; H272-A359 HydrophobicContact CB-CB 3.93Å
273L96.2Very high94.9Very high3 Ų321.9 Ų21.92%0.01610%0.1CC..Hα-helixtrans-60.2-46.1175.5-179.666.9000111.7I101 L245 Y269 G276 H277 A359 I378 A379 V382I101-L273 HydrophobicContact CD1-CD2 3.57Å; I101-L273 HydrophobicContact CG1-CD2 3.84Å; I101-L273 HydrophobicContact CG2-CD2 4.2Å; L245-L273 HydrophobicContact CD2-CD2 4.31Å; Y269-L273 HydrophobicContact CE1-CD2 3.79Å; Y269-L273 WeakPolarHBondContact O-CB 3.5Å; Y269-L273 PolarHBondContact O-N 3.41Å; L273-G276 PolarHBondContact O-N 2.78Å; L273-H277 WeakPolarHBondContact O-CB 3.31Å; L273-H277 PolarHBondContact O-N 3.23Å; L273-A359 HydrophobicContact CB-CB 4.5Å; L273-I378 HydrophobicContact CD1-CG2 3.99Å; L273-I378 HydrophobicContact CD2-CG2 4.31Å; L273-A379 HydrophobicContact CD1-CB 4.31Å; L273-V382 HydrophobicContact CD1-CG2 3.87Å
274S94.7Very high94.3Very high5 Ų523 Ų234%0.03511%0.106CC..Hα-helixtrans-67.4-40.8-179.154.40000113H241 G242 G270 K271 H272 H277 K278H241-S274 PolarHBondContact CD2-O 3.41Å; G242-S274 WeakPolarHBondContact CA-OG 3.41Å; G270-S274 WeakPolarHBondContact O-CB 3.42Å; G270-S274 PolarHBondContact O-N 3.06Å; G270-S274 VanDerWaalsContact O-N 3.13Å; G270-S274 PolarHBondContact O-OG 3.47Å; K271-S274 PolarHBondContact O-OG 2.81Å; H272-S274 PolarHBondContact O-N 3.44Å; S274-H277 PolarHBondContact O-N 3.22Å; S274-K278 PolarHBondContact O-N 2.6Å
275L95.3Very high93.6Very high2 Ų218.3 Ų18.31%0.019%0.09CC..Hα-helixtrans-65.1-43.9174.6-70.8171.5000111.8A237 F238 K271 H272 H277 K278 L279 H355A237-L275 HydrophobicContact CB-CD2 3.75Å; F238-L275 HydrophobicContact CB-CD2 4.22Å; K271-L275 HydrophobicContact CG-CD1 4.04Å; K271-L275 WeakPolarHBondContact O-CG 3.45Å; K271-L275 PolarHBondContact O-N 3.35Å; K271-L275 VanDerWaalsContact O-N 3.13Å; H272-L275 PolarHBondContact O-N 3.18Å; L275-H277 VanDerWaalsContact C-N 3.33Å; L275-H277 PolarHBondContact O-N 3.29Å; L275-K278 PolarHBondContact O-N 3.38Å; L275-L279 WeakPolarHBondContact O-CG 3.17Å; L275-L279 PolarHBondContact O-N 3.28Å; L275-H355 WeakPolarHBondContact CB-CD2 3.32Å
276G93.8Very high93Very high0 Ų017.5 Ų17.50%09%0.086CC..Hα-helixtrans-58.3-45.4173.900000111.8H272 L273 K278 L279 N280 C352 V382H272-G276 PolarHBondContact O-N 3.36Å; L273-G276 PolarHBondContact O-N 2.78Å; G276-K278 PolarHBondContact O-N 2.88Å; G276-L279 PolarHBondContact O-N 3.37Å; G276-N280 PolarHBondContact O-N 3.22Å; G276-C352 PolarHBondContact O-SG 3Å; G276-C352 VanDerWaalsContact O-SG 3.4Å; G276-V382 VanDerWaalsContact O-CG1 3.27Å; G276-V382 WeakPolarHBondContact O-CG1 3.42Å
277H90.6Very high92.2Very high22 Ų2220.7 Ų20.710%0.10211%0.105CC..Hα-helixtrans-61.9-42.9177.4175.4-93000111.9M97 H241 L273 S274 L275 N280 S281 V382M97-H277 WeakPolarHBondContact CE-NE2 3.48Å; H241-H277 AromaticContact CE1-ND1 3.97Å; H241-H277 AromaticContact NE2-ND1 3.32Å; H241-H277 PolarHBondContact NE2-ND1 3.35Å; L273-H277 WeakPolarHBondContact O-CB 3.31Å; L273-H277 PolarHBondContact O-N 3.23Å; S274-H277 PolarHBondContact O-N 3.22Å; L275-H277 VanDerWaalsContact C-N 3.33Å; L275-H277 PolarHBondContact O-N 3.29Å; H277-N280 PolarHBondContact O-N 3.27Å; H277-S281 PolarHBondContact O-N 3.01Å; H277-V382 HydrophobicContact CB-CG2 4.47Å
278K91Very high90.9Very high31 Ų3121.4 Ų21.414%0.13511%0.109CC..Hα-helixtrans-61.6-44175.4-177.360.3171.476.80111.8W233 S274 L275 G276 S281 D282W233-K278 HydrophobicContact CH2-CB 4.45Å; W233-K278 HydrophobicContact CH2-CG 4.15Å; W233-K278 HydrophobicContact CZ2-CG 3.89Å; S274-K278 PolarHBondContact O-N 2.6Å; L275-K278 PolarHBondContact O-N 3.38Å; G276-K278 PolarHBondContact O-N 2.88Å; K278-S281 PolarHBondContact O-N 3.33Å; K278-D282 IonicContact NZ-OD1 3.44Å; K278-D282 PolarHBondContact NZ-OD1 3.09Å; K278-D282 IonicContact NZ-OD2 3.84Å; K278-D282 PolarHBondContact NZ-OD2 3.34Å; K278-D282 WeakPolarHBondContact O-CB 3.39Å; K278-D282 PolarHBondContact O-N 3.08Å
279L92.1Very high89Confident0 Ų021 Ų210%011%0.11CC..Hα-helixtrans-61.6-44.5175.3-75.6161.6000111.8W233 L275 G276 S281 D282 L283 A302 A348 L351 C352W233-L279 HydrophobicContact CE3-CD2 4.34Å; W233-L279 HydrophobicContact CH2-CD1 4.21Å; W233-L279 HydrophobicContact CH2-CD2 3.5Å; W233-L279 VanDerWaalsContact CH2-CD2 3.5Å; W233-L279 HydrophobicContact CH2-CG 3.45Å; W233-L279 VanDerWaalsContact CH2-CG 3.45Å; W233-L279 HydrophobicContact CZ2-CD2 3.98Å; W233-L279 HydrophobicContact CZ2-CG 4.27Å; W233-L279 HydrophobicContact CZ3-CD1 4.09Å; W233-L279 HydrophobicContact CZ3-CD2 3.67Å; W233-L279 HydrophobicContact CZ3-CG 3.78Å; L275-L279 WeakPolarHBondContact O-CG 3.17Å; L275-L279 PolarHBondContact O-N 3.28Å; G276-L279 PolarHBondContact O-N 3.37Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 3.12Å; L279-D282 PolarHBondContact O-N 2.98Å; L279-L283 WeakPolarHBondContact O-CB 3.13Å; L279-L283 WeakPolarHBondContact O-CD1 3.13Å; L279-L283 VanDerWaalsContact O-CG 3.29Å; L279-L283 WeakPolarHBondContact O-CG 3.14Å; L279-L283 PolarHBondContact O-N 3.43Å; L279-A302 HydrophobicContact CD2-CB 3.42Å; L279-A302 VanDerWaalsContact CD2-CB 3.42Å; L279-A348 HydrophobicContact CD2-CB 4.32Å; L279-L351 HydrophobicContact CD1-CB 3.99Å; L279-L351 HydrophobicContact CD1-CD2 3.96Å; L279-L351 HydrophobicContact CD1-CG 3.72Å; L279-L351 HydrophobicContact CD2-CD2 4.21Å; L279-C352 HydrophobicContact CB-CB 3.76Å; L279-C352 HydrophobicContact CD1-CB 4.09Å; L279-C352 HydrophobicContact CG-CB 4.5Å
280N89.6Confident86.9Confident24 Ų2429.3 Ų29.313%0.12814%0.141CC..Hα-helixtrans-58-47.7177.7-176.4-78.2000111.2G276 H277 D282 L283 Q284 V382 K384 F385G276-N280 PolarHBondContact O-N 3.22Å; H277-N280 PolarHBondContact O-N 3.27Å; N280-D282 PolarHBondContact O-N 3.48Å; N280-L283 PolarHBondContact O-N 2.92Å; N280-Q284 WeakPolarHBondContact O-CG 3.03Å; N280-Q284 PolarHBondContact O-N 3.24Å; N280-Q284 PolarHBondContact OD1-NE2 3Å; N280-V382 HydrophobicContact CB-CG1 4.35Å; N280-V382 WeakPolarHBondContact CB-O 3.37Å; N280-V382 PolarHBondContact ND2-O 3.08Å; N280-K384 PolarHBondContact ND2-O 2.96Å; N280-F385 HydrophobicContact CB-CE1 4.35Å; N280-F385 WeakPolarHBondContact ND2-CE1 3.48Å
281S85.8Confident84.5Confident26 Ų2638.2 Ų38.218%0.18219%0.188CC..Hα-helixtrans-59-45.2176.2178.80000112.2L25 H277 K278 L279 L283 Q284L25-S281 VanDerWaalsContact CD2-OG 3.24Å; L25-S281 WeakPolarHBondContact CD2-OG 3.45Å; H277-S281 PolarHBondContact O-N 3.01Å; K278-S281 PolarHBondContact O-N 3.33Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 3.12Å; S281-L283 PolarHBondContact O-N 3.26Å; S281-Q284 PolarHBondContact O-N 3.41Å
282D88.9Confident82Confident9 Ų939.6 Ų39.65%0.04822%0.218CC..Hα-helixtrans-65.8-26.7178.5-76.1-7000113.3K278 L279 N280 P285 F286 A301 A302K278-D282 IonicContact NZ-OD1 3.44Å; K278-D282 PolarHBondContact NZ-OD1 3.09Å; K278-D282 IonicContact NZ-OD2 3.84Å; K278-D282 PolarHBondContact NZ-OD2 3.34Å; K278-D282 WeakPolarHBondContact O-CB 3.39Å; K278-D282 PolarHBondContact O-N 3.08Å; L279-D282 PolarHBondContact O-N 2.98Å; N280-D282 PolarHBondContact O-N 3.48Å; D282-P285 WeakPolarHBondContact O-CD 3.48Å; D282-F286 VanDerWaalsContact O-CD2 3.25Å; D282-F286 WeakPolarHBondContact O-CD2 3.39Å; D282-F286 VanDerWaalsContact O-CE2 3.27Å; D282-F286 WeakPolarHBondContact O-CE2 3.45Å; D282-A301 HydrophobicContact CB-CB 3.96Å; D282-A301 WeakPolarHBondContact OD2-CA 3.42Å; D282-A302 PolarHBondContact OD2-N 3.19Å
283L89.4Confident79.9Confident0 Ų041.3 Ų41.30%024%0.236CC..Hα-helixtrans-82.6-23.2179.6-79.4163.8000113.5L279 N280 S281 P285 F286 V287 P303 V345 A348 V349 C352 F385L279-L283 WeakPolarHBondContact O-CB 3.13Å; L279-L283 WeakPolarHBondContact O-CD1 3.13Å; L279-L283 VanDerWaalsContact O-CG 3.29Å; L279-L283 WeakPolarHBondContact O-CG 3.14Å; L279-L283 PolarHBondContact O-N 3.43Å; N280-L283 PolarHBondContact O-N 2.92Å; S281-L283 PolarHBondContact O-N 3.26Å; L283-P285 VanDerWaalsContact C-CD 3.45Å; L283-P285 VanDerWaalsContact C-N 3.35Å; L283-F286 PolarHBondContact O-N 3.07Å; L283-V287 HydrophobicContact CB-CG2 4.37Å; L283-V287 PolarHBondContact O-N 3.3Å; L283-P303 HydrophobicContact CD2-CG 3.84Å; L283-P303 HydrophobicContact CG-CG 4.3Å; L283-V345 HydrophobicContact CD2-CG1 3.99Å; L283-A348 HydrophobicContact CD1-CB 4.31Å; L283-A348 HydrophobicContact CD2-CB 3.81Å; L283-A348 HydrophobicContact CG-CB 4.16Å; L283-V349 HydrophobicContact CD1-CG2 3.92Å; L283-V349 HydrophobicContact CD2-CG2 3.77Å; L283-C352 HydrophobicContact CD1-CB 4.27Å; L283-F385 HydrophobicContact CB-CD1 4.16Å; L283-F385 HydrophobicContact CB-CE1 3.98Å; L283-F385 HydrophobicContact CD1-CD1 4.17Å; L283-F385 HydrophobicContact CD1-CE1 3.3Å; L283-F385 HydrophobicContact CD1-CZ 3.61Å; L283-F385 HydrophobicContact CG-CE1 4.27Å
284Q86.1Confident78.1Confident46 Ų4649.8 Ų49.822%0.21528%0.278CS..Hα-helixtrans-50.7-45.5-176.6-67.2-57.7-45.100113.7N280 S281 F286 K288N280-Q284 WeakPolarHBondContact O-CG 3.03Å; N280-Q284 PolarHBondContact O-N 3.24Å; N280-Q284 PolarHBondContact OD1-NE2 3Å; S281-Q284 PolarHBondContact O-N 3.41Å; Q284-F286 PolarHBondContact O-N 3.43Å; Q284-K288 PolarHBondContact O-N 3.3Å
285P84.8Confident76.9Confident19 Ų1951.5 Ų51.512%0.12329%0.288CS..Hα-helixtrans-61.5-27.2177.9-25.237.4000114D282 L283 S289 T295 F297 L336D282-P285 WeakPolarHBondContact O-CD 3.48Å; L283-P285 VanDerWaalsContact C-CD 3.45Å; L283-P285 VanDerWaalsContact C-N 3.35Å; P285-S289 VanDerWaalsContact O-CB 3.28Å; P285-S289 WeakPolarHBondContact O-CB 3.1Å; P285-T295 HydrophobicContact CB-CG2 3.69Å; P285-T295 HydrophobicContact CG-CG2 4.39Å; P285-F297 HydrophobicContact CB-CB 4.01Å; P285-F297 HydrophobicContact CG-CB 3.85Å; P285-L336 HydrophobicContact CB-CD1 4.43Å
286F85.8Confident75.8Confident8 Ų854.3 Ų54.34%0.03531%0.308CS..Hα-helixtrans-93.1-38.1-172.8-56.8-87.7000111.8D282 L283 Q284 F297 P303 V304 L336 V339 K340 V345D282-F286 VanDerWaalsContact O-CD2 3.25Å; D282-F286 WeakPolarHBondContact O-CD2 3.39Å; D282-F286 VanDerWaalsContact O-CE2 3.27Å; D282-F286 WeakPolarHBondContact O-CE2 3.45Å; L283-F286 PolarHBondContact O-N 3.07Å; Q284-F286 PolarHBondContact O-N 3.43Å; F286-F297 HydrophobicContact CE2-CG 4.45Å; F286-F297 HydrophobicContact CZ-CB 4.49Å; F286-F297 HydrophobicContact CZ-CD1 4.24Å; F286-F297 AromaticContact CZ-CD2 3.9Å; F286-F297 HydrophobicContact CZ-CD2 3.9Å; F286-F297 HydrophobicContact CZ-CE1 4.44Å; F286-F297 HydrophobicContact CZ-CE2 4.13Å; F286-F297 AromaticContact CZ-CG 3.96Å; F286-F297 HydrophobicContact CZ-CG 3.96Å; F286-F297 HydrophobicContact CZ-CZ 4.37Å; F286-P303 HydrophobicContact CD2-CB 4.05Å; F286-P303 HydrophobicContact CD2-CG 3.8Å; F286-P303 HydrophobicContact CE1-CB 4.43Å; F286-P303 HydrophobicContact CE2-CB 3.91Å; F286-P303 HydrophobicContact CE2-CG 3.84Å; F286-P303 HydrophobicContact CG-CB 4.38Å; F286-P303 HydrophobicContact CG-CG 4.47Å; F286-P303 HydrophobicContact CZ-CB 4.13Å; F286-V304 HydrophobicContact CZ-CG2 3.8Å; F286-L336 HydrophobicContact CD1-CD1 3.54Å; F286-L336 HydrophobicContact CD1-CG 4.47Å; F286-L336 HydrophobicContact CE1-CD1 3.54Å; F286-L336 HydrophobicContact CG-CD1 4.23Å; F286-L336 HydrophobicContact CZ-CD1 4.23Å; F286-V339 HydrophobicContact CD1-CB 4.4Å; F286-V339 HydrophobicContact CD1-CG1 3.89Å; F286-V339 HydrophobicContact CE1-CB 3.78Å; F286-V339 HydrophobicContact CE1-CG1 3.39Å; F286-V339 HydrophobicContact CE1-CG2 4.46Å; F286-V339 HydrophobicContact CZ-CG1 4.09Å; F286-K340 HydrophobicContact CD1-CG 4.27Å; F286-K340 WeakPolarHBondContact O-CE 3.21Å; F286-K340 PolarHBondContact O-NZ 3.29Å; F286-V345 HydrophobicContact CB-CG1 4.15Å; F286-V345 HydrophobicContact CB-CG2 4.01Å; F286-V345 HydrophobicContact CD1-CG2 3.97Å; F286-V345 HydrophobicContact CG-CG2 4.11Å
287V82Confident75.2Confident67 Ų6755.1 Ų55.141%0.40631%0.311SS..Hα-helixtrans-84.4-38.3-176.6-175.30000112.4L283 F385L283-V287 HydrophobicContact CB-CG2 4.37Å; L283-V287 PolarHBondContact O-N 3.3Å; V287-F385 HydrophobicContact CB-CB 4.35Å; V287-F385 HydrophobicContact CG1-CB 3.81Å; V287-F385 HydrophobicContact CG2-CB 4.35Å
288K70Confident74.8Confident68 Ų6856.1 Ų56.130%0.29632%0.321SS..SBendtrans-102.62.5-171.6-65.1-168.3-172.5157.10116.1S31 Q284 R290 F385S31-K288 PolarHBondContact OG-NZ 3.34Å; Q284-K288 PolarHBondContact O-N 3.3Å; K288-R290 PolarHBondContact O-N 2.99Å; K288-F385 WeakPolarHBondContact CE-OXT 3.32Å
289S60.6Low74.4Confident33 Ų3357.2 Ų57.223%0.23133%0.328CS..  trans-60.4108-178.9175.50000110.2P285P285-S289 VanDerWaalsContact O-CB 3.28Å; P285-S289 WeakPolarHBondContact O-CB 3.1Å
290R54Low74.1Confident175 Ų17558 Ų5866%0.6633%0.334SS*.  trans-68.4137.2166.9-62.7-172-169.4-144.93.7107.9S29 K288 G292 A293S29-R290 PolarHBondContact OG-NH2 2.77Å; K288-R290 PolarHBondContact O-N 2.99Å; R290-G292 PolarHBondContact O-N 3.23Å; R290-G292 VanDerWaalsContact O-N 3.07Å; R290-A293 PolarHBondContact O-N 3.15Å; R290-A293 VanDerWaalsContact O-N 3.15Å
291L47.3Very low74Confident187 Ų18757 Ų5798%0.97933%0.328SS*.THydrogen-bonded Turntrans-49.6119.2173.4-111.882.4000109.5
292G46.1Very low74.3Confident86 Ų8655.7 Ų55.789%0.88732%0.319SS*.THydrogen-bonded Turntrans99.2-6.7175.800000116.9R290R290-G292 PolarHBondContact O-N 3.23Å; R290-G292 VanDerWaalsContact O-N 3.07Å
293A54.1Low74.4Confident57 Ų5755.3 Ų55.347%0.47132%0.317SS..  trans-84.4121.1174.500000111.3R290 T295R290-A293 PolarHBondContact O-N 3.15Å; R290-A293 VanDerWaalsContact O-N 3.15Å; A293-T295 PolarHBondContact O-N 3.47Å; A293-T295 PolarHBondContact O-OG1 3.37Å
294M57.9Low74.5Confident181 Ų18155.3 Ų55.389%0.89232%0.317SS*.  trans-60.5106.4170.2-83.3-172.976.400109.2
295T68.9Low74.6Confident41 Ų4154.5 Ų54.525%0.25232%0.315SS..  trans-113.5114.6-179.9-43.80000108.2P285 A293P285-T295 HydrophobicContact CB-CG2 3.69Å; P285-T295 HydrophobicContact CG-CG2 4.39Å; A293-T295 PolarHBondContact O-N 3.47Å; A293-T295 PolarHBondContact O-OG1 3.37Å
296S72.1Confident75Confident60 Ų6054.8 Ų54.842%0.4232%0.315SS..  trans-88.6154.7171.155.40000110.5
297F81.6Confident75.2Confident18 Ų1854.4 Ų54.48%0.07931%0.313CS..  trans-150.7161.8177.157.6-93.9000110.7P285 F286 L299 V304 Y332 L335 L336P285-F297 HydrophobicContact CB-CB 4.01Å; P285-F297 HydrophobicContact CG-CB 3.85Å; F286-F297 HydrophobicContact CE2-CG 4.45Å; F286-F297 HydrophobicContact CZ-CB 4.49Å; F286-F297 HydrophobicContact CZ-CD1 4.24Å; F286-F297 AromaticContact CZ-CD2 3.9Å; F286-F297 HydrophobicContact CZ-CD2 3.9Å; F286-F297 HydrophobicContact CZ-CE1 4.44Å; F286-F297 HydrophobicContact CZ-CE2 4.13Å; F286-F297 AromaticContact CZ-CG 3.96Å; F286-F297 HydrophobicContact CZ-CG 3.96Å; F286-F297 HydrophobicContact CZ-CZ 4.37Å; F297-L299 HydrophobicContact CE2-CD2 4.43Å; F297-V304 HydrophobicContact CD2-CG2 3.62Å; F297-V304 HydrophobicContact CE2-CG2 3.47Å; F297-V304 VanDerWaalsContact CE2-CG2 3.47Å; F297-Y332 HydrophobicContact CD1-CD1 4.02Å; F297-Y332 AromaticContact CE1-CD1 3.9Å; F297-Y332 HydrophobicContact CE1-CD1 3.9Å; F297-Y332 HydrophobicContact CE2-CD1 4.46Å; F297-Y332 HydrophobicContact CG-CD1 4.36Å; F297-Y332 HydrophobicContact CZ-CD1 4.15Å; F297-Y332 VanDerWaalsContact O-CE1 3.25Å; F297-Y332 WeakPolarHBondContact O-CE1 3.34Å; F297-L335 HydrophobicContact CE2-CD2 3.95Å; F297-L335 HydrophobicContact CE2-CG 4.34Å; F297-L335 HydrophobicContact CZ-CB 3.97Å; F297-L335 HydrophobicContact CZ-CD2 3.81Å; F297-L335 HydrophobicContact CZ-CG 3.86Å; F297-L336 HydrophobicContact CD1-CD1 3.93Å; F297-L336 HydrophobicContact CE1-CB 3.96Å; F297-L336 HydrophobicContact CE1-CD1 3.76Å
298S82.4Confident75.6Confident43 Ų4355.4 Ų55.430%0.30131%0.31SS..  trans-78.9140.5176.5-173.40000111.6S300 A301S298-S300 PolarHBondContact O-N 3.49Å; S298-S300 PolarHBondContact OG-N 3.27Å; S298-S300 PolarHBondContact OG-OG 3.43Å; S298-A301 WeakPolarHBondContact O-CB 3.29Å; S298-A301 PolarHBondContact O-N 3.44Å
299L83.8Confident76.5Confident53 Ų5357.7 Ų57.728%0.27732%0.321SS..THydrogen-bonded Turntrans-68.3-18171-60.6-178.3000112.7F297 A301 V304 W316 L320 L330 L335F297-L299 HydrophobicContact CE2-CD2 4.43Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-V304 HydrophobicContact CD2-CG1 4.44Å; L299-W316 HydrophobicContact CD2-CH2 4.27Å; L299-W316 HydrophobicContact CD2-CZ2 4.26Å; L299-L320 HydrophobicContact CD1-CD2 4.38Å; L299-L330 HydrophobicContact CD1-CD1 4.5Å; L299-L335 HydrophobicContact CD2-CD2 3.54Å
300S84.1Confident77.9Confident18 Ų1859.8 Ų59.813%0.12633%0.329CS..THydrogen-bonded Turntrans-85.81171.562.70000113.7E215 W233 S298E215-S300 PolarHBondContact OE1-OG 2.73Å; W233-S300 PolarHBondContact NE1-O 2.94Å; S298-S300 PolarHBondContact O-N 3.49Å; S298-S300 PolarHBondContact OG-N 3.27Å; S298-S300 PolarHBondContact OG-OG 3.43Å
301A88.5Confident79.6Confident1 Ų152.4 Ų52.41%0.00830%0.303CS..SBendtrans-67142.5178.400000111.3D282 S298 L299 V304 V305D282-A301 HydrophobicContact CB-CB 3.96Å; D282-A301 WeakPolarHBondContact OD2-CA 3.42Å; S298-A301 WeakPolarHBondContact O-CB 3.29Å; S298-A301 PolarHBondContact O-N 3.44Å; L299-A301 VanDerWaalsContact C-N 3.32Å; A301-V304 HydrophobicContact CB-CG2 4.26Å; A301-V304 WeakPolarHBondContact O-CA 3.34Å; A301-V304 WeakPolarHBondContact O-CB 3.42Å; A301-V304 PolarHBondContact O-N 2.59Å; A301-V305 PolarHBondContact O-N 3.04Å
302A91.6Very high81.6Confident0 Ų044.9 Ų44.90%027%0.271CS..Hα-helixtrans-51.3-47.2-173.900000114.5W233 L279 D282 V304 V305 F306 A348W233-A302 HydrophobicContact CD2-CB 3.84Å; W233-A302 HydrophobicContact CE3-CB 4.41Å; W233-A302 HydrophobicContact CG-CB 4.34Å; W233-A302 HydrophobicContact CH2-CB 4.32Å; W233-A302 HydrophobicContact CZ2-CB 3.64Å; L279-A302 HydrophobicContact CD2-CB 3.42Å; L279-A302 VanDerWaalsContact CD2-CB 3.42Å; D282-A302 PolarHBondContact OD2-N 3.19Å; A302-V304 PolarHBondContact O-N 2.84Å; A302-V305 PolarHBondContact O-N 3.44Å; A302-F306 HydrophobicContact CB-CD2 4.38Å; A302-F306 HydrophobicContact CB-CE2 3.87Å; A302-F306 HydrophobicContact CB-CZ 4.27Å; A302-F306 WeakPolarHBondContact O-CB 3.04Å; A302-F306 VanDerWaalsContact O-CD2 3.23Å; A302-F306 WeakPolarHBondContact O-CD2 3.41Å; A302-F306 VanDerWaalsContact O-CG 3.24Å; A302-F306 WeakPolarHBondContact O-CG 3.44Å; A302-F306 PolarHBondContact O-N 3.16Å; A302-A348 HydrophobicContact CB-CB 4.21Å
303P92.2Very high83.5Confident0 Ų046.1 Ų46.10%025%0.252CS..Hα-helixtrans-58.8-34.5178.9-24.635.5000113.3L283 F286 H307 V339 V345 A348L283-P303 HydrophobicContact CD2-CG 3.84Å; L283-P303 HydrophobicContact CG-CG 4.3Å; F286-P303 HydrophobicContact CD2-CB 4.05Å; F286-P303 HydrophobicContact CD2-CG 3.8Å; F286-P303 HydrophobicContact CE1-CB 4.43Å; F286-P303 HydrophobicContact CE2-CB 3.91Å; F286-P303 HydrophobicContact CE2-CG 3.84Å; F286-P303 HydrophobicContact CG-CB 4.38Å; F286-P303 HydrophobicContact CG-CG 4.47Å; F286-P303 HydrophobicContact CZ-CB 4.13Å; P303-H307 WeakPolarHBondContact O-CB 3.42Å; P303-H307 PolarHBondContact O-N 3.36Å; P303-V339 HydrophobicContact CB-CG1 4.04Å; P303-V345 HydrophobicContact CB-CG2 4.19Å; P303-A348 HydrophobicContact CB-CB 4.47Å; P303-A348 HydrophobicContact CG-CB 3.83Å
304V90.2Very high85.1Confident1 Ų150.9 Ų50.91%0.00627%0.265CS..Hα-helixtrans-75.7-43.8-179.7-173.80000110.8F286 F297 L299 A301 A302 H307 R308 W316 V339F286-V304 HydrophobicContact CZ-CG2 3.8Å; F297-V304 HydrophobicContact CD2-CG2 3.62Å; F297-V304 HydrophobicContact CE2-CG2 3.47Å; F297-V304 VanDerWaalsContact CE2-CG2 3.47Å; L299-V304 HydrophobicContact CD2-CG1 4.44Å; A301-V304 HydrophobicContact CB-CG2 4.26Å; A301-V304 WeakPolarHBondContact O-CA 3.34Å; A301-V304 WeakPolarHBondContact O-CB 3.42Å; A301-V304 PolarHBondContact O-N 2.59Å; A302-V304 PolarHBondContact O-N 2.84Å; V304-H307 PolarHBondContact O-N 3.34Å; V304-R308 WeakPolarHBondContact O-CB 3.42Å; V304-R308 PolarHBondContact O-N 3.45Å; V304-W316 HydrophobicContact CG1-CH2 3.33Å; V304-W316 HydrophobicContact CG1-CZ2 3.94Å; V304-W316 HydrophobicContact CG1-CZ3 4Å; V304-V339 HydrophobicContact CG2-CG2 4.39Å
305V89.6Confident86.7Confident29 Ų2946.4 Ų46.418%0.17624%0.24CC..Hα-helixtrans-62.2-45.3176.9174.40000110.5W233 A301 A302 R308 Q309W233-V305 HydrophobicContact CB-CG1 4.19Å; A301-V305 PolarHBondContact O-N 3.04Å; A302-V305 PolarHBondContact O-N 3.44Å; V305-R308 PolarHBondContact O-N 3.34Å; V305-Q309 WeakPolarHBondContact O-CG 3.46Å; V305-Q309 PolarHBondContact O-N 3Å
306F91.6Very high87.6Confident25 Ų2544.9 Ų44.911%0.1123%0.23CC..Hα-helixtrans-65.6-40.8176.2-61.1-29.4000112.1W233 A302 Q309 I310 L347 A348 L351W233-F306 HydrophobicContact CB-CE1 4.07Å; W233-F306 HydrophobicContact CB-CZ 4.45Å; W233-F306 HydrophobicContact CD2-CZ 4.45Å; W233-F306 HydrophobicContact CE3-CZ 4.35Å; W233-F306 HydrophobicContact CG-CE1 4.48Å; W233-F306 HydrophobicContact CG-CZ 4.49Å; A302-F306 HydrophobicContact CB-CD2 4.38Å; A302-F306 HydrophobicContact CB-CE2 3.87Å; A302-F306 HydrophobicContact CB-CZ 4.27Å; A302-F306 WeakPolarHBondContact O-CB 3.04Å; A302-F306 VanDerWaalsContact O-CD2 3.23Å; A302-F306 WeakPolarHBondContact O-CD2 3.41Å; A302-F306 VanDerWaalsContact O-CG 3.24Å; A302-F306 WeakPolarHBondContact O-CG 3.44Å; A302-F306 PolarHBondContact O-N 3.16Å; F306-Q309 PolarHBondContact O-N 3.46Å; F306-I310 WeakPolarHBondContact O-CD1 3.37Å; F306-I310 VanDerWaalsContact O-CG1 3.23Å; F306-I310 WeakPolarHBondContact O-CG1 3.44Å; F306-I310 PolarHBondContact O-N 3.04Å; F306-L347 HydrophobicContact CB-CD1 4.36Å; F306-L347 HydrophobicContact CD2-CB 3.95Å; F306-L347 HydrophobicContact CG-CB 4.43Å; F306-A348 HydrophobicContact CD2-CB 3.96Å; F306-A348 HydrophobicContact CE2-CB 3.95Å; F306-L351 HydrophobicContact CE2-CD2 4.18Å; F306-L351 HydrophobicContact CZ-CD2 3.73Å
307H91.1Very high88.4Confident0 Ų044 Ų440%022%0.219CC..Hα-helixtrans-58.2-49.3173175.882000111.9P303 V304 Q309 I310 V311 W316 Q319 A338 V339 E342P303-H307 WeakPolarHBondContact O-CB 3.42Å; P303-H307 PolarHBondContact O-N 3.36Å; V304-H307 PolarHBondContact O-N 3.34Å; H307-Q309 VanDerWaalsContact C-N 3.28Å; H307-Q309 PolarHBondContact O-N 2.94Å; H307-I310 PolarHBondContact O-N 3.27Å; H307-I310 VanDerWaalsContact O-N 3.08Å; H307-V311 WeakPolarHBondContact O-CG2 3.25Å; H307-V311 PolarHBondContact O-N 3.31Å; H307-W316 AromaticContact CD2-CE3 3.77Å; H307-W316 AromaticContact CD2-CZ3 3.78Å; H307-Q319 PolarHBondContact NE2-OE1 3.49Å; H307-A338 PolarHBondContact CE1-O 3.31Å; H307-V339 HydrophobicContact CB-CG1 4.18Å; H307-V339 HydrophobicContact CB-CG2 4.17Å; H307-E342 VanDerWaalsContact CE1-CG 3.46Å; H307-E342 WeakPolarHBondContact CE1-CG 3.25Å; H307-E342 WeakPolarHBondContact ND1-CB 3.41Å; H307-E342 WeakPolarHBondContact ND1-CG 3.37Å
308R89.7Confident88.7Confident88 Ų8848.3 Ų48.333%0.33224%0.239SC..Hα-helixtrans-55.7-41.5176.1175.9-179.4176.8-176.22.7112.1V304 V305 G312 W316V304-R308 WeakPolarHBondContact O-CB 3.42Å; V304-R308 PolarHBondContact O-N 3.45Å; V305-R308 PolarHBondContact O-N 3.34Å; R308-G312 PolarHBondContact O-N 3.33Å; R308-W316 HydrophobicContact CB-CD2 4.08Å; R308-W316 HydrophobicContact CB-CE3 4.42Å; R308-W316 HydrophobicContact CB-CG 4.14Å; R308-W316 HydrophobicContact CG-CB 4.14Å; R308-W316 HydrophobicContact CG-CD2 4.16Å; R308-W316 HydrophobicContact CG-CG 3.74Å
309Q88.8Confident89Confident116 Ų11647.6 Ų47.654%0.54223%0.231SC..Hα-helixtrans-65.9-40.5176.6-72.3173-9.100112.1V305 F306 H307V305-Q309 WeakPolarHBondContact O-CG 3.46Å; V305-Q309 PolarHBondContact O-N 3Å; F306-Q309 PolarHBondContact O-N 3.46Å; H307-Q309 VanDerWaalsContact C-N 3.28Å; H307-Q309 PolarHBondContact O-N 2.94Å
310I90.4Very high89.2Confident76 Ų7645.4 Ų45.439%0.3922%0.22SC..Hα-helixtrans-67.5-49.3179-68.1160.2000111.4F306 H307 G312 K343 L347F306-I310 WeakPolarHBondContact O-CD1 3.37Å; F306-I310 VanDerWaalsContact O-CG1 3.23Å; F306-I310 WeakPolarHBondContact O-CG1 3.44Å; F306-I310 PolarHBondContact O-N 3.04Å; H307-I310 PolarHBondContact O-N 3.27Å; H307-I310 VanDerWaalsContact O-N 3.08Å; I310-G312 VanDerWaalsContact C-N 3.33Å; I310-K343 HydrophobicContact CD1-CB 4Å; I310-L347 HydrophobicContact CD1-CD1 3.88Å
311V89.8Confident89.2Confident21 Ų2149.7 Ų49.713%0.12724%0.238CC..Hα-helixtrans-80.1-17.8-173.7-57.40000113.1H307 K315 W316 E342H307-V311 WeakPolarHBondContact O-CG2 3.25Å; H307-V311 PolarHBondContact O-N 3.31Å; V311-K315 HydrophobicContact CB-CB 4.13Å; V311-K315 HydrophobicContact CB-CD 3.91Å; V311-K315 HydrophobicContact CB-CG 4.07Å; V311-K315 HydrophobicContact CG1-CD 4.31Å; V311-K315 HydrophobicContact CG2-CB 4.34Å; V311-K315 HydrophobicContact CG2-CG 4.47Å; V311-K315 WeakPolarHBondContact O-CB 3.35Å; V311-W316 HydrophobicContact CG2-CB 3.99Å; V311-E342 HydrophobicContact CG1-CG 4.08Å
312G89.4Confident89.1Confident29 Ų2954.7 Ų54.730%0.29926%0.261SS..Hα-helixtrans80.8164.4-176.600000113.4R308 I310 E314 W316R308-G312 PolarHBondContact O-N 3.33Å; I310-G312 VanDerWaalsContact C-N 3.33Å; G312-E314 PolarHBondContact O-N 2.87Å; G312-W316 WeakPolarHBondContact O-CB 3.39Å; G312-W316 PolarHBondContact O-N 3.47Å; G312-W316 VanDerWaalsContact O-N 3.12Å
313K86Confident88.8Confident111 Ų11154.7 Ų54.748%0.48326%0.261SS..Hα-helixtrans-56.6-48.6-173.8-168.8176179.5176.70111.9W316 H317K313-W316 PolarHBondContact O-N 3.45Å; K313-H317 WeakPolarHBondContact CG-CE1 3.44Å; K313-H317 PolarHBondContact O-N 3.27Å; K313-H317 PolarHBondContact O-ND1 3.14Å
314E88.1Confident88.3Confident158 Ų15857.7 Ų57.774%0.73827%0.274SS*.Hα-helixtrans-62.2-53.8-174.5-169.363.8-166.800112.8G312 W316 H317 Q318G312-E314 PolarHBondContact O-N 2.87Å; E314-W316 VanDerWaalsContact C-N 3.28Å; E314-W316 PolarHBondContact O-N 2.98Å; E314-H317 PolarHBondContact O-N 3.46Å; E314-H317 VanDerWaalsContact O-N 3.12Å; E314-Q318 PolarHBondContact O-N 3.37Å
315K89.9Confident87.7Confident87 Ų8760.5 Ų60.538%0.37829%0.292SS..Hα-helixtrans-63.5-35.2179.6-175.2170.9166.6-160.90111.5V311 Q318 Q319 E342V311-K315 HydrophobicContact CB-CB 4.13Å; V311-K315 HydrophobicContact CB-CD 3.91Å; V311-K315 HydrophobicContact CB-CG 4.07Å; V311-K315 HydrophobicContact CG1-CD 4.31Å; V311-K315 HydrophobicContact CG2-CB 4.34Å; V311-K315 HydrophobicContact CG2-CG 4.47Å; V311-K315 WeakPolarHBondContact O-CB 3.35Å; K315-Q318 PolarHBondContact O-N 2.98Å; K315-Q319 VanDerWaalsContact O-CG 3.29Å; K315-Q319 WeakPolarHBondContact O-CG 3.5Å; K315-Q319 PolarHBondContact O-N 3.34Å; K315-E342 IonicContact NZ-OE1 3.93Å; K315-E342 PolarHBondContact NZ-OE1 3.13Å
316W89.6Confident86.7Confident8 Ų868.2 Ų68.23%0.0333%0.331CS..Hα-helixtrans-63.3-44.5173.2173.8-109.4000112.5L299 V304 H307 R308 V311 G312 K313 E314 Q318 Q319 L320 L335L299-W316 HydrophobicContact CD2-CH2 4.27Å; L299-W316 HydrophobicContact CD2-CZ2 4.26Å; V304-W316 HydrophobicContact CG1-CH2 3.33Å; V304-W316 HydrophobicContact CG1-CZ2 3.94Å; V304-W316 HydrophobicContact CG1-CZ3 4Å; H307-W316 AromaticContact CD2-CE3 3.77Å; H307-W316 AromaticContact CD2-CZ3 3.78Å; R308-W316 HydrophobicContact CB-CD2 4.08Å; R308-W316 HydrophobicContact CB-CE3 4.42Å; R308-W316 HydrophobicContact CB-CG 4.14Å; R308-W316 HydrophobicContact CG-CB 4.14Å; R308-W316 HydrophobicContact CG-CD2 4.16Å; R308-W316 HydrophobicContact CG-CG 3.74Å; V311-W316 HydrophobicContact CG2-CB 3.99Å; G312-W316 WeakPolarHBondContact O-CB 3.39Å; G312-W316 PolarHBondContact O-N 3.47Å; G312-W316 VanDerWaalsContact O-N 3.12Å; K313-W316 PolarHBondContact O-N 3.45Å; E314-W316 VanDerWaalsContact C-N 3.28Å; E314-W316 PolarHBondContact O-N 2.98Å; W316-Q318 VanDerWaalsContact C-N 3.33Å; W316-Q318 PolarHBondContact O-N 3.11Å; W316-Q319 PolarHBondContact O-N 2.82Å; W316-L320 HydrophobicContact CD2-CD1 4.35Å; W316-L320 HydrophobicContact CD2-CG 4.38Å; W316-L320 HydrophobicContact CG-CD1 4.48Å; W316-L320 HydrophobicContact CH2-CD2 4.46Å; W316-L320 HydrophobicContact CZ2-CD1 3.93Å; W316-L320 HydrophobicContact CZ2-CD2 3.98Å; W316-L320 HydrophobicContact CZ2-CG 3.9Å; W316-L320 PolarHBondContact O-N 3Å; W316-L335 HydrophobicContact CH2-CD1 3.75Å; W316-L335 HydrophobicContact CH2-CD2 4Å; W316-L335 HydrophobicContact CH2-CG 4.23Å; W316-L335 HydrophobicContact CZ3-CD1 3.6Å; W316-L335 HydrophobicContact CZ3-CG 4.4Å
317H87.3Confident85.5Confident41 Ų4176 Ų7619%0.1936%0.359CS..Hα-helixtrans-62.6-42.6176.6-75.964.5000110.8D222 K313 E314 Q319 L320 Q321D222-H317 IonicContact OD1-CD2 2.78Å; D222-H317 IonicContact OD1-CE1 2.86Å; D222-H317 IonicContact OD1-NE2 2.95Å; D222-H317 PolarHBondContact OD1-NE2 2.99Å; K313-H317 WeakPolarHBondContact CG-CE1 3.44Å; K313-H317 PolarHBondContact O-N 3.27Å; K313-H317 PolarHBondContact O-ND1 3.14Å; E314-H317 PolarHBondContact O-N 3.46Å; E314-H317 VanDerWaalsContact O-N 3.12Å; H317-Q319 PolarHBondContact O-N 3.19Å; H317-L320 WeakPolarHBondContact O-CB 3.41Å; H317-L320 PolarHBondContact O-N 3.19Å; H317-Q321 WeakPolarHBondContact O-CG 3.38Å; H317-Q321 PolarHBondContact O-N 3.21Å
318Q89Confident84.3Confident109 Ų10980.5 Ų80.551%0.50938%0.383SS..Hα-helixtrans-57.8-49.3174.8-175.8-177.3-5.300111.6E314 K315 W316 L320 Q321 E322E314-Q318 PolarHBondContact O-N 3.37Å; K315-Q318 PolarHBondContact O-N 2.98Å; W316-Q318 VanDerWaalsContact C-N 3.33Å; W316-Q318 PolarHBondContact O-N 3.11Å; Q318-L320 VanDerWaalsContact C-N 3.3Å; Q318-L320 PolarHBondContact O-N 3.41Å; Q318-Q321 PolarHBondContact O-N 3.48Å; Q318-Q321 VanDerWaalsContact O-N 3.12Å; Q318-E322 HydrophobicContact CG-CG 4.46Å; Q318-E322 WeakPolarHBondContact CG-OE1 3.34Å; Q318-E322 PolarHBondContact NE2-OE1 3.36Å; Q318-E322 WeakPolarHBondContact O-CG 3.48Å; Q318-E322 PolarHBondContact O-N 3.39Å
319Q89.4Confident83.3Confident28 Ų2879.2 Ų79.213%0.13138%0.381CS..Hα-helixtrans-60.2-38.2177.6-73.2173.9-14.400112.5H307 K315 W316 H317 A323H307-Q319 PolarHBondContact NE2-OE1 3.49Å; K315-Q319 VanDerWaalsContact O-CG 3.29Å; K315-Q319 WeakPolarHBondContact O-CG 3.5Å; K315-Q319 PolarHBondContact O-N 3.34Å; W316-Q319 PolarHBondContact O-N 2.82Å; H317-Q319 PolarHBondContact O-N 3.19Å; Q319-A323 VanDerWaalsContact O-CB 3.26Å; Q319-A323 WeakPolarHBondContact O-CB 3.21Å; Q319-A323 PolarHBondContact O-N 2.77Å
320L86.2Confident82.8Confident8 Ų875.6 Ų75.64%0.04237%0.365CS..Hα-helixtrans-63.6-42.9173.8-84.3171.2000112.1L299 W316 H317 Q318 A323 K324 L330L299-L320 HydrophobicContact CD1-CD2 4.38Å; W316-L320 HydrophobicContact CD2-CD1 4.35Å; W316-L320 HydrophobicContact CD2-CG 4.38Å; W316-L320 HydrophobicContact CG-CD1 4.48Å; W316-L320 HydrophobicContact CH2-CD2 4.46Å; W316-L320 HydrophobicContact CZ2-CD1 3.93Å; W316-L320 HydrophobicContact CZ2-CD2 3.98Å; W316-L320 HydrophobicContact CZ2-CG 3.9Å; W316-L320 PolarHBondContact O-N 3Å; H317-L320 WeakPolarHBondContact O-CB 3.41Å; H317-L320 PolarHBondContact O-N 3.19Å; Q318-L320 VanDerWaalsContact C-N 3.3Å; Q318-L320 PolarHBondContact O-N 3.41Å; L320-A323 PolarHBondContact O-N 3.06Å; L320-K324 WeakPolarHBondContact O-CG 3.24Å; L320-K324 PolarHBondContact O-N 3.03Å; L320-L330 HydrophobicContact CD2-CD2 3.97Å
321Q85.5Confident82.3Confident107 Ų10774 Ų7450%0.536%0.358SS..Hα-helixtrans-68.1-40.4178.1-62-61.5-17.700111.8H317 Q318 A323 K324H317-Q321 WeakPolarHBondContact O-CG 3.38Å; H317-Q321 PolarHBondContact O-N 3.21Å; Q318-Q321 PolarHBondContact O-N 3.48Å; Q318-Q321 VanDerWaalsContact O-N 3.12Å; Q321-A323 VanDerWaalsContact C-N 3.27Å; Q321-A323 PolarHBondContact O-N 3.07Å; Q321-K324 VanDerWaalsContact NE2-NZ 3.14Å; Q321-K324 WeakPolarHBondContact O-CB 3.31Å; Q321-K324 PolarHBondContact O-N 3.1Å
322E86.1Confident82Confident106 Ų10675 Ų7550%0.49536%0.359SS..Hα-helixtrans-67-28.9176.5-70.9173-175.400113.1Q318 K324 K334Q318-E322 HydrophobicContact CG-CG 4.46Å; Q318-E322 WeakPolarHBondContact CG-OE1 3.34Å; Q318-E322 PolarHBondContact NE2-OE1 3.36Å; Q318-E322 WeakPolarHBondContact O-CG 3.48Å; Q318-E322 PolarHBondContact O-N 3.39Å; E322-K324 VanDerWaalsContact C-N 3.26Å; E322-K334 PolarHBondContact O-NZ 3.13Å; E322-K334 VanDerWaalsContact O-NZ 3.07Å
323A84.3Confident81.7Confident1 Ų177.3 Ų77.31%0.00837%0.371CS..THydrogen-bonded Turntrans-76.5-10.217200000112.7Q319 L320 Q321 L330 D331 K334Q319-A323 VanDerWaalsContact O-CB 3.26Å; Q319-A323 WeakPolarHBondContact O-CB 3.21Å; Q319-A323 PolarHBondContact O-N 2.77Å; L320-A323 PolarHBondContact O-N 3.06Å; Q321-A323 VanDerWaalsContact C-N 3.27Å; Q321-A323 PolarHBondContact O-N 3.07Å; A323-L330 HydrophobicContact CB-CD2 4.24Å; A323-D331 WeakPolarHBondContact O-CB 3.32Å; A323-D331 PolarHBondContact O-N 2.9Å; A323-K334 HydrophobicContact CB-CB 4.46Å
324K83.1Confident81.5Confident63 Ų6377.6 Ų77.627%0.27437%0.372SS..BIsolated β-bridgetrans-77.2131.2175.5-72.2170.2-174.1172.70111.2L320 Q321 E322 N328 Q329L320-K324 WeakPolarHBondContact O-CG 3.24Å; L320-K324 PolarHBondContact O-N 3.03Å; Q321-K324 VanDerWaalsContact NE2-NZ 3.14Å; Q321-K324 WeakPolarHBondContact O-CB 3.31Å; Q321-K324 PolarHBondContact O-N 3.1Å; E322-K324 VanDerWaalsContact C-N 3.26Å; K324-N328 WeakPolarHBondContact CD-OD1 3.35Å; K324-N328 WeakPolarHBondContact CG-O 3.25Å; K324-Q329 CarbonylContact C-O 3.58Å; K324-Q329 WeakPolarHBondContact CA-O 3.32Å
325T76.8Confident81.4Confident60 Ų6070.1 Ų70.137%0.36834%0.337SS..  trans-84.4169.3172.780.20000110.6R327 N328 Q329 D331T325-R327 PolarHBondContact O-N 2.65Å; T325-R327 PolarHBondContact OG1-N 2.98Å; T325-N328 VanDerWaalsContact O-CA 3.23Å; T325-N328 WeakPolarHBondContact O-CA 3.4Å; T325-N328 PolarHBondContact O-N 3Å; T325-Q329 PolarHBondContact N-O 3.38Å; T325-Q329 WeakPolarHBondContact OG1-CA 3.44Å; T325-D331 HydrophobicContact CG2-CB 4.06Å
326L68.1Low81.3Confident190 Ų19066.7 Ų66.7100%0.99532%0.323SS*.THydrogen-bonded Turntrans-55.5-23.4178-68.3167000113.9N328L326-N328 PolarHBondContact O-N 3.12Å
327R66.5Low81.1Confident190 Ų19069.1 Ų69.172%0.71735%0.345SS*.THydrogen-bonded Turntrans-89.921.9174.9-65.6-176.3-178.1-179.80.8112.5T325 Q329T325-R327 PolarHBondContact O-N 2.65Å; T325-R327 PolarHBondContact OG1-N 2.98Å; R327-Q329 HydrophobicContact CB-CG 4.01Å; R327-Q329 WeakPolarHBondContact O-CG 3.26Å; R327-Q329 PolarHBondContact O-N 2.97Å
328N66.6Low81.1Confident94 Ų9468.1 Ų68.150%0.50334%0.344SS..SBendtrans61.7-20.3-167.5-159.217.1000114.4R18 K324 T325 L326R18-N328 PolarHBondContact NH1-O 3.27Å; R18-N328 PolarHBondContact NH2-O 2.71Å; K324-N328 WeakPolarHBondContact CD-OD1 3.35Å; K324-N328 WeakPolarHBondContact CG-O 3.25Å; T325-N328 VanDerWaalsContact O-CA 3.23Å; T325-N328 WeakPolarHBondContact O-CA 3.4Å; T325-N328 PolarHBondContact O-N 3Å; L326-N328 PolarHBondContact O-N 3.12Å
329Q68.8Low81.1Confident61 Ų6163 Ų6329%0.28532%0.32SS..  trans3.1117.5154.519.8157-46.900120.9S16 R18 K324 T325 R327 D331S16-Q329 PolarHBondContact OG-NE2 3.2Å; R18-Q329 VanDerWaalsContact NH2-CA 3.31Å; K324-Q329 CarbonylContact C-O 3.58Å; K324-Q329 WeakPolarHBondContact CA-O 3.32Å; T325-Q329 PolarHBondContact N-O 3.38Å; T325-Q329 WeakPolarHBondContact OG1-CA 3.44Å; R327-Q329 HydrophobicContact CB-CG 4.01Å; R327-Q329 WeakPolarHBondContact O-CG 3.26Å; R327-Q329 PolarHBondContact O-N 2.97Å; Q329-D331 PolarHBondContact O-N 3.17Å
330L77.6Confident81.1Confident39 Ų3965.8 Ų65.820%0.20433%0.332CS..BIsolated β-bridgetrans-83.9117.5169-100159.1000109.3L299 L320 A323 Y332L299-L330 HydrophobicContact CD1-CD1 4.5Å; L320-L330 HydrophobicContact CD2-CD2 3.97Å; A323-L330 HydrophobicContact CB-CD2 4.24Å; L330-Y332 HydrophobicContact CB-CE2 4.21Å; L330-Y332 WeakPolarHBondContact O-CD2 3.38Å; L330-Y332 PolarHBondContact O-N 2.99Å
331D81.1Confident80.9Confident44 Ų4469.7 Ų69.724%0.23536%0.36CS..  trans-85.692.3172.9-173.4-8.8000109.9A323 T325 Q329 S333 K334 L335A323-D331 WeakPolarHBondContact O-CB 3.32Å; A323-D331 PolarHBondContact O-N 2.9Å; T325-D331 HydrophobicContact CG2-CB 4.06Å; Q329-D331 PolarHBondContact O-N 3.17Å; D331-S333 PolarHBondContact O-N 3.22Å; D331-S333 VanDerWaalsContact O-N 3.16Å; D331-S333 WeakPolarHBondContact OD1-CB 3.32Å; D331-S333 PolarHBondContact OD1-N 3.1Å; D331-S333 PolarHBondContact OD1-OG 3.22Å; D331-K334 HydrophobicContact CB-CD 4.37Å; D331-K334 HydrophobicContact CB-CG 4.49Å; D331-K334 PolarHBondContact O-N 3.12Å; D331-L335 PolarHBondContact O-N 3.48Å
332Y82.1Confident80.7Confident40 Ų4067.6 Ų67.616%0.15735%0.35CS..Hα-helixtrans-60.7-22.5179.5-70.1-86.4000113.1F297 L330 L335 L336F297-Y332 HydrophobicContact CD1-CD1 4.02Å; F297-Y332 AromaticContact CE1-CD1 3.9Å; F297-Y332 HydrophobicContact CE1-CD1 3.9Å; F297-Y332 HydrophobicContact CE2-CD1 4.46Å; F297-Y332 HydrophobicContact CG-CD1 4.36Å; F297-Y332 HydrophobicContact CZ-CD1 4.15Å; F297-Y332 VanDerWaalsContact O-CE1 3.25Å; F297-Y332 WeakPolarHBondContact O-CE1 3.34Å; L330-Y332 HydrophobicContact CB-CE2 4.21Å; L330-Y332 WeakPolarHBondContact O-CD2 3.38Å; L330-Y332 PolarHBondContact O-N 2.99Å; Y332-L335 PolarHBondContact O-N 3.29Å; Y332-L336 WeakPolarHBondContact O-CB 3.47Å; Y332-L336 PolarHBondContact O-N 3.35Å
333S82.7Confident80.9Confident79 Ų7969.8 Ų69.855%0.55236%0.358SS*.Hα-helixtrans-69.5-42-178.872.90000112.1D331 L336 A337D331-S333 PolarHBondContact O-N 3.22Å; D331-S333 VanDerWaalsContact O-N 3.16Å; D331-S333 WeakPolarHBondContact OD1-CB 3.32Å; D331-S333 PolarHBondContact OD1-N 3.1Å; D331-S333 PolarHBondContact OD1-OG 3.22Å; S333-L336 PolarHBondContact O-N 2.83Å; S333-A337 PolarHBondContact O-N 3.47Å; S333-A337 VanDerWaalsContact O-N 3.14Å
334K83.4Confident81.1Confident116 Ų11669.8 Ų69.850%0.50436%0.357SS..Hα-helixtrans-64.4-44.9174.4-69.3-178.9-179.5-174.50111.4E322 A323 D331 A337 A338E322-K334 PolarHBondContact O-NZ 3.13Å; E322-K334 VanDerWaalsContact O-NZ 3.07Å; A323-K334 HydrophobicContact CB-CB 4.46Å; D331-K334 HydrophobicContact CB-CD 4.37Å; D331-K334 HydrophobicContact CB-CG 4.49Å; D331-K334 PolarHBondContact O-N 3.12Å; K334-A337 PolarHBondContact O-N 2.96Å; K334-A338 PolarHBondContact O-N 3.25Å; K334-A338 VanDerWaalsContact O-N 3.07Å
335L85.9Confident81.5Confident1 Ų167.9 Ų67.91%0.00535%0.351CS..Hα-helixtrans-67-38.6-179.6-164.563.9000111.6F297 L299 W316 D331 Y332 A337 A338 V339F297-L335 HydrophobicContact CE2-CD2 3.95Å; F297-L335 HydrophobicContact CE2-CG 4.34Å; F297-L335 HydrophobicContact CZ-CB 3.97Å; F297-L335 HydrophobicContact CZ-CD2 3.81Å; F297-L335 HydrophobicContact CZ-CG 3.86Å; L299-L335 HydrophobicContact CD2-CD2 3.54Å; W316-L335 HydrophobicContact CH2-CD1 3.75Å; W316-L335 HydrophobicContact CH2-CD2 4Å; W316-L335 HydrophobicContact CH2-CG 4.23Å; W316-L335 HydrophobicContact CZ3-CD1 3.6Å; W316-L335 HydrophobicContact CZ3-CG 4.4Å; D331-L335 PolarHBondContact O-N 3.48Å; Y332-L335 PolarHBondContact O-N 3.29Å; L335-A337 VanDerWaalsContact C-N 3.32Å; L335-A337 PolarHBondContact O-N 2.92Å; L335-A338 PolarHBondContact O-N 2.93Å; L335-V339 VanDerWaalsContact O-CG2 3.31Å; L335-V339 WeakPolarHBondContact O-CG2 3.37Å; L335-V339 PolarHBondContact O-N 2.77Å
336L87.4Confident82.3Confident16 Ų1667.7 Ų67.78%0.08435%0.352CS..Hα-helixtrans-58.3-45.2173.7-168.378.1000111.1P285 F286 F297 Y332 S333 V339 K340P285-L336 HydrophobicContact CB-CD1 4.43Å; F286-L336 HydrophobicContact CD1-CD1 3.54Å; F286-L336 HydrophobicContact CD1-CG 4.47Å; F286-L336 HydrophobicContact CE1-CD1 3.54Å; F286-L336 HydrophobicContact CG-CD1 4.23Å; F286-L336 HydrophobicContact CZ-CD1 4.23Å; F297-L336 HydrophobicContact CD1-CD1 3.93Å; F297-L336 HydrophobicContact CE1-CB 3.96Å; F297-L336 HydrophobicContact CE1-CD1 3.76Å; Y332-L336 WeakPolarHBondContact O-CB 3.47Å; Y332-L336 PolarHBondContact O-N 3.35Å; S333-L336 PolarHBondContact O-N 2.83Å; L336-V339 PolarHBondContact O-N 3.41Å; L336-K340 HydrophobicContact CG-CD 4.32Å; L336-K340 WeakPolarHBondContact O-CB 3.26Å; L336-K340 VanDerWaalsContact O-CG 3.27Å; L336-K340 WeakPolarHBondContact O-CG 3.44Å; L336-K340 PolarHBondContact O-N 2.67Å
337A85.9Confident83.5Confident59 Ų5962.6 Ų62.649%0.48833%0.325SS..Hα-helixtrans-63-43.3178.200000112S333 K334 L335 K340 S341S333-A337 PolarHBondContact O-N 3.47Å; S333-A337 VanDerWaalsContact O-N 3.14Å; K334-A337 PolarHBondContact O-N 2.96Å; L335-A337 VanDerWaalsContact C-N 3.32Å; L335-A337 PolarHBondContact O-N 2.92Å; A337-K340 PolarHBondContact O-N 3.01Å; A337-S341 PolarHBondContact O-N 2.99Å
338A87.5Confident84.8Confident20 Ų2053.5 Ų53.517%0.16529%0.291CS..Hα-helixtrans-63.2-42.3177.500000112.7H307 K334 L335 K340 S341H307-A338 PolarHBondContact CE1-O 3.31Å; K334-A338 PolarHBondContact O-N 3.25Å; K334-A338 VanDerWaalsContact O-N 3.07Å; L335-A338 PolarHBondContact O-N 2.93Å; A338-K340 VanDerWaalsContact C-N 3.34Å; A338-S341 PolarHBondContact O-N 3.26Å; A338-S341 PolarHBondContact O-OG 3.4Å
339V89Confident86.1Confident0 Ų050 Ų500%027%0.273CS..Hα-helixtrans-68.9-35.5177.81740000111.2F286 P303 V304 H307 L335 L336 V345F286-V339 HydrophobicContact CD1-CB 4.4Å; F286-V339 HydrophobicContact CD1-CG1 3.89Å; F286-V339 HydrophobicContact CE1-CB 3.78Å; F286-V339 HydrophobicContact CE1-CG1 3.39Å; F286-V339 HydrophobicContact CE1-CG2 4.46Å; F286-V339 HydrophobicContact CZ-CG1 4.09Å; P303-V339 HydrophobicContact CB-CG1 4.04Å; V304-V339 HydrophobicContact CG2-CG2 4.39Å; H307-V339 HydrophobicContact CB-CG1 4.18Å; H307-V339 HydrophobicContact CB-CG2 4.17Å; L335-V339 VanDerWaalsContact O-CG2 3.31Å; L335-V339 WeakPolarHBondContact O-CG2 3.37Å; L335-V339 PolarHBondContact O-N 2.77Å; L336-V339 PolarHBondContact O-N 3.41Å; V339-V345 HydrophobicContact CG1-CG2 4.09Å
340K87.6Confident87.3Confident88 Ų8851 Ų5138%0.38328%0.281SS..Hα-helixtrans-70.2-28176.1-78.5-177.7174.3-159.70113.8F286 L336 A337 A338 E342F286-K340 HydrophobicContact CD1-CG 4.27Å; F286-K340 WeakPolarHBondContact O-CE 3.21Å; F286-K340 PolarHBondContact O-NZ 3.29Å; L336-K340 HydrophobicContact CG-CD 4.32Å; L336-K340 WeakPolarHBondContact O-CB 3.26Å; L336-K340 VanDerWaalsContact O-CG 3.27Å; L336-K340 WeakPolarHBondContact O-CG 3.44Å; L336-K340 PolarHBondContact O-N 2.67Å; A337-K340 PolarHBondContact O-N 3.01Å; A338-K340 VanDerWaalsContact C-N 3.34Å; K340-E342 VanDerWaalsContact C-N 3.27Å; K340-E342 PolarHBondContact O-N 3.43Å
341S82.6Confident88.1Confident90 Ų9050.7 Ų50.763%0.62928%0.279SS*.Hα-helixtrans-73.7-20.3-178.660.40000113.5A337 A338A337-S341 PolarHBondContact O-N 2.99Å; A338-S341 PolarHBondContact O-N 3.26Å; A338-S341 PolarHBondContact O-OG 3.4Å
342E80.8Confident88.8Confident63 Ų6348.6 Ų48.629%0.29427%0.268SS..SBendtrans-108.5174.9-176.7-62-75.7-170.600111.6H307 V311 K315 K340 G344H307-E342 VanDerWaalsContact CE1-CG 3.46Å; H307-E342 WeakPolarHBondContact CE1-CG 3.25Å; H307-E342 WeakPolarHBondContact ND1-CB 3.41Å; H307-E342 WeakPolarHBondContact ND1-CG 3.37Å; V311-E342 HydrophobicContact CG1-CG 4.08Å; K315-E342 IonicContact NZ-OE1 3.93Å; K315-E342 PolarHBondContact NZ-OE1 3.13Å; K340-E342 VanDerWaalsContact C-N 3.27Å; K340-E342 PolarHBondContact O-N 3.43Å; E342-G344 PolarHBondContact O-N 3.07Å; E342-G344 VanDerWaalsContact O-N 3.14Å
343K90.1Very high89.4Confident152 Ų15252.1 Ų52.166%0.66128%0.28SS*.THydrogen-bonded Turntrans-73.41-176.4-64.6-177.6179.7178.90115.3I310 V345 S346 L347I310-K343 HydrophobicContact CD1-CB 4Å; K343-V345 VanDerWaalsContact C-N 3.35Å; K343-V345 PolarHBondContact O-N 2.77Å; K343-S346 WeakPolarHBondContact CA-OG 3.44Å; K343-S346 PolarHBondContact O-N 3.46Å; K343-S346 PolarHBondContact O-OG 2.94Å; K343-L347 WeakPolarHBondContact O-CG 3.27Å; K343-L347 PolarHBondContact O-N 3.34Å
344G89.6Confident90Very high0 Ų053.9 Ų53.90%028%0.276CS..Hα-helixtrans-59.5-42.7-176.900000113E342 A348E342-G344 PolarHBondContact O-N 3.07Å; E342-G344 VanDerWaalsContact O-N 3.14Å; G344-A348 PolarHBondContact O-N 3.17Å
345V91.9Very high90.7Very high24 Ų2448.5 Ų48.515%0.14525%0.253CS..Hα-helixtrans-66.1-45.1176.9-178.70000111.2L283 F286 P303 V339 K343 L347 A348 V349L283-V345 HydrophobicContact CD2-CG1 3.99Å; F286-V345 HydrophobicContact CB-CG1 4.15Å; F286-V345 HydrophobicContact CB-CG2 4.01Å; F286-V345 HydrophobicContact CD1-CG2 3.97Å; F286-V345 HydrophobicContact CG-CG2 4.11Å; P303-V345 HydrophobicContact CB-CG2 4.19Å; V339-V345 HydrophobicContact CG1-CG2 4.09Å; K343-V345 VanDerWaalsContact C-N 3.35Å; K343-V345 PolarHBondContact O-N 2.77Å; V345-L347 PolarHBondContact O-N 3.23Å; V345-A348 PolarHBondContact O-N 2.95Å; V345-V349 WeakPolarHBondContact O-CG2 3.46Å; V345-V349 PolarHBondContact O-N 3.14Å
346S92.4Very high91.1Very high55 Ų5548.7 Ų48.739%0.38525%0.254SS..Hα-helixtrans-62.3-41.517946.60000112.4K343 A348 V349 D350K343-S346 WeakPolarHBondContact CA-OG 3.44Å; K343-S346 PolarHBondContact O-N 3.46Å; K343-S346 PolarHBondContact O-OG 2.94Å; S346-A348 VanDerWaalsContact C-N 3.34Å; S346-A348 PolarHBondContact O-N 3.16Å; S346-V349 PolarHBondContact O-N 3.4Å; S346-D350 PolarHBondContact O-N 3.46Å
347L93.2Very high91.6Very high83 Ų8351.7 Ų51.744%0.43527%0.27SS..Hα-helixtrans-62.1-41.8176.8-71176.7000111.8F306 I310 K343 V345 D350 L351F306-L347 HydrophobicContact CB-CD1 4.36Å; F306-L347 HydrophobicContact CD2-CB 3.95Å; F306-L347 HydrophobicContact CG-CB 4.43Å; I310-L347 HydrophobicContact CD1-CD1 3.88Å; K343-L347 WeakPolarHBondContact O-CG 3.27Å; K343-L347 PolarHBondContact O-N 3.34Å; V345-L347 PolarHBondContact O-N 3.23Å; L347-D350 PolarHBondContact O-N 3.06Å; L347-L351 WeakPolarHBondContact O-CB 3.12Å; L347-L351 PolarHBondContact O-N 3.33Å
348A93.8Very high92.1Very high0 Ų053.5 Ų53.50%026%0.264CS..Hα-helixtrans-65.4-37.3176.300000112.6L279 L283 A302 P303 F306 G344 V345 S346 C352L279-A348 HydrophobicContact CD2-CB 4.32Å; L283-A348 HydrophobicContact CD1-CB 4.31Å; L283-A348 HydrophobicContact CD2-CB 3.81Å; L283-A348 HydrophobicContact CG-CB 4.16Å; A302-A348 HydrophobicContact CB-CB 4.21Å; P303-A348 HydrophobicContact CB-CB 4.47Å; P303-A348 HydrophobicContact CG-CB 3.83Å; F306-A348 HydrophobicContact CD2-CB 3.96Å; F306-A348 HydrophobicContact CE2-CB 3.95Å; G344-A348 PolarHBondContact O-N 3.17Å; V345-A348 PolarHBondContact O-N 2.95Å; S346-A348 VanDerWaalsContact C-N 3.34Å; S346-A348 PolarHBondContact O-N 3.16Å; A348-C352 WeakPolarHBondContact O-CB 3.21Å; A348-C352 PolarHBondContact O-N 3.47Å
349V93.8Very high92.6Very high19 Ų1952.6 Ų52.612%0.11526%0.256CS..Hα-helixtrans-63.6-47174.1169.80000111L283 V345 S346 L351 C352 R353 F385L283-V349 HydrophobicContact CD1-CG2 3.92Å; L283-V349 HydrophobicContact CD2-CG2 3.77Å; V345-V349 WeakPolarHBondContact O-CG2 3.46Å; V345-V349 PolarHBondContact O-N 3.14Å; S346-V349 PolarHBondContact O-N 3.4Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 3.41Å; V349-C352 WeakPolarHBondContact O-CB 3.39Å; V349-C352 PolarHBondContact O-N 3.3Å; V349-R353 VanDerWaalsContact CG1-CZ 3.46Å; V349-R353 WeakPolarHBondContact O-CG 3.45Å; V349-R353 PolarHBondContact O-N 2.98Å; V349-F385 HydrophobicContact CG1-CE2 4.03Å
350D94.7Very high92.9Very high84 Ų8454 Ų5445%0.44926%0.264SS..Hα-helixtrans-65.8-37.9180-69.6-26.2000112S346 L347 C352 R353 Y354S346-D350 PolarHBondContact O-N 3.46Å; L347-D350 PolarHBondContact O-N 3.06Å; D350-C352 VanDerWaalsContact C-N 3.33Å; D350-C352 PolarHBondContact O-N 3.2Å; D350-R353 WeakPolarHBondContact O-CB 3.3Å; D350-R353 PolarHBondContact O-N 2.89Å; D350-R353 IonicContact OD1-CZ 3.01Å; D350-R353 IonicContact OD1-NH1 3.23Å; D350-R353 PolarHBondContact OD1-NH1 2.86Å; D350-Y354 PolarHBondContact O-N 3.3Å
351L95.4Very high93.4Very high32 Ų3253.9 Ų53.917%0.16827%0.265CS..Hα-helixtrans-66.5-35.9174.3-16964.7000112.3W233 E234 L279 F306 L347 V349 Y354 H355W233-L351 HydrophobicContact CE3-CD2 4.11Å; W233-L351 HydrophobicContact CZ3-CD2 4.14Å; E234-L351 HydrophobicContact CG-CD2 4Å; E234-L351 WeakPolarHBondContact OE1-CD1 3.17Å; L279-L351 HydrophobicContact CD1-CB 3.99Å; L279-L351 HydrophobicContact CD1-CD2 3.96Å; L279-L351 HydrophobicContact CD1-CG 3.72Å; L279-L351 HydrophobicContact CD2-CD2 4.21Å; F306-L351 HydrophobicContact CE2-CD2 4.18Å; F306-L351 HydrophobicContact CZ-CD2 3.73Å; L347-L351 WeakPolarHBondContact O-CB 3.12Å; L347-L351 PolarHBondContact O-N 3.33Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 3.41Å; L351-Y354 HydrophobicContact CD1-CD1 4.03Å; L351-Y354 WeakPolarHBondContact O-CB 3.39Å; L351-Y354 PolarHBondContact O-N 3.3Å; L351-H355 PolarHBondContact O-N 3.47Å
352C94.6Very high94.1Very high0 Ų049.9 Ų49.90%024%0.237CC..Hα-helixtrans-64.9-42.8176.3-171.20000111G276 L279 L283 A348 V349 D350 Y354 H355 S356 F385G276-C352 PolarHBondContact O-SG 3Å; G276-C352 VanDerWaalsContact O-SG 3.4Å; L279-C352 HydrophobicContact CB-CB 3.76Å; L279-C352 HydrophobicContact CD1-CB 4.09Å; L279-C352 HydrophobicContact CG-CB 4.5Å; L283-C352 HydrophobicContact CD1-CB 4.27Å; A348-C352 WeakPolarHBondContact O-CB 3.21Å; A348-C352 PolarHBondContact O-N 3.47Å; V349-C352 WeakPolarHBondContact O-CB 3.39Å; V349-C352 PolarHBondContact O-N 3.3Å; D350-C352 VanDerWaalsContact C-N 3.33Å; D350-C352 PolarHBondContact O-N 3.2Å; C352-Y354 VanDerWaalsContact C-N 3.35Å; C352-Y354 PolarHBondContact O-N 2.99Å; C352-H355 PolarHBondContact O-N 3.07Å; C352-S356 WeakPolarHBondContact O-CB 3.39Å; C352-S356 PolarHBondContact O-N 3.38Å; C352-F385 HydrophobicContact CB-CZ 3.83Å
353R94.9Very high94.9Very high113 Ų11346.9 Ų46.943%0.42622%0.223SC..Hα-helixtrans-59.2-45.6172.5-70.1169.8-178.2155.7-3.2111.6V349 D350 H355 S356 N357 N383V349-R353 VanDerWaalsContact CG1-CZ 3.46Å; V349-R353 WeakPolarHBondContact O-CG 3.45Å; V349-R353 PolarHBondContact O-N 2.98Å; D350-R353 WeakPolarHBondContact O-CB 3.3Å; D350-R353 PolarHBondContact O-N 2.89Å; D350-R353 IonicContact OD1-CZ 3.01Å; D350-R353 IonicContact OD1-NH1 3.23Å; D350-R353 PolarHBondContact OD1-NH1 2.86Å; R353-H355 PolarHBondContact O-N 3.43Å; R353-S356 PolarHBondContact O-N 3.15Å; R353-N357 VanDerWaalsContact O-CG 3.32Å; R353-N357 PolarHBondContact O-N 3.26Å; R353-N357 PolarHBondContact O-ND2 3.26Å; R353-N383 WeakPolarHBondContact CG-OD1 3.22Å
354Y96.5Very high95.1Very high117 Ų11745.3 Ų45.346%0.45922%0.218SC..Hα-helixtrans-55.6-52.3177.9169.1-105.8000111.5D350 L351 C352 S356 N357 R358D350-Y354 PolarHBondContact O-N 3.3Å; L351-Y354 HydrophobicContact CD1-CD1 4.03Å; L351-Y354 WeakPolarHBondContact O-CB 3.39Å; L351-Y354 PolarHBondContact O-N 3.3Å; C352-Y354 VanDerWaalsContact C-N 3.35Å; C352-Y354 PolarHBondContact O-N 2.99Å; Y354-S356 PolarHBondContact O-N 3.1Å; Y354-N357 PolarHBondContact O-N 3.32Å; Y354-R358 HydrophobicContact CD2-CG 4.13Å; Y354-R358 HydrophobicContact CE1-CG 4.2Å; Y354-R358 HydrophobicContact CE2-CG 3.71Å; Y354-R358 VanDerWaalsContact O-CG 3.3Å; Y354-R358 WeakPolarHBondContact O-CG 3.29Å; Y354-R358 PolarHBondContact O-N 3.43Å
355H97.1Very high95.3Very high3 Ų348.5 Ų48.51%0.01424%0.244CC..Hα-helixtrans-66.7-37.7179.1-72.2-35.5000113.4E234 H272 L275 L351 C352 R353 N357 R358 A359E234-H355 IonicContact OE1-CE1 3.33Å; E234-H355 PolarHBondContact OE1-CE1 3.22Å; E234-H355 IonicContact OE1-NE2 3.65Å; E234-H355 PolarHBondContact OE1-NE2 2.87Å; E234-H355 VanDerWaalsContact OE1-NE2 3.09Å; H272-H355 HydrophobicContact CB-CB 4.43Å; H272-H355 WeakPolarHBondContact CB-O 3.32Å; H272-H355 AromaticContact CE1-ND1 3.76Å; H272-H355 AromaticContact ND1-CE1 3.81Å; H272-H355 AromaticContact ND1-CG 3.95Å; H272-H355 AromaticContact ND1-ND1 3.06Å; H272-H355 PolarHBondContact ND1-ND1 2.97Å; H272-H355 WeakPolarHBondContact O-CB 3.31Å; L275-H355 WeakPolarHBondContact CB-CD2 3.32Å; L351-H355 PolarHBondContact O-N 3.47Å; C352-H355 PolarHBondContact O-N 3.07Å; R353-H355 PolarHBondContact O-N 3.43Å; H355-N357 VanDerWaalsContact C-N 3.34Å; H355-N357 PolarHBondContact O-N 3.22Å; H355-R358 PolarHBondContact O-N 3.18Å; H355-A359 WeakPolarHBondContact O-CB 3.23Å; H355-A359 PolarHBondContact O-N 3.19Å
356S94.9Very high95.4Very high4 Ų447.9 Ų47.93%0.02824%0.24CC..Hα-helixtrans-57.5-47.6173.4178.50000111.3C352 R353 Y354 A359 L360 A379C352-S356 WeakPolarHBondContact O-CB 3.39Å; C352-S356 PolarHBondContact O-N 3.38Å; R353-S356 PolarHBondContact O-N 3.15Å; Y354-S356 PolarHBondContact O-N 3.1Å; S356-A359 PolarHBondContact O-N 3.4Å; S356-L360 WeakPolarHBondContact O-CG 3.47Å; S356-L360 PolarHBondContact O-N 3.32Å; S356-A379 PolarHBondContact OG-O 3.16Å
357N96.4Very high95.5Very high80 Ų8049 Ų4943%0.42825%0.246SC..Hα-helixtrans-64.5-42.6178.1-69.2-17.6000112.5R353 Y354 H355 A359 L360 E361R353-N357 VanDerWaalsContact O-CG 3.32Å; R353-N357 PolarHBondContact O-N 3.26Å; R353-N357 PolarHBondContact O-ND2 3.26Å; Y354-N357 PolarHBondContact O-N 3.32Å; H355-N357 VanDerWaalsContact C-N 3.34Å; H355-N357 PolarHBondContact O-N 3.22Å; N357-A359 VanDerWaalsContact C-N 3.31Å; N357-A359 PolarHBondContact O-N 3.13Å; N357-L360 WeakPolarHBondContact O-CB 3.39Å; N357-L360 PolarHBondContact O-N 2.89Å; N357-E361 WeakPolarHBondContact O-CG 3.23Å; N357-E361 PolarHBondContact O-N 3.38Å
358R98Very high95.6Very high97 Ų9749.5 Ų49.537%0.36626%0.256SS..Hα-helixtrans-63.4-35.5176.5-69.1-67.197.5160.911.4112.7H272 Y354 H355 E361 A362H272-R358 HydrophobicContact CB-CB 4.15Å; H272-R358 VanDerWaalsContact CD2-CB 3.48Å; H272-R358 WeakPolarHBondContact CD2-CB 3.09Å; Y354-R358 HydrophobicContact CD2-CG 4.13Å; Y354-R358 HydrophobicContact CE1-CG 4.2Å; Y354-R358 HydrophobicContact CE2-CG 3.71Å; Y354-R358 VanDerWaalsContact O-CG 3.3Å; Y354-R358 WeakPolarHBondContact O-CG 3.29Å; Y354-R358 PolarHBondContact O-N 3.43Å; H355-R358 PolarHBondContact O-N 3.18Å; R358-E361 IonicContact CZ-OE1 3.65Å; R358-E361 VanDerWaalsContact CZ-OE1 3.22Å; R358-E361 IonicContact CZ-OE2 3.09Å; R358-E361 IonicContact NE-OE1 2.61Å; R358-E361 PolarHBondContact NE-OE1 2.85Å; R358-E361 IonicContact NE-OE2 2.6Å; R358-E361 PolarHBondContact NE-OE2 2.83Å; R358-E361 VanDerWaalsContact NE-OE2 3.16Å; R358-E361 IonicContact NH1-OE2 2.77Å; R358-E361 PolarHBondContact NH1-OE2 2.96Å; R358-E361 IonicContact NH2-OE1 2.72Å; R358-E361 PolarHBondContact NH2-OE1 3.02Å; R358-E361 IonicContact NH2-OE2 3.05Å; R358-E361 PolarHBondContact NH2-OE2 2.74Å; R358-A362 PolarHBondContact O-N 2.85Å; R358-A362 VanDerWaalsContact O-N 3.14Å
359A97.3Very high95.7Very high0 Ų051.2 Ų51.20%027%0.268CS..Hα-helixtrans-65.5-44.3172.800000111Y269 H272 L273 H355 S356 N357 E361 A362 I363 A379Y269-A359 HydrophobicContact CD2-CB 4.1Å; Y269-A359 VanDerWaalsContact CD2-O 3.32Å; Y269-A359 WeakPolarHBondContact CD2-O 3.21Å; Y269-A359 HydrophobicContact CE2-CB 4.22Å; H272-A359 HydrophobicContact CB-CB 3.93Å; L273-A359 HydrophobicContact CB-CB 4.5Å; H355-A359 WeakPolarHBondContact O-CB 3.23Å; H355-A359 PolarHBondContact O-N 3.19Å; S356-A359 PolarHBondContact O-N 3.4Å; N357-A359 VanDerWaalsContact C-N 3.31Å; N357-A359 PolarHBondContact O-N 3.13Å; A359-E361 PolarHBondContact O-N 3.4Å; A359-A362 PolarHBondContact O-N 2.53Å; A359-I363 PolarHBondContact O-N 3.38Å; A359-I363 VanDerWaalsContact O-N 3.12Å; A359-A379 HydrophobicContact CB-CB 4.13Å
360L96.5Very high95.7Very high31 Ų3157.2 Ų57.216%0.16230%0.295CS..Hα-helixtrans-58.9-44.8176.6-70.6172.3000112.4S356 N357 A362 I363 Q364 E376 A379S356-L360 WeakPolarHBondContact O-CG 3.47Å; S356-L360 PolarHBondContact O-N 3.32Å; N357-L360 WeakPolarHBondContact O-CB 3.39Å; N357-L360 PolarHBondContact O-N 2.89Å; L360-A362 VanDerWaalsContact C-N 3.35Å; L360-A362 PolarHBondContact O-N 3.02Å; L360-I363 VanDerWaalsContact O-CG2 3.29Å; L360-I363 WeakPolarHBondContact O-CG2 3.48Å; L360-I363 PolarHBondContact O-N 3.49Å; L360-Q364 VanDerWaalsContact O-CG 3.26Å; L360-Q364 WeakPolarHBondContact O-CG 3.46Å; L360-Q364 PolarHBondContact O-N 3.1Å; L360-Q364 VanDerWaalsContact O-N 3.12Å; L360-E376 HydrophobicContact CD2-CB 3.93Å; L360-E376 HydrophobicContact CD2-CG 4.16Å; L360-E376 WeakPolarHBondContact CD2-O 3.46Å; L360-A379 HydrophobicContact CD2-CB 3.87Å; L360-A379 HydrophobicContact CG-CB 4.13Å
361E97.1Very high95.7Very high84 Ų8453.3 Ų53.339%0.39327%0.274SS..Hα-helixtrans-63.7-40.1177.6-72168.8-14500112.6N357 R358 A359 I363 Q364N357-E361 WeakPolarHBondContact O-CG 3.23Å; N357-E361 PolarHBondContact O-N 3.38Å; R358-E361 IonicContact CZ-OE1 3.65Å; R358-E361 VanDerWaalsContact CZ-OE1 3.22Å; R358-E361 IonicContact CZ-OE2 3.09Å; R358-E361 IonicContact NE-OE1 2.61Å; R358-E361 PolarHBondContact NE-OE1 2.85Å; R358-E361 IonicContact NE-OE2 2.6Å; R358-E361 PolarHBondContact NE-OE2 2.83Å; R358-E361 VanDerWaalsContact NE-OE2 3.16Å; R358-E361 IonicContact NH1-OE2 2.77Å; R358-E361 PolarHBondContact NH1-OE2 2.96Å; R358-E361 IonicContact NH2-OE1 2.72Å; R358-E361 PolarHBondContact NH2-OE1 3.02Å; R358-E361 IonicContact NH2-OE2 3.05Å; R358-E361 PolarHBondContact NH2-OE2 2.74Å; A359-E361 PolarHBondContact O-N 3.4Å; E361-I363 VanDerWaalsContact C-N 3.32Å; E361-I363 PolarHBondContact O-N 3.07Å; E361-Q364 PolarHBondContact O-N 3.19Å
362A97.7Very high95.8Very high6 Ų654 Ų545%0.0528%0.275CS..Hα-helixtrans-63.9-37.7178.300000112.2L268 R358 A359 L360L268-A362 HydrophobicContact CB-CB 4.14Å; R358-A362 PolarHBondContact O-N 2.85Å; R358-A362 VanDerWaalsContact O-N 3.14Å; A359-A362 PolarHBondContact O-N 2.53Å; L360-A362 VanDerWaalsContact C-N 3.35Å; L360-A362 PolarHBondContact O-N 3.02Å
363I96.7Very high95.9Very high0 Ų056.1 Ų56.10%029%0.29CS..Hα-helixtrans-81.1-24-177.6-162.460.5000113.5L105 Y269 A359 L360 E361 A365 F366 R372 L375 E376L105-I363 HydrophobicContact CD1-CD1 3.42Å; L105-I363 VanDerWaalsContact CD1-CD1 3.42Å; Y269-I363 HydrophobicContact CD2-CB 3.7Å; Y269-I363 HydrophobicContact CD2-CD1 4.46Å; Y269-I363 HydrophobicContact CD2-CG1 4.34Å; Y269-I363 HydrophobicContact CD2-CG2 4.3Å; Y269-I363 HydrophobicContact CE2-CB 3.93Å; Y269-I363 HydrophobicContact CE2-CG1 4.32Å; Y269-I363 HydrophobicContact CE2-CG2 4.18Å; A359-I363 PolarHBondContact O-N 3.38Å; A359-I363 VanDerWaalsContact O-N 3.12Å; L360-I363 VanDerWaalsContact O-CG2 3.29Å; L360-I363 WeakPolarHBondContact O-CG2 3.48Å; L360-I363 PolarHBondContact O-N 3.49Å; E361-I363 VanDerWaalsContact C-N 3.32Å; E361-I363 PolarHBondContact O-N 3.07Å; I363-A365 PolarHBondContact O-N 2.97Å; I363-F366 HydrophobicContact CD1-CB 4.35Å; I363-F366 HydrophobicContact CD1-CD2 3.75Å; I363-F366 HydrophobicContact CD1-CE2 4.29Å; I363-F366 HydrophobicContact CD1-CG 4.12Å; I363-F366 WeakPolarHBondContact O-CB 3.17Å; I363-F366 PolarHBondContact O-N 3.26Å; I363-R372 HydrophobicContact CG1-CG 3.85Å; I363-R372 WeakPolarHBondContact O-CD 3.37Å; I363-L375 HydrophobicContact CD1-CB 4.38Å; I363-L375 HydrophobicContact CD1-CD1 3.53Å; I363-L375 HydrophobicContact CG1-CB 3.94Å; I363-L375 HydrophobicContact CG1-CD1 4Å; I363-E376 HydrophobicContact CG2-CG 3.7Å
364Q95.5Very high95.8Very high120 Ų12051.1 Ų51.156%0.56127%0.272SS*.Hα-helixtrans-61.9-24.5178.4-81.3171.6-3.200113.9L360 E361 F366L360-Q364 VanDerWaalsContact O-CG 3.26Å; L360-Q364 WeakPolarHBondContact O-CG 3.46Å; L360-Q364 PolarHBondContact O-N 3.1Å; L360-Q364 VanDerWaalsContact O-N 3.12Å; E361-Q364 PolarHBondContact O-N 3.19Å; Q364-F366 PolarHBondContact O-N 3.33Å
365A92.5Very high95.8Very high66 Ų6645.6 Ų45.655%0.54525%0.251SS..THydrogen-bonded Turntrans-70.4-15175.300000113.7L265 I363L265-A365 HydrophobicContact CD1-CB 3.6Å; L265-A365 HydrophobicContact CD2-CB 4.47Å; I363-A365 PolarHBondContact O-N 2.97Å
366F95.3Very high95.7Very high12 Ų1247.5 Ų47.55%0.05326%0.26CS..SBendtrans-84.6155.2177.1-69.8-97.9000111.8L105 A109 M253 L265 A266 I363 Q364 R372L105-F366 HydrophobicContact CD1-CE1 4.47Å; L105-F366 HydrophobicContact CD1-CE2 4.36Å; L105-F366 HydrophobicContact CD1-CZ 4.23Å; A109-F366 HydrophobicContact CB-CD1 3.72Å; A109-F366 HydrophobicContact CB-CE1 3.77Å; M253-F366 HydrophobicContact SD-CE1 3.8Å; M253-F366 HydrophobicContact SD-CZ 4.39Å; L265-F366 HydrophobicContact CB-CE2 3.84Å; L265-F366 HydrophobicContact CB-CZ 4.26Å; A266-F366 HydrophobicContact CB-CZ 4.16Å; I363-F366 HydrophobicContact CD1-CB 4.35Å; I363-F366 HydrophobicContact CD1-CD2 3.75Å; I363-F366 HydrophobicContact CD1-CE2 4.29Å; I363-F366 HydrophobicContact CD1-CG 4.12Å; I363-F366 WeakPolarHBondContact O-CB 3.17Å; I363-F366 PolarHBondContact O-N 3.26Å; Q364-F366 PolarHBondContact O-N 3.33Å; F366-R372 WeakPolarHBondContact O-CD 3.5Å; F366-R372 PolarHBondContact O-NH1 2.8Å
367P94.3Very high95.6Very high79 Ų7951.8 Ų51.851%0.51328%0.282SS..PPolyproline II helixtrans-55141.6179.2-26.534.5000113.9S369 R372P367-S369 PolarHBondContact O-N 2.97Å; P367-S369 PolarHBondContact O-OG 3.47Å; P367-R372 WeakPolarHBondContact O-CD 3.27Å
368S95.1Very high95.3Very high93 Ų9348.1 Ų48.165%0.6526%0.262SS*.PPolyproline II helixtrans-61.7122.7176.7-176.10000111R372S368-R372 VanDerWaalsContact CA-CZ 3.4Å; S368-R372 VanDerWaalsContact CA-NH1 3.33Å; S368-R372 PolarHBondContact OG-NH2 3.31Å
369S95.5Very high95Very high36 Ų3643.5 Ų43.525%0.25225%0.245SC..SBendtrans-159166.2-179.359.90000110.7P367 A371 R372 S373P367-S369 PolarHBondContact O-N 2.97Å; P367-S369 PolarHBondContact O-OG 3.47Å; S369-A371 PolarHBondContact O-N 2.8Å; S369-R372 PolarHBondContact O-N 2.74Å; S369-R372 WeakPolarHBondContact OG-CB 3.4Å; S369-R372 PolarHBondContact OG-N 3.03Å; S369-R372 VanDerWaalsContact OG-N 3.08Å; S369-S373 PolarHBondContact O-N 3.35Å; S369-S373 PolarHBondContact O-OG 3.29Å
370E94.5Very high94.7Very high144 Ų14445.6 Ų45.667%0.67326%0.26SS*.Hα-helixtrans-58.6-37.9170.3-65.9-17716900111.4I45 S373 A374I45-E370 HydrophobicContact CD1-CB 4.3Å; I45-E370 HydrophobicContact CG2-CB 4.4Å; E370-S373 PolarHBondContact O-N 3.47Å; E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.27Å
371A94.7Very high94.3Very high2 Ų244.6 Ų44.62%0.01726%0.256CS..Hα-helixtrans-65-43.2177.800000112.2I45 L104 K107 A108 S369 A374 L375I45-A371 HydrophobicContact CG2-CB 4.02Å; L104-A371 HydrophobicContact CD2-CB 4.36Å; K107-A371 HydrophobicContact CB-CB 3.92Å; K107-A371 HydrophobicContact CD-CB 4.07Å; K107-A371 HydrophobicContact CG-CB 4.02Å; A108-A371 HydrophobicContact CB-CB 3.97Å; S369-A371 PolarHBondContact O-N 2.8Å; A371-A374 PolarHBondContact O-N 2.95Å; A371-L375 WeakPolarHBondContact O-CG 3.46Å; A371-L375 PolarHBondContact O-N 3.16Å
372R96.4Very high93.6Very high47 Ų4740.9 Ų40.918%0.17724%0.239CC..Hα-helixtrans-60.7-46.1173.6-163.2-170.573.2-166.3-6.4111.2A108 I363 F366 P367 S368 S369 A374 L375 E376A108-R372 HydrophobicContact CB-CB 4.19Å; I363-R372 HydrophobicContact CG1-CG 3.85Å; I363-R372 WeakPolarHBondContact O-CD 3.37Å; F366-R372 WeakPolarHBondContact O-CD 3.5Å; F366-R372 PolarHBondContact O-NH1 2.8Å; P367-R372 WeakPolarHBondContact O-CD 3.27Å; S368-R372 VanDerWaalsContact CA-CZ 3.4Å; S368-R372 VanDerWaalsContact CA-NH1 3.33Å; S368-R372 PolarHBondContact OG-NH2 3.31Å; S369-R372 PolarHBondContact O-N 2.74Å; S369-R372 WeakPolarHBondContact OG-CB 3.4Å; S369-R372 PolarHBondContact OG-N 3.03Å; S369-R372 VanDerWaalsContact OG-N 3.08Å; R372-A374 VanDerWaalsContact C-N 3.29Å; R372-A374 PolarHBondContact O-N 3.24Å; R372-L375 WeakPolarHBondContact O-CB 3.35Å; R372-L375 PolarHBondContact O-N 3.42Å; R372-L375 VanDerWaalsContact O-N 3.14Å; R372-E376 IonicContact CZ-OE1 3.72Å; R372-E376 IonicContact NE-OE1 2.92Å; R372-E376 PolarHBondContact NE-OE1 2.97Å; R372-E376 IonicContact NH2-OE1 3.92Å; R372-E376 WeakPolarHBondContact O-CG 3.34Å; R372-E376 PolarHBondContact O-N 2.78Å
373S96.3Very high92.7Very high45 Ų4542.9 Ų42.932%0.31525%0.249SC..Hα-helixtrans-61.4-37.4178.4-52.70000111.9S369 E370 E376 N377S369-S373 PolarHBondContact O-N 3.35Å; S369-S373 PolarHBondContact O-OG 3.29Å; E370-S373 PolarHBondContact O-N 3.47Å; S373-E376 PolarHBondContact O-N 2.66Å; S373-N377 WeakPolarHBondContact O-CB 3.42Å; S373-N377 PolarHBondContact O-N 3.42Å; S373-N377 PolarHBondContact O-ND2 3.27Å; S373-N377 VanDerWaalsContact O-ND2 3.15Å
374A93.6Very high91.8Very high8 Ų848.2 Ų48.27%0.06627%0.272CS..Hα-helixtrans-65.4-42.1174.600000112.4A42 I45 L104 E370 A371 R372 N377 I378A42-A374 HydrophobicContact CB-CB 4.1Å; I45-A374 HydrophobicContact CD1-CB 3.62Å; L104-A374 HydrophobicContact CD2-CB 4.12Å; E370-A374 WeakPolarHBondContact O-CB 3.49Å; E370-A374 PolarHBondContact O-N 3.27Å; A371-A374 PolarHBondContact O-N 2.95Å; R372-A374 VanDerWaalsContact C-N 3.29Å; R372-A374 PolarHBondContact O-N 3.24Å; A374-N377 PolarHBondContact O-N 3.06Å; A374-I378 VanDerWaalsContact O-CG1 3.27Å; A374-I378 WeakPolarHBondContact O-CG1 3.1Å; A374-I378 PolarHBondContact O-N 3.39Å
375L95.4Very high90.5Very high0 Ų045.7 Ų45.70%026%0.26CS..Hα-helixtrans-62.7-42.9174.4-69.3167.3000111.7I101 L104 L105 A108 Y269 I363 A371 R372 N377 I378 A379I101-L375 HydrophobicContact CD1-CD2 3.66Å; I101-L375 HydrophobicContact CG2-CD2 4.32Å; L104-L375 HydrophobicContact CB-CD1 4.09Å; L104-L375 HydrophobicContact CB-CD2 3.66Å; L104-L375 HydrophobicContact CB-CG 3.82Å; L104-L375 HydrophobicContact CD1-CD2 4.02Å; L104-L375 HydrophobicContact CD1-CG 4.43Å; L105-L375 HydrophobicContact CB-CD1 4.25Å; L105-L375 HydrophobicContact CD1-CD1 4.04Å; A108-L375 HydrophobicContact CB-CD1 4.14Å; Y269-L375 HydrophobicContact CE1-CD2 3.68Å; Y269-L375 HydrophobicContact CE2-CB 4.26Å; Y269-L375 WeakPolarHBondContact OH-CA 3.38Å; Y269-L375 WeakPolarHBondContact OH-CB 3.27Å; Y269-L375 VanDerWaalsContact OH-CD2 3.27Å; Y269-L375 WeakPolarHBondContact OH-CD2 3.34Å; Y269-L375 PolarHBondContact OH-O 3.31Å; Y269-L375 VanDerWaalsContact OH-O 3.09Å; I363-L375 HydrophobicContact CD1-CB 4.38Å; I363-L375 HydrophobicContact CD1-CD1 3.53Å; I363-L375 HydrophobicContact CG1-CB 3.94Å; I363-L375 HydrophobicContact CG1-CD1 4Å; A371-L375 WeakPolarHBondContact O-CG 3.46Å; A371-L375 PolarHBondContact O-N 3.16Å; R372-L375 WeakPolarHBondContact O-CB 3.35Å; R372-L375 PolarHBondContact O-N 3.42Å; R372-L375 VanDerWaalsContact O-N 3.14Å; L375-N377 VanDerWaalsContact C-N 3.34Å; L375-N377 PolarHBondContact O-N 2.91Å; L375-I378 PolarHBondContact O-N 2.78Å; L375-A379 WeakPolarHBondContact O-CB 3.44Å; L375-A379 PolarHBondContact O-N 3.27Å
376E95.6Very high90.4Very high44 Ų4444.7 Ų44.721%0.20625%0.245CC..Hα-helixtrans-59.8-43.4173.9-69.9166.7-167.600111.8L360 I363 R372 S373 A379 S380L360-E376 HydrophobicContact CD2-CB 3.93Å; L360-E376 HydrophobicContact CD2-CG 4.16Å; L360-E376 WeakPolarHBondContact CD2-O 3.46Å; I363-E376 HydrophobicContact CG2-CG 3.7Å; R372-E376 IonicContact CZ-OE1 3.72Å; R372-E376 IonicContact NE-OE1 2.92Å; R372-E376 PolarHBondContact NE-OE1 2.97Å; R372-E376 IonicContact NH2-OE1 3.92Å; R372-E376 WeakPolarHBondContact O-CG 3.34Å; R372-E376 PolarHBondContact O-N 2.78Å; S373-E376 PolarHBondContact O-N 2.66Å; E376-A379 PolarHBondContact O-N 2.82Å; E376-S380 WeakPolarHBondContact O-CB 3.45Å; E376-S380 PolarHBondContact O-N 3.11Å; E376-S380 PolarHBondContact O-OG 2.92Å
377N92.5Very high90.1Very high94 Ų9446.4 Ų46.450%0.50326%0.255SS..Hα-helixtrans-63.8-41.9176.4-74.5-31.5000112.2V38 S373 A374 L375 S380 A381V38-N377 HydrophobicContact CG1-CB 4.25Å; S373-N377 WeakPolarHBondContact O-CB 3.42Å; S373-N377 PolarHBondContact O-N 3.42Å; S373-N377 PolarHBondContact O-ND2 3.27Å; S373-N377 VanDerWaalsContact O-ND2 3.15Å; A374-N377 PolarHBondContact O-N 3.06Å; L375-N377 VanDerWaalsContact C-N 3.34Å; L375-N377 PolarHBondContact O-N 2.91Å; N377-S380 PolarHBondContact O-N 3.49Å; N377-A381 WeakPolarHBondContact O-CB 3.42Å; N377-A381 PolarHBondContact O-N 3.45Å
378I90.7Very high89.9Confident2 Ų244.6 Ų44.61%0.0124%0.241CC..Hα-helixtrans-62.5-50.4176-69.5164.9000110.3W35 V38 A42 I101 L104 L273 A374 L375 S380 A381 V382W35-I378 HydrophobicContact CH2-CG2 3.71Å; W35-I378 HydrophobicContact CZ3-CG2 4.14Å; V38-I378 HydrophobicContact CG1-CB 4.4Å; V38-I378 HydrophobicContact CG1-CG1 3.54Å; A42-I378 HydrophobicContact CB-CD1 4.16Å; I101-I378 HydrophobicContact CD1-CD1 3.7Å; I101-I378 HydrophobicContact CD1-CG2 4.06Å; L104-I378 HydrophobicContact CD1-CD1 3.78Å; L273-I378 HydrophobicContact CD1-CG2 3.99Å; L273-I378 HydrophobicContact CD2-CG2 4.31Å; A374-I378 VanDerWaalsContact O-CG1 3.27Å; A374-I378 WeakPolarHBondContact O-CG1 3.1Å; A374-I378 PolarHBondContact O-N 3.39Å; L375-I378 PolarHBondContact O-N 2.78Å; I378-S380 VanDerWaalsContact C-N 3.27Å; I378-S380 PolarHBondContact O-N 2.86Å; I378-A381 PolarHBondContact O-N 3.14Å; I378-A381 VanDerWaalsContact O-N 3.12Å; I378-V382 PolarHBondContact O-N 3.08Å
379A92.1Very high89.6Confident1 Ų141.8 Ų41.81%0.00822%0.217CC..Hα-helixtrans-59.5-37.9178.200000112.3Y269 L273 S356 A359 L360 L375 E376Y269-A379 HydrophobicContact CE2-CB 4.43Å; L273-A379 HydrophobicContact CD1-CB 4.31Å; S356-A379 PolarHBondContact OG-O 3.16Å; A359-A379 HydrophobicContact CB-CB 4.13Å; L360-A379 HydrophobicContact CD2-CB 3.87Å; L360-A379 HydrophobicContact CG-CB 4.13Å; L375-A379 WeakPolarHBondContact O-CB 3.44Å; L375-A379 PolarHBondContact O-N 3.27Å; E376-A379 PolarHBondContact O-N 2.82Å
380S91.1Very high89.2Confident44 Ų4442.1 Ų42.131%0.30822%0.215SC..Hα-helixtrans-70.3-35.3176.3-60.30000112.8E376 N377 I378 V382 N383E376-S380 WeakPolarHBondContact O-CB 3.45Å; E376-S380 PolarHBondContact O-N 3.11Å; E376-S380 PolarHBondContact O-OG 2.92Å; N377-S380 PolarHBondContact O-N 3.49Å; I378-S380 VanDerWaalsContact C-N 3.27Å; I378-S380 PolarHBondContact O-N 2.86Å; S380-V382 VanDerWaalsContact C-N 3.31Å; S380-V382 PolarHBondContact O-N 3.08Å; S380-N383 PolarHBondContact O-N 3.33Å
381A86.7Confident88.9Confident10 Ų1035.3 Ų35.38%0.08318%0.184CC..Hα-helixtrans-69.4-28.718000000112.6W35 N377 I378 N383 K384W35-A381 HydrophobicContact CE3-CB 3.71Å; W35-A381 HydrophobicContact CZ3-CB 3.87Å; N377-A381 WeakPolarHBondContact O-CB 3.42Å; N377-A381 PolarHBondContact O-N 3.45Å; I378-A381 PolarHBondContact O-N 3.14Å; I378-A381 VanDerWaalsContact O-N 3.12Å; A381-N383 PolarHBondContact O-N 2.92Å; A381-K384 PolarHBondContact O-N 3.15Å; A381-K384 VanDerWaalsContact O-N 3.09Å
382V83.2Confident88.5Confident5 Ų537.7 Ų37.73%0.0320%0.196CC..THydrogen-bonded Turntrans-58.5-28.4174.3168.70000112.7W35 L273 G276 H277 N280 I378 S380 K384W35-V382 HydrophobicContact CH2-CG2 3.99Å; W35-V382 HydrophobicContact CZ3-CG2 3.81Å; L273-V382 HydrophobicContact CD1-CG2 3.87Å; G276-V382 VanDerWaalsContact O-CG1 3.27Å; G276-V382 WeakPolarHBondContact O-CG1 3.42Å; H277-V382 HydrophobicContact CB-CG2 4.47Å; N280-V382 HydrophobicContact CB-CG1 4.35Å; N280-V382 WeakPolarHBondContact CB-O 3.37Å; N280-V382 PolarHBondContact ND2-O 3.08Å; I378-V382 PolarHBondContact O-N 3.08Å; S380-V382 VanDerWaalsContact C-N 3.31Å; S380-V382 PolarHBondContact O-N 3.08Å; V382-K384 VanDerWaalsContact C-N 3.34Å
383N79.6Confident87.9Confident48 Ų4837 Ų3726%0.25720%0.198SC..THydrogen-bonded Turntrans-89.14.9-179.7-170.623.5000113.6R353 S380 A381 F385R353-N383 WeakPolarHBondContact CG-OD1 3.22Å; S380-N383 PolarHBondContact O-N 3.33Å; A381-N383 PolarHBondContact O-N 2.92Å; N383-F385 WeakPolarHBondContact O-CD2 3.13Å; N383-F385 WeakPolarHBondContact O-CE2 3.27Å
384K77.9Confident87.2Confident113 Ų11336.3 Ų36.349%0.49119%0.188SC..  trans-94.1116.3178.4-63.2-176.8-177176.30109.3N280 A381 V382N280-K384 PolarHBondContact ND2-O 2.96Å; A381-K384 PolarHBondContact O-N 3.15Å; A381-K384 VanDerWaalsContact O-N 3.09Å; V382-K384 VanDerWaalsContact C-N 3.34Å
385F67.4Low86.6Confident67 Ų6738.9 Ų38.929%0.29420%0.199SC..  trans-102.80-179.6-55.3-74.7000112.1N280 L283 V287 K288 V349 C352 N383N280-F385 HydrophobicContact CB-CE1 4.35Å; N280-F385 WeakPolarHBondContact ND2-CE1 3.48Å; L283-F385 HydrophobicContact CB-CD1 4.16Å; L283-F385 HydrophobicContact CB-CE1 3.98Å; L283-F385 HydrophobicContact CD1-CD1 4.17Å; L283-F385 HydrophobicContact CD1-CE1 3.3Å; L283-F385 HydrophobicContact CD1-CZ 3.61Å; L283-F385 HydrophobicContact CG-CE1 4.27Å; V287-F385 HydrophobicContact CB-CB 4.35Å; V287-F385 HydrophobicContact CG1-CB 3.81Å; V287-F385 HydrophobicContact CG2-CB 4.35Å; K288-F385 WeakPolarHBondContact CE-OXT 3.32Å; V349-F385 HydrophobicContact CG1-CE2 4.03Å; C352-F385 HydrophobicContact CB-CZ 3.83Å; N383-F385 WeakPolarHBondContact O-CD2 3.13Å; N383-F385 WeakPolarHBondContact O-CE2 3.27Å

Retrieved 385 of 385 residues in 593.5 ms (Link to these results)