A0A077Z0A7_TRITR Loading...

Amino acid transporter

AlphaFold DB , UniProt , Accession A0A077Z0A7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 562 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.4Very low57.4Low192 Ų192131.5 Ų131.595%0.94666%0.66SS**  0-550-87.1-92.5-79.600109.3E3 L4 T5M1-E3 PolarHBondContact O-N 2.81Å; M1-L4 WeakPolarHBondContact O-CB 3.49Å; M1-L4 PolarHBondContact O-N 2.99Å; M1-T5 PolarHBondContact O-N 3.4Å; M1-T5 PolarHBondContact O-OG1 3.24Å; M1-T5 VanDerWaalsContact O-OG1 3.13Å
2E52.6Low56.2Low173 Ų173127.3 Ų127.381%0.80865%0.647SS**Hα-helixtrans-55.5-43.3176.2-72.6173.3148.900114.5L4 T5 E6E2-L4 PolarHBondContact O-N 3.23Å; E2-T5 PolarHBondContact O-N 3.24Å; E2-T5 VanDerWaalsContact O-N 3.1Å; E2-E6 PolarHBondContact O-N 3.21Å
3E55.5Low54.8Low151 Ų151122.6 Ų122.671%0.70664%0.639SS**Hα-helixtrans-62.5-25.8175.3-88-171.5141.900114.4M1 K7M1-E3 PolarHBondContact O-N 2.81Å; E3-K7 PolarHBondContact O-N 3.37Å
4L65.7Low53.3Low129 Ų129126.4 Ų126.468%0.67565%0.653SS**Hα-helixtrans-80-33.6176.2-74.9164.9000110.8M1 E2 S8M1-L4 WeakPolarHBondContact O-CB 3.49Å; M1-L4 PolarHBondContact O-N 2.99Å; E2-L4 PolarHBondContact O-N 3.23Å; L4-S8 PolarHBondContact O-N 2.93Å; L4-S8 VanDerWaalsContact O-N 3.16Å
5T69.1Low52Low77 Ų77126.7 Ų126.747%0.47266%0.662SS.*Hα-helixtrans-69.2-39.6175.9-41.40000111.3M1 E2 S8 N9M1-T5 PolarHBondContact O-N 3.4Å; M1-T5 PolarHBondContact O-OG1 3.24Å; M1-T5 VanDerWaalsContact O-OG1 3.13Å; E2-T5 PolarHBondContact O-N 3.24Å; E2-T5 VanDerWaalsContact O-N 3.1Å; T5-S8 PolarHBondContact O-N 2.83Å; T5-N9 PolarHBondContact O-N 3.25Å
6E64.1Low50.5Low140 Ų140124.9 Ų124.965%0.65466%0.663SS**Hα-helixtrans-67.3-40.9179.5-158.7174.3-15800112.2E2 S8 N9 M10E2-E6 PolarHBondContact O-N 3.21Å; E6-S8 VanDerWaalsContact C-N 3.34Å; E6-S8 PolarHBondContact O-N 3.21Å; E6-N9 PolarHBondContact O-N 2.86Å; E6-M10 PolarHBondContact O-N 3.5Å
7K65.2Low49.2Very low148 Ų148121.1 Ų121.164%0.64366%0.66SS**Hα-helixtrans-66.1-33.7173.7-77.8-179.9178.1170.20113.1E3 L11E3-K7 PolarHBondContact O-N 3.37Å; K7-L11 WeakPolarHBondContact O-CD1 3.21Å; K7-L11 PolarHBondContact O-N 2.85Å
8S62.8Low48.1Very low62 Ų62122.7 Ų122.743%0.43468%0.675SS.*Hα-helixtrans-69-38.8174.5-171.70000111.8L4 T5 E6 L11 T12L4-S8 PolarHBondContact O-N 2.93Å; L4-S8 VanDerWaalsContact O-N 3.16Å; T5-S8 PolarHBondContact O-N 2.83Å; E6-S8 VanDerWaalsContact C-N 3.34Å; E6-S8 PolarHBondContact O-N 3.21Å; S8-L11 PolarHBondContact O-N 3.43Å; S8-T12 PolarHBondContact O-N 3.07Å; S8-T12 PolarHBondContact O-OG1 3.37Å
9N54.1Low46.9Very low97 Ų97121.1 Ų121.152%0.51968%0.68SS.*Hα-helixtrans-72.3-32.3179.9-72.4-10.8000112.8T5 E6 L11 T12 A13T5-N9 PolarHBondContact O-N 3.25Å; E6-N9 PolarHBondContact O-N 2.86Å; N9-L11 VanDerWaalsContact C-N 3.32Å; N9-T12 WeakPolarHBondContact CA-OG1 3.35Å; N9-T12 PolarHBondContact O-N 3.3Å; N9-T12 PolarHBondContact O-OG1 2.84Å; N9-A13 WeakPolarHBondContact O-CB 3.33Å; N9-A13 PolarHBondContact O-N 3.25Å; N9-A13 VanDerWaalsContact O-N 3.13Å
10M49.2Very low45.8Very low147 Ų147120.1 Ų120.172%0.72468%0.681SS**Hα-helixtrans-64.6-36.5169.9-81.3-160.985.800112.3E6E6-M10 PolarHBondContact O-N 3.5Å
11L46.9Very low44.9Very low130 Ų130122.7 Ų122.768%0.68169%0.687SS**Hα-helixtrans-73.1-26.6179.6-82.3159.4000113.1K7 S8 N9K7-L11 WeakPolarHBondContact O-CD1 3.21Å; K7-L11 PolarHBondContact O-N 2.85Å; S8-L11 PolarHBondContact O-N 3.43Å; N9-L11 VanDerWaalsContact C-N 3.32Å
12T42.9Very low43.9Very low81 Ų81118.6 Ų118.650%0.49767%0.673SS.*Hα-helixtrans-87.3-24.9177.148.90000113.4S8 N9 V15 S16S8-T12 PolarHBondContact O-N 3.07Å; S8-T12 PolarHBondContact O-OG1 3.37Å; N9-T12 WeakPolarHBondContact CA-OG1 3.35Å; N9-T12 PolarHBondContact O-N 3.3Å; N9-T12 PolarHBondContact O-OG1 2.84Å; T12-V15 PolarHBondContact O-N 3.48Å; T12-S16 PolarHBondContact O-OG 2.92Å
13A37.5Very low42.6Very low67 Ų67119.9 Ų119.955%0.55468%0.679SS**Hα-helixtrans-69.9-29.8177.100000113.5N9 V15N9-A13 WeakPolarHBondContact O-CB 3.33Å; N9-A13 PolarHBondContact O-N 3.25Å; N9-A13 VanDerWaalsContact O-N 3.13Å; A13-V15 VanDerWaalsContact C-N 3.31Å; A13-V15 PolarHBondContact O-N 2.9Å
14E34.2Very low41.2Very low176 Ų176116.6 Ų116.682%0.82269%0.685SS**THydrogen-bonded Turntrans-78.7-9.8178.7-83.6-173.4156.900114.3
15V34.2Very low39.1Very low130 Ų130122.2 Ų122.279%0.78870%0.698SS**THydrogen-bonded Turntrans-99.4-9.2-179.6-174.20000112.6T12 A13T12-V15 PolarHBondContact O-N 3.48Å; A13-V15 VanDerWaalsContact C-N 3.31Å; A13-V15 PolarHBondContact O-N 2.9Å
16S28.4Very low37Very low99 Ų99123.3 Ų123.369%0.69271%0.709SS**SBendtrans-112.359.8-179.651.30000111.8T12T12-S16 PolarHBondContact O-OG 2.92Å
17G27.3Very low35.3Very low59 Ų59121.3 Ų121.361%0.60871%0.71SS**  trans-140.946.3-174.700000114.5
18T30.3Very low33.5Very low150 Ų150121 Ų12192%0.9272%0.72SS**  trans-160.881158.435.20000110.2
19A24.3Very low32.2Very low93 Ų93123.6 Ų123.677%0.76974%0.736SS**  trans-105.3145.1161.800000109.7
20S24.8Very low31Very low100 Ų100124.4 Ų124.470%0.69975%0.75SS**  trans64.8113155.462.70000120.3
21H28.4Very low29.8Very low176 Ų176124 Ų12482%0.81576%0.756SS**  -174.598.1126.9-93.1-63.7000107.1
22T24.4Very low29.1Very low106 Ų106124.3 Ų124.365%0.6576%0.762SS**  57.4116.389.859.30000116.1
23E24.7Very low28.2Very low199 Ų199131.9 Ų131.993%0.9378%0.782SS**  trans78.6135.7143.6-64.8179.1178.900121.3
24G26Very low27.9Very low82 Ų82134.6 Ų134.685%0.84579%0.794SS**  trans142.8103.7157.900000116
25W21.8Very low27.8Very low248 Ų248135.5 Ų135.594%0.93980%0.795SS**  trans-66.7160.3180-96.315.6000117.4
26S26.5Very low27.7Very low100 Ų100136.6 Ų136.670%0.69979%0.791SS**  trans81.9124137.566.20000123
27S27.7Very low27.9Very low98 Ų98143.6 Ų143.669%0.68580%0.803SS**  trans70.8112.213756.40000123.1
28T28Very low28.3Very low140 Ų140147.2 Ų147.286%0.85981%0.807SS**  trans80.1144.9135.152.70000121.6
29P33.9Very low28.8Very low117 Ų117144.9 Ų144.976%0.7680%0.797SS**  trans-113.2143.6-15536-20.8000113.5
30S28.8Very low29.6Very low115 Ų115147.9 Ų147.980%0.80480%0.795SS**  trans-163.2134.914545.70000112.8
31T25.3Very low31Very low139 Ų139146.4 Ų146.485%0.85379%0.785SS**  trans-31.9119.3168.640.80000117.4
32V32.8Very low32.1Very low135 Ų135141.7 Ų141.782%0.81877%0.772SS**  trans-138.5118150.1-178.70000109.4
33R22.6Very low33.6Very low240 Ų240139.5 Ų139.591%0.90676%0.764SS**PPolyproline II helixtrans-78.6134.1168.9-69.9-177.5-178.4-166.21.4109.9
34P31.6Very low35.1Very low125 Ų125135.5 Ų135.581%0.81275%0.749SS**PPolyproline II helixtrans-103.8128.6157.316.61.8000111.5
35K31.9Very low36.7Very low194 Ų194139.7 Ų139.784%0.84374%0.74SS**PPolyproline II helixtrans-72146.3172.8-71.5175.2173.9175.90111.7
36H31.7Very low38.3Very low154 Ų154137.5 Ų137.571%0.71373%0.731SS**  trans50.897.4148.1-82.2-103000120L38H36-L38 VanDerWaalsContact CE1-CD1 3.46Å; H36-L38 WeakPolarHBondContact CE1-CD1 3.39Å; H36-L38 WeakPolarHBondContact ND1-CD1 3.23Å
37R33.2Very low40Very low245 Ų245137.7 Ų137.793%0.92572%0.723SS**  trans-112.775.5142.1-84.1-170.8-169.8-143.12.7109.8
38L34.7Very low41.4Very low135 Ų135142.5 Ų142.571%0.70773%0.726SS**  trans-103.590.7169.1-89.6159.6000108.2H36H36-L38 VanDerWaalsContact CE1-CD1 3.46Å; H36-L38 WeakPolarHBondContact CE1-CD1 3.39Å; H36-L38 WeakPolarHBondContact ND1-CD1 3.23Å
39S41.5Very low42.7Very low101 Ų101143.1 Ų143.171%0.70671%0.713SS**SBendtrans-164.1-24.9163.5-175.90000114.9S41S39-S41 PolarHBondContact O-N 2.69Å
40Q40.9Very low43.6Very low156 Ų156141.7 Ų141.773%0.72970%0.699SS**THydrogen-bonded Turntrans-86.1-4.3-174.3-75.7179.4-15.500116.2
41S53.5Low44.8Very low69 Ų69145.6 Ų145.648%0.48370%0.696SS.*Hα-helixtrans-85.4-15.6-173.286.60000115.5S39 R45S39-S41 PolarHBondContact O-N 2.69Å; S41-R45 PolarHBondContact O-NE 2.99Å; S41-R45 PolarHBondContact OG-NH2 2.94Å; S41-R45 VanDerWaalsContact OG-NH2 3.13Å
42S52.8Low46Very low78 Ų78146 Ų14655%0.54569%0.688SS.*Hα-helixtrans-85.3-41.6-178.159.30000112.1R45 R46S42-R45 PolarHBondContact O-N 3.47Å; S42-R46 PolarHBondContact O-N 3.49Å
43A56.2Low46.5Very low59 Ų59145.7 Ų145.749%0.48868%0.676SS.*Hα-helixtrans-62.9-44.4178.300000111.9R45 R46 I47A43-R45 VanDerWaalsContact C-N 3.27Å; A43-R45 PolarHBondContact O-N 2.71Å; A43-R46 PolarHBondContact O-N 3.16Å; A43-I47 PolarHBondContact O-N 3.04Å
44N56.7Low47.3Very low115 Ų115141.4 Ų141.462%0.61567%0.668SS**Hα-helixtrans-65-28.6177-81.8-7.8000113R48N44-R48 VanDerWaalsContact O-CB 3.26Å; N44-R48 WeakPolarHBondContact O-CB 3.08Å; N44-R48 PolarHBondContact O-N 2.93Å; N44-R48 VanDerWaalsContact O-N 3.13Å
45R57.7Low48Very low171 Ų171141.3 Ų141.365%0.64566%0.664SS**Hα-helixtrans-69.2-40.4175.6-103.5-177.6-76.8-158.9-1.4112.7S41 S42 A43 W49S41-R45 PolarHBondContact O-NE 2.99Å; S41-R45 PolarHBondContact OG-NH2 2.94Å; S41-R45 VanDerWaalsContact OG-NH2 3.13Å; S42-R45 PolarHBondContact O-N 3.47Å; A43-R45 VanDerWaalsContact C-N 3.27Å; A43-R45 PolarHBondContact O-N 2.71Å; R45-W49 WeakPolarHBondContact O-CB 3.13Å; R45-W49 PolarHBondContact O-N 3.05Å
46R55.4Low48.4Very low202 Ų202136.1 Ų136.176%0.76265%0.649SS**Hα-helixtrans-68.9-40.7178.6-84.4-177175.4-179.8-1112.6S42 A43 W49 L50S42-R46 PolarHBondContact O-N 3.49Å; A43-R46 PolarHBondContact O-N 3.16Å; R46-W49 PolarHBondContact O-N 3.02Å; R46-L50 PolarHBondContact O-N 3.29Å
47I63.4Low48.8Very low103 Ų103138.2 Ų138.253%0.52866%0.656SS.*Hα-helixtrans-66.9-40178-63.2171.9000110.7A43 L50 R51A43-I47 PolarHBondContact O-N 3.04Å; I47-L50 PolarHBondContact O-N 3.06Å; I47-R51 PolarHBondContact O-N 3Å
48R56.7Low49Very low199 Ų199137.2 Ų137.275%0.75165%0.653SS**Hα-helixtrans-66.8-37.3177.7-153.8171.2179.1178-0.6112N44 Q52N44-R48 VanDerWaalsContact O-CB 3.26Å; N44-R48 WeakPolarHBondContact O-CB 3.08Å; N44-R48 PolarHBondContact O-N 2.93Å; N44-R48 VanDerWaalsContact O-N 3.13Å; R48-Q52 WeakPolarHBondContact O-CB 2.98Å; R48-Q52 PolarHBondContact O-N 3.22Å
49W55.8Low49.3Very low153 Ų153133.6 Ų133.658%0.5865%0.647SS**Hα-helixtrans-67.1-40.4174.5-169.881.7000112.9R45 R46 Q52 K53R45-W49 WeakPolarHBondContact O-CB 3.13Å; R45-W49 PolarHBondContact O-N 3.05Å; R46-W49 PolarHBondContact O-N 3.02Å; W49-Q52 PolarHBondContact O-N 2.98Å; W49-K53 HydrophobicContact CH2-CD 4.01Å; W49-K53 VanDerWaalsContact CH2-NZ 3.34Å; W49-K53 HydrophobicContact CZ2-CD 4.07Å; W49-K53 HydrophobicContact CZ3-CD 4.29Å; W49-K53 PolarHBondContact O-N 3.31Å
50L53.3Low49.3Very low88 Ų88133.9 Ų133.946%0.46165%0.648SS.*Hα-helixtrans-68.2-40.7175.6-78163.8000112.4R46 I47 Q52 K53 M54R46-L50 PolarHBondContact O-N 3.29Å; I47-L50 PolarHBondContact O-N 3.06Å; L50-Q52 VanDerWaalsContact C-N 3.29Å; L50-Q52 PolarHBondContact O-N 3.25Å; L50-K53 PolarHBondContact O-N 3.48Å; L50-M54 PolarHBondContact O-N 3.27Å
51R54.1Low49.4Very low196 Ų196135.1 Ų135.174%0.7465%0.654SS**Hα-helixtrans-60.7-38.6172.6-105.9-176.2178.7-171.50112I47 K53 M54 V55I47-R51 PolarHBondContact O-N 3Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 2.89Å; R51-M54 PolarHBondContact O-N 3.28Å; R51-V55 WeakPolarHBondContact O-CG2 3.42Å; R51-V55 PolarHBondContact O-N 2.95Å
52Q49.8Very low49.5Very low149 Ų149136.9 Ų136.970%0.69665%0.653SS**Hα-helixtrans-71.3-24.4179.8-156.4166.42.600113.1R48 W49 L50R48-Q52 WeakPolarHBondContact O-CB 2.98Å; R48-Q52 PolarHBondContact O-N 3.22Å; W49-Q52 PolarHBondContact O-N 2.98Å; L50-Q52 VanDerWaalsContact C-N 3.29Å; L50-Q52 PolarHBondContact O-N 3.25Å
53K43.1Very low50.5Low128 Ų128138 Ų13856%0.55765%0.653SS**Hα-helixtrans-87.6-29.1172.1-89-173.2171.4-178.10114.4W49 L50 R51 T56W49-K53 HydrophobicContact CH2-CD 4.01Å; W49-K53 VanDerWaalsContact CH2-NZ 3.34Å; W49-K53 HydrophobicContact CZ2-CD 4.07Å; W49-K53 HydrophobicContact CZ3-CD 4.29Å; W49-K53 PolarHBondContact O-N 3.31Å; L50-K53 PolarHBondContact O-N 3.48Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 2.89Å; K53-T56 PolarHBondContact O-OG1 3.12Å
54M39.5Very low51.5Low149 Ų149142.6 Ų142.673%0.73466%0.662SS**Hα-helixtrans-78.8-20.9178.8-75.9-172.7-165.800114.1L50 R51 T56L50-M54 PolarHBondContact O-N 3.27Å; R51-M54 PolarHBondContact O-N 3.28Å; M54-T56 VanDerWaalsContact C-N 3.3Å
55V47.1Very low52.1Low123 Ų123140.6 Ų140.675%0.74565%0.649SS**SBendtrans-81.6-7.3176.4177.80000112.8R51 K57R51-V55 WeakPolarHBondContact O-CG2 3.42Å; R51-V55 PolarHBondContact O-N 2.95Å; V55-K57 PolarHBondContact O-N 3.25Å
56T40.3Very low53.1Low85 Ų85136.5 Ų136.552%0.52164%0.637SS.*  trans-83.655168.233.20000112.8K53 M54 R58K53-T56 PolarHBondContact O-OG1 3.12Å; M54-T56 VanDerWaalsContact C-N 3.3Å; T56-R58 PolarHBondContact O-N 3.46Å
57K38.8Very low54.5Low198 Ų198129.5 Ų129.586%0.86161%0.614SS**  trans-78.883.5147.3-87.9-170.8177.1-178.80106.9V55 G59V55-K57 PolarHBondContact O-N 3.25Å; K57-G59 PolarHBondContact O-N 2.87Å
58R38.7Very low55.5Low225 Ų225125.4 Ų125.485%0.84959%0.593SS**  trans-64.885.8165.7-70.1-177.4-166.6174.13.9107.5T56 C60T56-R58 PolarHBondContact O-N 3.46Å; R58-C60 PolarHBondContact O-N 2.88Å
59G39.2Very low56.7Low58 Ų58116.5 Ų116.560%0.59856%0.56SS**  trans-54137.1150.500000106.7K57 H61K57-G59 PolarHBondContact O-N 2.87Å; G59-H61 PolarHBondContact O-N 3.35Å
60C43.1Very low58.2Low107 Ų107112.9 Ų112.972%0.72355%0.552SS**  trans-68.569.8175.9-154.20000108.4R58 F62R58-C60 PolarHBondContact O-N 2.88Å; C60-F62 VanDerWaalsContact C-N 3.26Å; C60-F62 HydrophobicContact CB-CE2 4.46Å; C60-F62 PolarHBondContact O-N 3.43Å; C60-F62 WeakPolarHBondContact SG-CE2 3.33Å
61H41.3Very low60Low183 Ų183112.6 Ų112.685%0.84755%0.547SS*.  trans-73.990.9168.2-114.1-45.7000105.3G59 D63G59-H61 PolarHBondContact O-N 3.35Å; H61-D63 PolarHBondContact O-N 3.17Å
62F56.8Low61.6Low105 Ų105103.3 Ų103.346%0.46151%0.513SS..  trans-58.6123.4162.1-74.6-82.3000107.1C60 Q66 L67C60-F62 VanDerWaalsContact C-N 3.26Å; C60-F62 HydrophobicContact CB-CE2 4.46Å; C60-F62 PolarHBondContact O-N 3.43Å; C60-F62 WeakPolarHBondContact SG-CE2 3.33Å; F62-Q66 HydrophobicContact CB-CB 4.46Å; F62-Q66 HydrophobicContact CD1-CB 3.95Å; F62-L67 HydrophobicContact CB-CB 4.46Å
63D73Confident63.3Low102 Ų10298.6 Ų98.655%0.54549%0.494SS..  trans-59.7150.2167.2-159.8-16.9000108.3H61 E65 Q66 L67H61-D63 PolarHBondContact O-N 3.17Å; D63-E65 PolarHBondContact O-N 3.49Å; D63-Q66 HydrophobicContact CB-CG 4.48Å; D63-Q66 PolarHBondContact O-N 3.21Å; D63-L67 PolarHBondContact O-N 3.28Å
64K77.6Confident65.6Low155 Ų15596.2 Ų96.267%0.67449%0.487SS*.Hα-helixtrans-51.9-33.2-178.4-70.4-177.6179.4-179.50111.7L68 W306K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 PolarHBondContact O-N 3.16Å; K64-W306 HydrophobicContact CB-CZ2 4.35Å
65E69.7Low68Low74 Ų7489.2 Ų89.235%0.34645%0.453SS..Hα-helixtrans-69.6-39.5177.9-62.2-176.217000113.3D63 L69 N398D63-E65 PolarHBondContact O-N 3.49Å; E65-L69 WeakPolarHBondContact O-CB 3.4Å; E65-L69 PolarHBondContact O-N 2.83Å; E65-N398 PolarHBondContact OE2-OD1 3.31Å
66Q77.5Confident70Confident84 Ų8484 Ų8439%0.39342%0.422SS..Hα-helixtrans-69.8-38.1176.5-65.8179-18.100111.3F62 D63 L69 L70F62-Q66 HydrophobicContact CB-CB 4.46Å; F62-Q66 HydrophobicContact CD1-CB 3.95Å; D63-Q66 HydrophobicContact CB-CG 4.48Å; D63-Q66 PolarHBondContact O-N 3.21Å; Q66-L69 PolarHBondContact O-N 3.47Å; Q66-L70 WeakPolarHBondContact O-CB 3.39Å; Q66-L70 PolarHBondContact O-N 2.82Å
67L85Confident72.3Confident55 Ų5584.6 Ų84.629%0.28842%0.421SS..Hα-helixtrans-63.8-46.4175.7-177.362.5000111.3F62 D63 L69 L70 F71 W306F62-L67 HydrophobicContact CB-CB 4.46Å; D63-L67 PolarHBondContact O-N 3.28Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.2Å; L67-L70 WeakPolarHBondContact O-CB 3.34Å; L67-L70 PolarHBondContact O-N 3.22Å; L67-F71 HydrophobicContact CD1-CD1 4.49Å; L67-F71 HydrophobicContact CD1-CD2 4.36Å; L67-F71 HydrophobicContact CD1-CE1 3.83Å; L67-F71 HydrophobicContact CD1-CE2 3.69Å; L67-F71 HydrophobicContact CD1-CZ 3.39Å; L67-F71 HydrophobicContact CD2-CE2 3.93Å; L67-F71 HydrophobicContact CD2-CZ 4.23Å; L67-F71 HydrophobicContact CG-CD2 4.05Å; L67-F71 HydrophobicContact CG-CE2 3.5Å; L67-F71 VanDerWaalsContact CG-CE2 3.5Å; L67-F71 HydrophobicContact CG-CZ 3.78Å; L67-F71 WeakPolarHBondContact O-CD2 3.23Å; L67-F71 WeakPolarHBondContact O-CG 3.4Å; L67-F71 PolarHBondContact O-N 3.23Å; L67-W306 HydrophobicContact CD2-CH2 4.19Å
68L84.6Confident74.9Confident18 Ų1879.7 Ų79.79%0.09440%0.403CS..Hα-helixtrans-58.5-45.9174.4171.572.4000111.4K64 L70 F71 T72 I305K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 PolarHBondContact O-N 3.16Å; L68-L70 VanDerWaalsContact C-N 3.34Å; L68-L70 PolarHBondContact O-N 3.44Å; L68-F71 PolarHBondContact O-N 2.79Å; L68-T72 WeakPolarHBondContact O-CB 3.41Å; L68-T72 PolarHBondContact O-N 3.18Å; L68-T72 PolarHBondContact O-OG1 3.48Å; L68-I305 HydrophobicContact CD1-CG2 3.64Å; L68-I305 WeakPolarHBondContact CD1-O 3.37Å; L68-I305 HydrophobicContact CD2-CG2 3.13Å; L68-I305 HydrophobicContact CG-CG2 3.92Å
69L83.3Confident77.5Confident11 Ų1169 Ų696%0.05836%0.363CS..Hα-helixtrans-60.6-46.1177.9174.360.1000111.2E65 Q66 L67 F71 T72 V73 Y369 L372 P373E65-L69 WeakPolarHBondContact O-CB 3.4Å; E65-L69 PolarHBondContact O-N 2.83Å; Q66-L69 PolarHBondContact O-N 3.47Å; L67-L69 VanDerWaalsContact C-N 3.33Å; L67-L69 PolarHBondContact O-N 3.2Å; L69-F71 VanDerWaalsContact C-N 3.33Å; L69-F71 PolarHBondContact O-N 3.01Å; L69-T72 WeakPolarHBondContact O-CB 3.49Å; L69-T72 PolarHBondContact O-N 3.5Å; L69-T72 VanDerWaalsContact O-N 3.14Å; L69-V73 HydrophobicContact CD1-CG2 3.98Å; L69-V73 HydrophobicContact CG-CG2 4.44Å; L69-V73 WeakPolarHBondContact O-CG2 3.36Å; L69-V73 PolarHBondContact O-N 3.04Å; L69-Y369 HydrophobicContact CD2-CD1 4.37Å; L69-Y369 HydrophobicContact CD2-CD2 4.1Å; L69-Y369 HydrophobicContact CD2-CE1 3.82Å; L69-Y369 HydrophobicContact CD2-CE2 3.5Å; L69-L372 HydrophobicContact CD1-CB 3.76Å; L69-L372 HydrophobicContact CD1-CD2 3.73Å; L69-L372 HydrophobicContact CD1-CG 3.71Å; L69-L372 HydrophobicContact CD2-CD2 4.31Å; L69-L372 HydrophobicContact CG-CD2 4.48Å; L69-P373 HydrophobicContact CD1-CG 3.87Å
70L87.4Confident79.8Confident77 Ų7770 Ų7040%0.40335%0.354SS..Hα-helixtrans-56.3-48176177.663.8000111.1Q66 L67 L68 T72 V73 L74Q66-L70 WeakPolarHBondContact O-CB 3.39Å; Q66-L70 PolarHBondContact O-N 2.82Å; L67-L70 WeakPolarHBondContact O-CB 3.34Å; L67-L70 PolarHBondContact O-N 3.22Å; L68-L70 VanDerWaalsContact C-N 3.34Å; L68-L70 PolarHBondContact O-N 3.44Å; L70-T72 VanDerWaalsContact C-N 3.31Å; L70-T72 PolarHBondContact O-N 3.27Å; L70-V73 PolarHBondContact O-N 3.37Å; L70-L74 HydrophobicContact CD1-CD1 4.07Å; L70-L74 HydrophobicContact CD1-CG 4.22Å; L70-L74 HydrophobicContact CG-CD1 3.94Å; L70-L74 HydrophobicContact CG-CG 4.48Å; L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 VanDerWaalsContact O-CG 3.24Å; L70-L74 WeakPolarHBondContact O-CG 3.21Å; L70-L74 PolarHBondContact O-N 2.89Å
71F90.6Very high82.2Confident82 Ų8268.1 Ų68.136%0.3634%0.342SS..Hα-helixtrans-64.1-34.5176.9-66.1-26.2000113.2L67 L68 L69 G75 W306 P309L67-F71 HydrophobicContact CD1-CD1 4.49Å; L67-F71 HydrophobicContact CD1-CD2 4.36Å; L67-F71 HydrophobicContact CD1-CE1 3.83Å; L67-F71 HydrophobicContact CD1-CE2 3.69Å; L67-F71 HydrophobicContact CD1-CZ 3.39Å; L67-F71 HydrophobicContact CD2-CE2 3.93Å; L67-F71 HydrophobicContact CD2-CZ 4.23Å; L67-F71 HydrophobicContact CG-CD2 4.05Å; L67-F71 HydrophobicContact CG-CE2 3.5Å; L67-F71 VanDerWaalsContact CG-CE2 3.5Å; L67-F71 HydrophobicContact CG-CZ 3.78Å; L67-F71 WeakPolarHBondContact O-CD2 3.23Å; L67-F71 WeakPolarHBondContact O-CG 3.4Å; L67-F71 PolarHBondContact O-N 3.23Å; L68-F71 PolarHBondContact O-N 2.79Å; L69-F71 VanDerWaalsContact C-N 3.33Å; L69-F71 PolarHBondContact O-N 3.01Å; F71-G75 WeakPolarHBondContact O-CA 3.41Å; F71-G75 PolarHBondContact O-N 3.15Å; F71-W306 HydrophobicContact CD2-CZ3 4.29Å; F71-W306 HydrophobicContact CE2-CZ3 4.21Å; F71-P309 HydrophobicContact CB-CB 4.11Å; F71-P309 HydrophobicContact CB-CG 3.64Å
72T86.5Confident84.6Confident2 Ų262.5 Ų62.51%0.01232%0.318CS..Hα-helixtrans-67.7-45.2177.3-54.80000110.8L68 L69 L70 G75 C76 I312 L376L68-T72 WeakPolarHBondContact O-CB 3.41Å; L68-T72 PolarHBondContact O-N 3.18Å; L68-T72 PolarHBondContact O-OG1 3.48Å; L69-T72 WeakPolarHBondContact O-CB 3.49Å; L69-T72 PolarHBondContact O-N 3.5Å; L69-T72 VanDerWaalsContact O-N 3.14Å; L70-T72 VanDerWaalsContact C-N 3.31Å; L70-T72 PolarHBondContact O-N 3.27Å; T72-G75 PolarHBondContact O-N 2.84Å; T72-C76 PolarHBondContact O-N 2.99Å; T72-I312 HydrophobicContact CG2-CD1 3.34Å; T72-L376 HydrophobicContact CG2-CB 4.13Å; T72-L376 HydrophobicContact CG2-CD1 3.68Å
73V87Confident86.2Confident49 Ų4957.5 Ų57.530%0.29730%0.296SS..Hα-helixtrans-64.4-47.4176.2172.70000110.6L69 L70 G75 C76 I77 L372 L376L69-V73 HydrophobicContact CD1-CG2 3.98Å; L69-V73 HydrophobicContact CG-CG2 4.44Å; L69-V73 WeakPolarHBondContact O-CG2 3.36Å; L69-V73 PolarHBondContact O-N 3.04Å; L70-V73 PolarHBondContact O-N 3.37Å; V73-G75 VanDerWaalsContact C-N 3.29Å; V73-G75 PolarHBondContact O-N 3.38Å; V73-C76 WeakPolarHBondContact O-CB 3.42Å; V73-C76 PolarHBondContact O-N 3.35Å; V73-I77 HydrophobicContact CG1-CD1 4.06Å; V73-I77 WeakPolarHBondContact O-CG1 3.46Å; V73-I77 PolarHBondContact O-N 3.42Å; V73-L372 HydrophobicContact CG2-CD2 4.29Å; V73-L376 HydrophobicContact CG2-CD1 3.79Å
74L90.9Very high86.9Confident79 Ų7956.4 Ų56.441%0.41429%0.293SS..Hα-helixtrans-59.9-41.5174.9-71.8173.3000111.2L70 C76 I77 L78L70-L74 HydrophobicContact CD1-CD1 4.07Å; L70-L74 HydrophobicContact CD1-CG 4.22Å; L70-L74 HydrophobicContact CG-CD1 3.94Å; L70-L74 HydrophobicContact CG-CG 4.48Å; L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 VanDerWaalsContact O-CG 3.24Å; L70-L74 WeakPolarHBondContact O-CG 3.21Å; L70-L74 PolarHBondContact O-N 2.89Å; L74-C76 VanDerWaalsContact C-N 3.33Å; L74-C76 PolarHBondContact O-N 2.9Å; L74-I77 PolarHBondContact O-N 3Å; L74-L78 WeakPolarHBondContact O-CB 3.08Å; L74-L78 VanDerWaalsContact O-CG 3.26Å; L74-L78 WeakPolarHBondContact O-CG 3.2Å; L74-L78 PolarHBondContact O-N 3.34Å
75G90.1Very high87.5Confident2 Ų251.1 Ų51.12%0.02128%0.282CS..Hα-helixtrans-60.7-40.6175.400000112.5F71 T72 V73 L78 G79 I313F71-G75 WeakPolarHBondContact O-CA 3.41Å; F71-G75 PolarHBondContact O-N 3.15Å; T72-G75 PolarHBondContact O-N 2.84Å; V73-G75 VanDerWaalsContact C-N 3.29Å; V73-G75 PolarHBondContact O-N 3.38Å; G75-L78 PolarHBondContact O-N 2.94Å; G75-G79 PolarHBondContact O-N 3.5Å; G75-I313 VanDerWaalsContact CA-CG1 3.41Å; G75-I313 WeakPolarHBondContact O-CA 3.37Å; G75-I313 WeakPolarHBondContact O-CG1 3.11Å
76C87.7Confident88.5Confident13 Ų1349.9 Ų49.99%0.08828%0.278CS..Hα-helixtrans-62.7-47.4174-171.10000111.9T72 V73 L74 L78 G79 L80 I312 L376T72-C76 PolarHBondContact O-N 2.99Å; V73-C76 WeakPolarHBondContact O-CB 3.42Å; V73-C76 PolarHBondContact O-N 3.35Å; L74-C76 VanDerWaalsContact C-N 3.33Å; L74-C76 PolarHBondContact O-N 2.9Å; C76-L78 PolarHBondContact O-N 3.11Å; C76-G79 PolarHBondContact O-N 2.92Å; C76-L80 WeakPolarHBondContact O-CG 3.47Å; C76-L80 PolarHBondContact O-N 2.88Å; C76-I312 HydrophobicContact CB-CG2 3.97Å; C76-L376 HydrophobicContact CB-CD2 4.28Å
77I89.8Confident88.8Confident98 Ų9849.7 Ų49.750%0.50327%0.274SS..Hα-helixtrans-62.7-42.9178.3-64.4167000111.2V73 L74 L80 S81V73-I77 HydrophobicContact CG1-CD1 4.06Å; V73-I77 WeakPolarHBondContact O-CG1 3.46Å; V73-I77 PolarHBondContact O-N 3.42Å; L74-I77 PolarHBondContact O-N 3Å; I77-L80 PolarHBondContact O-N 3.29Å; I77-S81 WeakPolarHBondContact O-CB 3.26Å; I77-S81 PolarHBondContact O-N 3.34Å; I77-S81 PolarHBondContact O-OG 3.11Å
78L94Very high88.7Confident95 Ų9555.4 Ų55.450%0.49730%0.296SS..Hα-helixtrans-64.2-40.5175.3-73174.1000111.6L74 G75 C76 S81 L82 I313L74-L78 WeakPolarHBondContact O-CB 3.08Å; L74-L78 VanDerWaalsContact O-CG 3.26Å; L74-L78 WeakPolarHBondContact O-CG 3.2Å; L74-L78 PolarHBondContact O-N 3.34Å; G75-L78 PolarHBondContact O-N 2.94Å; C76-L78 PolarHBondContact O-N 3.11Å; L78-S81 WeakPolarHBondContact CA-OG 3.34Å; L78-S81 PolarHBondContact O-N 3.19Å; L78-S81 PolarHBondContact O-OG 3.33Å; L78-L82 WeakPolarHBondContact O-CB 3.4Å; L78-L82 PolarHBondContact O-N 3.45Å; L78-I313 HydrophobicContact CB-CD1 4.41Å; L78-I313 HydrophobicContact CB-CG1 4.09Å; L78-I313 HydrophobicContact CD1-CD1 4.35Å
79G91.5Very high88.5Confident0 Ų060 Ų600%031%0.312CS..Hα-helixtrans-62.6-43.917400000112.8G75 C76 G83 I313 A317G75-G79 PolarHBondContact O-N 3.5Å; C76-G79 PolarHBondContact O-N 2.92Å; G79-G83 PolarHBondContact O-N 3.09Å; G79-I313 WeakPolarHBondContact CA-O 3.41Å; G79-A317 VanDerWaalsContact O-CA 3.24Å; G79-A317 WeakPolarHBondContact O-CA 3.33Å; G79-A317 WeakPolarHBondContact O-CB 3.48Å; G79-A317 PolarHBondContact O-N 3.43Å
80L89.1Confident88Confident78 Ų7868 Ų6841%0.40835%0.35SS..Hα-helixtrans-61.6-50.3175.7-72.8171.2000111.4C76 I77 G83 V84 T316 I320C76-L80 WeakPolarHBondContact O-CG 3.47Å; C76-L80 PolarHBondContact O-N 2.88Å; I77-L80 PolarHBondContact O-N 3.29Å; L80-G83 PolarHBondContact O-N 3.28Å; L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 2.79Å; L80-T316 HydrophobicContact CB-CG2 4.42Å; L80-T316 HydrophobicContact CD2-CG2 3.56Å; L80-T316 HydrophobicContact CG-CG2 3.65Å; L80-I320 HydrophobicContact CD2-CD1 3.97Å; L80-I320 HydrophobicContact CD2-CG1 4.15Å
81S92.1Very high87.6Confident68 Ų6870.4 Ų70.448%0.47636%0.358SS..Hα-helixtrans-64.2-41.718054.10000112.4I77 L78 G85I77-S81 WeakPolarHBondContact O-CB 3.26Å; I77-S81 PolarHBondContact O-N 3.34Å; I77-S81 PolarHBondContact O-OG 3.11Å; L78-S81 WeakPolarHBondContact CA-OG 3.34Å; L78-S81 PolarHBondContact O-N 3.19Å; L78-S81 PolarHBondContact O-OG 3.33Å; S81-G85 PolarHBondContact O-N 2.89Å
82L93Very high87.2Confident65 Ų6572 Ų7234%0.3438%0.377SS..Hα-helixtrans-60.8-47.6173.3179.262.2000111L78 V84 G85 L86 I313 A317L78-L82 WeakPolarHBondContact O-CB 3.4Å; L78-L82 PolarHBondContact O-N 3.45Å; L82-V84 PolarHBondContact O-N 3.26Å; L82-G85 PolarHBondContact O-N 3.45Å; L82-L86 HydrophobicContact CD1-CD1 3.95Å; L82-L86 HydrophobicContact CD1-CD2 4.41Å; L82-L86 HydrophobicContact CD1-CG 3.97Å; L82-L86 HydrophobicContact CG-CD1 3.87Å; L82-L86 HydrophobicContact CG-CG 4.28Å; L82-L86 WeakPolarHBondContact O-CB 2.93Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.36Å; L82-L86 PolarHBondContact O-N 3.2Å; L82-I313 HydrophobicContact CD2-CG2 4.17Å; L82-A317 HydrophobicContact CB-CB 4.11Å; L82-A317 HydrophobicContact CD2-CB 3.81Å; L82-A317 HydrophobicContact CG-CB 3.93Å
83G89.8Confident87Confident0 Ų073.9 Ų73.90%039%0.385CS..Hα-helixtrans-60.1-46.8178.500000113.2G79 L80 G85 L86 R87 I320G79-G83 PolarHBondContact O-N 3.09Å; L80-G83 PolarHBondContact O-N 3.28Å; G83-G85 VanDerWaalsContact C-N 3.33Å; G83-G85 PolarHBondContact O-N 3.22Å; G83-L86 PolarHBondContact O-N 2.98Å; G83-R87 PolarHBondContact O-N 2.92Å; G83-I320 VanDerWaalsContact C-CG2 3.4Å
84V88.3Confident87.1Confident79 Ų7974.8 Ų74.848%0.47939%0.391SS..Hα-helixtrans-63.7-39.6176.1172.80000111.1L80 L82 I320L80-V84 WeakPolarHBondContact O-CG2 3.31Å; L80-V84 PolarHBondContact O-N 2.79Å; L82-V84 PolarHBondContact O-N 3.26Å; V84-I320 HydrophobicContact CG2-CG2 4.02Å
85G89.9Confident87Confident44 Ų4476.3 Ų76.345%0.45441%0.406SS..Hα-helixtrans-64.3-47176.600000112.7S81 L82 G83 R87 K88S81-G85 PolarHBondContact O-N 2.89Å; L82-G85 PolarHBondContact O-N 3.45Å; G83-G85 VanDerWaalsContact C-N 3.33Å; G83-G85 PolarHBondContact O-N 3.22Å; G85-R87 VanDerWaalsContact C-N 3.28Å; G85-R87 PolarHBondContact O-N 2.9Å; G85-K88 PolarHBondContact O-N 2.98Å
86L90.4Very high87Confident49 Ų4984.4 Ų84.426%0.25744%0.436SS..Hα-helixtrans-63.2-34178.8-72176.6000112L82 G83 K88 R89 F93 L101 V321L82-L86 HydrophobicContact CD1-CD1 3.95Å; L82-L86 HydrophobicContact CD1-CD2 4.41Å; L82-L86 HydrophobicContact CD1-CG 3.97Å; L82-L86 HydrophobicContact CG-CD1 3.87Å; L82-L86 HydrophobicContact CG-CG 4.28Å; L82-L86 WeakPolarHBondContact O-CB 2.93Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.36Å; L82-L86 PolarHBondContact O-N 3.2Å; G83-L86 PolarHBondContact O-N 2.98Å; L86-K88 PolarHBondContact O-N 3.01Å; L86-R89 WeakPolarHBondContact O-CB 3.42Å; L86-R89 PolarHBondContact O-N 3.07Å; L86-F93 HydrophobicContact CB-CE2 4.13Å; L86-F93 HydrophobicContact CB-CZ 3.77Å; L86-F93 HydrophobicContact CD1-CZ 4.48Å; L86-F93 HydrophobicContact CD2-CZ 4.01Å; L86-F93 HydrophobicContact CG-CZ 4.28Å; L86-F93 WeakPolarHBondContact O-CE2 3.24Å; L86-L101 HydrophobicContact CD1-CD1 3.68Å; L86-L101 HydrophobicContact CD1-CD2 3.83Å; L86-L101 HydrophobicContact CD1-CG 4.44Å; L86-V321 HydrophobicContact CB-CG2 3.66Å; L86-V321 HydrophobicContact CD1-CG2 4.23Å
87R83.1Confident87.3Confident80 Ų8086.6 Ų86.630%0.30244%0.444SS..Hα-helixtrans-63.4-23.1177.7-166.8174.6-176.2-161.23.7114.1G83 G85 R89 F323 D325G83-R87 PolarHBondContact O-N 2.92Å; G85-R87 VanDerWaalsContact C-N 3.28Å; G85-R87 PolarHBondContact O-N 2.9Å; R87-R89 PolarHBondContact O-N 3.14Å; R87-F323 VanDerWaalsContact CZ-O 3.29Å; R87-F323 PolarHBondContact NE-O 3.5Å; R87-F323 PolarHBondContact NH2-O 3.46Å; R87-D325 IonicContact CZ-OD1 3.98Å; R87-D325 IonicContact NE-OD1 3.39Å; R87-D325 IonicContact NH1-OD1 2.81Å; R87-D325 VanDerWaalsContact NH2-CA 3.34Å; R87-D325 VanDerWaalsContact NH2-CG 3.34Å; R87-D325 IonicContact NH2-OD1 3.71Å; R87-D325 PolarHBondContact NH2-OD1 3.23Å; R87-D325 IonicContact NH2-OD2 3.15Å
88K83.1Confident87.3Confident175 Ų17583.6 Ų83.676%0.76143%0.429SS*.THydrogen-bonded Turntrans-73.4-2.5178.2-65.5-178.4178.4-177.40114G85 L86G85-K88 PolarHBondContact O-N 2.98Å; L86-K88 PolarHBondContact O-N 3.01Å
89R80.2Confident87.2Confident113 Ų11384.3 Ų84.343%0.42643%0.431SS..  trans-65.4136177.3-172.1-177.1177.7-170.1-0.1110.3L86 R87 H91 F93 E97L86-R89 WeakPolarHBondContact O-CB 3.42Å; L86-R89 PolarHBondContact O-N 3.07Å; R87-R89 PolarHBondContact O-N 3.14Å; R89-H91 VanDerWaalsContact C-N 3.31Å; R89-H91 WeakPolarHBondContact CD-O 3.43Å; R89-H91 PolarHBondContact O-N 3.05Å; R89-F93 HydrophobicContact CB-CE2 4.45Å; R89-E97 IonicContact CZ-OE1 3.8Å; R89-E97 VanDerWaalsContact NH1-CD 3.27Å; R89-E97 IonicContact NH1-OE1 2.73Å; R89-E97 PolarHBondContact NH1-OE1 3.33Å; R89-E97 IonicContact NH1-OE2 3Å; R89-E97 PolarHBondContact NH1-OE2 2.89Å; R89-E97 IonicContact NH2-OE1 2.99Å; R89-E97 PolarHBondContact NH2-OE1 3.13Å
90E73.8Confident87.4Confident181 Ų18191.4 Ų91.485%0.84646%0.459SS*.SBendtrans-63-35.4179.9-66.8-179.4173.900113.2
91H79.6Confident87.6Confident126 Ų12688.6 Ų88.658%0.58344%0.444SS*.SBendtrans-95.2130.9177.9-61.7-52.3000111.2R89R89-H91 VanDerWaalsContact C-N 3.31Å; R89-H91 WeakPolarHBondContact CD-O 3.43Å; R89-H91 PolarHBondContact O-N 3.05Å
92P80.4Confident87.6Confident116 Ų11688.9 Ų88.975%0.75344%0.437SS*.PPolyproline II helixtrans-60.6143173.627.1-33.7000109.6T94P92-T94 PolarHBondContact O-N 3.4Å
93F84.3Confident87.7Confident41 Ų4190.8 Ų90.818%0.1844%0.443CS..PPolyproline II helixtrans-61.5133.4178.7-77.6-104000110.4L86 R89 E97 L98 V321L86-F93 HydrophobicContact CB-CE2 4.13Å; L86-F93 HydrophobicContact CB-CZ 3.77Å; L86-F93 HydrophobicContact CD1-CZ 4.48Å; L86-F93 HydrophobicContact CD2-CZ 4.01Å; L86-F93 HydrophobicContact CG-CZ 4.28Å; L86-F93 WeakPolarHBondContact O-CE2 3.24Å; R89-F93 HydrophobicContact CB-CE2 4.45Å; F93-E97 HydrophobicContact CD1-CB 3.8Å; F93-L98 HydrophobicContact CB-CD1 4.38Å; F93-L98 HydrophobicContact CB-CD2 3.7Å; F93-L98 HydrophobicContact CB-CG 3.68Å; F93-L98 HydrophobicContact CG-CD2 4.15Å; F93-V321 HydrophobicContact CB-CG1 4.33Å; F93-V321 HydrophobicContact CD1-CG1 4.43Å; F93-V321 HydrophobicContact CD2-CG1 3.29Å; F93-V321 HydrophobicContact CE2-CG1 3.63Å; F93-V321 HydrophobicContact CG-CG1 3.77Å; F93-V321 HydrophobicContact CZ-CG1 4.35Å
94T88.5Confident88Confident68 Ų6892 Ų9242%0.41745%0.45SS..PPolyproline II helixtrans-66152.7169.662.80000109.9P92 R96 E97 L98P92-T94 PolarHBondContact O-N 3.4Å; T94-R96 PolarHBondContact O-N 3.42Å; T94-E97 PolarHBondContact N-OE2 3.4Å; T94-E97 PolarHBondContact O-N 3.13Å; T94-E97 WeakPolarHBondContact OG1-CG 3.49Å; T94-E97 PolarHBondContact OG1-N 2.93Å; T94-E97 PolarHBondContact OG1-OE2 2.9Å; T94-L98 PolarHBondContact O-N 3.17Å
95P87.5Confident88.2Confident112 Ų11288.2 Ų88.273%0.72743%0.428SS*.Hα-helixtrans-53.8-30.4175-27.935.2000113.5M99P95-M99 WeakPolarHBondContact O-CB 3.42Å; P95-M99 PolarHBondContact O-N 3.45Å
96R92.1Very high88.2Confident172 Ų17288.2 Ų88.265%0.64942%0.416SS*.Hα-helixtrans-71.7-43.6176.6-173.4177.9-64.4160.71.7112.7T94 L98 M99 Y100T94-R96 PolarHBondContact O-N 3.42Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-M99 WeakPolarHBondContact O-CB 3.43Å; R96-M99 PolarHBondContact O-N 3.33Å; R96-Y100 HydrophobicContact CG-CD2 4.45Å; R96-Y100 HydrophobicContact CG-CE1 4.34Å; R96-Y100 HydrophobicContact CG-CE2 3.81Å; R96-Y100 PolarHBondContact O-N 2.78Å
97E92.6Very high88.4Confident58 Ų5888.6 Ų88.627%0.27142%0.417SS..Hα-helixtrans-66.6-38.2175.9-67.9163.4135.600111.2R89 F93 T94 M99 Y100 L101R89-E97 IonicContact CZ-OE1 3.8Å; R89-E97 VanDerWaalsContact NH1-CD 3.27Å; R89-E97 IonicContact NH1-OE1 2.73Å; R89-E97 PolarHBondContact NH1-OE1 3.33Å; R89-E97 IonicContact NH1-OE2 3Å; R89-E97 PolarHBondContact NH1-OE2 2.89Å; R89-E97 IonicContact NH2-OE1 2.99Å; R89-E97 PolarHBondContact NH2-OE1 3.13Å; F93-E97 HydrophobicContact CD1-CB 3.8Å; T94-E97 PolarHBondContact N-OE2 3.4Å; T94-E97 PolarHBondContact O-N 3.13Å; T94-E97 WeakPolarHBondContact OG1-CG 3.49Å; T94-E97 PolarHBondContact OG1-N 2.93Å; T94-E97 PolarHBondContact OG1-OE2 2.9Å; E97-M99 VanDerWaalsContact C-N 3.33Å; E97-Y100 PolarHBondContact O-N 3.24Å; E97-L101 WeakPolarHBondContact O-CB 3.38Å; E97-L101 PolarHBondContact O-N 2.94Å
98L90.1Very high88.8Confident35 Ų3584.8 Ų84.818%0.18340%0.403CS..Hα-helixtrans-60.3-43.8172.1-71.6175.3000111.5F93 T94 R96 Y100 L101 K102 H318 V321 I322F93-L98 HydrophobicContact CB-CD1 4.38Å; F93-L98 HydrophobicContact CB-CD2 3.7Å; F93-L98 HydrophobicContact CB-CG 3.68Å; F93-L98 HydrophobicContact CG-CD2 4.15Å; T94-L98 PolarHBondContact O-N 3.17Å; R96-L98 VanDerWaalsContact C-N 3.34Å; L98-Y100 VanDerWaalsContact C-N 3.32Å; L98-Y100 PolarHBondContact O-N 3.41Å; L98-L101 PolarHBondContact O-N 3.3Å; L98-K102 WeakPolarHBondContact O-CB 3.31Å; L98-K102 PolarHBondContact O-N 3.42Å; L98-H318 PolarHBondContact O-CD2 3.35Å; L98-V321 HydrophobicContact CD2-CB 4.33Å; L98-V321 HydrophobicContact CD2-CG1 3.65Å; L98-I322 HydrophobicContact CD1-CG1 4.27Å; L98-I322 HydrophobicContact CD2-CG1 4.16Å
99M92.4Very high89.1Confident110 Ų11077.8 Ų77.854%0.54237%0.374SS..Hα-helixtrans-57.1-45.3174.2-179.5-173.9173.800111.3P95 R96 E97 K102 F103P95-M99 WeakPolarHBondContact O-CB 3.42Å; P95-M99 PolarHBondContact O-N 3.45Å; R96-M99 WeakPolarHBondContact O-CB 3.43Å; R96-M99 PolarHBondContact O-N 3.33Å; E97-M99 VanDerWaalsContact C-N 3.33Å; M99-K102 PolarHBondContact O-N 2.88Å; M99-F103 WeakPolarHBondContact O-CB 3.3Å; M99-F103 PolarHBondContact O-N 3.46Å
100Y95.3Very high89.6Confident149 Ų14979.8 Ų79.858%0.58438%0.381SS*.Hα-helixtrans-66.2-39.7177.8-64.2-22.3000113.2R96 E97 L98 K102 F103 P104R96-Y100 HydrophobicContact CG-CD2 4.45Å; R96-Y100 HydrophobicContact CG-CE1 4.34Å; R96-Y100 HydrophobicContact CG-CE2 3.81Å; R96-Y100 PolarHBondContact O-N 2.78Å; E97-Y100 PolarHBondContact O-N 3.24Å; L98-Y100 VanDerWaalsContact C-N 3.32Å; L98-Y100 PolarHBondContact O-N 3.41Å; Y100-K102 VanDerWaalsContact C-N 3.33Å; Y100-K102 PolarHBondContact O-N 2.87Å; Y100-F103 PolarHBondContact O-N 3.14Å; Y100-P104 WeakPolarHBondContact O-CD 3.43Å
101L93.9Very high90.5Very high19 Ų1973.3 Ų73.310%0.09935%0.352CS..Hα-helixtrans-63.2-40.5175.1-177.964.4000111.5L86 E97 L98 F314 A317 H318 V321L86-L101 HydrophobicContact CD1-CD1 3.68Å; L86-L101 HydrophobicContact CD1-CD2 3.83Å; L86-L101 HydrophobicContact CD1-CG 4.44Å; E97-L101 WeakPolarHBondContact O-CB 3.38Å; E97-L101 PolarHBondContact O-N 2.94Å; L98-L101 PolarHBondContact O-N 3.3Å; L101-F314 HydrophobicContact CD1-CD1 4.2Å; L101-F314 WeakPolarHBondContact O-CD1 3.47Å; L101-A317 HydrophobicContact CD1-CB 4.35Å; L101-H318 HydrophobicContact CD2-CB 4.24Å; L101-H318 HydrophobicContact CG-CB 4.13Å; L101-V321 HydrophobicContact CD2-CB 4.2Å; L101-V321 HydrophobicContact CD2-CG2 3.88Å
102K91.7Very high90.9Very high75 Ų7567.3 Ų67.333%0.32632%0.324SS..Hα-helixtrans-70.8-31.6178.6-160.7-175.4179-179.20113.1L98 M99 Y100 G105 E106 H318L98-K102 WeakPolarHBondContact O-CB 3.31Å; L98-K102 PolarHBondContact O-N 3.42Å; M99-K102 PolarHBondContact O-N 2.88Å; Y100-K102 VanDerWaalsContact C-N 3.33Å; Y100-K102 PolarHBondContact O-N 2.87Å; K102-G105 CarbonylContact O-C 3.53Å; K102-G105 WeakPolarHBondContact O-CA 3.33Å; K102-G105 PolarHBondContact O-N 3.3Å; K102-E106 PolarHBondContact O-N 3.37Å; K102-H318 HydrophobicContact CB-CB 4.38Å; K102-H318 VanDerWaalsContact CB-CD2 3.43Å; K102-H318 WeakPolarHBondContact CB-CD2 3.16Å
103F95.8Very high91.3Very high104 Ų10466.8 Ų66.846%0.45631%0.312SS..Hα-helixtrans-54.5-45.6-162.4-175.9-109.2000114.9M99 Y100 G105 E106 I107M99-F103 WeakPolarHBondContact O-CB 3.3Å; M99-F103 PolarHBondContact O-N 3.46Å; Y100-F103 PolarHBondContact O-N 3.14Å; F103-G105 VanDerWaalsContact C-N 3.26Å; F103-G105 PolarHBondContact O-N 3.29Å; F103-E106 WeakPolarHBondContact O-CB 3.09Å; F103-E106 PolarHBondContact O-N 2.9Å; F103-E106 VanDerWaalsContact O-N 3.12Å; F103-I107 HydrophobicContact CD1-CD1 3.83Å; F103-I107 HydrophobicContact CE1-CD1 3.44Å; F103-I107 VanDerWaalsContact CE1-CD1 3.44Å; F103-I107 HydrophobicContact CE1-CG1 4.24Å; F103-I107 HydrophobicContact CE2-CG1 4.47Å; F103-I107 HydrophobicContact CZ-CD1 3.83Å; F103-I107 HydrophobicContact CZ-CG1 4.19Å; F103-I107 WeakPolarHBondContact O-CG1 3.49Å; F103-I107 PolarHBondContact O-N 3.44Å
104P95.5Very high91.6Very high25 Ų2571.1 Ų71.116%0.16233%0.334CS..Hα-helixtrans-62.2-35.5176.3-22.334.3000112.7Y100 F108 Y307 I310 F314Y100-P104 WeakPolarHBondContact O-CD 3.43Å; P104-F108 PolarHBondContact O-N 3.48Å; P104-Y307 WeakPolarHBondContact O-CE1 3.41Å; P104-Y307 PolarHBondContact O-OH 3.18Å; P104-I310 HydrophobicContact CB-CG2 4.43Å; P104-F314 HydrophobicContact CB-CB 4Å; P104-F314 HydrophobicContact CB-CD1 4.38Å; P104-F314 HydrophobicContact CB-CD2 3.52Å; P104-F314 HydrophobicContact CB-CE2 4.07Å; P104-F314 HydrophobicContact CB-CG 3.71Å; P104-F314 HydrophobicContact CG-CB 4.3Å; P104-F314 HydrophobicContact CG-CD1 3.89Å; P104-F314 HydrophobicContact CG-CD2 3.84Å; P104-F314 HydrophobicContact CG-CE1 4.14Å; P104-F314 HydrophobicContact CG-CE2 4.1Å; P104-F314 HydrophobicContact CG-CG 3.74Å; P104-F314 HydrophobicContact CG-CZ 4.24Å
105G91.3Very high91.7Very high0 Ų068.1 Ų68.10%032%0.315CS..Hα-helixtrans-68.4-37.6173.500000113.2K102 F103 F108 L109K102-G105 CarbonylContact O-C 3.53Å; K102-G105 WeakPolarHBondContact O-CA 3.33Å; K102-G105 PolarHBondContact O-N 3.3Å; F103-G105 VanDerWaalsContact C-N 3.26Å; F103-G105 PolarHBondContact O-N 3.29Å; G105-F108 WeakPolarHBondContact O-CB 3.48Å; G105-F108 PolarHBondContact O-N 3.48Å; G105-L109 PolarHBondContact O-N 2.84Å; G105-L109 VanDerWaalsContact O-N 3.11Å
106E90.7Very high91.9Very high44 Ų4463.3 Ų63.321%0.20628%0.283CS..Hα-helixtrans-65.1-40.5174.2-171.9-178.3151.100112K102 F103 F108 L109 R110K102-E106 PolarHBondContact O-N 3.37Å; F103-E106 WeakPolarHBondContact O-CB 3.09Å; F103-E106 PolarHBondContact O-N 2.9Å; F103-E106 VanDerWaalsContact O-N 3.12Å; E106-F108 VanDerWaalsContact C-N 3.27Å; E106-F108 PolarHBondContact O-N 3.31Å; E106-L109 WeakPolarHBondContact O-CB 3.37Å; E106-L109 PolarHBondContact O-N 3.01Å; E106-R110 HydrophobicContact CG-CG 4.42Å; E106-R110 WeakPolarHBondContact O-CG 3.18Å; E106-R110 PolarHBondContact O-N 3.13Å; E106-R110 IonicContact OE1-CZ 3.64Å; E106-R110 VanDerWaalsContact OE1-CZ 3.22Å; E106-R110 IonicContact OE1-NE 2.67Å; E106-R110 PolarHBondContact OE1-NE 2.87Å; E106-R110 IonicContact OE1-NH2 3.53Å; E106-R110 PolarHBondContact OE1-NH2 3.44Å
107I94.5Very high91.9Very high57 Ų5757.4 Ų57.429%0.29227%0.265SS..Hα-helixtrans-57.4-44.1174-69.7164.8000110.4F103 L109 R110 M111 Y307F103-I107 HydrophobicContact CD1-CD1 3.83Å; F103-I107 HydrophobicContact CE1-CD1 3.44Å; F103-I107 VanDerWaalsContact CE1-CD1 3.44Å; F103-I107 HydrophobicContact CE1-CG1 4.24Å; F103-I107 HydrophobicContact CE2-CG1 4.47Å; F103-I107 HydrophobicContact CZ-CD1 3.83Å; F103-I107 HydrophobicContact CZ-CG1 4.19Å; F103-I107 WeakPolarHBondContact O-CG1 3.49Å; F103-I107 PolarHBondContact O-N 3.44Å; I107-L109 PolarHBondContact O-N 2.94Å; I107-R110 PolarHBondContact O-N 3.36Å; I107-M111 HydrophobicContact CG2-CE 4.13Å; I107-M111 WeakPolarHBondContact O-CG 3.28Å; I107-M111 PolarHBondContact O-N 2.92Å; I107-Y307 HydrophobicContact CG2-CE1 4.29Å
108F92Very high91.9Very high0 Ų056.7 Ų56.70%027%0.265CS..Hα-helixtrans-58.8-48.1176.2178.5-125.7000112.2P104 G105 E106 R110 M111 L112 V304 Y307 A308 I312 L315 T377P104-F108 PolarHBondContact O-N 3.48Å; G105-F108 WeakPolarHBondContact O-CB 3.48Å; G105-F108 PolarHBondContact O-N 3.48Å; E106-F108 VanDerWaalsContact C-N 3.27Å; E106-F108 PolarHBondContact O-N 3.31Å; F108-R110 PolarHBondContact O-N 3.14Å; F108-M111 HydrophobicContact CD2-CE 4.29Å; F108-M111 PolarHBondContact O-N 2.66Å; F108-L112 HydrophobicContact CD1-CD1 4.43Å; F108-L112 HydrophobicContact CE1-CD1 3.87Å; F108-L112 HydrophobicContact CE2-CD1 4.03Å; F108-L112 HydrophobicContact CE2-CD2 4.45Å; F108-L112 HydrophobicContact CE2-CG 4.15Å; F108-L112 HydrophobicContact CZ-CD1 3.63Å; F108-L112 HydrophobicContact CZ-CG 4.26Å; F108-L112 PolarHBondContact O-N 3.46Å; F108-L112 VanDerWaalsContact O-N 3.09Å; F108-V304 HydrophobicContact CD2-CG1 4.35Å; F108-V304 HydrophobicContact CE2-CG1 4.19Å; F108-Y307 HydrophobicContact CB-CD1 3.73Å; F108-Y307 HydrophobicContact CB-CE1 3.77Å; F108-Y307 AromaticContact CD2-CD1 3.95Å; F108-Y307 HydrophobicContact CD2-CD1 3.95Å; F108-Y307 HydrophobicContact CG-CD1 4.2Å; F108-A308 HydrophobicContact CE1-CB 4.19Å; F108-A308 HydrophobicContact CE2-CB 3.6Å; F108-A308 HydrophobicContact CZ-CB 3.4Å; F108-I312 HydrophobicContact CE1-CG1 4.43Å; F108-L315 HydrophobicContact CD1-CD1 4.18Å; F108-T377 HydrophobicContact CE1-CG2 3.9Å; F108-T377 HydrophobicContact CZ-CG2 4.29Å
109L88.1Confident92Very high28 Ų2855.1 Ų55.115%0.14726%0.256CS..Hα-helixtrans-58.9-44.9176.3-83175.8000112.7G105 E106 I107 M111 L112 Q113 L315 T381 A386G105-L109 PolarHBondContact O-N 2.84Å; G105-L109 VanDerWaalsContact O-N 3.11Å; E106-L109 WeakPolarHBondContact O-CB 3.37Å; E106-L109 PolarHBondContact O-N 3.01Å; I107-L109 PolarHBondContact O-N 2.94Å; L109-M111 VanDerWaalsContact C-N 3.33Å; L109-M111 PolarHBondContact O-N 2.83Å; L109-L112 PolarHBondContact O-N 3.16Å; L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 WeakPolarHBondContact O-CG 3.33Å; L109-Q113 PolarHBondContact O-N 3.36Å; L109-L315 HydrophobicContact CD1-CD1 4.45Å; L109-L315 HydrophobicContact CD1-CD2 3.84Å; L109-L315 HydrophobicContact CG-CD1 4.28Å; L109-L315 HydrophobicContact CG-CD2 4.44Å; L109-T381 HydrophobicContact CD1-CG2 4.34Å; L109-T381 HydrophobicContact CD2-CG2 3.21Å; L109-T381 HydrophobicContact CG-CG2 3.96Å; L109-A386 HydrophobicContact CD2-CB 3.89Å
110R91.5Very high91.9Very high155 Ų15549.9 Ų49.959%0.58523%0.231SC*.Hα-helixtrans-62.9-39.8177.9-73.5176.7177.9-92.21.6111.8E106 I107 F108 Q113 M114E106-R110 HydrophobicContact CG-CG 4.42Å; E106-R110 WeakPolarHBondContact O-CG 3.18Å; E106-R110 PolarHBondContact O-N 3.13Å; E106-R110 IonicContact OE1-CZ 3.64Å; E106-R110 VanDerWaalsContact OE1-CZ 3.22Å; E106-R110 IonicContact OE1-NE 2.67Å; E106-R110 PolarHBondContact OE1-NE 2.87Å; E106-R110 IonicContact OE1-NH2 3.53Å; E106-R110 PolarHBondContact OE1-NH2 3.44Å; I107-R110 PolarHBondContact O-N 3.36Å; F108-R110 PolarHBondContact O-N 3.14Å; R110-Q113 PolarHBondContact O-N 2.77Å; R110-M114 WeakPolarHBondContact O-CB 3.44Å; R110-M114 PolarHBondContact O-N 3.02Å
111M92.6Very high91.8Very high45 Ų4543.9 Ų43.922%0.22221%0.209CC..Hα-helixtrans-62.4-41.5174.9-73-170.5-65.900112.1I107 F108 L109 L115 V304 Y307I107-M111 HydrophobicContact CG2-CE 4.13Å; I107-M111 WeakPolarHBondContact O-CG 3.28Å; I107-M111 PolarHBondContact O-N 2.92Å; F108-M111 HydrophobicContact CD2-CE 4.29Å; F108-M111 PolarHBondContact O-N 2.66Å; L109-M111 VanDerWaalsContact C-N 3.33Å; L109-M111 PolarHBondContact O-N 2.83Å; M111-L115 WeakPolarHBondContact O-CG 3.19Å; M111-V304 HydrophobicContact CB-CB 4.49Å; M111-V304 HydrophobicContact CB-CG1 3.64Å; M111-V304 HydrophobicContact CB-CG2 3.98Å; M111-V304 HydrophobicContact CE-CG1 4.36Å; M111-V304 HydrophobicContact SD-CG2 4.3Å; M111-Y307 HydrophobicContact CE-CD1 3.25Å; M111-Y307 HydrophobicContact CE-CD2 4.28Å; M111-Y307 HydrophobicContact CE-CE1 3.84Å; M111-Y307 HydrophobicContact CE-CG 3.5Å
112L88.9Confident91.8Very high0 Ų043 Ų430%020%0.204CC..Hα-helixtrans-66.4-48.1175-69.3175.6000111.3F108 L109 M114 L115 I116 V304 T377 A386F108-L112 HydrophobicContact CD1-CD1 4.43Å; F108-L112 HydrophobicContact CE1-CD1 3.87Å; F108-L112 HydrophobicContact CE2-CD1 4.03Å; F108-L112 HydrophobicContact CE2-CD2 4.45Å; F108-L112 HydrophobicContact CE2-CG 4.15Å; F108-L112 HydrophobicContact CZ-CD1 3.63Å; F108-L112 HydrophobicContact CZ-CG 4.26Å; F108-L112 PolarHBondContact O-N 3.46Å; F108-L112 VanDerWaalsContact O-N 3.09Å; L109-L112 PolarHBondContact O-N 3.16Å; L112-M114 VanDerWaalsContact C-N 3.28Å; L112-M114 PolarHBondContact O-N 2.86Å; L112-L115 WeakPolarHBondContact O-CA 3.3Å; L112-L115 WeakPolarHBondContact O-CB 3.48Å; L112-L115 PolarHBondContact O-N 3.49Å; L112-I116 WeakPolarHBondContact O-CG1 3.49Å; L112-I116 PolarHBondContact O-N 3.09Å; L112-V304 HydrophobicContact CD2-CG1 3.82Å; L112-V304 HydrophobicContact CG-CG1 4.2Å; L112-T377 HydrophobicContact CD1-CG2 4.04Å; L112-A386 WeakPolarHBondContact CB-O 3.36Å; L112-A386 WeakPolarHBondContact CD1-O 3.39Å
113Q87.9Confident91.7Very high106 Ų10639.4 Ų39.450%0.49519%0.188SC..Hα-helixtrans-58.8-38-179.5-75.3177.2-12.200113.1L109 R110 L115 I116L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 WeakPolarHBondContact O-CG 3.33Å; L109-Q113 PolarHBondContact O-N 3.36Å; R110-Q113 PolarHBondContact O-N 2.77Å; Q113-L115 PolarHBondContact O-N 3.2Å; Q113-I116 HydrophobicContact CB-CD1 4.26Å; Q113-I116 HydrophobicContact CG-CD1 3.99Å; Q113-I116 PolarHBondContact O-N 2.69Å
114M90.5Very high91.4Very high131 Ų13134.5 Ų34.565%0.64517%0.167SC*.Hα-helixtrans-59.6-28.9174.1-176.2175.165.800112.9R110 L112R110-M114 WeakPolarHBondContact O-CB 3.44Å; R110-M114 PolarHBondContact O-N 3.02Å; L112-M114 VanDerWaalsContact C-N 3.28Å; L112-M114 PolarHBondContact O-N 2.86Å
115L91.8Very high91.3Very high6 Ų633.3 Ų33.33%0.03116%0.159CC..Hα-helixtrans-92.2-14.6-178.5-61176.6000113.4M111 L112 Q113 L119 M297 L300 I301 V304M111-L115 WeakPolarHBondContact O-CG 3.19Å; L112-L115 WeakPolarHBondContact O-CA 3.3Å; L112-L115 WeakPolarHBondContact O-CB 3.48Å; L112-L115 PolarHBondContact O-N 3.49Å; Q113-L115 PolarHBondContact O-N 3.2Å; L115-L119 WeakPolarHBondContact O-CB 3.48Å; L115-L119 PolarHBondContact O-N 3.06Å; L115-L119 VanDerWaalsContact O-N 3.12Å; L115-M297 HydrophobicContact CD2-SD 4.05Å; L115-L300 HydrophobicContact CD1-CB 4.24Å; L115-L300 HydrophobicContact CD2-CB 3.91Å; L115-L300 HydrophobicContact CD2-CD1 3.91Å; L115-I301 HydrophobicContact CB-CG1 4.46Å; L115-I301 HydrophobicContact CD1-CB 4.48Å; L115-I301 HydrophobicContact CD1-CG1 3.73Å; L115-V304 HydrophobicContact CD1-CB 4.32Å; L115-V304 HydrophobicContact CD1-CG2 3.76Å
116I90.2Very high91.2Very high11 Ų1133.4 Ų33.46%0.05616%0.16CC..Hα-helixtrans-61.8-56.4-174.7-56.9169.4000110.8L112 Q113 L119 I120 M260 S385 P389L112-I116 WeakPolarHBondContact O-CG1 3.49Å; L112-I116 PolarHBondContact O-N 3.09Å; Q113-I116 HydrophobicContact CB-CD1 4.26Å; Q113-I116 HydrophobicContact CG-CD1 3.99Å; Q113-I116 PolarHBondContact O-N 2.69Å; I116-L119 PolarHBondContact O-N 2.88Å; I116-I120 HydrophobicContact CG2-CD1 3.45Å; I116-I120 VanDerWaalsContact CG2-CD1 3.45Å; I116-I120 HydrophobicContact CG2-CG1 4.02Å; I116-I120 WeakPolarHBondContact O-CB 3.13Å; I116-I120 VanDerWaalsContact O-CG1 3.3Å; I116-I120 WeakPolarHBondContact O-CG1 3.48Å; I116-I120 PolarHBondContact O-N 2.93Å; I116-M260 HydrophobicContact CB-CE 4.01Å; I116-M260 HydrophobicContact CG2-CE 3.29Å; I116-S385 WeakPolarHBondContact CD1-O 3.3Å; I116-P389 HydrophobicContact CB-CG 4.46Å; I116-P389 HydrophobicContact CG1-CG 3.83Å
117L92.2Very high90.9Very high48 Ų4831.4 Ų31.425%0.25115%0.151SC..Hα-helixtrans-60.9-54.6-173.5172.869.4000112.3L119 I120 I121 C210 M260 L265L117-L119 VanDerWaalsContact C-N 3.27Å; L117-L119 PolarHBondContact O-N 2.94Å; L117-I120 PolarHBondContact O-N 3.31Å; L117-I121 HydrophobicContact CD1-CD1 3.46Å; L117-I121 VanDerWaalsContact CD1-CD1 3.46Å; L117-I121 HydrophobicContact CD1-CG1 4.08Å; L117-I121 HydrophobicContact CG-CD1 4.03Å; L117-I121 WeakPolarHBondContact O-CG1 3.34Å; L117-I121 PolarHBondContact O-N 2.73Å; L117-I121 VanDerWaalsContact O-N 3.12Å; L117-C210 HydrophobicContact CD1-CB 4.27Å; L117-C210 HydrophobicContact CD2-CB 3.76Å; L117-M260 HydrophobicContact CB-CE 4.49Å; L117-M260 HydrophobicContact CB-SD 3.65Å; L117-M260 HydrophobicContact CD1-SD 3.52Å; L117-M260 VanDerWaalsContact CD1-SD 3.52Å; L117-M260 HydrophobicContact CG-SD 4.14Å; L117-L265 HydrophobicContact CD1-CD1 3.59Å; L117-L265 HydrophobicContact CD1-CD2 4.4Å
118P93.3Very high90.5Very high43 Ų4329 Ų2928%0.27914%0.138SC..Hα-helixtrans-62.9-35.9-180-21.934.5000112.3S122 M297P118-S122 WeakPolarHBondContact O-CB 3.25Å; P118-S122 PolarHBondContact O-N 3.45Å; P118-S122 PolarHBondContact O-OG 3.11Å; P118-M297 HydrophobicContact CB-CG 4.16Å; P118-M297 HydrophobicContact CB-SD 3.73Å; P118-M297 HydrophobicContact CG-SD 4.45Å
119L92.6Very high90.1Very high1 Ų129 Ų291%0.00514%0.139CC..Hα-helixtrans-66.3-52.3176.8-17674.8000111L115 I116 L117 I121 S122 T123 M297 M298 I301 P389 I392L115-L119 WeakPolarHBondContact O-CB 3.48Å; L115-L119 PolarHBondContact O-N 3.06Å; L115-L119 VanDerWaalsContact O-N 3.12Å; I116-L119 PolarHBondContact O-N 2.88Å; L117-L119 VanDerWaalsContact C-N 3.27Å; L117-L119 PolarHBondContact O-N 2.94Å; L119-I121 VanDerWaalsContact C-N 3.31Å; L119-I121 PolarHBondContact O-N 2.84Å; L119-S122 PolarHBondContact O-N 3.31Å; L119-S122 PolarHBondContact O-OG 3.2Å; L119-S122 VanDerWaalsContact O-OG 3.12Å; L119-T123 HydrophobicContact CD1-CG2 3.47Å; L119-T123 VanDerWaalsContact CD1-CG2 3.47Å; L119-T123 HydrophobicContact CG-CG2 3.75Å; L119-T123 WeakPolarHBondContact O-CB 3.42Å; L119-T123 WeakPolarHBondContact O-CG2 3.17Å; L119-T123 PolarHBondContact O-N 3.12Å; L119-T123 PolarHBondContact O-OG1 3.17Å; L119-M297 HydrophobicContact CB-CB 4.37Å; L119-M297 HydrophobicContact CD1-CB 3.69Å; L119-M298 HydrophobicContact CD1-SD 4.19Å; L119-I301 HydrophobicContact CD1-CD1 3.78Å; L119-I301 HydrophobicContact CD2-CD1 3.52Å; L119-I301 HydrophobicContact CG-CD1 4.18Å; L119-P389 HydrophobicContact CD2-CB 3.67Å; L119-P389 HydrophobicContact CD2-CG 4.11Å; L119-I392 HydrophobicContact CD2-CD1 3.98Å
120I90.3Very high89.6Confident1 Ų130.2 Ų30.21%0.00514%0.143CC..Hα-helixtrans-55.4-49.1-178.7-72.3180000110.3I116 L117 T123 I124 M260 I262 I266 L388 P411I116-I120 HydrophobicContact CG2-CD1 3.45Å; I116-I120 VanDerWaalsContact CG2-CD1 3.45Å; I116-I120 HydrophobicContact CG2-CG1 4.02Å; I116-I120 WeakPolarHBondContact O-CB 3.13Å; I116-I120 VanDerWaalsContact O-CG1 3.3Å; I116-I120 WeakPolarHBondContact O-CG1 3.48Å; I116-I120 PolarHBondContact O-N 2.93Å; L117-I120 PolarHBondContact O-N 3.31Å; I120-T123 WeakPolarHBondContact CA-OG1 3.44Å; I120-T123 PolarHBondContact O-N 3.23Å; I120-T123 PolarHBondContact O-OG1 2.92Å; I120-T123 VanDerWaalsContact O-OG1 3.06Å; I120-I124 HydrophobicContact CG2-CD1 3.56Å; I120-I124 HydrophobicContact CG2-CG1 4.43Å; I120-I124 WeakPolarHBondContact O-CB 3.44Å; I120-I124 WeakPolarHBondContact O-CG1 3.37Å; I120-I124 PolarHBondContact O-N 3.12Å; I120-M260 HydrophobicContact CD1-CE 4.03Å; I120-I262 HydrophobicContact CD1-CD1 4.4Å; I120-I262 HydrophobicContact CD1-CG1 4.22Å; I120-I262 HydrophobicContact CD1-CG2 4.03Å; I120-I266 HydrophobicContact CG2-CG1 4.48Å; I120-L388 HydrophobicContact CD1-CD2 3.65Å; I120-L388 HydrophobicContact CG1-CD2 3.94Å; I120-P411 HydrophobicContact CD1-CB 4.5Å; I120-P411 HydrophobicContact CG1-CB 4.44Å; I120-P411 HydrophobicContact CG1-CG 4.49Å
121I92.9Very high89.1Confident23 Ų2323.2 Ų23.212%0.11812%0.118CC..Hα-helixtrans-63-53.1-178.3-64.4177.3000110.4L117 L119 T123 I124 V125 F269 F290L117-I121 HydrophobicContact CD1-CD1 3.46Å; L117-I121 VanDerWaalsContact CD1-CD1 3.46Å; L117-I121 HydrophobicContact CD1-CG1 4.08Å; L117-I121 HydrophobicContact CG-CD1 4.03Å; L117-I121 WeakPolarHBondContact O-CG1 3.34Å; L117-I121 PolarHBondContact O-N 2.73Å; L117-I121 VanDerWaalsContact O-N 3.12Å; L119-I121 VanDerWaalsContact C-N 3.31Å; L119-I121 PolarHBondContact O-N 2.84Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.18Å; I121-I124 PolarHBondContact O-N 3.32Å; I121-V125 WeakPolarHBondContact O-CG2 3.16Å; I121-V125 PolarHBondContact O-N 3.38Å; I121-F269 HydrophobicContact CB-CD2 4.33Å; I121-F269 HydrophobicContact CB-CE2 4.21Å; I121-F269 HydrophobicContact CB-CZ 4.35Å; I121-F269 HydrophobicContact CD1-CD2 4.25Å; I121-F269 HydrophobicContact CD1-CE2 3.45Å; I121-F269 VanDerWaalsContact CD1-CE2 3.45Å; I121-F269 HydrophobicContact CD1-CZ 3.76Å; I121-F269 HydrophobicContact CG1-CD2 3.72Å; I121-F269 HydrophobicContact CG1-CE2 3.45Å; I121-F269 VanDerWaalsContact CG1-CE2 3.45Å; I121-F269 HydrophobicContact CG1-CG 4.46Å; I121-F269 HydrophobicContact CG1-CZ 3.97Å; I121-F269 HydrophobicContact CG2-CD1 3.75Å; I121-F269 HydrophobicContact CG2-CD2 4.05Å; I121-F269 HydrophobicContact CG2-CE1 3.45Å; I121-F269 VanDerWaalsContact CG2-CE1 3.45Å; I121-F269 HydrophobicContact CG2-CE2 3.8Å; I121-F269 HydrophobicContact CG2-CG 4.04Å; I121-F269 HydrophobicContact CG2-CZ 3.48Å; I121-F269 VanDerWaalsContact CG2-CZ 3.48Å; I121-F290 HydrophobicContact CG2-CD1 4.23Å; I121-F290 HydrophobicContact CG2-CE1 3.57Å; I121-F290 HydrophobicContact CG2-CZ 4.31Å
122S93.8Very high88.6Confident0 Ų022.7 Ų22.70%012%0.116CC..Hα-helixtrans-64.1-36.2-177.461.80000112.8P118 L119 S126 F290 E294P118-S122 WeakPolarHBondContact O-CB 3.25Å; P118-S122 PolarHBondContact O-N 3.45Å; P118-S122 PolarHBondContact O-OG 3.11Å; L119-S122 PolarHBondContact O-N 3.31Å; L119-S122 PolarHBondContact O-OG 3.2Å; L119-S122 VanDerWaalsContact O-OG 3.12Å; S122-S126 WeakPolarHBondContact O-CB 3.45Å; S122-S126 PolarHBondContact O-N 3.13Å; S122-S126 PolarHBondContact O-OG 3.1Å; S122-F290 WeakPolarHBondContact CB-O 3.41Å; S122-E294 WeakPolarHBondContact OG-CA 3.27Å
123T88.5Confident88.2Confident0 Ų027.1 Ų27.10%014%0.143CC..Hα-helixtrans-73.4-42.3-179.557.20000112.4L119 I120 I121 S126 S127 E294 R407L119-T123 HydrophobicContact CD1-CG2 3.47Å; L119-T123 VanDerWaalsContact CD1-CG2 3.47Å; L119-T123 HydrophobicContact CG-CG2 3.75Å; L119-T123 WeakPolarHBondContact O-CB 3.42Å; L119-T123 WeakPolarHBondContact O-CG2 3.17Å; L119-T123 PolarHBondContact O-N 3.12Å; L119-T123 PolarHBondContact O-OG1 3.17Å; I120-T123 WeakPolarHBondContact CA-OG1 3.44Å; I120-T123 PolarHBondContact O-N 3.23Å; I120-T123 PolarHBondContact O-OG1 2.92Å; I120-T123 VanDerWaalsContact O-OG1 3.06Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.18Å; T123-S126 PolarHBondContact O-OG 2.81Å; T123-S127 WeakPolarHBondContact O-CB 2.97Å; T123-S127 PolarHBondContact O-N 3.19Å; T123-S127 PolarHBondContact O-OG 2.99Å; T123-E294 HydrophobicContact CG2-CG 3.73Å; T123-R407 HydrophobicContact CG2-CG 3.85Å
124I91.3Very high88.1Confident0 Ų030.6 Ų30.60%015%0.152CC..Hα-helixtrans-64.3-49.4176.1-69.9172.5000110.3I120 I121 S127 I128 I266 F269 V270 R407I120-I124 HydrophobicContact CG2-CD1 3.56Å; I120-I124 HydrophobicContact CG2-CG1 4.43Å; I120-I124 WeakPolarHBondContact O-CB 3.44Å; I120-I124 WeakPolarHBondContact O-CG1 3.37Å; I120-I124 PolarHBondContact O-N 3.12Å; I121-I124 PolarHBondContact O-N 3.32Å; I124-S127 PolarHBondContact O-N 3.35Å; I124-I128 HydrophobicContact CG2-CD1 3.7Å; I124-I128 HydrophobicContact CG2-CG1 4.47Å; I124-I128 WeakPolarHBondContact O-CB 3.36Å; I124-I128 WeakPolarHBondContact O-CG1 3.31Å; I124-I128 PolarHBondContact O-N 3.01Å; I124-I266 HydrophobicContact CD1-CB 4.09Å; I124-I266 HydrophobicContact CD1-CG1 3.6Å; I124-I266 HydrophobicContact CD1-CG2 4.24Å; I124-F269 HydrophobicContact CB-CB 4.49Å; I124-F269 HydrophobicContact CG2-CB 3.95Å; I124-V270 HydrophobicContact CG2-CG2 4.03Å; I124-R407 WeakPolarHBondContact CG1-O 3.46Å
125V92.6Very high87.9Confident0 Ų024.6 Ų24.60%012%0.122CC..Hα-helixtrans-65.1-48.4-178.8-179.20000110.9I121 S127 A129 F269 F272 A273 I276 F290I121-V125 WeakPolarHBondContact O-CG2 3.16Å; I121-V125 PolarHBondContact O-N 3.38Å; V125-S127 VanDerWaalsContact C-N 3.28Å; V125-S127 PolarHBondContact O-N 3.27Å; V125-A129 WeakPolarHBondContact O-CB 3.33Å; V125-A129 PolarHBondContact O-N 3.22Å; V125-F269 HydrophobicContact CG2-CB 4.11Å; V125-F269 HydrophobicContact CG2-CD1 3.57Å; V125-F269 HydrophobicContact CG2-CE1 4.43Å; V125-F269 HydrophobicContact CG2-CG 4.21Å; V125-F272 HydrophobicContact CG1-CD1 4.43Å; V125-F272 HydrophobicContact CG1-CE1 4.4Å; V125-F272 HydrophobicContact CG2-CD1 3.9Å; V125-F272 HydrophobicContact CG2-CE1 4.27Å; V125-A273 HydrophobicContact CB-CB 4.49Å; V125-A273 HydrophobicContact CG1-CB 4.36Å; V125-A273 HydrophobicContact CG2-CB 4.49Å; V125-I276 HydrophobicContact CG1-CD1 3.68Å; V125-F290 HydrophobicContact CB-CB 4.06Å; V125-F290 HydrophobicContact CB-CD1 4.29Å; V125-F290 HydrophobicContact CB-CD2 3.94Å; V125-F290 HydrophobicContact CB-CE2 4.49Å; V125-F290 HydrophobicContact CB-CG 3.83Å; V125-F290 HydrophobicContact CG1-CB 4Å; V125-F290 HydrophobicContact CG1-CD2 3.39Å; V125-F290 HydrophobicContact CG1-CE2 4.01Å; V125-F290 HydrophobicContact CG1-CG 3.75Å; V125-F290 HydrophobicContact CG2-CD2 4.37Å; V125-F290 HydrophobicContact CG2-CE2 4.45Å; V125-F290 HydrophobicContact CG2-CG 4.42Å
126S88.7Confident87.7Confident3 Ų325.3 Ų25.32%0.02113%0.129CC..Hα-helixtrans-62.4-34.3178.464.30000112.5S122 T123 Q130S122-S126 WeakPolarHBondContact O-CB 3.45Å; S122-S126 PolarHBondContact O-N 3.13Å; S122-S126 PolarHBondContact O-OG 3.1Å; T123-S126 PolarHBondContact O-OG 2.81Å; S126-Q130 VanDerWaalsContact O-CD 3.28Å; S126-Q130 WeakPolarHBondContact O-CG 3.5Å; S126-Q130 PolarHBondContact O-NE2 3.03Å
127S85.6Confident87.6Confident1 Ų126.9 Ų26.91%0.00715%0.148CC..Hα-helixtrans-76.5-53.6179.7-74.70000113.5T123 I124 V125 Q130 P403 R404 R407T123-S127 WeakPolarHBondContact O-CB 2.97Å; T123-S127 PolarHBondContact O-N 3.19Å; T123-S127 PolarHBondContact O-OG 2.99Å; I124-S127 PolarHBondContact O-N 3.35Å; V125-S127 VanDerWaalsContact C-N 3.28Å; V125-S127 PolarHBondContact O-N 3.27Å; S127-Q130 WeakPolarHBondContact O-CB 3.42Å; S127-Q130 PolarHBondContact O-N 2.93Å; S127-P403 PolarHBondContact OG-O 3.13Å; S127-R404 WeakPolarHBondContact OG-CA 3.48Å; S127-R407 WeakPolarHBondContact OG-CB 3.38Å; S127-R407 WeakPolarHBondContact OG-CD 3.2Å
128I86.2Confident87.5Confident6 Ų626.3 Ų26.33%0.03114%0.144CC..Hα-helixtrans-72.9-35.1-173.8-63.4178.2000110.4I124 Q130 L131 V270 A273 I274 F408I124-I128 HydrophobicContact CG2-CD1 3.7Å; I124-I128 HydrophobicContact CG2-CG1 4.47Å; I124-I128 WeakPolarHBondContact O-CB 3.36Å; I124-I128 WeakPolarHBondContact O-CG1 3.31Å; I124-I128 PolarHBondContact O-N 3.01Å; I128-Q130 PolarHBondContact O-N 3.14Å; I128-Q130 VanDerWaalsContact O-N 3.09Å; I128-L131 PolarHBondContact O-N 3.47Å; I128-V270 HydrophobicContact CD1-CB 3.93Å; I128-V270 HydrophobicContact CD1-CG1 4Å; I128-V270 HydrophobicContact CD1-CG2 3.39Å; I128-A273 HydrophobicContact CB-CB 3.72Å; I128-A273 HydrophobicContact CG2-CB 3.78Å; I128-I274 HydrophobicContact CG2-CG1 4.05Å; I128-F408 HydrophobicContact CD1-CD2 3.92Å; I128-F408 HydrophobicContact CD1-CE2 4.44Å
129A83.4Confident87.4Confident2 Ų224.4 Ų24.42%0.01713%0.131CC..THydrogen-bonded Turntrans-67.7-10.7176.200000112.9V125 A273 I276 S277 R287V125-A129 WeakPolarHBondContact O-CB 3.33Å; V125-A129 PolarHBondContact O-N 3.22Å; A129-A273 HydrophobicContact CB-CB 4.39Å; A129-I276 HydrophobicContact CB-CB 4.48Å; A129-I276 HydrophobicContact CB-CG2 3.93Å; A129-S277 VanDerWaalsContact C-OG 3.28Å; A129-S277 WeakPolarHBondContact CA-OG 3.45Å; A129-S277 PolarHBondContact O-OG 2.92Å; A129-R287 HydrophobicContact CB-CG 3.86Å; A129-R287 VanDerWaalsContact O-CZ 3.31Å; A129-R287 PolarHBondContact O-NE 3.45Å; A129-R287 PolarHBondContact O-NH2 3.28Å
130Q76.5Confident87.3Confident52 Ų5225.1 Ų25.124%0.24314%0.139CC..THydrogen-bonded Turntrans-95.1-9173-70.2-177.867.700113.4S126 S127 I128S126-Q130 VanDerWaalsContact O-CD 3.28Å; S126-Q130 WeakPolarHBondContact O-CG 3.5Å; S126-Q130 PolarHBondContact O-NE2 3.03Å; S127-Q130 WeakPolarHBondContact O-CB 3.42Å; S127-Q130 PolarHBondContact O-N 2.93Å; I128-Q130 PolarHBondContact O-N 3.14Å; I128-Q130 VanDerWaalsContact O-N 3.09Å
131L81.6Confident87.5Confident8 Ų829.3 Ų29.34%0.04216%0.16CC..SBendtrans-96.5146.6179.7-66.5176000110.7I128 T135 A136 L139 R404 L521I128-L131 PolarHBondContact O-N 3.47Å; L131-T135 HydrophobicContact CD2-CG2 3.84Å; L131-A136 HydrophobicContact CB-CB 4.37Å; L131-A136 HydrophobicContact CD1-CB 4.5Å; L131-L139 HydrophobicContact CD1-CD2 4.05Å; L131-R404 HydrophobicContact CD1-CB 4.35Å; L131-R404 HydrophobicContact CD2-CB 4.34Å; L131-R404 HydrophobicContact CD2-CG 4.44Å; L131-R404 HydrophobicContact CG-CB 4.48Å; L131-L521 HydrophobicContact CD2-CD2 3.82Å
132N82.2Confident87.7Confident35 Ų3530.8 Ų30.819%0.18716%0.164CC..  trans-69.4154.4162.267.812.9000109.8R134 T135 A136 S524 E527N132-R134 PolarHBondContact O-N 3.1Å; N132-T135 PolarHBondContact O-N 3.03Å; N132-T135 VanDerWaalsContact O-N 3.16Å; N132-T135 WeakPolarHBondContact OD1-CA 3.46Å; N132-T135 WeakPolarHBondContact OD1-CB 3.16Å; N132-T135 PolarHBondContact OD1-N 3.42Å; N132-T135 PolarHBondContact OD1-OG1 2.76Å; N132-A136 PolarHBondContact O-N 3.29Å; N132-S524 PolarHBondContact N-OG 3.02Å; N132-E527 PolarHBondContact ND2-OE2 3.33Å
133T80.3Confident87.7Confident93 Ų9330.8 Ų30.857%0.57116%0.164SC*.Hα-helixtrans-57.4-35.8-176.750.80000112.5G137 I274T133-G137 PolarHBondContact O-N 3.17Å; T133-I274 HydrophobicContact CG2-CG2 4.27Å
134R85.7Confident87.9Confident179 Ų17934.8 Ų34.868%0.67519%0.188SC*.Hα-helixtrans-63.7-48.6176.6-172177.3-179.3173.83.7112.4N132 A136 G137 E138N132-R134 PolarHBondContact O-N 3.1Å; R134-A136 VanDerWaalsContact C-N 3.33Å; R134-A136 PolarHBondContact O-N 3.42Å; R134-G137 PolarHBondContact O-N 3.1Å; R134-E138 VanDerWaalsContact O-CG 3.31Å; R134-E138 WeakPolarHBondContact O-CG 3.41Å; R134-E138 PolarHBondContact O-N 3.46Å
135T86.9Confident88.1Confident5 Ų539 Ų393%0.03121%0.21CC..Hα-helixtrans-68.1-35.4180-57.60000111.2L131 N132 G137 E138 L139 Y520 L521L131-T135 HydrophobicContact CD2-CG2 3.84Å; N132-T135 PolarHBondContact O-N 3.03Å; N132-T135 VanDerWaalsContact O-N 3.16Å; N132-T135 WeakPolarHBondContact OD1-CA 3.46Å; N132-T135 WeakPolarHBondContact OD1-CB 3.16Å; N132-T135 PolarHBondContact OD1-N 3.42Å; N132-T135 PolarHBondContact OD1-OG1 2.76Å; T135-G137 VanDerWaalsContact C-N 3.33Å; T135-E138 PolarHBondContact O-N 3.24Å; T135-L139 VanDerWaalsContact O-CB 3.31Å; T135-L139 WeakPolarHBondContact O-CB 3.45Å; T135-L139 PolarHBondContact O-N 2.97Å; T135-Y520 PolarHBondContact OG1-O 3.16Å; T135-L521 HydrophobicContact CG2-CD2 4.07Å
136A86Confident88.3Confident20 Ų2039.8 Ų39.817%0.16521%0.213CC..Hα-helixtrans-60.8-42.8172.800000111.8L131 N132 R134 L139 G140L131-A136 HydrophobicContact CB-CB 4.37Å; L131-A136 HydrophobicContact CD1-CB 4.5Å; N132-A136 PolarHBondContact O-N 3.29Å; R134-A136 VanDerWaalsContact C-N 3.33Å; R134-A136 PolarHBondContact O-N 3.42Å; A136-L139 PolarHBondContact O-N 3.06Å; A136-G140 PolarHBondContact O-N 2.92Å
137G88Confident88.6Confident45 Ų4540 Ų4046%0.46421%0.213SC..Hα-helixtrans-63-45.9175.600000113.3T133 R134 T135 G140 M141T133-G137 PolarHBondContact O-N 3.17Å; R134-G137 PolarHBondContact O-N 3.1Å; T135-G137 VanDerWaalsContact C-N 3.33Å; G137-G140 PolarHBondContact O-N 3.19Å; G137-M141 WeakPolarHBondContact O-CB 3.35Å; G137-M141 PolarHBondContact O-N 2.72Å
138E91.4Very high88.9Confident36 Ų3645.8 Ų45.817%0.16824%0.239CC..Hα-helixtrans-62.3-43.9176.9-63.6-77.7-177.300111.3R134 T135 G140 M141 Y142 Y520R134-E138 VanDerWaalsContact O-CG 3.31Å; R134-E138 WeakPolarHBondContact O-CG 3.41Å; R134-E138 PolarHBondContact O-N 3.46Å; T135-E138 PolarHBondContact O-N 3.24Å; E138-G140 VanDerWaalsContact C-N 3.34Å; E138-G140 PolarHBondContact O-N 3.01Å; E138-M141 PolarHBondContact O-N 3.17Å; E138-M141 WeakPolarHBondContact OE2-CE 3.29Å; E138-Y142 HydrophobicContact CB-CE2 4.37Å; E138-Y142 WeakPolarHBondContact O-CD2 3.21Å; E138-Y142 PolarHBondContact O-N 3.22Å; E138-Y520 HydrophobicContact CB-CD1 4.4Å; E138-Y520 HydrophobicContact CB-CE1 4.43Å; E138-Y520 HydrophobicContact CG-CD1 3.93Å; E138-Y520 HydrophobicContact CG-CE1 3.71Å
139L91.7Very high89.3Confident2 Ų248.4 Ų48.41%0.0126%0.255CS..Hα-helixtrans-57.3-47.2174.8-176.971.6000111.3L131 T135 A136 T143 R404 V405 F408 V409 V513 C517L131-L139 HydrophobicContact CD1-CD2 4.05Å; T135-L139 VanDerWaalsContact O-CB 3.31Å; T135-L139 WeakPolarHBondContact O-CB 3.45Å; T135-L139 PolarHBondContact O-N 2.97Å; A136-L139 PolarHBondContact O-N 3.06Å; L139-T143 WeakPolarHBondContact O-CB 3.43Å; L139-T143 PolarHBondContact O-N 3.39Å; L139-T143 VanDerWaalsContact O-N 3.14Å; L139-T143 PolarHBondContact O-OG1 3.48Å; L139-R404 WeakPolarHBondContact CD2-O 3.37Å; L139-V405 HydrophobicContact CD1-CB 4.26Å; L139-V405 HydrophobicContact CD1-CG1 4.13Å; L139-V405 HydrophobicContact CD1-CG2 3.83Å; L139-F408 HydrophobicContact CD2-CB 4Å; L139-F408 HydrophobicContact CD2-CD1 3.88Å; L139-F408 HydrophobicContact CD2-CG 4.07Å; L139-F408 HydrophobicContact CG-CD1 3.96Å; L139-V409 HydrophobicContact CD1-CG2 4.5Å; L139-V513 HydrophobicContact CD1-CG1 3.65Å; L139-C517 HydrophobicContact CD1-CB 4.41Å
140G90.6Very high89.9Confident16 Ų1648.3 Ų48.317%0.16525%0.254CS..Hα-helixtrans-58.1-50.4175.500000112.7A136 G137 E138 T143 V144A136-G140 PolarHBondContact O-N 2.92Å; G137-G140 PolarHBondContact O-N 3.19Å; E138-G140 VanDerWaalsContact C-N 3.34Å; E138-G140 PolarHBondContact O-N 3.01Å; G140-T143 WeakPolarHBondContact O-CB 3.22Å; G140-T143 PolarHBondContact O-N 3.36Å; G140-V144 WeakPolarHBondContact O-CG2 3.13Å; G140-V144 PolarHBondContact O-N 2.95Å
141M94.2Very high90.7Very high90 Ų9046 Ų4644%0.44324%0.244SC..Hα-helixtrans-60.5-49.8-178.5-177.8-177.66600112.3G137 E138 T143 V144 I145G137-M141 WeakPolarHBondContact O-CB 3.35Å; G137-M141 PolarHBondContact O-N 2.72Å; E138-M141 PolarHBondContact O-N 3.17Å; E138-M141 WeakPolarHBondContact OE2-CE 3.29Å; M141-T143 PolarHBondContact O-N 2.85Å; M141-V144 PolarHBondContact O-N 2.93Å; M141-I145 HydrophobicContact CG-CD1 3.8Å; M141-I145 VanDerWaalsContact O-CG1 3.32Å; M141-I145 WeakPolarHBondContact O-CG1 3.5Å; M141-I145 PolarHBondContact O-N 3.36Å
142Y95.6Very high91.2Very high54 Ų5450 Ų5021%0.21226%0.261CS..Hα-helixtrans-62.5-33.7178.6-74.6-60.2000112.5E138 Y146 L516 C517 Y520E138-Y142 HydrophobicContact CB-CE2 4.37Å; E138-Y142 WeakPolarHBondContact O-CD2 3.21Å; E138-Y142 PolarHBondContact O-N 3.22Å; Y142-Y146 WeakPolarHBondContact O-CB 3.23Å; Y142-Y146 PolarHBondContact O-N 3.38Å; Y142-L516 HydrophobicContact CD1-CB 4.21Å; Y142-L516 HydrophobicContact CD1-CD1 3.84Å; Y142-L516 HydrophobicContact CD2-CB 4.4Å; Y142-L516 HydrophobicContact CE1-CB 4.4Å; Y142-L516 HydrophobicContact CE1-CD1 4.41Å; Y142-L516 HydrophobicContact CG-CB 4.21Å; Y142-L516 HydrophobicContact CG-CD1 4.3Å; Y142-C517 VanDerWaalsContact CD2-SG 3.52Å; Y142-Y520 HydrophobicContact CE2-CE2 4.06Å
143T94.9Very high91.9Very high0 Ų051.6 Ų51.60%027%0.269CS..Hα-helixtrans-65.2-49.6176.7-55.70000111.3L139 G140 M141 I145 Y146 Y147 F408 V409 L412L139-T143 WeakPolarHBondContact O-CB 3.43Å; L139-T143 PolarHBondContact O-N 3.39Å; L139-T143 VanDerWaalsContact O-N 3.14Å; L139-T143 PolarHBondContact O-OG1 3.48Å; G140-T143 WeakPolarHBondContact O-CB 3.22Å; G140-T143 PolarHBondContact O-N 3.36Å; M141-T143 PolarHBondContact O-N 2.85Å; T143-I145 PolarHBondContact O-N 2.77Å; T143-Y146 PolarHBondContact O-N 3.35Å; T143-Y147 HydrophobicContact CG2-CD2 3.71Å; T143-Y147 HydrophobicContact CG2-CE2 3.23Å; T143-Y147 WeakPolarHBondContact O-CD2 3.3Å; T143-Y147 VanDerWaalsContact O-CG 3.32Å; T143-Y147 PolarHBondContact O-N 3.19Å; T143-F408 HydrophobicContact CG2-CE1 4.35Å; T143-V409 HydrophobicContact CG2-CB 4.42Å; T143-V409 HydrophobicContact CG2-CG1 4.13Å; T143-V409 HydrophobicContact CG2-CG2 4.15Å; T143-V409 WeakPolarHBondContact OG1-CG2 3.43Å; T143-L412 HydrophobicContact CG2-CD2 3.89Å
144V93.3Very high92.7Very high83 Ų8347.2 Ų47.250%0.50324%0.242SC..Hα-helixtrans-63-43.6178.8173.30000111.4G140 M141 Y146 Y147 F148G140-V144 WeakPolarHBondContact O-CG2 3.13Å; G140-V144 PolarHBondContact O-N 2.95Å; M141-V144 PolarHBondContact O-N 2.93Å; V144-Y146 VanDerWaalsContact C-N 3.34Å; V144-Y146 PolarHBondContact O-N 3.02Å; V144-Y147 PolarHBondContact O-N 2.93Å; V144-F148 WeakPolarHBondContact O-CB 3.3Å; V144-F148 PolarHBondContact O-N 2.89Å
145I95.1Very high93.2Very high89 Ų8938.7 Ų38.746%0.45621%0.21SC..Hα-helixtrans-60.4-45.8177.4-69.7169.3000110.6M141 T143 T149M141-I145 HydrophobicContact CG-CD1 3.8Å; M141-I145 VanDerWaalsContact O-CG1 3.32Å; M141-I145 WeakPolarHBondContact O-CG1 3.5Å; M141-I145 PolarHBondContact O-N 3.36Å; T143-I145 PolarHBondContact O-N 2.77Å; I145-T149 VanDerWaalsContact O-CB 3.26Å; I145-T149 WeakPolarHBondContact O-CB 3.34Å; I145-T149 PolarHBondContact O-N 3.22Å; I145-T149 PolarHBondContact O-OG1 3Å
146Y96.4Very high93.6Very high17 Ų1741.1 Ų41.17%0.06723%0.225CC..Hα-helixtrans-59.7-53.1178.6173-100.1000111Y142 T143 V144 F148 T149 T150 L355 G505 G509 I512Y142-Y146 WeakPolarHBondContact O-CB 3.23Å; Y142-Y146 PolarHBondContact O-N 3.38Å; T143-Y146 PolarHBondContact O-N 3.35Å; V144-Y146 VanDerWaalsContact C-N 3.34Å; V144-Y146 PolarHBondContact O-N 3.02Å; Y146-F148 PolarHBondContact O-N 3.01Å; Y146-T149 PolarHBondContact O-N 3.27Å; Y146-T149 VanDerWaalsContact O-N 3.16Å; Y146-T150 HydrophobicContact CD2-CG2 4.03Å; Y146-T150 HydrophobicContact CE1-CG2 4.1Å; Y146-T150 HydrophobicContact CE2-CG2 3.49Å; Y146-T150 VanDerWaalsContact CE2-CG2 3.49Å; Y146-T150 PolarHBondContact O-N 3.37Å; Y146-T150 PolarHBondContact O-OG1 2.97Å; Y146-L355 HydrophobicContact CE2-CD1 4.45Å; Y146-G505 PolarHBondContact OH-O 3.09Å; Y146-G505 VanDerWaalsContact OH-O 3.07Å; Y146-G509 PolarHBondContact OH-N 3.04Å; Y146-I512 HydrophobicContact CD2-CD1 4.32Å; Y146-I512 HydrophobicContact CD2-CG2 4.35Å; Y146-I512 HydrophobicContact CE2-CD1 3.58Å
147Y94.5Very high94.1Very high6 Ų641.2 Ų41.22%0.02422%0.222CC..Hα-helixtrans-61.9-46.2-178-65.1-25.7000113.2T143 V144 T149 T150 T151 V409 L412 G413 I416 N417T143-Y147 HydrophobicContact CG2-CD2 3.71Å; T143-Y147 HydrophobicContact CG2-CE2 3.23Å; T143-Y147 WeakPolarHBondContact O-CD2 3.3Å; T143-Y147 VanDerWaalsContact O-CG 3.32Å; T143-Y147 PolarHBondContact O-N 3.19Å; V144-Y147 PolarHBondContact O-N 2.93Å; Y147-T149 VanDerWaalsContact C-N 3.26Å; Y147-T149 PolarHBondContact O-N 3.41Å; Y147-T150 PolarHBondContact O-N 2.96Å; Y147-T150 PolarHBondContact O-OG1 3.43Å; Y147-T151 VanDerWaalsContact O-CB 3.3Å; Y147-T151 WeakPolarHBondContact O-CB 3.42Å; Y147-T151 PolarHBondContact O-N 3.25Å; Y147-T151 PolarHBondContact O-OG1 3.4Å; Y147-V409 HydrophobicContact CE1-CG1 4.46Å; Y147-V409 VanDerWaalsContact OH-C 3.29Å; Y147-V409 WeakPolarHBondContact OH-CG1 3.14Å; Y147-V409 PolarHBondContact OH-O 3.38Å; Y147-L412 HydrophobicContact CE2-CB 4.39Å; Y147-L412 HydrophobicContact CE2-CD2 4.32Å; Y147-L412 HydrophobicContact CE2-CG 4.18Å; Y147-G413 VanDerWaalsContact CZ-CA 3.46Å; Y147-G413 VanDerWaalsContact OH-CA 3.28Å; Y147-G413 WeakPolarHBondContact OH-CA 3.32Å; Y147-G413 PolarHBondContact OH-N 2.9Å; Y147-I416 HydrophobicContact CD2-CD1 3.83Å; Y147-I416 HydrophobicContact CD2-CG1 3.88Å; Y147-I416 HydrophobicContact CE2-CD1 4.42Å; Y147-I416 HydrophobicContact CE2-CG1 4.3Å; Y147-N417 WeakPolarHBondContact CA-OD1 3.5Å; Y147-N417 WeakPolarHBondContact CB-OD1 3.01Å; Y147-N417 HydrophobicContact CD1-CB 3.39Å; Y147-N417 WeakPolarHBondContact CD1-ND2 3.44Å; Y147-N417 WeakPolarHBondContact CD1-OD1 3.45Å; Y147-N417 HydrophobicContact CD2-CB 3.91Å; Y147-N417 HydrophobicContact CE1-CB 3.72Å; Y147-N417 HydrophobicContact CE2-CB 4.16Å; Y147-N417 HydrophobicContact CG-CB 3.51Å
148F92.5Very high94.5Very high123 Ų12339.1 Ų39.154%0.53920%0.2SC..Hα-helixtrans-60.4-40.7176.1-174-95.1000111.5V144 Y146 F152 T453V144-F148 WeakPolarHBondContact O-CB 3.3Å; V144-F148 PolarHBondContact O-N 2.89Å; Y146-F148 PolarHBondContact O-N 3.01Å; F148-F152 WeakPolarHBondContact O-CB 3.04Å; F148-F152 PolarHBondContact O-N 3.44Å; F148-T453 HydrophobicContact CE2-CG2 4.43Å
149T93.8Very high94.7Very high61 Ų6138.2 Ų38.237%0.37420%0.196SC..Hα-helixtrans-67.5-47.3-179.8-56.50000111.9I145 Y146 Y147 F152 L153I145-T149 VanDerWaalsContact O-CB 3.26Å; I145-T149 WeakPolarHBondContact O-CB 3.34Å; I145-T149 PolarHBondContact O-N 3.22Å; I145-T149 PolarHBondContact O-OG1 3Å; Y146-T149 PolarHBondContact O-N 3.27Å; Y146-T149 VanDerWaalsContact O-N 3.16Å; Y147-T149 VanDerWaalsContact C-N 3.26Å; Y147-T149 PolarHBondContact O-N 3.41Å; T149-F152 PolarHBondContact O-N 2.85Å; T149-L153 HydrophobicContact CG2-CD1 4.1Å; T149-L153 HydrophobicContact CG2-CG 4.49Å; T149-L153 WeakPolarHBondContact O-CB 3.2Å; T149-L153 VanDerWaalsContact O-CG 3.23Å; T149-L153 WeakPolarHBondContact O-CG 3.39Å; T149-L153 PolarHBondContact O-N 2.97Å
150T95.8Very high94.9Very high0 Ų042 Ų420%022%0.219CC..Hα-helixtrans-66.4-43-179.250.30000111.8Y146 Y147 F152 L153 A154 L352 L355 N417 D419Y146-T150 HydrophobicContact CD2-CG2 4.03Å; Y146-T150 HydrophobicContact CE1-CG2 4.1Å; Y146-T150 HydrophobicContact CE2-CG2 3.49Å; Y146-T150 VanDerWaalsContact CE2-CG2 3.49Å; Y146-T150 PolarHBondContact O-N 3.37Å; Y146-T150 PolarHBondContact O-OG1 2.97Å; Y147-T150 PolarHBondContact O-N 2.96Å; Y147-T150 PolarHBondContact O-OG1 3.43Å; T150-F152 PolarHBondContact O-N 3.49Å; T150-L153 PolarHBondContact O-N 2.69Å; T150-A154 WeakPolarHBondContact O-CB 3.41Å; T150-A154 PolarHBondContact O-N 2.93Å; T150-L352 HydrophobicContact CG2-CD2 4.06Å; T150-L355 HydrophobicContact CG2-CD1 3.7Å; T150-N417 PolarHBondContact OG1-OD1 2.79Å; T150-D419 VanDerWaalsContact C-OD1 3.27Å; T150-D419 WeakPolarHBondContact CB-OD2 3.32Å; T150-D419 PolarHBondContact OG1-OD1 2.75Å; T150-D419 PolarHBondContact OG1-OD2 3.45Å
151T94.5Very high95.2Very high4 Ų442.4 Ų42.43%0.02522%0.217CC..Hα-helixtrans-64.8-43.2178.7-61.60000110.7Y147 L153 A154 V155 N417 D419 A422 T453 S456Y147-T151 VanDerWaalsContact O-CB 3.3Å; Y147-T151 WeakPolarHBondContact O-CB 3.42Å; Y147-T151 PolarHBondContact O-N 3.25Å; Y147-T151 PolarHBondContact O-OG1 3.4Å; T151-L153 PolarHBondContact O-N 3.23Å; T151-A154 WeakPolarHBondContact O-CB 3.38Å; T151-A154 PolarHBondContact O-N 2.82Å; T151-V155 WeakPolarHBondContact O-CG2 3.44Å; T151-V155 PolarHBondContact O-N 2.92Å; T151-N417 PolarHBondContact OG1-OD1 2.82Å; T151-D419 WeakPolarHBondContact CA-OD1 3.5Å; T151-D419 PolarHBondContact N-OD1 3.21Å; T151-D419 PolarHBondContact OG1-OD1 3.25Å; T151-A422 HydrophobicContact CG2-CB 3.62Å; T151-T453 HydrophobicContact CG2-CG2 4.1Å; T151-S456 WeakPolarHBondContact CG2-OG 3.37Å
152F92.6Very high95.2Very high92 Ų9238.1 Ų38.140%0.40420%0.196SC..Hα-helixtrans-61.8-43.4175.2-177.7-103000112.3F148 T149 T150 A154 V155 V156F148-F152 WeakPolarHBondContact O-CB 3.04Å; F148-F152 PolarHBondContact O-N 3.44Å; T149-F152 PolarHBondContact O-N 2.85Å; T150-F152 PolarHBondContact O-N 3.49Å; F152-A154 VanDerWaalsContact C-N 3.33Å; F152-A154 PolarHBondContact O-N 3.07Å; F152-V155 PolarHBondContact O-N 3.38Å; F152-V156 HydrophobicContact CD1-CG2 4.22Å; F152-V156 HydrophobicContact CE1-CG2 3.8Å; F152-V156 HydrophobicContact CE2-CG2 4.22Å; F152-V156 HydrophobicContact CZ-CG2 3.8Å; F152-V156 WeakPolarHBondContact O-CG2 3.46Å; F152-V156 PolarHBondContact O-N 3.23Å
153L95.5Very high95.1Very high69 Ų6938.5 Ų38.536%0.36120%0.201SC..Hα-helixtrans-61-41.6175-72.5173.1000111.7T149 T150 T151 V156 E157 V351T149-L153 HydrophobicContact CG2-CD1 4.1Å; T149-L153 HydrophobicContact CG2-CG 4.49Å; T149-L153 WeakPolarHBondContact O-CB 3.2Å; T149-L153 VanDerWaalsContact O-CG 3.23Å; T149-L153 WeakPolarHBondContact O-CG 3.39Å; T149-L153 PolarHBondContact O-N 2.97Å; T150-L153 PolarHBondContact O-N 2.69Å; T151-L153 PolarHBondContact O-N 3.23Å; L153-V156 PolarHBondContact O-N 3.32Å; L153-E157 WeakPolarHBondContact O-CB 3.42Å; L153-E157 PolarHBondContact O-N 2.85Å; L153-V351 HydrophobicContact CB-CG1 4.45Å; L153-V351 HydrophobicContact CD1-CG1 4.15Å
154A97.2Very high95.1Very high0 Ų043.1 Ų43.10%023%0.229CC..Hα-helixtrans-62.9-41.3177.600000112.1T150 T151 F152 E157 G158 D419 L423T150-A154 WeakPolarHBondContact O-CB 3.41Å; T150-A154 PolarHBondContact O-N 2.93Å; T151-A154 WeakPolarHBondContact O-CB 3.38Å; T151-A154 PolarHBondContact O-N 2.82Å; F152-A154 VanDerWaalsContact C-N 3.33Å; F152-A154 PolarHBondContact O-N 3.07Å; A154-E157 PolarHBondContact O-N 3.01Å; A154-G158 PolarHBondContact O-N 3.44Å; A154-D419 HydrophobicContact CB-CB 3.92Å; A154-D419 WeakPolarHBondContact CB-O 3.28Å; A154-L423 HydrophobicContact CB-CB 4.18Å; A154-L423 HydrophobicContact CB-CD1 4.49Å; A154-L423 WeakPolarHBondContact O-CD1 3.38Å; A154-L423 WeakPolarHBondContact O-CG 3.45Å
155V96.1Very high95.1Very high0 Ų041.4 Ų41.40%022%0.216CC..Hα-helixtrans-65.4-48176.1170.10000111.3T151 F152 E157 G158 I159 A422 A426 S449 A452T151-V155 WeakPolarHBondContact O-CG2 3.44Å; T151-V155 PolarHBondContact O-N 2.92Å; F152-V155 PolarHBondContact O-N 3.38Å; V155-E157 VanDerWaalsContact C-N 3.3Å; V155-E157 PolarHBondContact O-N 2.85Å; V155-G158 PolarHBondContact O-N 3.05Å; V155-I159 HydrophobicContact CG1-CD1 3.8Å; V155-I159 HydrophobicContact CG1-CG1 4.46Å; V155-I159 VanDerWaalsContact O-CG1 3.28Å; V155-I159 WeakPolarHBondContact O-CG1 3.27Å; V155-I159 PolarHBondContact O-N 3.46Å; V155-A422 HydrophobicContact CG2-CB 3.45Å; V155-A422 VanDerWaalsContact CG2-CB 3.45Å; V155-A426 HydrophobicContact CG1-CB 4.3Å; V155-S449 WeakPolarHBondContact CG1-OG 3.44Å; V155-A452 HydrophobicContact CG2-CB 4.42Å
156V94.9Very high94.9Very high56 Ų5643.3 Ų43.334%0.33922%0.218SC..Hα-helixtrans-59.5-43.9177.2170.40000110.7F152 L153 I159 V160F152-V156 HydrophobicContact CD1-CG2 4.22Å; F152-V156 HydrophobicContact CE1-CG2 3.8Å; F152-V156 HydrophobicContact CE2-CG2 4.22Å; F152-V156 HydrophobicContact CZ-CG2 3.8Å; F152-V156 WeakPolarHBondContact O-CG2 3.46Å; F152-V156 PolarHBondContact O-N 3.23Å; L153-V156 PolarHBondContact O-N 3.32Å; V156-I159 PolarHBondContact O-N 2.95Å; V156-V160 HydrophobicContact CG1-CG2 4.33Å; V156-V160 WeakPolarHBondContact O-CB 3.49Å; V156-V160 VanDerWaalsContact O-CG2 3.27Å; V156-V160 WeakPolarHBondContact O-CG2 3.49Å; V156-V160 PolarHBondContact O-N 3.49Å
157E96.8Very high94.7Very high23 Ų2342.6 Ų42.611%0.10722%0.215CC..Hα-helixtrans-59-48.1175.4-178.6-176.6168.200112L153 A154 V155 I159 V160 L161 I346 H347 L423L153-E157 WeakPolarHBondContact O-CB 3.42Å; L153-E157 PolarHBondContact O-N 2.85Å; A154-E157 PolarHBondContact O-N 3.01Å; V155-E157 VanDerWaalsContact C-N 3.3Å; V155-E157 PolarHBondContact O-N 2.85Å; E157-I159 PolarHBondContact O-N 3.44Å; E157-V160 PolarHBondContact O-N 3.06Å; E157-L161 HydrophobicContact CG-CD1 4.12Å; E157-L161 WeakPolarHBondContact O-CB 3.4Å; E157-L161 VanDerWaalsContact O-CG 3.31Å; E157-L161 WeakPolarHBondContact O-CG 3.22Å; E157-L161 PolarHBondContact O-N 3.36Å; E157-I346 WeakPolarHBondContact OE1-CB 3.45Å; E157-I346 WeakPolarHBondContact OE1-CG2 3.34Å; E157-H347 PolarHBondContact OE1-N 2.73Å; E157-H347 WeakPolarHBondContact OE2-CB 3.48Å; E157-H347 IonicContact OE2-CG 3.96Å; E157-H347 IonicContact OE2-ND1 3.91Å; E157-H347 PolarHBondContact OE2-ND1 3.25Å; E157-L423 HydrophobicContact CG-CD1 4.46Å
158G97.4Very high94.3Very high0 Ų042.4 Ų42.40%022%0.216CC..Hα-helixtrans-58.4-45.8175.600000112.7A154 V155 L161 V162 V427A154-G158 PolarHBondContact O-N 3.44Å; V155-G158 PolarHBondContact O-N 3.05Å; G158-L161 PolarHBondContact O-N 2.88Å; G158-V162 WeakPolarHBondContact O-CG1 2.78Å; G158-V162 PolarHBondContact O-N 3Å; G158-V427 WeakPolarHBondContact O-CG2 3.46Å
159I95.7Very high94Very high18 Ų1839.9 Ų39.99%0.09221%0.208CC..Hα-helixtrans-61.9-48177.3-69.7170.9000111.1V155 V156 E157 L161 V162 M163 A426 L430 V445V155-I159 HydrophobicContact CG1-CD1 3.8Å; V155-I159 HydrophobicContact CG1-CG1 4.46Å; V155-I159 VanDerWaalsContact O-CG1 3.28Å; V155-I159 WeakPolarHBondContact O-CG1 3.27Å; V155-I159 PolarHBondContact O-N 3.46Å; V156-I159 PolarHBondContact O-N 2.95Å; E157-I159 PolarHBondContact O-N 3.44Å; I159-L161 VanDerWaalsContact C-N 3.3Å; I159-L161 PolarHBondContact O-N 3.03Å; I159-V162 WeakPolarHBondContact O-CG1 3.33Å; I159-V162 PolarHBondContact O-N 3.29Å; I159-M163 HydrophobicContact CG2-CG 4.24Å; I159-M163 VanDerWaalsContact O-CB 3.27Å; I159-M163 WeakPolarHBondContact O-CB 3.4Å; I159-M163 WeakPolarHBondContact O-CG 3.4Å; I159-M163 PolarHBondContact O-N 3.05Å; I159-A426 HydrophobicContact CG1-CB 4.19Å; I159-L430 HydrophobicContact CB-CD1 4.37Å; I159-L430 HydrophobicContact CG1-CD1 3.87Å; I159-L430 HydrophobicContact CG2-CD1 4.32Å; I159-V445 HydrophobicContact CD1-CG1 4.13Å; I159-V445 HydrophobicContact CG2-CG1 3.45Å; I159-V445 VanDerWaalsContact CG2-CG1 3.45Å
160V95.5Very high93.5Very high80 Ų8043.3 Ų43.349%0.48521%0.214SC..Hα-helixtrans-60.1-43.71791690000110.3V156 E157 T164V156-V160 HydrophobicContact CG1-CG2 4.33Å; V156-V160 WeakPolarHBondContact O-CB 3.49Å; V156-V160 VanDerWaalsContact O-CG2 3.27Å; V156-V160 WeakPolarHBondContact O-CG2 3.49Å; V156-V160 PolarHBondContact O-N 3.49Å; E157-V160 PolarHBondContact O-N 3.06Å; V160-T164 HydrophobicContact CG1-CG2 4.39Å; V160-T164 WeakPolarHBondContact O-CB 3.34Å; V160-T164 WeakPolarHBondContact O-CG2 3.49Å; V160-T164 PolarHBondContact O-N 3.41Å; V160-T164 PolarHBondContact O-OG1 3.36Å
161L96.8Very high92.3Very high25 Ų2544.2 Ų44.213%0.13122%0.22CC..Hα-helixtrans-66.8-44.9-180-72.8170.5000112.9E157 G158 I159 M163 T164 I165 T339 I346E157-L161 HydrophobicContact CG-CD1 4.12Å; E157-L161 WeakPolarHBondContact O-CB 3.4Å; E157-L161 VanDerWaalsContact O-CG 3.31Å; E157-L161 WeakPolarHBondContact O-CG 3.22Å; E157-L161 PolarHBondContact O-N 3.36Å; G158-L161 PolarHBondContact O-N 2.88Å; I159-L161 VanDerWaalsContact C-N 3.3Å; I159-L161 PolarHBondContact O-N 3.03Å; L161-M163 VanDerWaalsContact C-N 3.34Å; L161-M163 PolarHBondContact O-N 3.26Å; L161-T164 WeakPolarHBondContact CA-OG1 3.12Å; L161-T164 PolarHBondContact O-N 2.83Å; L161-T164 PolarHBondContact O-OG1 3.39Å; L161-T164 VanDerWaalsContact O-OG1 3.06Å; L161-I165 HydrophobicContact CD2-CD1 4.4Å; L161-I165 VanDerWaalsContact O-CB 3.31Å; L161-I165 WeakPolarHBondContact O-CB 3.47Å; L161-I165 WeakPolarHBondContact O-CG1 3.47Å; L161-I165 PolarHBondContact O-N 2.72Å; L161-T339 HydrophobicContact CB-CG2 4.05Å; L161-I346 HydrophobicContact CD1-CD1 4.25Å; L161-I346 HydrophobicContact CD2-CD1 4.22Å
162V95.3Very high90.8Very high0 Ų051.4 Ų51.40%025%0.253CS..Hα-helixtrans-70.2-32.1179.871.30000112.2G158 I159 R166 P167 T339 V427 L430 Q434G158-V162 WeakPolarHBondContact O-CG1 2.78Å; G158-V162 PolarHBondContact O-N 3Å; I159-V162 WeakPolarHBondContact O-CG1 3.33Å; I159-V162 PolarHBondContact O-N 3.29Å; V162-R166 VanDerWaalsContact O-CA 3.31Å; V162-R166 WeakPolarHBondContact O-CA 3.24Å; V162-R166 PolarHBondContact O-N 3.44Å; V162-P167 HydrophobicContact CG2-CG 3.84Å; V162-P167 WeakPolarHBondContact O-CD 3.45Å; V162-T339 HydrophobicContact CB-CG2 4.06Å; V162-V427 HydrophobicContact CB-CG1 4.23Å; V162-V427 HydrophobicContact CB-CG2 4.42Å; V162-V427 HydrophobicContact CG2-CG1 4.22Å; V162-L430 HydrophobicContact CG1-CB 3.67Å; V162-L430 HydrophobicContact CG1-CD1 3.44Å; V162-L430 VanDerWaalsContact CG1-CD1 3.44Å; V162-L430 HydrophobicContact CG1-CG 4.19Å; V162-L430 HydrophobicContact CG2-CB 4.02Å; V162-Q434 PolarHBondContact O-NE2 3.41Å
163M93.1Very high89.3Confident62 Ų6252.1 Ų52.131%0.30526%0.261SS..Hα-helixtrans-73.5-30.4175.4-69.5-67.3169.900112.9I159 L161 R166 L430 L440 V445I159-M163 HydrophobicContact CG2-CG 4.24Å; I159-M163 VanDerWaalsContact O-CB 3.27Å; I159-M163 WeakPolarHBondContact O-CB 3.4Å; I159-M163 WeakPolarHBondContact O-CG 3.4Å; I159-M163 PolarHBondContact O-N 3.05Å; L161-M163 VanDerWaalsContact C-N 3.34Å; L161-M163 PolarHBondContact O-N 3.26Å; M163-R166 VanDerWaalsContact O-CG 3.23Å; M163-R166 WeakPolarHBondContact O-CG 3.4Å; M163-L430 HydrophobicContact CE-CD1 3.73Å; M163-L430 HydrophobicContact CE-CD2 3.76Å; M163-L430 HydrophobicContact CE-CG 4.21Å; M163-L440 HydrophobicContact CE-CB 4.18Å; M163-L440 HydrophobicContact CE-CD1 3.74Å; M163-L440 HydrophobicContact CE-CG 4.48Å; M163-L440 HydrophobicContact SD-CD1 4.43Å; M163-V445 HydrophobicContact CE-CG2 3.47Å; M163-V445 VanDerWaalsContact CE-CG2 3.47Å
164T93.5Very high87.5Confident97 Ų9752.8 Ų52.860%0.59526%0.262SS*.Hα-helixtrans-85-45.3179.450.30000112.7V160 L161V160-T164 HydrophobicContact CG1-CG2 4.39Å; V160-T164 WeakPolarHBondContact O-CB 3.34Å; V160-T164 WeakPolarHBondContact O-CG2 3.49Å; V160-T164 PolarHBondContact O-N 3.41Å; V160-T164 PolarHBondContact O-OG1 3.36Å; L161-T164 WeakPolarHBondContact CA-OG1 3.12Å; L161-T164 PolarHBondContact O-N 2.83Å; L161-T164 PolarHBondContact O-OG1 3.39Å; L161-T164 VanDerWaalsContact O-OG1 3.06Å
165I93.7Very high85.6Confident47 Ų4756.8 Ų56.824%0.24129%0.289CS..Hα-helixtrans-75.1-32.4-179.9-63.5172.1000111L161 P167 W170 T339L161-I165 HydrophobicContact CD2-CD1 4.4Å; L161-I165 VanDerWaalsContact O-CB 3.31Å; L161-I165 WeakPolarHBondContact O-CB 3.47Å; L161-I165 WeakPolarHBondContact O-CG1 3.47Å; L161-I165 PolarHBondContact O-N 2.72Å; I165-P167 HydrophobicContact CG2-CB 4.49Å; I165-W170 HydrophobicContact CG2-CH2 3.9Å; I165-W170 HydrophobicContact CG2-CZ2 3.69Å; I165-T339 HydrophobicContact CD1-CG2 4.28Å
166R92Very high83.7Confident130 Ų13059.4 Ų59.449%0.49131%0.305SS..  trans48.756.9-175.1-60.7-177.655.3142.44.4112.8V162 M163 G168 D169V162-R166 VanDerWaalsContact O-CA 3.31Å; V162-R166 WeakPolarHBondContact O-CA 3.24Å; V162-R166 PolarHBondContact O-N 3.44Å; M163-R166 VanDerWaalsContact O-CG 3.23Å; M163-R166 WeakPolarHBondContact O-CG 3.4Å; R166-G168 PolarHBondContact O-N 2.96Å; R166-G168 VanDerWaalsContact O-N 3.13Å; R166-D169 WeakPolarHBondContact CB-OD2 3.33Å; R166-D169 IonicContact CZ-OD2 2.76Å; R166-D169 VanDerWaalsContact CZ-OD2 3.3Å; R166-D169 IonicContact NE-OD2 3.24Å; R166-D169 PolarHBondContact NE-OD2 3.24Å; R166-D169 IonicContact NH2-OD1 3.6Å; R166-D169 IonicContact NH2-OD2 3.53Å; R166-D169 PolarHBondContact NH2-OD2 2.95Å; R166-D169 VanDerWaalsContact NH2-OD2 3.09Å; R166-D169 PolarHBondContact O-N 3.19Å; R166-D169 VanDerWaalsContact O-N 3.14Å
167P90.9Very high81.6Confident1 Ų159.8 Ų59.81%0.00631%0.311CS..G310 helixtrans-62-22.6-175.426.6-35.7000113.9V162 I165 D169 W170 G335 T339 Y431V162-P167 HydrophobicContact CG2-CG 3.84Å; V162-P167 WeakPolarHBondContact O-CD 3.45Å; I165-P167 HydrophobicContact CG2-CB 4.49Å; P167-D169 PolarHBondContact O-N 3.44Å; P167-W170 WeakPolarHBondContact O-CB 3.33Å; P167-W170 PolarHBondContact O-N 3.38Å; P167-W170 VanDerWaalsContact O-N 3.16Å; P167-G335 VanDerWaalsContact CB-C 3.41Å; P167-T339 HydrophobicContact CG-CG2 4.44Å; P167-T339 WeakPolarHBondContact CG-OG1 3.42Å; P167-Y431 HydrophobicContact CB-CD2 3.99Å; P167-Y431 HydrophobicContact CB-CE2 4.37Å; P167-Y431 HydrophobicContact CG-CD2 3.93Å
168G87.7Confident79.5Confident3 Ų367.2 Ų67.23%0.03135%0.345CS..G310 helixtrans-68.2-20.9178.100000114R166 W170 S171 Q434 T435R166-G168 PolarHBondContact O-N 2.96Å; R166-G168 VanDerWaalsContact O-N 3.13Å; G168-W170 PolarHBondContact O-N 3.04Å; G168-S171 PolarHBondContact O-OG 2.81Å; G168-Q434 VanDerWaalsContact N-OE1 3.15Å; G168-T435 WeakPolarHBondContact CA-OG1 3.01Å
169D84.6Confident77.2Confident70 Ų7074.9 Ų74.937%0.37438%0.381SS..G310 helixtrans-72.9-15.8174.7-65.1-28000111.8R166 P167R166-D169 WeakPolarHBondContact CB-OD2 3.33Å; R166-D169 IonicContact CZ-OD2 2.76Å; R166-D169 VanDerWaalsContact CZ-OD2 3.3Å; R166-D169 IonicContact NE-OD2 3.24Å; R166-D169 PolarHBondContact NE-OD2 3.24Å; R166-D169 IonicContact NH2-OD1 3.6Å; R166-D169 IonicContact NH2-OD2 3.53Å; R166-D169 PolarHBondContact NH2-OD2 2.95Å; R166-D169 VanDerWaalsContact NH2-OD2 3.09Å; R166-D169 PolarHBondContact O-N 3.19Å; R166-D169 VanDerWaalsContact O-N 3.14Å; P167-D169 PolarHBondContact O-N 3.44Å
170W83Confident75.1Confident132 Ų13275.8 Ų75.850%0.539%0.391SS..G310 helixtrans-86.3-14.1-175.3-56.36.1000112.5I165 P167 G168 H172I165-W170 HydrophobicContact CG2-CH2 3.9Å; I165-W170 HydrophobicContact CG2-CZ2 3.69Å; P167-W170 WeakPolarHBondContact O-CB 3.33Å; P167-W170 PolarHBondContact O-N 3.38Å; P167-W170 VanDerWaalsContact O-N 3.16Å; G168-W170 PolarHBondContact O-N 3.04Å; W170-H172 PolarHBondContact O-N 2.94Å
171S72.3Confident73.1Confident20 Ų2072.9 Ų72.914%0.1437%0.374CS..  trans-90.4101.4178.338.30000111.1G168 T435G168-S171 PolarHBondContact O-OG 2.81Å; S171-T435 WeakPolarHBondContact OG-CG2 3.42Å; S171-T435 PolarHBondContact OG-OG1 3.25Å
172H63Low71Confident154 Ų15480.4 Ų80.471%0.71341%0.414SS*.  trans-94.5-16.6179.9-77.3-74.3000115.1W170W170-H172 PolarHBondContact O-N 2.94Å
173D60.9Low69.1Low107 Ų10784.7 Ų84.757%0.57244%0.444SS*.  trans-114.899.3-179.7-75-15.6000111.4R332D173-R332 IonicContact OD2-NH2 3.25Å; D173-R332 PolarHBondContact OD2-NH2 2.9Å
174F58.2Low67.7Low84 Ų8482.8 Ų82.837%0.36844%0.439SS..  trans-99.595.6179.1-146.8-90.4000110.3V176 T435 L436 Y483 L486F174-V176 HydrophobicContact CD1-CG2 4.37Å; F174-V176 HydrophobicContact CE1-CG2 3.76Å; F174-T435 HydrophobicContact CD2-CG2 3.34Å; F174-T435 HydrophobicContact CE2-CG2 3.22Å; F174-T435 HydrophobicContact CZ-CG2 4.44Å; F174-L436 HydrophobicContact CE1-CD2 4.15Å; F174-L436 HydrophobicContact CZ-CD2 3.92Å; F174-Y483 AromaticContact CE1-CD1 3.65Å; F174-Y483 HydrophobicContact CE1-CD1 3.65Å; F174-Y483 AromaticContact CE1-CE1 3.47Å; F174-Y483 HydrophobicContact CE1-CE1 3.47Å; F174-Y483 VanDerWaalsContact CE1-CE1 3.47Å; F174-Y483 AromaticContact CZ-CD1 3.58Å; F174-Y483 HydrophobicContact CZ-CD1 3.58Å; F174-Y483 AromaticContact CZ-CE1 3.84Å; F174-Y483 HydrophobicContact CZ-CE1 3.84Å; F174-L486 HydrophobicContact CE2-CD2 3.87Å; F174-L486 HydrophobicContact CZ-CD2 4.32Å
175S55.7Low66.7Low83 Ų8379.1 Ų79.158%0.5842%0.416SS*.  trans-125.8111.4162.2480000106.5S177S175-S177 PolarHBondContact O-N 3.23Å
176V55.9Low66.1Low55 Ų5578.1 Ų78.133%0.33341%0.413SS..  trans-66.8114.9166-1790000104.6F174 E178 Y483F174-V176 HydrophobicContact CD1-CG2 4.37Å; F174-V176 HydrophobicContact CE1-CG2 3.76Å; V176-E178 PolarHBondContact O-N 3.44Å; V176-E178 VanDerWaalsContact O-N 3.11Å; V176-Y483 HydrophobicContact CG2-CD1 4.07Å; V176-Y483 HydrophobicContact CG2-CE1 4.11Å
177S52.5Low65.6Low65 Ų6572.1 Ų72.146%0.45539%0.391SS..  trans-53.8120163.447.50000106.9S175 E179S175-S177 PolarHBondContact O-N 3.23Å; S177-E179 PolarHBondContact O-N 3.27Å
178E50.9Low65.3Low178 Ų17872.7 Ų72.783%0.83240%0.395SS*.  trans-63.30.4177.6-73.5-174.9160.900113.3V176 A180 Q239V176-E178 PolarHBondContact O-N 3.44Å; V176-E178 VanDerWaalsContact O-N 3.11Å; E178-A180 PolarHBondContact O-N 3.17Å; E178-Q239 PolarHBondContact O-NE2 3.01Å; E178-Q239 VanDerWaalsContact O-NE2 3.15Å
179E50.6Low65.2Low161 Ų16175.1 Ų75.175%0.75241%0.407SS*.  trans-60.897.7171-68.6-176.4-177.100109.5S177S177-E179 PolarHBondContact O-N 3.27Å
180A51.7Low65.2Low37 Ų3772.9 Ų72.931%0.30640%0.398SS..  trans-56.2144.1165.900000108.8E178 D182 E235E178-A180 PolarHBondContact O-N 3.17Å; A180-D182 PolarHBondContact O-N 3.36Å; A180-E235 HydrophobicContact CB-CB 4.39Å
181P53Low65.4Low20 Ų2071.2 Ų71.213%0.1340%0.402CS..  trans-54.5140.9170.6-8.717.1000109.9S183 F484 I485 M488P181-S183 PolarHBondContact O-N 3.11Å; P181-F484 HydrophobicContact CG-CE1 4.11Å; P181-F484 HydrophobicContact CG-CE2 4.48Å; P181-F484 HydrophobicContact CG-CZ 3.52Å; P181-I485 HydrophobicContact CG-CD1 4.46Å; P181-I485 HydrophobicContact CG-CG1 4.46Å; P181-M488 HydrophobicContact CB-CE 3.98Å; P181-M488 HydrophobicContact CG-CE 3.89Å
182D52.1Low66.2Low182 Ų18271.3 Ų71.397%0.97340%0.401SS*.SBendtrans-54.2-19.9176.5-74.7-32.9000113.3A180A180-D182 PolarHBondContact O-N 3.36Å
183S56.3Low67.2Low90 Ų9064.7 Ų64.763%0.62937%0.372SS*.SBendtrans-145.8124.7171.260.60000110.5P181P181-S183 PolarHBondContact O-N 3.11Å
184A62.2Low68.5Low23 Ų2363 Ų6319%0.1936%0.362CS..PPolyproline II helixtrans-67.1131.5177.500000111.8T234 E235 M238A184-T234 HydrophobicContact CB-CG2 3.74Å; A184-E235 HydrophobicContact CB-CB 4.38Å; A184-E235 HydrophobicContact CB-CG 3.66Å; A184-E235 WeakPolarHBondContact CB-OE1 3.39Å; A184-E235 PolarHBondContact N-OE1 3.38Å; A184-M238 HydrophobicContact CB-CE 4.34Å; A184-M238 HydrophobicContact CB-SD 4.26Å
185P74.2Confident70Confident19 Ų1962.5 Ų62.512%0.12336%0.363CS..PPolyproline II helixtrans-62.9153.2170.220-27.1000112L187 M238 V468 L471 F484P185-L187 PolarHBondContact O-N 2.85Å; P185-M238 HydrophobicContact CB-CE 4.41Å; P185-M238 HydrophobicContact CG-CE 3.53Å; P185-M238 HydrophobicContact CG-SD 4.13Å; P185-M238 WeakPolarHBondContact O-CE 3.5Å; P185-V468 HydrophobicContact CB-CG2 4.08Å; P185-L471 HydrophobicContact CB-CD1 3.71Å; P185-L471 HydrophobicContact CG-CD1 3.51Å; P185-F484 HydrophobicContact CG-CE1 4.3Å; P185-F484 HydrophobicContact CG-CE2 4.17Å; P185-F484 HydrophobicContact CG-CZ 3.7Å
186C80Confident71.6Confident27 Ų2759 Ų5918%0.18234%0.338CS..PPolyproline II helixtrans-63.2128.2172.8176.30000109.6T216 C217 V468C186-T216 PolarHBondContact SG-O 2.93Å; C186-T216 VanDerWaalsContact SG-O 3.32Å; C186-C217 HydrophobicContact CB-CB 4.17Å; C186-C217 WeakPolarHBondContact CB-SG 3.27Å; C186-C217 WeakPolarHBondContact SG-CA 3.43Å; C186-C217 WeakPolarHBondContact SG-CB 3.43Å; C186-C217 CovalentContact SG-SG 2.03Å; C186-C217 PolarHBondContact SG-SG 3.37Å; C186-V468 HydrophobicContact CB-CG1 4.25Å
187L82.9Confident73.2Confident4 Ų459.1 Ų59.12%0.02134%0.336CS..PPolyproline II helixtrans-97126.3174.3-157.173.8000110.4P185 C217 M218 F220 L471 I475 T481P185-L187 PolarHBondContact O-N 2.85Å; L187-C217 WeakPolarHBondContact O-CA 3.16Å; L187-M218 PolarHBondContact O-N 3.02Å; L187-F220 HydrophobicContact CD2-CE2 4.44Å; L187-F220 HydrophobicContact CD2-CZ 3.74Å; L187-L471 HydrophobicContact CD1-CB 3.96Å; L187-L471 HydrophobicContact CD1-CD1 4.06Å; L187-I475 HydrophobicContact CD1-CD1 3.45Å; L187-I475 VanDerWaalsContact CD1-CD1 3.45Å; L187-I475 HydrophobicContact CD1-CG1 4.39Å; L187-I475 HydrophobicContact CD2-CD1 3.92Å; L187-I475 HydrophobicContact CG-CD1 3.54Å; L187-T481 HydrophobicContact CD1-CG2 3.71Å
188S83.6Confident75Confident12 Ų1260.3 Ų60.38%0.08434%0.337CS..  trans-143.4151.1177.8640000110.4T216S188-T216 WeakPolarHBondContact CB-O 3.33Å
189N85.3Confident77Confident54 Ų5456.2 Ų56.229%0.28931%0.313SS..  trans-94.2169174.4-65.5-9.5000110.6V191 D192 T193 I475N189-V191 PolarHBondContact O-N 3.29Å; N189-D192 PolarHBondContact N-OD2 3.3Å; N189-D192 WeakPolarHBondContact O-CB 3.46Å; N189-D192 PolarHBondContact O-N 3.15Å; N189-T193 PolarHBondContact O-N 3.47Å; N189-T193 VanDerWaalsContact O-N 3.09Å; N189-T193 PolarHBondContact O-OG1 2.66Å; N189-I475 WeakPolarHBondContact OD1-CG2 3.33Å
190A84.5Confident78.9Confident23 Ų2349.5 Ų49.519%0.1928%0.283CS..Hα-helixtrans-56.5-37.7-178.800000113.5T193 I194 M472A190-T193 PolarHBondContact O-N 3.31Å; A190-I194 WeakPolarHBondContact O-CG1 3.25Å; A190-I194 PolarHBondContact O-N 3.48Å; A190-I194 VanDerWaalsContact O-N 3.13Å; A190-M472 VanDerWaalsContact CA-SD 3.58Å; A190-M472 HydrophobicContact CB-CE 4.23Å; A190-M472 HydrophobicContact CB-CG 4.28Å; A190-M472 HydrophobicContact CB-SD 4.22Å
191V87.7Confident80.8Confident97 Ų9750.4 Ų50.459%0.58828%0.282SS*.Hα-helixtrans-65.4-43.1176.51800000111N189 T193 I194 L195N189-V191 PolarHBondContact O-N 3.29Å; V191-T193 VanDerWaalsContact C-N 3.32Å; V191-T193 PolarHBondContact O-N 2.87Å; V191-I194 PolarHBondContact O-N 3.21Å; V191-L195 HydrophobicContact CG1-CD1 4.08Å; V191-L195 HydrophobicContact CG1-CG 4.32Å; V191-L195 VanDerWaalsContact O-CG 3.31Å; V191-L195 WeakPolarHBondContact O-CG 3.23Å; V191-L195 PolarHBondContact O-N 2.87Å
192D88Confident82.8Confident22 Ų2254.4 Ų54.412%0.11830%0.302CS..Hα-helixtrans-62.1-41.7178.7-59.8-47.8000111.3N189 I194 L195 D196 T216 M218N189-D192 PolarHBondContact N-OD2 3.3Å; N189-D192 WeakPolarHBondContact O-CB 3.46Å; N189-D192 PolarHBondContact O-N 3.15Å; D192-I194 VanDerWaalsContact C-N 3.34Å; D192-I194 PolarHBondContact O-N 3.29Å; D192-L195 CarbonylContact O-C 3.39Å; D192-L195 PolarHBondContact O-N 2.94Å; D192-D196 WeakPolarHBondContact O-CB 3.41Å; D192-D196 PolarHBondContact O-N 3.26Å; D192-T216 HydrophobicContact CB-CG2 4.19Å; D192-M218 WeakPolarHBondContact OD2-CE 3.45Å
193T85Confident84.7Confident15 Ų1547.5 Ų47.59%0.09227%0.267CS..Hα-helixtrans-63-39176.5-57.30000112N189 A190 V191 D196 L197 M472N189-T193 PolarHBondContact O-N 3.47Å; N189-T193 VanDerWaalsContact O-N 3.09Å; N189-T193 PolarHBondContact O-OG1 2.66Å; A190-T193 PolarHBondContact O-N 3.31Å; V191-T193 VanDerWaalsContact C-N 3.32Å; V191-T193 PolarHBondContact O-N 2.87Å; T193-D196 PolarHBondContact O-N 3.08Å; T193-L197 WeakPolarHBondContact O-CB 3.42Å; T193-L197 PolarHBondContact O-N 3.46Å; T193-M472 VanDerWaalsContact CB-SD 3.57Å; T193-M472 HydrophobicContact CG2-SD 3.94Å; T193-M472 PolarHBondContact OG1-SD 3.33Å
194I87.6Confident86.4Confident73 Ų7352.3 Ų52.337%0.37428%0.28SS..Hα-helixtrans-65.9-43.8173.6-67166.7000110.7A190 V191 D192 D196 L197 I198 L454A190-I194 WeakPolarHBondContact O-CG1 3.25Å; A190-I194 PolarHBondContact O-N 3.48Å; A190-I194 VanDerWaalsContact O-N 3.13Å; V191-I194 PolarHBondContact O-N 3.21Å; D192-I194 VanDerWaalsContact C-N 3.34Å; D192-I194 PolarHBondContact O-N 3.29Å; I194-D196 VanDerWaalsContact C-N 3.32Å; I194-D196 PolarHBondContact O-N 3.29Å; I194-L197 WeakPolarHBondContact O-CB 3.32Å; I194-L197 PolarHBondContact O-N 3.28Å; I194-I198 HydrophobicContact CG2-CD1 4.49Å; I194-I198 WeakPolarHBondContact O-CG1 3.31Å; I194-I198 PolarHBondContact O-N 3.07Å; I194-I198 VanDerWaalsContact O-N 3.12Å; I194-L454 HydrophobicContact CD1-CD1 4.22Å; I194-L454 HydrophobicContact CD1-CD2 4.3Å; I194-L454 HydrophobicContact CG1-CD2 4.33Å
195L91.2Very high87.9Confident72 Ų7255 Ų5538%0.37729%0.291SS..Hα-helixtrans-64.1-39.3177.1-67.6175.9000111.4V191 D192 L197 I198 R199V191-L195 HydrophobicContact CG1-CD1 4.08Å; V191-L195 HydrophobicContact CG1-CG 4.32Å; V191-L195 VanDerWaalsContact O-CG 3.31Å; V191-L195 WeakPolarHBondContact O-CG 3.23Å; V191-L195 PolarHBondContact O-N 2.87Å; D192-L195 CarbonylContact O-C 3.39Å; D192-L195 PolarHBondContact O-N 2.94Å; L195-L197 VanDerWaalsContact C-N 3.33Å; L195-I198 PolarHBondContact O-N 3.24Å; L195-R199 WeakPolarHBondContact O-CG 3.2Å; L195-R199 PolarHBondContact O-N 2.97Å
196D88.5Confident88.8Confident11 Ų1156.9 Ų56.96%0.05930%0.3CS..Hα-helixtrans-65.7-35.9174.4-71.8-19.1000111.7D192 T193 I194 I198 R199 N200 K215 T216D192-D196 WeakPolarHBondContact O-CB 3.41Å; D192-D196 PolarHBondContact O-N 3.26Å; T193-D196 PolarHBondContact O-N 3.08Å; I194-D196 VanDerWaalsContact C-N 3.32Å; I194-D196 PolarHBondContact O-N 3.29Å; D196-I198 VanDerWaalsContact C-N 3.3Å; D196-I198 PolarHBondContact O-N 3.49Å; D196-R199 PolarHBondContact O-N 3.33Å; D196-R199 IonicContact OD1-CZ 3.14Å; D196-R199 IonicContact OD1-NH1 3.5Å; D196-R199 PolarHBondContact OD1-NH1 3.24Å; D196-N200 VanDerWaalsContact O-CB 3.32Å; D196-N200 WeakPolarHBondContact O-CB 3.35Å; D196-N200 PolarHBondContact O-N 3.09Å; D196-N200 PolarHBondContact O-ND2 3.37Å; D196-K215 WeakPolarHBondContact OD2-CA 3.36Å; D196-T216 VanDerWaalsContact CG-N 3.32Å; D196-T216 WeakPolarHBondContact OD1-CB 3.46Å; D196-T216 PolarHBondContact OD1-N 3.39Å; D196-T216 PolarHBondContact OD1-OG1 3.35Å; D196-T216 PolarHBondContact OD2-N 2.82Å
197L88.8Confident89.4Confident56 Ų5660.5 Ų60.529%0.29332%0.321SS..Hα-helixtrans-59.5-44.3172.4-170.872.3000110.6T193 I194 L195 N200 L201 L263 I457T193-L197 WeakPolarHBondContact O-CB 3.42Å; T193-L197 PolarHBondContact O-N 3.46Å; I194-L197 WeakPolarHBondContact O-CB 3.32Å; I194-L197 PolarHBondContact O-N 3.28Å; L195-L197 VanDerWaalsContact C-N 3.33Å; L197-N200 PolarHBondContact O-N 3.33Å; L197-L201 VanDerWaalsContact O-CB 3.26Å; L197-L201 WeakPolarHBondContact O-CB 3.42Å; L197-L201 PolarHBondContact O-N 2.7Å; L197-L263 HydrophobicContact CD1-CD2 3.32Å; L197-L263 HydrophobicContact CG-CD2 4.03Å; L197-I457 HydrophobicContact CD1-CG2 3.91Å; L197-I457 HydrophobicContact CD2-CG2 3.74Å
198I91.2Very high89.9Confident91 Ų9162.6 Ų62.647%0.46733%0.33SS..Hα-helixtrans-66.9-44.3177.3-62.9168.8000111.2I194 L195 D196 N200 L201 L202I194-I198 HydrophobicContact CG2-CD1 4.49Å; I194-I198 WeakPolarHBondContact O-CG1 3.31Å; I194-I198 PolarHBondContact O-N 3.07Å; I194-I198 VanDerWaalsContact O-N 3.12Å; L195-I198 PolarHBondContact O-N 3.24Å; D196-I198 VanDerWaalsContact C-N 3.3Å; D196-I198 PolarHBondContact O-N 3.49Å; I198-N200 VanDerWaalsContact C-N 3.3Å; I198-N200 PolarHBondContact O-N 3.28Å; I198-L201 WeakPolarHBondContact O-CB 3.02Å; I198-L201 PolarHBondContact O-N 3.25Å; I198-L202 PolarHBondContact O-N 3.26Å
199R92.2Very high90.4Very high91 Ų9162.1 Ų62.134%0.34333%0.327SS..Hα-helixtrans-60.8-39.7176.2-71176.1-170.4122.9-3.7112L195 D196 L202 V214 T216L195-R199 WeakPolarHBondContact O-CG 3.2Å; L195-R199 PolarHBondContact O-N 2.97Å; D196-R199 PolarHBondContact O-N 3.33Å; D196-R199 IonicContact OD1-CZ 3.14Å; D196-R199 IonicContact OD1-NH1 3.5Å; D196-R199 PolarHBondContact OD1-NH1 3.24Å; R199-L202 CarbonylContact O-C 3.56Å; R199-L202 VanDerWaalsContact O-O 3.07Å; R199-V214 HydrophobicContact CB-CG1 4.48Å; R199-T216 PolarHBondContact NH1-OG1 3.44Å
200N91.4Very high90.7Very high20 Ų2061.3 Ų61.311%0.10733%0.325CS..Hα-helixtrans-75.3-32.3176.1-74.5-61.7000111.7D196 L197 I198 L202 V214 N261 G264D196-N200 VanDerWaalsContact O-CB 3.32Å; D196-N200 WeakPolarHBondContact O-CB 3.35Å; D196-N200 PolarHBondContact O-N 3.09Å; D196-N200 PolarHBondContact O-ND2 3.37Å; L197-N200 PolarHBondContact O-N 3.33Å; I198-N200 VanDerWaalsContact C-N 3.3Å; I198-N200 PolarHBondContact O-N 3.28Å; N200-L202 VanDerWaalsContact C-N 3.29Å; N200-L202 PolarHBondContact O-N 2.7Å; N200-V214 PolarHBondContact ND2-O 3.46Å; N200-V214 PolarHBondContact OD1-N 3.45Å; N200-N261 WeakPolarHBondContact CA-ND2 3.38Å; N200-N261 WeakPolarHBondContact CB-OD1 3.4Å; N200-N261 PolarHBondContact O-ND2 3.4Å; N200-N261 PolarHBondContact O-OD1 3.13Å; N200-G264 WeakPolarHBondContact O-CA 3.47Å; N200-G264 PolarHBondContact O-N 2.98Å; N200-G264 VanDerWaalsContact O-N 3.12Å
201L91.9Very high91Very high57 Ų5767.1 Ų67.130%0.29834%0.343SS..Hα-helixtrans-63.2-38173.2-170.272.7000111.6L197 I198 P203 L263 F267L197-L201 VanDerWaalsContact O-CB 3.26Å; L197-L201 WeakPolarHBondContact O-CB 3.42Å; L197-L201 PolarHBondContact O-N 2.7Å; I198-L201 WeakPolarHBondContact O-CB 3.02Å; I198-L201 PolarHBondContact O-N 3.25Å; L201-P203 VanDerWaalsContact O-CD 3.29Å; L201-P203 WeakPolarHBondContact O-CD 3.18Å; L201-L263 HydrophobicContact CB-CD2 4.39Å; L201-L263 HydrophobicContact CD1-CD1 4.01Å; L201-L263 HydrophobicContact CD1-CD2 4.35Å; L201-L263 HydrophobicContact CD1-CG 3.95Å; L201-F267 HydrophobicContact CD1-CB 3.69Å; L201-F267 HydrophobicContact CD1-CD2 3.72Å; L201-F267 HydrophobicContact CD1-CG 3.83Å; L201-F267 HydrophobicContact CD2-CD2 4.34Å; L201-F267 HydrophobicContact CD2-CE2 4.49Å; L201-F267 HydrophobicContact CG-CB 4.22Å; L201-F267 HydrophobicContact CG-CD2 3.89Å; L201-F267 HydrophobicContact CG-CE2 4.42Å; L201-F267 HydrophobicContact CG-CG 3.94Å; L201-F267 VanDerWaalsContact O-CD1 3.26Å; L201-F267 WeakPolarHBondContact O-CD1 3.37Å
202L93.9Very high91.2Very high103 Ų10363 Ų6354%0.53932%0.319SS..SBendtrans-116.474.2179.3-61.9176.9000110.9I198 R199 N200 F267I198-L202 PolarHBondContact O-N 3.26Å; R199-L202 CarbonylContact O-C 3.56Å; R199-L202 VanDerWaalsContact O-O 3.07Å; N200-L202 VanDerWaalsContact C-N 3.29Å; N200-L202 PolarHBondContact O-N 2.7Å; L202-F267 HydrophobicContact CD2-CD1 3.87Å; L202-F267 HydrophobicContact CD2-CE1 3.27Å; L202-F267 HydrophobicContact CD2-CZ 3.83Å
203P91.8Very high91.2Very high38 Ų3862.8 Ų62.825%0.24732%0.319CS..  trans-65.4144-178.227.6-34000111.8L201 N205 A209L201-P203 VanDerWaalsContact O-CD 3.29Å; L201-P203 WeakPolarHBondContact O-CD 3.18Å; P203-N205 VanDerWaalsContact C-N 3.27Å; P203-N205 PolarHBondContact O-N 3.18Å; P203-A209 HydrophobicContact CB-CB 3.89Å; P203-A209 HydrophobicContact CG-CB 4.07Å
204E91.5Very high91.4Very high191 Ų19163.4 Ų63.489%0.89332%0.323SS*.SBendtrans-63.5-34.7177.4-61.6-178.3-173.400112.1
205N93.9Very high91.3Very high78 Ų7862.8 Ų62.842%0.41732%0.318SS..  trans-141.5130.5-178.9-170.2-68.1000111.4P203 V207 E208 A209P203-N205 VanDerWaalsContact C-N 3.27Å; P203-N205 PolarHBondContact O-N 3.18Å; N205-V207 VanDerWaalsContact C-N 3.34Å; N205-V207 PolarHBondContact O-N 3.47Å; N205-V207 WeakPolarHBondContact OD1-CA 3.08Å; N205-V207 WeakPolarHBondContact OD1-CB 3.34Å; N205-V207 PolarHBondContact OD1-N 3.31Å; N205-E208 HydrophobicContact CB-CB 3.9Å; N205-E208 PolarHBondContact O-N 3.31Å; N205-E208 PolarHBondContact OD1-N 2.96Å; N205-A209 PolarHBondContact O-N 3.48Å
206L93.3Very high91.2Very high60 Ų6059.4 Ų59.431%0.31430%0.3SS..Hα-helixtrans-65-37.4179.7-174.265.9000112.6A209 C210 L265 F268 F269L206-A209 PolarHBondContact O-N 3.42Å; L206-C210 PolarHBondContact O-N 2.82Å; L206-C210 PolarHBondContact O-SG 3.33Å; L206-L265 HydrophobicContact CD1-CD2 3.78Å; L206-F268 HydrophobicContact CD1-CB 4.26Å; L206-F268 HydrophobicContact CD1-CD1 3.56Å; L206-F268 HydrophobicContact CD1-CD2 4.49Å; L206-F268 HydrophobicContact CD1-CE1 4.01Å; L206-F268 HydrophobicContact CD1-CG 3.84Å; L206-F268 HydrophobicContact CD2-CD1 3.96Å; L206-F268 HydrophobicContact CD2-CE1 3.49Å; L206-F268 VanDerWaalsContact CD2-CE1 3.49Å; L206-F268 HydrophobicContact CD2-CZ 3.88Å; L206-F268 HydrophobicContact CG-CD1 4.41Å; L206-F268 HydrophobicContact CG-CE1 4.39Å; L206-F269 HydrophobicContact CD1-CE2 4Å; L206-F269 HydrophobicContact CD1-CZ 4.49Å; L206-F269 HydrophobicContact CD2-CE2 4.45Å; L206-F269 HydrophobicContact CD2-CZ 4.13Å
207V93.9Very high91.2Very high103 Ų10359.2 Ų59.262%0.62430%0.299SS*.Hα-helixtrans-68.7-38.6178.5-175.20000110.4N205 C210 Y211N205-V207 VanDerWaalsContact C-N 3.34Å; N205-V207 PolarHBondContact O-N 3.47Å; N205-V207 WeakPolarHBondContact OD1-CA 3.08Å; N205-V207 WeakPolarHBondContact OD1-CB 3.34Å; N205-V207 PolarHBondContact OD1-N 3.31Å; V207-C210 VanDerWaalsContact O-CB 3.32Å; V207-C210 WeakPolarHBondContact O-CB 3.49Å; V207-C210 PolarHBondContact O-N 2.8Å; V207-Y211 WeakPolarHBondContact O-CD1 3.43Å; V207-Y211 VanDerWaalsContact O-CE1 3.26Å; V207-Y211 WeakPolarHBondContact O-CE1 3.36Å
208E93.2Very high91.2Very high47 Ų4757.4 Ų57.422%0.2229%0.29CS..Hα-helixtrans-64.1-43.5173.8-172.4177.2174.700112N205 C210 Y211 S212N205-E208 HydrophobicContact CB-CB 3.9Å; N205-E208 PolarHBondContact O-N 3.31Å; N205-E208 PolarHBondContact OD1-N 2.96Å; E208-C210 PolarHBondContact O-N 3.31Å; E208-Y211 HydrophobicContact CB-CE1 4.47Å; E208-Y211 PolarHBondContact O-N 2.8Å; E208-S212 PolarHBondContact O-N 2.78Å
209A93.3Very high91Very high3 Ų355.5 Ų55.53%0.02528%0.278CS..Hα-helixtrans-57.3-25.1177.100000113.1P203 N205 L206 Y211 N261 L265P203-A209 HydrophobicContact CB-CB 3.89Å; P203-A209 HydrophobicContact CG-CB 4.07Å; N205-A209 PolarHBondContact O-N 3.48Å; L206-A209 PolarHBondContact O-N 3.42Å; A209-Y211 VanDerWaalsContact C-N 3.28Å; A209-Y211 PolarHBondContact O-N 3.25Å; A209-N261 HydrophobicContact CB-CB 4.09Å; A209-N261 PolarHBondContact O-N 3.44Å; A209-L265 HydrophobicContact CB-CD2 4.21Å; A209-L265 HydrophobicContact CB-CG 4.33Å
210C92.3Very high90.7Very high36 Ų3651.2 Ų51.224%0.24326%0.262CS..THydrogen-bonded Turntrans-67.6-22.4176.7-67.20000114.2L117 L206 V207 E208L117-C210 HydrophobicContact CD1-CB 4.27Å; L117-C210 HydrophobicContact CD2-CB 3.76Å; L206-C210 PolarHBondContact O-N 2.82Å; L206-C210 PolarHBondContact O-SG 3.33Å; V207-C210 VanDerWaalsContact O-CB 3.32Å; V207-C210 WeakPolarHBondContact O-CB 3.49Å; V207-C210 PolarHBondContact O-N 2.8Å; E208-C210 PolarHBondContact O-N 3.31Å
211Y90.9Very high90.5Very high145 Ų14554 Ų5457%0.56927%0.27SS*.THydrogen-bonded Turntrans-131.7-11.5-176.465.4-94.2000114.6V207 E208 A209 G259V207-Y211 WeakPolarHBondContact O-CD1 3.43Å; V207-Y211 VanDerWaalsContact O-CE1 3.26Å; V207-Y211 WeakPolarHBondContact O-CE1 3.36Å; E208-Y211 HydrophobicContact CB-CE1 4.47Å; E208-Y211 PolarHBondContact O-N 2.8Å; A209-Y211 VanDerWaalsContact C-N 3.28Å; A209-Y211 PolarHBondContact O-N 3.25Å; Y211-G259 CarbonylContact O-C 3.4Å; Y211-G259 PolarHBondContact O-N 2.96Å
212S90.6Very high90.2Very high12 Ų1254.7 Ų54.78%0.08428%0.275CS..EExtended strand (participates in β ladder)trans-139.8155.2-173.4-84.70000113.1E208 I256 G257 G259 N261E208-S212 PolarHBondContact O-N 2.78Å; S212-I256 VanDerWaalsContact CB-CG2 3.43Å; S212-I256 VanDerWaalsContact OG-CG2 3.25Å; S212-I256 WeakPolarHBondContact OG-CG2 3.45Å; S212-G257 WeakPolarHBondContact CA-O 3.5Å; S212-G257 PolarHBondContact OG-O 3.35Å; S212-G259 CarbonylContact C-O 3.55Å; S212-G259 WeakPolarHBondContact CA-O 3.2Å; S212-G259 PolarHBondContact N-O 2.88Å; S212-N261 VanDerWaalsContact O-CB 3.26Å; S212-N261 WeakPolarHBondContact O-CB 3.25Å; S212-N261 PolarHBondContact O-N 3.4Å
213S88.3Confident89.6Confident17 Ų1754.5 Ų54.512%0.11927%0.273CS..EExtended strand (participates in β ladder)trans-132.2150176.246.30000109.6G257 G259S213-G257 PolarHBondContact N-O 3.11Å; S213-G257 VanDerWaalsContact N-O 3.16Å; S213-G257 WeakPolarHBondContact O-CA 3.24Å; S213-G257 PolarHBondContact O-N 2.93Å; S213-G259 PolarHBondContact N-O 2.88Å; S213-G259 PolarHBondContact OG-O 3.35Å
214V89.6Confident89Confident28 Ų2855 Ų5517%0.1728%0.276CS..EExtended strand (participates in β ladder)trans-96133.9-176.3-1800000109.5R199 N200 T254R199-V214 HydrophobicContact CB-CG1 4.48Å; N200-V214 PolarHBondContact ND2-O 3.46Å; N200-V214 PolarHBondContact OD1-N 3.45Å; V214-T254 HydrophobicContact CG1-CG2 3.24Å
215K86.4Confident88.3Confident60 Ų6052.3 Ų52.326%0.26128%0.278SS..EExtended strand (participates in β ladder)trans-138.2141174.4-63.3-171.3177.7-169.80110.6D196 K255D196-K215 WeakPolarHBondContact OD2-CA 3.36Å; K215-K255 PolarHBondContact N-O 3.47Å; K215-K255 PolarHBondContact O-N 2.64Å; K215-K255 VanDerWaalsContact O-O 3.12Å
216T89.3Confident87.6Confident1 Ų153.8 Ų53.81%0.00629%0.29CS..EExtended strand (participates in β ladder)trans-91.3126.2173.9-58.60000108.9C186 S188 D192 D196 R199 P252C186-T216 PolarHBondContact SG-O 2.93Å; C186-T216 VanDerWaalsContact SG-O 3.32Å; S188-T216 WeakPolarHBondContact CB-O 3.33Å; D192-T216 HydrophobicContact CB-CG2 4.19Å; D196-T216 VanDerWaalsContact CG-N 3.32Å; D196-T216 WeakPolarHBondContact OD1-CB 3.46Å; D196-T216 PolarHBondContact OD1-N 3.39Å; D196-T216 PolarHBondContact OD1-OG1 3.35Å; D196-T216 PolarHBondContact OD2-N 2.82Å; R199-T216 PolarHBondContact NH1-OG1 3.44Å; T216-P252 HydrophobicContact CG2-CB 3.72Å
217C88Confident86.8Confident7 Ų757.5 Ų57.55%0.04731%0.31CS..EExtended strand (participates in β ladder)trans-124.1143.2174.7-55.50000110.3C186 L187 E253 K255C186-C217 HydrophobicContact CB-CB 4.17Å; C186-C217 WeakPolarHBondContact CB-SG 3.27Å; C186-C217 WeakPolarHBondContact SG-CA 3.43Å; C186-C217 WeakPolarHBondContact SG-CB 3.43Å; C186-C217 CovalentContact SG-SG 2.03Å; C186-C217 PolarHBondContact SG-SG 3.37Å; L187-C217 WeakPolarHBondContact O-CA 3.16Å; C217-E253 PolarHBondContact N-O 3.3Å; C217-E253 WeakPolarHBondContact O-CA 3.14Å; C217-E253 PolarHBondContact O-N 3.46Å; C217-K255 HydrophobicContact CB-CD 4.05Å; C217-K255 HydrophobicContact CB-CG 4.34Å
218M87.9Confident86.3Confident18 Ų1856.5 Ų56.59%0.08930%0.304CS..EExtended strand (participates in β ladder)trans-73.2131.3175.1-62.6-55.5174.800112.1L187 D192 F220 P252L187-M218 PolarHBondContact O-N 3.02Å; D192-M218 WeakPolarHBondContact OD2-CE 3.45Å; M218-F220 HydrophobicContact CB-CE1 4.26Å; M218-F220 HydrophobicContact CB-CE2 3.75Å; M218-F220 HydrophobicContact CB-CZ 3.56Å; M218-F220 HydrophobicContact CG-CZ 4.45Å; M218-P252 HydrophobicContact SD-CB 4.39Å
219K86.7Confident85.7Confident50 Ų5058.4 Ų58.422%0.21732%0.319CS..EExtended strand (participates in β ladder)trans-93.6133.7160.1-80-171.7-173.2166.50109.6E250 S251 E253K219-E250 WeakPolarHBondContact O-CA 3.48Å; K219-S251 PolarHBondContact N-O 3.38Å; K219-S251 PolarHBondContact O-N 3.2Å; K219-E253 HydrophobicContact CD-CB 4.23Å; K219-E253 WeakPolarHBondContact CE-OE1 3.37Å; K219-E253 WeakPolarHBondContact CE-OE2 3.14Å; K219-E253 HydrophobicContact CG-CB 3.98Å; K219-E253 IonicContact NZ-OE1 3.4Å; K219-E253 PolarHBondContact NZ-OE1 3.07Å; K219-E253 IonicContact NZ-OE2 3.53Å
220F87.4Confident85.3Confident1 Ų161.7 Ų61.70%0.00434%0.339CS..EExtended strand (participates in β ladder)trans-108.6130.2174.6-56.8-85.4000109.7L187 M218 V232 T234 V237 L248 E250L187-F220 HydrophobicContact CD2-CE2 4.44Å; L187-F220 HydrophobicContact CD2-CZ 3.74Å; M218-F220 HydrophobicContact CB-CE1 4.26Å; M218-F220 HydrophobicContact CB-CE2 3.75Å; M218-F220 HydrophobicContact CB-CZ 3.56Å; M218-F220 HydrophobicContact CG-CZ 4.45Å; F220-V232 HydrophobicContact CB-CB 4.19Å; F220-V232 PolarHBondContact O-N 3.41Å; F220-T234 HydrophobicContact CE2-CG2 4.34Å; F220-V237 HydrophobicContact CB-CG2 3.6Å; F220-V237 HydrophobicContact CD1-CB 4.49Å; F220-V237 HydrophobicContact CD1-CG1 3.72Å; F220-V237 HydrophobicContact CD1-CG2 4.13Å; F220-V237 HydrophobicContact CD2-CB 4.05Å; F220-V237 HydrophobicContact CD2-CG1 3.97Å; F220-V237 HydrophobicContact CD2-CG2 3.69Å; F220-V237 HydrophobicContact CE1-CG1 3.67Å; F220-V237 HydrophobicContact CE2-CB 4.3Å; F220-V237 HydrophobicContact CE2-CG1 3.94Å; F220-V237 HydrophobicContact CE2-CG2 4.43Å; F220-V237 HydrophobicContact CG-CB 4.17Å; F220-V237 HydrophobicContact CG-CG1 3.88Å; F220-V237 HydrophobicContact CG-CG2 3.53Å; F220-V237 HydrophobicContact CZ-CG1 3.79Å; F220-L248 HydrophobicContact CB-CD1 4.15Å; F220-L248 HydrophobicContact CD1-CD1 4.41Å; F220-E250 HydrophobicContact CD1-CG 3.77Å; F220-E250 VanDerWaalsContact CE1-CD 3.47Å; F220-E250 HydrophobicContact CE1-CG 3.67Å; F220-E250 WeakPolarHBondContact CE1-OE1 3.31Å
221R86.4Confident85Confident78 Ų7866.8 Ų66.829%0.29436%0.357SS..EExtended strand (participates in β ladder)trans-126.4132.2174.7-63.2-172.6-176.387.1-5.3110V230 S249 S251R221-V230 VanDerWaalsContact CA-O 3.31Å; R221-V230 WeakPolarHBondContact CA-O 3.47Å; R221-S249 PolarHBondContact N-O 3.07Å; R221-S249 PolarHBondContact O-N 2.92Å; R221-S251 PolarHBondContact NH1-OG 2.93Å
222N86Confident84.6Confident73 Ų7360.8 Ų60.839%0.3934%0.335SS..EExtended strand (participates in β ladder)trans-93.3129.1167.5-169.3-16.3000108.5V230 V232 L248N222-V230 PolarHBondContact N-O 3.37Å; N222-V230 PolarHBondContact O-N 2.96Å; N222-V232 HydrophobicContact CB-CG2 3.78Å; N222-L248 HydrophobicContact CB-CD2 3.68Å
223I81.9Confident84.2Confident98 Ų9863.3 Ų63.350%0.50335%0.351SS..EExtended strand (participates in β ladder)trans-95105.8175-54.5177000107T229I223-T229 HydrophobicContact CG1-CG2 4.36Å
224T78.8Confident83.9Confident49 Ų4963.8 Ų63.830%0.30135%0.354SS..  trans-69.7160.9176.158.70000111.3T226 N227 V228 V230T224-T226 PolarHBondContact O-N 3.5Å; T224-T226 PolarHBondContact OG1-OG1 3.32Å; T224-N227 PolarHBondContact O-N 3.15Å; T224-V228 PolarHBondContact N-O 3.09Å; T224-V228 WeakPolarHBondContact OG1-CB 3.28Å; T224-V228 PolarHBondContact OG1-N 2.86Å; T224-V228 PolarHBondContact OG1-O 2.88Å; T224-V230 HydrophobicContact CG2-CG2 4.12Å
225S76.1Confident83.3Confident134 Ų13465.3 Ų65.394%0.93736%0.359SS*.THydrogen-bonded Turntrans-56.6-15.5177.7-48.80000114.5
226T78.3Confident83Confident109 Ų10965.6 Ų65.667%0.66937%0.365SS*.THydrogen-bonded Turntrans-94.215.6176.353.50000113.3T224 V228T224-T226 PolarHBondContact O-N 3.5Å; T224-T226 PolarHBondContact OG1-OG1 3.32Å; T226-V228 PolarHBondContact O-N 3.36Å; T226-V228 VanDerWaalsContact O-N 3.14Å
227N76.9Confident82.7Confident139 Ų13965.8 Ų65.874%0.74337%0.366SS*.SBendtrans58.615.7-173.8-76.1-18.6000114.6T224T224-N227 PolarHBondContact O-N 3.15Å
228V84.4Confident82.1Confident81 Ų8165.7 Ų65.749%0.49137%0.365SS..  trans-81.5124173.3-179.20000108.9T224 T226 V230T224-V228 PolarHBondContact N-O 3.09Å; T224-V228 WeakPolarHBondContact OG1-CB 3.28Å; T224-V228 PolarHBondContact OG1-N 2.86Å; T224-V228 PolarHBondContact OG1-O 2.88Å; T226-V228 PolarHBondContact O-N 3.36Å; T226-V228 VanDerWaalsContact O-N 3.14Å; V228-V230 HydrophobicContact CG1-CG2 4.26Å
229T79.5Confident81.6Confident87 Ų8769 Ų6953%0.53438%0.38SS..EExtended strand (participates in β ladder)trans-86.9115.217560.60000110I223I223-T229 HydrophobicContact CG1-CG2 4.36Å
230V85.8Confident81.2Confident73 Ų7368.5 Ų68.544%0.44238%0.38SS..EExtended strand (participates in β ladder)trans-105.1124.9178.6-177.50000108.4R221 N222 T224 V228 V232R221-V230 VanDerWaalsContact CA-O 3.31Å; R221-V230 WeakPolarHBondContact CA-O 3.47Å; N222-V230 PolarHBondContact N-O 3.37Å; N222-V230 PolarHBondContact O-N 2.96Å; T224-V230 HydrophobicContact CG2-CG2 4.12Å; V228-V230 HydrophobicContact CG1-CG2 4.26Å; V230-V232 PolarHBondContact O-N 3.13Å
231K84.9Confident80.8Confident142 Ų14270.1 Ų70.162%0.61739%0.392SS*.EExtended strand (participates in β ladder)trans-66.8122173.2-176.7-177.7177.1-173.40108.6
232V83.6Confident80.3Confident19 Ų1971.9 Ų71.912%0.11540%0.403CS..EExtended strand (participates in β ladder)trans-91.5125.2175.1-172.50000108F220 N222 V230 V236 V237 L248F220-V232 HydrophobicContact CB-CB 4.19Å; F220-V232 PolarHBondContact O-N 3.41Å; N222-V232 HydrophobicContact CB-CG2 3.78Å; V230-V232 PolarHBondContact O-N 3.13Å; V232-V236 HydrophobicContact CG1-CB 4.02Å; V232-V236 HydrophobicContact CG1-CG1 4.05Å; V232-V237 HydrophobicContact CB-CG2 4.04Å; V232-V237 HydrophobicContact CG1-CG2 3.56Å; V232-L248 HydrophobicContact CG2-CD1 4.5Å; V232-L248 HydrophobicContact CG2-CD2 4.02Å
233P82.8Confident80Confident66 Ų6674.7 Ų74.743%0.42941%0.414SS..PPolyproline II helixtrans-57.9141.2173.1-21.132.1000111E235 V236 V237P233-E235 WeakPolarHBondContact CB-OE2 3.47Å; P233-E235 PolarHBondContact O-N 3.15Å; P233-V236 HydrophobicContact CB-CG2 4.24Å; P233-V236 HydrophobicContact CG-CG2 4.28Å; P233-V236 PolarHBondContact O-N 3.42Å; P233-V236 VanDerWaalsContact O-N 3.11Å; P233-V237 WeakPolarHBondContact O-CG2 3.31Å; P233-V237 PolarHBondContact O-N 3.3Å
234T81.8Confident80.1Confident27 Ų2774.6 Ų74.617%0.16641%0.412CS..Hα-helixtrans-64-27.9-177.9-55.40000111.3A184 F220 V236 V237 M238A184-T234 HydrophobicContact CB-CG2 3.74Å; F220-T234 HydrophobicContact CE2-CG2 4.34Å; T234-V236 VanDerWaalsContact C-N 3.31Å; T234-V236 PolarHBondContact O-N 3.01Å; T234-V237 PolarHBondContact O-N 3.1Å; T234-M238 HydrophobicContact CG2-CE 3.68Å; T234-M238 HydrophobicContact CG2-SD 4.47Å; T234-M238 WeakPolarHBondContact O-CG 3.21Å; T234-M238 PolarHBondContact O-N 2.77Å
235E77.2Confident80.1Confident60 Ų6074.4 Ų74.428%0.2841%0.405SS..Hα-helixtrans-57.8-44.4174.2-61.172.6-163.200111.2A180 A184 P233A180-E235 HydrophobicContact CB-CB 4.39Å; A184-E235 HydrophobicContact CB-CB 4.38Å; A184-E235 HydrophobicContact CB-CG 3.66Å; A184-E235 WeakPolarHBondContact CB-OE1 3.39Å; A184-E235 PolarHBondContact N-OE1 3.38Å; P233-E235 WeakPolarHBondContact CB-OE2 3.47Å; P233-E235 PolarHBondContact O-N 3.15Å
236V80Confident80.4Confident65 Ų6572.4 Ų72.439%0.39439%0.391SS..Hα-helixtrans-68.6-45.41771790000109.7V232 P233 T234 M238 Q239 L240V232-V236 HydrophobicContact CG1-CB 4.02Å; V232-V236 HydrophobicContact CG1-CG1 4.05Å; P233-V236 HydrophobicContact CB-CG2 4.24Å; P233-V236 HydrophobicContact CG-CG2 4.28Å; P233-V236 PolarHBondContact O-N 3.42Å; P233-V236 VanDerWaalsContact O-N 3.11Å; T234-V236 VanDerWaalsContact C-N 3.31Å; T234-V236 PolarHBondContact O-N 3.01Å; V236-M238 VanDerWaalsContact C-N 3.25Å; V236-M238 PolarHBondContact O-N 3.13Å; V236-Q239 WeakPolarHBondContact O-CB 3.21Å; V236-Q239 PolarHBondContact O-N 3.49Å; V236-L240 WeakPolarHBondContact O-CG 3.11Å; V236-L240 PolarHBondContact O-N 3.07Å
237V81.3Confident80.7Confident5 Ų573.9 Ų73.93%0.0339%0.394CS..Hα-helixtrans-60.1-35.8-179.3179.20000112.7F220 V232 P233 T234 Q239 L240 R245 L248F220-V237 HydrophobicContact CB-CG2 3.6Å; F220-V237 HydrophobicContact CD1-CB 4.49Å; F220-V237 HydrophobicContact CD1-CG1 3.72Å; F220-V237 HydrophobicContact CD1-CG2 4.13Å; F220-V237 HydrophobicContact CD2-CB 4.05Å; F220-V237 HydrophobicContact CD2-CG1 3.97Å; F220-V237 HydrophobicContact CD2-CG2 3.69Å; F220-V237 HydrophobicContact CE1-CG1 3.67Å; F220-V237 HydrophobicContact CE2-CB 4.3Å; F220-V237 HydrophobicContact CE2-CG1 3.94Å; F220-V237 HydrophobicContact CE2-CG2 4.43Å; F220-V237 HydrophobicContact CG-CB 4.17Å; F220-V237 HydrophobicContact CG-CG1 3.88Å; F220-V237 HydrophobicContact CG-CG2 3.53Å; F220-V237 HydrophobicContact CZ-CG1 3.79Å; V232-V237 HydrophobicContact CB-CG2 4.04Å; V232-V237 HydrophobicContact CG1-CG2 3.56Å; P233-V237 WeakPolarHBondContact O-CG2 3.31Å; P233-V237 PolarHBondContact O-N 3.3Å; T234-V237 PolarHBondContact O-N 3.1Å; V237-Q239 PolarHBondContact O-N 2.86Å; V237-L240 HydrophobicContact CG2-CD1 4.48Å; V237-L240 PolarHBondContact O-N 2.95Å; V237-R245 HydrophobicContact CG1-CG 4.28Å; V237-L248 HydrophobicContact CG1-CD1 4.43Å; V237-L248 HydrophobicContact CG2-CD1 3.8Å
238M76.4Confident81.1Confident5 Ų568.1 Ų68.13%0.02536%0.363CS..Hα-helixtrans-62.3-30.1176.9-75.5174.3177.500112.5A184 P185 T234 V236 L471 K482 F484A184-M238 HydrophobicContact CB-CE 4.34Å; A184-M238 HydrophobicContact CB-SD 4.26Å; P185-M238 HydrophobicContact CB-CE 4.41Å; P185-M238 HydrophobicContact CG-CE 3.53Å; P185-M238 HydrophobicContact CG-SD 4.13Å; P185-M238 WeakPolarHBondContact O-CE 3.5Å; T234-M238 HydrophobicContact CG2-CE 3.68Å; T234-M238 HydrophobicContact CG2-SD 4.47Å; T234-M238 WeakPolarHBondContact O-CG 3.21Å; T234-M238 PolarHBondContact O-N 2.77Å; V236-M238 VanDerWaalsContact C-N 3.25Å; V236-M238 PolarHBondContact O-N 3.13Å; M238-L471 HydrophobicContact CE-CD1 4.04Å; M238-K482 WeakPolarHBondContact O-CB 3.24Å; M238-F484 HydrophobicContact SD-CE1 3.86Å; M238-F484 HydrophobicContact SD-CZ 4.44Å
239Q77.4Confident81.2Confident87 Ų8766.9 Ų66.941%0.40736%0.358SS..Hα-helixtrans-82.5-21.7-179.1-64.1-177.1-22.100113.5E178 V236 V237E178-Q239 PolarHBondContact O-NE2 3.01Å; E178-Q239 VanDerWaalsContact O-NE2 3.15Å; V236-Q239 WeakPolarHBondContact O-CB 3.21Å; V236-Q239 PolarHBondContact O-N 3.49Å; V237-Q239 PolarHBondContact O-N 2.86Å
240L79Confident81.5Confident40 Ų4066.3 Ų66.321%0.20935%0.35CS..SBendtrans-63.2153.2-178.7-63.9179.3000112.8V236 V237 E244 L248V236-L240 WeakPolarHBondContact O-CG 3.11Å; V236-L240 PolarHBondContact O-N 3.07Å; V237-L240 HydrophobicContact CG2-CD1 4.48Å; V237-L240 PolarHBondContact O-N 2.95Å; L240-E244 WeakPolarHBondContact CA-OE2 3.29Å; L240-E244 HydrophobicContact CB-CB 3.99Å; L240-E244 HydrophobicContact CD1-CB 4.47Å; L240-E244 HydrophobicContact CD2-CB 4.13Å; L240-E244 HydrophobicContact CG-CB 4.4Å; L240-L248 HydrophobicContact CD1-CD1 3.58Å; L240-L248 HydrophobicContact CD1-CG 4.47Å
241S77.3Confident81.5Confident36 Ų3664.2 Ų64.225%0.25234%0.338SS..  trans-69.4165.2166.190.90000111.3E243 E244 R245S241-E243 VanDerWaalsContact C-N 3.26Å; S241-E243 VanDerWaalsContact CB-OE2 3.25Å; S241-E243 WeakPolarHBondContact CB-OE2 3.43Å; S241-E243 PolarHBondContact O-N 3.32Å; S241-E243 PolarHBondContact OG-N 3.24Å; S241-E243 PolarHBondContact OG-OE2 3.46Å; S241-E244 PolarHBondContact N-OE2 2.97Å; S241-E244 PolarHBondContact O-N 2.92Å; S241-E244 PolarHBondContact OG-N 3.37Å; S241-E244 VanDerWaalsContact OG-N 3.15Å; S241-R245 VanDerWaalsContact O-CB 3.28Å; S241-R245 WeakPolarHBondContact O-CB 3.34Å; S241-R245 PolarHBondContact O-N 3.36Å
242E76.6Confident81.7Confident114 Ų11462 Ų6253%0.53334%0.338SS..Hα-helixtrans-62.6-36.9175-69.3-158146.600111.6R245 S246E242-R245 PolarHBondContact O-N 3.06Å; E242-S246 WeakPolarHBondContact O-CB 3.45Å; E242-S246 PolarHBondContact O-N 2.96Å
243E79.6Confident82Confident132 Ų13263.7 Ų63.762%0.61735%0.345SS*.Hα-helixtrans-64.2-47.7176.5-56.579.7-172.600111.2S241 R245 S246 L247S241-E243 VanDerWaalsContact C-N 3.26Å; S241-E243 VanDerWaalsContact CB-OE2 3.25Å; S241-E243 WeakPolarHBondContact CB-OE2 3.43Å; S241-E243 PolarHBondContact O-N 3.32Å; S241-E243 PolarHBondContact OG-N 3.24Å; S241-E243 PolarHBondContact OG-OE2 3.46Å; E243-R245 VanDerWaalsContact C-N 3.33Å; E243-R245 PolarHBondContact O-N 3.46Å; E243-S246 WeakPolarHBondContact O-CB 3.49Å; E243-S246 PolarHBondContact O-N 3.4Å; E243-S246 PolarHBondContact O-OG 3.34Å; E243-L247 PolarHBondContact O-N 2.88Å
244E83.5Confident82.2Confident97 Ų9764.5 Ų64.545%0.45335%0.349SS..Hα-helixtrans-63.1-40.3177-68.8175.2136.300111.9L240 S241 S246 L247L240-E244 WeakPolarHBondContact CA-OE2 3.29Å; L240-E244 HydrophobicContact CB-CB 3.99Å; L240-E244 HydrophobicContact CD1-CB 4.47Å; L240-E244 HydrophobicContact CD2-CB 4.13Å; L240-E244 HydrophobicContact CG-CB 4.4Å; S241-E244 PolarHBondContact N-OE2 2.97Å; S241-E244 PolarHBondContact O-N 2.92Å; S241-E244 PolarHBondContact OG-N 3.37Å; S241-E244 VanDerWaalsContact OG-N 3.15Å; E244-S246 VanDerWaalsContact C-N 3.31Å; E244-S246 PolarHBondContact O-N 2.91Å; E244-L247 WeakPolarHBondContact O-CB 3.47Å; E244-L247 PolarHBondContact O-N 3.35Å
245R80.7Confident82.5Confident45 Ų4567.3 Ų67.317%0.1736%0.359CS..Hα-helixtrans-64.2-37.4176.3-177.7176.9170.2-172-4.8111.6V237 S241 E242 E243 L247 L248 E250V237-R245 HydrophobicContact CG1-CG 4.28Å; S241-R245 VanDerWaalsContact O-CB 3.28Å; S241-R245 WeakPolarHBondContact O-CB 3.34Å; S241-R245 PolarHBondContact O-N 3.36Å; E242-R245 PolarHBondContact O-N 3.06Å; E243-R245 VanDerWaalsContact C-N 3.33Å; E243-R245 PolarHBondContact O-N 3.46Å; R245-L247 PolarHBondContact O-N 3.41Å; R245-L248 WeakPolarHBondContact O-CB 3.19Å; R245-L248 PolarHBondContact O-N 2.81Å; R245-E250 WeakPolarHBondContact CG-OE1 3.47Å; R245-E250 IonicContact CZ-OE1 2.69Å; R245-E250 IonicContact NE-OE1 3.82Å; R245-E250 PolarHBondContact NE-OE1 3.04Å; R245-E250 IonicContact NH2-OE1 3.47Å; R245-E250 PolarHBondContact NH2-OE1 3.38Å; R245-E250 VanDerWaalsContact NH2-OE1 3.15Å; R245-E250 IonicContact NH2-OE2 3.89Å; R245-E250 PolarHBondContact NH2-OE2 2.9Å; R245-E250 VanDerWaalsContact NH2-OE2 3.14Å
246S80.9Confident82.9Confident92 Ų9269.6 Ų69.664%0.64337%0.372SS*.Hα-helixtrans-63.8-21.4177.979.20000113.7E242 E243 E244 L248E242-S246 WeakPolarHBondContact O-CB 3.45Å; E242-S246 PolarHBondContact O-N 2.96Å; E243-S246 WeakPolarHBondContact O-CB 3.49Å; E243-S246 PolarHBondContact O-N 3.4Å; E243-S246 PolarHBondContact O-OG 3.34Å; E244-S246 VanDerWaalsContact C-N 3.31Å; E244-S246 PolarHBondContact O-N 2.91Å; S246-L248 VanDerWaalsContact C-N 3.28Å
247L85Confident82.8Confident139 Ų13967.5 Ų67.573%0.72836%0.363SS*.THydrogen-bonded Turntrans-78.3-13.1174.4-59.6173.9000112.8E243 E244 R245E243-L247 PolarHBondContact O-N 2.88Å; E244-L247 WeakPolarHBondContact O-CB 3.47Å; E244-L247 PolarHBondContact O-N 3.35Å; R245-L247 PolarHBondContact O-N 3.41Å
248L86.1Confident82.6Confident18 Ų1878.8 Ų78.89%0.09441%0.405CS..SBendtrans-86.8144.3177.9-58.1-179.9000110.9F220 N222 V232 V237 L240 R245 S246 E250F220-L248 HydrophobicContact CB-CD1 4.15Å; F220-L248 HydrophobicContact CD1-CD1 4.41Å; N222-L248 HydrophobicContact CB-CD2 3.68Å; V232-L248 HydrophobicContact CG2-CD1 4.5Å; V232-L248 HydrophobicContact CG2-CD2 4.02Å; V237-L248 HydrophobicContact CG1-CD1 4.43Å; V237-L248 HydrophobicContact CG2-CD1 3.8Å; L240-L248 HydrophobicContact CD1-CD1 3.58Å; L240-L248 HydrophobicContact CD1-CG 4.47Å; R245-L248 WeakPolarHBondContact O-CB 3.19Å; R245-L248 PolarHBondContact O-N 2.81Å; S246-L248 VanDerWaalsContact C-N 3.28Å; L248-E250 PolarHBondContact O-N 3.37Å
249S85Confident82.7Confident55 Ų5579.9 Ų79.939%0.38542%0.418SS..EExtended strand (participates in β ladder)trans-79.5112.5167.8179.50000109.3R221R221-S249 PolarHBondContact N-O 3.07Å; R221-S249 PolarHBondContact O-N 2.92Å
250E85.9Confident83.2Confident76 Ų7677.7 Ų77.736%0.35541%0.408SS..EExtended strand (participates in β ladder)trans-89.3131.2172.7-53-163.9-179.600110.1K219 F220 R245 L248K219-E250 WeakPolarHBondContact O-CA 3.48Å; F220-E250 HydrophobicContact CD1-CG 3.77Å; F220-E250 VanDerWaalsContact CE1-CD 3.47Å; F220-E250 HydrophobicContact CE1-CG 3.67Å; F220-E250 WeakPolarHBondContact CE1-OE1 3.31Å; R245-E250 WeakPolarHBondContact CG-OE1 3.47Å; R245-E250 IonicContact CZ-OE1 2.69Å; R245-E250 IonicContact NE-OE1 3.82Å; R245-E250 PolarHBondContact NE-OE1 3.04Å; R245-E250 IonicContact NH2-OE1 3.47Å; R245-E250 PolarHBondContact NH2-OE1 3.38Å; R245-E250 VanDerWaalsContact NH2-OE1 3.15Å; R245-E250 IonicContact NH2-OE2 3.89Å; R245-E250 PolarHBondContact NH2-OE2 2.9Å; R245-E250 VanDerWaalsContact NH2-OE2 3.14Å; L248-E250 PolarHBondContact O-N 3.37Å
251S87.5Confident83.8Confident28 Ų2876.2 Ų76.220%0.19640%0.401CS..EExtended strand (participates in β ladder)trans-139.8136.6173.555.70000110.4K219 R221K219-S251 PolarHBondContact N-O 3.38Å; K219-S251 PolarHBondContact O-N 3.2Å; R221-S251 PolarHBondContact NH1-OG 2.93Å
252P89.2Confident84.4Confident96 Ų9675 Ų7562%0.62339%0.391SS*.EExtended strand (participates in β ladder)trans-69.6134.6177.428.3-33.4000110.5T216 M218T216-P252 HydrophobicContact CG2-CB 3.72Å; M218-P252 HydrophobicContact SD-CB 4.39Å
253E88.9Confident85Confident54 Ų5470.5 Ų70.525%0.25237%0.371SS..EExtended strand (participates in β ladder)trans-121122.8168.3173.1-177.9-129.300109.7C217 K219 K255C217-E253 PolarHBondContact N-O 3.3Å; C217-E253 WeakPolarHBondContact O-CA 3.14Å; C217-E253 PolarHBondContact O-N 3.46Å; K219-E253 HydrophobicContact CD-CB 4.23Å; K219-E253 WeakPolarHBondContact CE-OE1 3.37Å; K219-E253 WeakPolarHBondContact CE-OE2 3.14Å; K219-E253 HydrophobicContact CG-CB 3.98Å; K219-E253 IonicContact NZ-OE1 3.4Å; K219-E253 PolarHBondContact NZ-OE1 3.07Å; K219-E253 IonicContact NZ-OE2 3.53Å; E253-K255 HydrophobicContact CG-CG 4.11Å; E253-K255 PolarHBondContact O-N 2.81Å; E253-K255 WeakPolarHBondContact OE2-CE 3.31Å
254T87.7Confident85.6Confident84 Ų8464.2 Ų64.252%0.51534%0.341SS..EExtended strand (participates in β ladder)trans-70.1119.7167.4-47.40000109.9V214V214-T254 HydrophobicContact CG1-CG2 3.24Å
255K86.8Confident86.1Confident85 Ų8559.6 Ų59.637%0.3732%0.32SS..EExtended strand (participates in β ladder)trans-112.1143.5173.7-65.5-167.2-173.9169.50110.9K215 C217 E253K215-K255 PolarHBondContact N-O 3.47Å; K215-K255 PolarHBondContact O-N 2.64Å; K215-K255 VanDerWaalsContact O-O 3.12Å; C217-K255 HydrophobicContact CB-CD 4.05Å; C217-K255 HydrophobicContact CB-CG 4.34Å; E253-K255 HydrophobicContact CG-CG 4.11Å; E253-K255 PolarHBondContact O-N 2.81Å; E253-K255 WeakPolarHBondContact OE2-CE 3.31Å
256I85.6Confident86.6Confident109 Ų10957.7 Ų57.756%0.55931%0.313SS*.EExtended strand (participates in β ladder)trans-88.5110173.2-57.1174.1000108.2S212S212-I256 VanDerWaalsContact CB-CG2 3.43Å; S212-I256 VanDerWaalsContact OG-CG2 3.25Å; S212-I256 WeakPolarHBondContact OG-CG2 3.45Å
257G79Confident87.1Confident20 Ų2057 Ų5721%0.20630%0.299CS..EExtended strand (participates in β ladder)trans-75.6144.6172.200000111.8S212 S213S212-G257 WeakPolarHBondContact CA-O 3.5Å; S212-G257 PolarHBondContact OG-O 3.35Å; S213-G257 PolarHBondContact N-O 3.11Å; S213-G257 VanDerWaalsContact N-O 3.16Å; S213-G257 WeakPolarHBondContact O-CA 3.24Å; S213-G257 PolarHBondContact O-N 2.93Å
258R76.1Confident87.6Confident242 Ų24254.3 Ų54.391%0.91328%0.281SS*.EExtended strand (participates in β ladder)trans-76.1125.3168.8-73.1-175.9176.1165.3-0.1109.2
259G79.8Confident88Confident29 Ų2954.2 Ų54.230%0.29928%0.28SS..SBendtrans132.6137.6-179.900000111.1Y211 S212 S213 N261Y211-G259 CarbonylContact O-C 3.4Å; Y211-G259 PolarHBondContact O-N 2.96Å; S212-G259 CarbonylContact C-O 3.55Å; S212-G259 WeakPolarHBondContact CA-O 3.2Å; S212-G259 PolarHBondContact N-O 2.88Å; S213-G259 PolarHBondContact N-O 2.88Å; S213-G259 PolarHBondContact OG-O 3.35Å; G259-N261 PolarHBondContact O-N 3.45Å
260M87.5Confident88.3Confident41 Ų4153 Ų5320%0.20227%0.27CS..  trans-57.6131-178.9178170.764.300111.9I116 L117 I120 I262 L265I116-M260 HydrophobicContact CB-CE 4.01Å; I116-M260 HydrophobicContact CG2-CE 3.29Å; L117-M260 HydrophobicContact CB-CE 4.49Å; L117-M260 HydrophobicContact CB-SD 3.65Å; L117-M260 HydrophobicContact CD1-SD 3.52Å; L117-M260 VanDerWaalsContact CD1-SD 3.52Å; L117-M260 HydrophobicContact CG-SD 4.14Å; I120-M260 HydrophobicContact CD1-CE 4.03Å; M260-I262 VanDerWaalsContact C-N 3.25Å; M260-I262 HydrophobicContact CE-CD1 3.98Å; M260-I262 HydrophobicContact CE-CG1 3.5Å; M260-I262 HydrophobicContact CG-CG1 4.13Å; M260-I262 PolarHBondContact O-N 2.97Å; M260-L265 HydrophobicContact CG-CD1 3.3Å; M260-L265 HydrophobicContact SD-CD1 3.45Å; M260-L265 WeakPolarHBondContact SD-CD1 3.42Å
261N90.7Very high88.6Confident9 Ų952 Ų525%0.04827%0.269CS..  trans-75.378.7170.1177.39.4000110.1N200 A209 S212 G259 L263 G264 L265N200-N261 WeakPolarHBondContact CA-ND2 3.38Å; N200-N261 WeakPolarHBondContact CB-OD1 3.4Å; N200-N261 PolarHBondContact O-ND2 3.4Å; N200-N261 PolarHBondContact O-OD1 3.13Å; A209-N261 HydrophobicContact CB-CB 4.09Å; A209-N261 PolarHBondContact O-N 3.44Å; S212-N261 VanDerWaalsContact O-CB 3.26Å; S212-N261 WeakPolarHBondContact O-CB 3.25Å; S212-N261 PolarHBondContact O-N 3.4Å; G259-N261 PolarHBondContact O-N 3.45Å; N261-L263 VanDerWaalsContact C-N 3.27Å; N261-L263 PolarHBondContact O-N 2.62Å; N261-G264 PolarHBondContact O-N 2.99Å; N261-G264 PolarHBondContact OD1-N 3.25Å; N261-L265 VanDerWaalsContact O-CG 3.28Å; N261-L265 WeakPolarHBondContact O-CG 3.41Å; N261-L265 PolarHBondContact O-N 3.05Å; N261-L265 VanDerWaalsContact O-N 3.07Å
262I89.6Confident88.9Confident10 Ų1053.6 Ų53.65%0.05127%0.273CS..Hα-helixtrans-58.4-40.5-179.9-66.7171.9000111I120 M260 L265 I266 S385 T415I120-I262 HydrophobicContact CD1-CD1 4.4Å; I120-I262 HydrophobicContact CD1-CG1 4.22Å; I120-I262 HydrophobicContact CD1-CG2 4.03Å; M260-I262 VanDerWaalsContact C-N 3.25Å; M260-I262 HydrophobicContact CE-CD1 3.98Å; M260-I262 HydrophobicContact CE-CG1 3.5Å; M260-I262 HydrophobicContact CG-CG1 4.13Å; M260-I262 PolarHBondContact O-N 2.97Å; I262-L265 PolarHBondContact O-N 3.27Å; I262-I266 HydrophobicContact CG2-CD1 3.57Å; I262-I266 HydrophobicContact CG2-CG1 4.16Å; I262-I266 WeakPolarHBondContact O-CG1 3.3Å; I262-I266 PolarHBondContact O-N 3.31Å; I262-S385 WeakPolarHBondContact CD1-OG 3.24Å; I262-T415 HydrophobicContact CB-CG2 3.59Å; I262-T415 HydrophobicContact CD1-CG2 4.47Å; I262-T415 HydrophobicContact CG2-CG2 3.5Å
263L90.4Very high89Confident20 Ų2049 Ų4911%0.10524%0.243CC..Hα-helixtrans-60.6-49.3-179.2-179.365.1000111.9L197 L201 N261 I266 F267 L412 I416L197-L263 HydrophobicContact CD1-CD2 3.32Å; L197-L263 HydrophobicContact CG-CD2 4.03Å; L201-L263 HydrophobicContact CB-CD2 4.39Å; L201-L263 HydrophobicContact CD1-CD1 4.01Å; L201-L263 HydrophobicContact CD1-CD2 4.35Å; L201-L263 HydrophobicContact CD1-CG 3.95Å; N261-L263 VanDerWaalsContact C-N 3.27Å; N261-L263 PolarHBondContact O-N 2.62Å; L263-I266 PolarHBondContact O-N 2.92Å; L263-F267 PolarHBondContact O-N 3.43Å; L263-L412 HydrophobicContact CD1-CD1 4.3Å; L263-I416 HydrophobicContact CD1-CG2 4.28Å
264G92.8Very high89.1Confident0 Ų049.2 Ų49.20%025%0.245CC..Hα-helixtrans-64.9-39.3177.900000113N200 N261 F267 F268N200-G264 WeakPolarHBondContact O-CA 3.47Å; N200-G264 PolarHBondContact O-N 2.98Å; N200-G264 VanDerWaalsContact O-N 3.12Å; N261-G264 PolarHBondContact O-N 2.99Å; N261-G264 PolarHBondContact OD1-N 3.25Å; G264-F267 PolarHBondContact O-N 3.46Å; G264-F268 WeakPolarHBondContact O-CB 3.37Å; G264-F268 PolarHBondContact O-N 3.33Å
265L93.1Very high89.3Confident0 Ų051.2 Ų51.20%025%0.247CC..Hα-helixtrans-62.5-44.4173.9-68.9170.5000111.4L117 L206 A209 M260 N261 I262 F269L117-L265 HydrophobicContact CD1-CD1 3.59Å; L117-L265 HydrophobicContact CD1-CD2 4.4Å; L206-L265 HydrophobicContact CD1-CD2 3.78Å; A209-L265 HydrophobicContact CB-CD2 4.21Å; A209-L265 HydrophobicContact CB-CG 4.33Å; M260-L265 HydrophobicContact CG-CD1 3.3Å; M260-L265 HydrophobicContact SD-CD1 3.45Å; M260-L265 WeakPolarHBondContact SD-CD1 3.42Å; N261-L265 VanDerWaalsContact O-CG 3.28Å; N261-L265 WeakPolarHBondContact O-CG 3.41Å; N261-L265 PolarHBondContact O-N 3.05Å; N261-L265 VanDerWaalsContact O-N 3.07Å; I262-L265 PolarHBondContact O-N 3.27Å; L265-F269 HydrophobicContact CD2-CD2 4.48Å; L265-F269 HydrophobicContact CD2-CE2 4.08Å; L265-F269 WeakPolarHBondContact O-CB 3.28Å; L265-F269 VanDerWaalsContact O-CD2 3.24Å; L265-F269 WeakPolarHBondContact O-CD2 3.26Å; L265-F269 PolarHBondContact O-N 3.22Å
266I91.5Very high89.5Confident5 Ų547.3 Ų47.33%0.02623%0.23CC..Hα-helixtrans-58.9-52.9175.7-69.6163.8000109.7I120 I124 I262 L263 F268 F269 V270 P411 L412I120-I266 HydrophobicContact CG2-CG1 4.48Å; I124-I266 HydrophobicContact CD1-CB 4.09Å; I124-I266 HydrophobicContact CD1-CG1 3.6Å; I124-I266 HydrophobicContact CD1-CG2 4.24Å; I262-I266 HydrophobicContact CG2-CD1 3.57Å; I262-I266 HydrophobicContact CG2-CG1 4.16Å; I262-I266 WeakPolarHBondContact O-CG1 3.3Å; I262-I266 PolarHBondContact O-N 3.31Å; L263-I266 PolarHBondContact O-N 2.92Å; I266-F268 PolarHBondContact O-N 3.46Å; I266-F269 PolarHBondContact O-N 3.4Å; I266-V270 HydrophobicContact CG2-CG2 3.98Å; I266-V270 WeakPolarHBondContact O-CB 3.3Å; I266-V270 WeakPolarHBondContact O-CG2 3.42Å; I266-V270 PolarHBondContact O-N 2.92Å; I266-P411 VanDerWaalsContact CD1-C 3.44Å; I266-P411 HydrophobicContact CD1-CB 3.74Å; I266-P411 WeakPolarHBondContact CD1-O 2.83Å; I266-P411 HydrophobicContact CG1-CB 4.18Å; I266-L412 HydrophobicContact CD1-CB 4.36Å
267F91.6Very high89.6Confident78 Ų7843 Ų4334%0.34221%0.209SC..Hα-helixtrans-57.6-51.5-177.8178.1-94.2000112L201 L202 L263 G264 F269 V270 V271L201-F267 HydrophobicContact CD1-CB 3.69Å; L201-F267 HydrophobicContact CD1-CD2 3.72Å; L201-F267 HydrophobicContact CD1-CG 3.83Å; L201-F267 HydrophobicContact CD2-CD2 4.34Å; L201-F267 HydrophobicContact CD2-CE2 4.49Å; L201-F267 HydrophobicContact CG-CB 4.22Å; L201-F267 HydrophobicContact CG-CD2 3.89Å; L201-F267 HydrophobicContact CG-CE2 4.42Å; L201-F267 HydrophobicContact CG-CG 3.94Å; L201-F267 VanDerWaalsContact O-CD1 3.26Å; L201-F267 WeakPolarHBondContact O-CD1 3.37Å; L202-F267 HydrophobicContact CD2-CD1 3.87Å; L202-F267 HydrophobicContact CD2-CE1 3.27Å; L202-F267 HydrophobicContact CD2-CZ 3.83Å; L263-F267 PolarHBondContact O-N 3.43Å; G264-F267 PolarHBondContact O-N 3.46Å; F267-F269 PolarHBondContact O-N 3.43Å; F267-V270 PolarHBondContact O-N 3.25Å; F267-V271 HydrophobicContact CE1-CG2 4.31Å; F267-V271 HydrophobicContact CZ-CG2 4.23Å; F267-V271 WeakPolarHBondContact O-CG2 3.47Å; F267-V271 PolarHBondContact O-N 3.48Å; F267-V271 VanDerWaalsContact O-N 3.14Å
268F94.9Very high90Very high82 Ų8246.3 Ų46.336%0.3623%0.226SC..Hα-helixtrans-59-49.5178.5177.1-92.3000111.6L206 G264 I266 V270 V271 F272L206-F268 HydrophobicContact CD1-CB 4.26Å; L206-F268 HydrophobicContact CD1-CD1 3.56Å; L206-F268 HydrophobicContact CD1-CD2 4.49Å; L206-F268 HydrophobicContact CD1-CE1 4.01Å; L206-F268 HydrophobicContact CD1-CG 3.84Å; L206-F268 HydrophobicContact CD2-CD1 3.96Å; L206-F268 HydrophobicContact CD2-CE1 3.49Å; L206-F268 VanDerWaalsContact CD2-CE1 3.49Å; L206-F268 HydrophobicContact CD2-CZ 3.88Å; L206-F268 HydrophobicContact CG-CD1 4.41Å; L206-F268 HydrophobicContact CG-CE1 4.39Å; G264-F268 WeakPolarHBondContact O-CB 3.37Å; G264-F268 PolarHBondContact O-N 3.33Å; I266-F268 PolarHBondContact O-N 3.46Å; F268-V270 VanDerWaalsContact C-N 3.33Å; F268-V270 PolarHBondContact O-N 2.64Å; F268-V271 PolarHBondContact O-N 3.23Å; F268-F272 HydrophobicContact CE1-CB 4.27Å; F268-F272 HydrophobicContact CE1-CD2 4.42Å; F268-F272 HydrophobicContact CE1-CG 4.42Å; F268-F272 HydrophobicContact CZ-CD2 4.49Å; F268-F272 VanDerWaalsContact O-CB 3.27Å; F268-F272 WeakPolarHBondContact O-CB 3.17Å; F268-F272 PolarHBondContact O-N 3.39Å
269F94.1Very high90.6Very high15 Ų1539 Ų397%0.06620%0.204CC..Hα-helixtrans-73.7-22.6-176-78.1-70.2000113.8I121 I124 V125 L206 L265 I266 F267 F272 A273I121-F269 HydrophobicContact CB-CD2 4.33Å; I121-F269 HydrophobicContact CB-CE2 4.21Å; I121-F269 HydrophobicContact CB-CZ 4.35Å; I121-F269 HydrophobicContact CD1-CD2 4.25Å; I121-F269 HydrophobicContact CD1-CE2 3.45Å; I121-F269 VanDerWaalsContact CD1-CE2 3.45Å; I121-F269 HydrophobicContact CD1-CZ 3.76Å; I121-F269 HydrophobicContact CG1-CD2 3.72Å; I121-F269 HydrophobicContact CG1-CE2 3.45Å; I121-F269 VanDerWaalsContact CG1-CE2 3.45Å; I121-F269 HydrophobicContact CG1-CG 4.46Å; I121-F269 HydrophobicContact CG1-CZ 3.97Å; I121-F269 HydrophobicContact CG2-CD1 3.75Å; I121-F269 HydrophobicContact CG2-CD2 4.05Å; I121-F269 HydrophobicContact CG2-CE1 3.45Å; I121-F269 VanDerWaalsContact CG2-CE1 3.45Å; I121-F269 HydrophobicContact CG2-CE2 3.8Å; I121-F269 HydrophobicContact CG2-CG 4.04Å; I121-F269 HydrophobicContact CG2-CZ 3.48Å; I121-F269 VanDerWaalsContact CG2-CZ 3.48Å; I124-F269 HydrophobicContact CB-CB 4.49Å; I124-F269 HydrophobicContact CG2-CB 3.95Å; V125-F269 HydrophobicContact CG2-CB 4.11Å; V125-F269 HydrophobicContact CG2-CD1 3.57Å; V125-F269 HydrophobicContact CG2-CE1 4.43Å; V125-F269 HydrophobicContact CG2-CG 4.21Å; L206-F269 HydrophobicContact CD1-CE2 4Å; L206-F269 HydrophobicContact CD1-CZ 4.49Å; L206-F269 HydrophobicContact CD2-CE2 4.45Å; L206-F269 HydrophobicContact CD2-CZ 4.13Å; L265-F269 HydrophobicContact CD2-CD2 4.48Å; L265-F269 HydrophobicContact CD2-CE2 4.08Å; L265-F269 WeakPolarHBondContact O-CB 3.28Å; L265-F269 VanDerWaalsContact O-CD2 3.24Å; L265-F269 WeakPolarHBondContact O-CD2 3.26Å; L265-F269 PolarHBondContact O-N 3.22Å; I266-F269 PolarHBondContact O-N 3.4Å; F267-F269 PolarHBondContact O-N 3.43Å; F269-F272 HydrophobicContact CD1-CB 4.36Å; F269-F272 AromaticContact CD1-CD1 3.8Å; F269-F272 HydrophobicContact CD1-CD1 3.8Å; F269-F272 HydrophobicContact CD1-CE1 4.4Å; F269-F272 HydrophobicContact CD1-CG 4.28Å; F269-F272 HydrophobicContact CE1-CD1 4.18Å; F269-F272 HydrophobicContact CE1-CE1 4.4Å; F269-A273 WeakPolarHBondContact O-CB 3.25Å; F269-A273 PolarHBondContact O-N 3.44Å
270V91.3Very high90.9Very high30 Ų3042.7 Ų42.718%0.18221%0.214CC..Hα-helixtrans-64.3-52167.1168.60000110.1I124 I128 I266 F267 F268 F272 A273 I274 F408I124-V270 HydrophobicContact CG2-CG2 4.03Å; I128-V270 HydrophobicContact CD1-CB 3.93Å; I128-V270 HydrophobicContact CD1-CG1 4Å; I128-V270 HydrophobicContact CD1-CG2 3.39Å; I266-V270 HydrophobicContact CG2-CG2 3.98Å; I266-V270 WeakPolarHBondContact O-CB 3.3Å; I266-V270 WeakPolarHBondContact O-CG2 3.42Å; I266-V270 PolarHBondContact O-N 2.92Å; F267-V270 PolarHBondContact O-N 3.25Å; F268-V270 VanDerWaalsContact C-N 3.33Å; F268-V270 PolarHBondContact O-N 2.64Å; V270-F272 PolarHBondContact O-N 2.94Å; V270-A273 PolarHBondContact O-N 3.12Å; V270-I274 HydrophobicContact CG1-CD1 3.95Å; V270-I274 VanDerWaalsContact O-CG1 3.28Å; V270-I274 WeakPolarHBondContact O-CG1 3.25Å; V270-I274 PolarHBondContact O-N 2.9Å; V270-F408 HydrophobicContact CG2-CD2 4.22Å; V270-F408 HydrophobicContact CG2-CE2 3.89Å
271V92.2Very high90.9Very high56 Ų5647.8 Ų47.834%0.33924%0.237SC..Hα-helixtrans-61.2-47.1178.5174.90000110.4F267 F268 A273 I274 F275F267-V271 HydrophobicContact CE1-CG2 4.31Å; F267-V271 HydrophobicContact CZ-CG2 4.23Å; F267-V271 WeakPolarHBondContact O-CG2 3.47Å; F267-V271 PolarHBondContact O-N 3.48Å; F267-V271 VanDerWaalsContact O-N 3.14Å; F268-V271 PolarHBondContact O-N 3.23Å; V271-A273 VanDerWaalsContact C-N 3.34Å; V271-A273 PolarHBondContact O-N 2.97Å; V271-I274 WeakPolarHBondContact O-CB 3.46Å; V271-I274 PolarHBondContact O-N 3.13Å; V271-I274 VanDerWaalsContact O-N 3.16Å; V271-F275 HydrophobicContact CG1-CD2 3.82Å; V271-F275 HydrophobicContact CG1-CE2 3.72Å; V271-F275 VanDerWaalsContact O-CD2 3.3Å; V271-F275 WeakPolarHBondContact O-CD2 3.31Å; V271-F275 PolarHBondContact O-N 3.27Å
272F93.6Very high90.9Very high61 Ų6154.8 Ų54.827%0.26827%0.269SS..Hα-helixtrans-56.9-45175.9-179.6-101000112.3V125 F268 F269 V270 I274 F275 I276 L286 F290V125-F272 HydrophobicContact CG1-CD1 4.43Å; V125-F272 HydrophobicContact CG1-CE1 4.4Å; V125-F272 HydrophobicContact CG2-CD1 3.9Å; V125-F272 HydrophobicContact CG2-CE1 4.27Å; F268-F272 HydrophobicContact CE1-CB 4.27Å; F268-F272 HydrophobicContact CE1-CD2 4.42Å; F268-F272 HydrophobicContact CE1-CG 4.42Å; F268-F272 HydrophobicContact CZ-CD2 4.49Å; F268-F272 VanDerWaalsContact O-CB 3.27Å; F268-F272 WeakPolarHBondContact O-CB 3.17Å; F268-F272 PolarHBondContact O-N 3.39Å; F269-F272 HydrophobicContact CD1-CB 4.36Å; F269-F272 AromaticContact CD1-CD1 3.8Å; F269-F272 HydrophobicContact CD1-CD1 3.8Å; F269-F272 HydrophobicContact CD1-CE1 4.4Å; F269-F272 HydrophobicContact CD1-CG 4.28Å; F269-F272 HydrophobicContact CE1-CD1 4.18Å; F269-F272 HydrophobicContact CE1-CE1 4.4Å; V270-F272 PolarHBondContact O-N 2.94Å; F272-I274 PolarHBondContact O-N 3.31Å; F272-F275 PolarHBondContact O-N 3.4Å; F272-I276 HydrophobicContact CD1-CD1 3.64Å; F272-I276 HydrophobicContact CD1-CG1 4.47Å; F272-I276 HydrophobicContact CE1-CD1 3.23Å; F272-I276 HydrophobicContact CE1-CG1 4.25Å; F272-I276 HydrophobicContact CG-CD1 4.48Å; F272-I276 HydrophobicContact CZ-CD1 3.77Å; F272-I276 HydrophobicContact CZ-CG1 4.46Å; F272-I276 WeakPolarHBondContact O-CG1 3.14Å; F272-I276 PolarHBondContact O-N 3Å; F272-L286 HydrophobicContact CZ-CD1 4.16Å; F272-F290 AromaticContact CE1-CE2 3.7Å; F272-F290 HydrophobicContact CE1-CE2 3.7Å; F272-F290 HydrophobicContact CE1-CZ 4.15Å; F272-F290 HydrophobicContact CZ-CE2 4.31Å
273A92.3Very high90.9Very high0 Ų054.3 Ų54.30%027%0.267CS..Hα-helixtrans-66.4-35.2177.200000113V125 I128 A129 F269 V270 V271 I276 S277V125-A273 HydrophobicContact CB-CB 4.49Å; V125-A273 HydrophobicContact CG1-CB 4.36Å; V125-A273 HydrophobicContact CG2-CB 4.49Å; I128-A273 HydrophobicContact CB-CB 3.72Å; I128-A273 HydrophobicContact CG2-CB 3.78Å; A129-A273 HydrophobicContact CB-CB 4.39Å; F269-A273 WeakPolarHBondContact O-CB 3.25Å; F269-A273 PolarHBondContact O-N 3.44Å; V270-A273 PolarHBondContact O-N 3.12Å; V271-A273 VanDerWaalsContact C-N 3.34Å; V271-A273 PolarHBondContact O-N 2.97Å; A273-I276 PolarHBondContact O-N 3.25Å; A273-S277 PolarHBondContact O-N 3.49Å
274I90.7Very high90.9Very high57 Ų5756.5 Ų56.529%0.29228%0.277SS..Hα-helixtrans-62.8-44.8173.1-69.7164.4000110.2I128 T133 V270 V271 F272 S277 V278I128-I274 HydrophobicContact CG2-CG1 4.05Å; T133-I274 HydrophobicContact CG2-CG2 4.27Å; V270-I274 HydrophobicContact CG1-CD1 3.95Å; V270-I274 VanDerWaalsContact O-CG1 3.28Å; V270-I274 WeakPolarHBondContact O-CG1 3.25Å; V270-I274 PolarHBondContact O-N 2.9Å; V271-I274 WeakPolarHBondContact O-CB 3.46Å; V271-I274 PolarHBondContact O-N 3.13Å; V271-I274 VanDerWaalsContact O-N 3.16Å; F272-I274 PolarHBondContact O-N 3.31Å; I274-S277 CarbonylContact O-C 3.22Å; I274-S277 WeakPolarHBondContact O-CA 3.45Å; I274-S277 VanDerWaalsContact O-CB 3.25Å; I274-S277 WeakPolarHBondContact O-CB 3.42Å; I274-S277 PolarHBondContact O-N 3.08Å; I274-V278 HydrophobicContact CG2-CG2 4.48Å; I274-V278 WeakPolarHBondContact O-CG2 3.36Å; I274-V278 PolarHBondContact O-N 2.85Å
275F91.8Very high91Very high127 Ų12760.9 Ų60.956%0.55731%0.305SS*.Hα-helixtrans-67.7-39.1177.7-82.4-75000113V271 F272 S277 V278 L279V271-F275 HydrophobicContact CG1-CD2 3.82Å; V271-F275 HydrophobicContact CG1-CE2 3.72Å; V271-F275 VanDerWaalsContact O-CD2 3.3Å; V271-F275 WeakPolarHBondContact O-CD2 3.31Å; V271-F275 PolarHBondContact O-N 3.27Å; F272-F275 PolarHBondContact O-N 3.4Å; F275-S277 PolarHBondContact O-N 3.35Å; F275-V278 PolarHBondContact O-N 3.39Å; F275-V278 VanDerWaalsContact O-N 3.12Å; F275-L279 WeakPolarHBondContact O-CG 3.27Å; F275-L279 PolarHBondContact O-N 3.39Å
276I91.7Very high91.1Very high3 Ų364.4 Ų64.42%0.01532%0.323CS..Hα-helixtrans-54.4-38.6167.5-73.8173.1000110.3V125 A129 F272 A273 L286 R287V125-I276 HydrophobicContact CG1-CD1 3.68Å; A129-I276 HydrophobicContact CB-CB 4.48Å; A129-I276 HydrophobicContact CB-CG2 3.93Å; F272-I276 HydrophobicContact CD1-CD1 3.64Å; F272-I276 HydrophobicContact CD1-CG1 4.47Å; F272-I276 HydrophobicContact CE1-CD1 3.23Å; F272-I276 HydrophobicContact CE1-CG1 4.25Å; F272-I276 HydrophobicContact CG-CD1 4.48Å; F272-I276 HydrophobicContact CZ-CD1 3.77Å; F272-I276 HydrophobicContact CZ-CG1 4.46Å; F272-I276 WeakPolarHBondContact O-CG1 3.14Å; F272-I276 PolarHBondContact O-N 3Å; A273-I276 PolarHBondContact O-N 3.25Å; I276-L286 HydrophobicContact CD1-CB 3.78Å; I276-L286 HydrophobicContact CD1-CD1 4.06Å; I276-L286 HydrophobicContact CG1-CB 4.27Å; I276-L286 HydrophobicContact CG1-CD1 4.06Å; I276-R287 HydrophobicContact CG2-CG 3.28Å
277S86.1Confident91.1Very high18 Ų1866.3 Ų66.313%0.12633%0.33CS..Hα-helixtrans-68.7-37.5177.4-88.40000115A129 A273 I274 F275 E280 R287A129-S277 VanDerWaalsContact C-OG 3.28Å; A129-S277 WeakPolarHBondContact CA-OG 3.45Å; A129-S277 PolarHBondContact O-OG 2.92Å; A273-S277 PolarHBondContact O-N 3.49Å; I274-S277 CarbonylContact O-C 3.22Å; I274-S277 WeakPolarHBondContact O-CA 3.45Å; I274-S277 VanDerWaalsContact O-CB 3.25Å; I274-S277 WeakPolarHBondContact O-CB 3.42Å; I274-S277 PolarHBondContact O-N 3.08Å; F275-S277 PolarHBondContact O-N 3.35Å; S277-E280 PolarHBondContact O-N 2.74Å; S277-R287 PolarHBondContact OG-NH2 3.28Å
278V88.2Confident91.1Very high90 Ų9066 Ų6655%0.54533%0.332SS..Hα-helixtrans-71.2-33.9178171.50000111.9I274 F275 E280I274-V278 HydrophobicContact CG2-CG2 4.48Å; I274-V278 WeakPolarHBondContact O-CG2 3.36Å; I274-V278 PolarHBondContact O-N 2.85Å; F275-V278 PolarHBondContact O-N 3.39Å; F275-V278 VanDerWaalsContact O-N 3.12Å; V278-E280 PolarHBondContact O-N 3.37Å
279L89.2Confident91.2Very high88 Ų8867.8 Ų67.846%0.46134%0.34SS..THydrogen-bonded Turntrans-71.6-6.3178-71.8175000114.2F275 E281 E282F275-L279 WeakPolarHBondContact O-CG 3.27Å; F275-L279 PolarHBondContact O-N 3.39Å; L279-E281 PolarHBondContact O-N 3.3Å; L279-E282 HydrophobicContact CB-CB 4.22Å; L279-E282 PolarHBondContact O-N 3.22Å
280E84.9Confident91.3Very high107 Ų10768 Ų6850%0.534%0.341SS..THydrogen-bonded Turntrans49.1-101.4177.2-56.4-163.8151.300113.8S277 V278 R287 R531S277-E280 PolarHBondContact O-N 2.74Å; V278-E280 PolarHBondContact O-N 3.37Å; E280-R287 PolarHBondContact O-NH1 2.77Å; E280-R531 IonicContact OE1-NH1 2.96Å; E280-R531 PolarHBondContact OE1-NH1 3.28Å
281E87.7Confident91.3Very high147 Ų14771.2 Ų71.269%0.68735%0.352SS*.THydrogen-bonded Turntrans-71.5-39.1-178.6-63.1-169.7167.400112.7L279 G283 Q284L279-E281 PolarHBondContact O-N 3.3Å; E281-G283 PolarHBondContact O-N 2.93Å; E281-Q284 VanDerWaalsContact O-CB 3.24Å; E281-Q284 WeakPolarHBondContact O-CB 3.36Å; E281-Q284 PolarHBondContact O-N 2.52Å; E281-Q284 VanDerWaalsContact O-N 3.13Å
282E90.4Very high91.5Very high156 Ų15672 Ų7273%0.72936%0.361SS*.THydrogen-bonded Turntrans-66.6-29.5178.8-66.5-177-171.300111.8L279 Q284 P285L279-E282 HydrophobicContact CB-CB 4.22Å; L279-E282 PolarHBondContact O-N 3.22Å; E282-Q284 VanDerWaalsContact C-N 3.34Å; E282-P285 WeakPolarHBondContact O-CD 3.32Å
283G90.7Very high91.6Very high0 Ų071.3 Ų71.30%036%0.359CS..THydrogen-bonded Turntrans-78.4-14.617600000114.2E281 L286 R287E281-G283 PolarHBondContact O-N 2.93Å; G283-L286 PolarHBondContact O-N 3.34Å; G283-R287 PolarHBondContact O-N 3.28Å; G283-R287 VanDerWaalsContact O-N 3.14Å
284Q90.3Very high91.6Very high67 Ų6772.1 Ų72.131%0.31336%0.363SS..Hα-helixtrans-60-42.2-171.7-171.557.234.100114.3E281 E282 L286 R287 D288E281-Q284 VanDerWaalsContact O-CB 3.24Å; E281-Q284 WeakPolarHBondContact O-CB 3.36Å; E281-Q284 PolarHBondContact O-N 2.52Å; E281-Q284 VanDerWaalsContact O-N 3.13Å; E282-Q284 VanDerWaalsContact C-N 3.34Å; Q284-L286 VanDerWaalsContact C-N 3.29Å; Q284-L286 PolarHBondContact O-N 3.45Å; Q284-R287 WeakPolarHBondContact O-CB 3.49Å; Q284-R287 PolarHBondContact O-N 2.91Å; Q284-R287 VanDerWaalsContact O-N 3.14Å; Q284-D288 PolarHBondContact NE2-OD1 3.38Å; Q284-D288 PolarHBondContact NE2-OD2 3.27Å; Q284-D288 PolarHBondContact O-N 2.98Å
285P94.9Very high91.7Very high91 Ų9172 Ų7259%0.59137%0.367SS*.Hα-helixtrans-59.1-38.7177.1-25.135.6000113.2E282 D288 F289E282-P285 WeakPolarHBondContact O-CD 3.32Å; P285-D288 PolarHBondContact O-N 3.18Å; P285-F289 WeakPolarHBondContact O-CB 3.46Å; P285-F289 PolarHBondContact O-N 2.87Å
286L94.6Very high91.9Very high74 Ų7469.5 Ų69.539%0.38736%0.362SS..Hα-helixtrans-68.1-42.8176.5-71173.2000111.1F272 I276 G283 Q284 D288 F289 F290F272-L286 HydrophobicContact CZ-CD1 4.16Å; I276-L286 HydrophobicContact CD1-CB 3.78Å; I276-L286 HydrophobicContact CD1-CD1 4.06Å; I276-L286 HydrophobicContact CG1-CB 4.27Å; I276-L286 HydrophobicContact CG1-CD1 4.06Å; G283-L286 PolarHBondContact O-N 3.34Å; Q284-L286 VanDerWaalsContact C-N 3.29Å; Q284-L286 PolarHBondContact O-N 3.45Å; L286-D288 VanDerWaalsContact C-N 3.31Å; L286-D288 PolarHBondContact O-N 3Å; L286-F289 PolarHBondContact O-N 3.21Å; L286-F290 HydrophobicContact CD2-CE2 4.49Å; L286-F290 WeakPolarHBondContact O-CD2 3.16Å; L286-F290 PolarHBondContact O-N 3.33Å
287R91Very high91.9Very high45 Ų4570.1 Ų70.117%0.1737%0.365CS..Hα-helixtrans-55.8-47.3174.8-67.9179.2163.4147.5-16111.6A129 I276 S277 E280 G283 Q284 F290 K291A129-R287 HydrophobicContact CB-CG 3.86Å; A129-R287 VanDerWaalsContact O-CZ 3.31Å; A129-R287 PolarHBondContact O-NE 3.45Å; A129-R287 PolarHBondContact O-NH2 3.28Å; I276-R287 HydrophobicContact CG2-CG 3.28Å; S277-R287 PolarHBondContact OG-NH2 3.28Å; E280-R287 PolarHBondContact O-NH1 2.77Å; G283-R287 PolarHBondContact O-N 3.28Å; G283-R287 VanDerWaalsContact O-N 3.14Å; Q284-R287 WeakPolarHBondContact O-CB 3.49Å; Q284-R287 PolarHBondContact O-N 2.91Å; Q284-R287 VanDerWaalsContact O-N 3.14Å; R287-F290 PolarHBondContact O-N 2.81Å; R287-K291 VanDerWaalsContact O-CB 3.25Å; R287-K291 WeakPolarHBondContact O-CB 3.17Å; R287-K291 PolarHBondContact O-N 2.81Å
288D93.4Very high92.1Very high71 Ų7170.2 Ų70.238%0.3836%0.364SS..Hα-helixtrans-70-36.8-176.8-70.2-28.6000112.3Q284 P285 L286 S292Q284-D288 PolarHBondContact NE2-OD1 3.38Å; Q284-D288 PolarHBondContact NE2-OD2 3.27Å; Q284-D288 PolarHBondContact O-N 2.98Å; P285-D288 PolarHBondContact O-N 3.18Å; L286-D288 VanDerWaalsContact C-N 3.31Å; L286-D288 PolarHBondContact O-N 3Å; D288-S292 WeakPolarHBondContact O-CB 3.46Å; D288-S292 PolarHBondContact O-N 3.12Å; D288-S292 PolarHBondContact O-OG 3.3Å
289F96Very high92.3Very high120 Ų12073.2 Ų73.253%0.52637%0.37SS..Hα-helixtrans-57.9-55.2170.5171.4-98.3000111.4P285 L286 K291 S292 L293P285-F289 WeakPolarHBondContact O-CB 3.46Å; P285-F289 PolarHBondContact O-N 2.87Å; L286-F289 PolarHBondContact O-N 3.21Å; F289-K291 VanDerWaalsContact C-N 3.34Å; F289-K291 PolarHBondContact O-N 3.04Å; F289-S292 PolarHBondContact O-N 3.24Å; F289-L293 HydrophobicContact CE1-CD2 4.14Å; F289-L293 HydrophobicContact CZ-CD2 4.27Å; F289-L293 WeakPolarHBondContact O-CB 3.19Å; F289-L293 PolarHBondContact O-N 2.97Å
290F95.2Very high92.5Very high20 Ų2072.3 Ų72.39%0.08837%0.365CS..Hα-helixtrans-67-34.8-177.3-76.1-68000112.6I121 S122 V125 F272 L286 R287 L293 E294I121-F290 HydrophobicContact CG2-CD1 4.23Å; I121-F290 HydrophobicContact CG2-CE1 3.57Å; I121-F290 HydrophobicContact CG2-CZ 4.31Å; S122-F290 WeakPolarHBondContact CB-O 3.41Å; V125-F290 HydrophobicContact CB-CB 4.06Å; V125-F290 HydrophobicContact CB-CD1 4.29Å; V125-F290 HydrophobicContact CB-CD2 3.94Å; V125-F290 HydrophobicContact CB-CE2 4.49Å; V125-F290 HydrophobicContact CB-CG 3.83Å; V125-F290 HydrophobicContact CG1-CB 4Å; V125-F290 HydrophobicContact CG1-CD2 3.39Å; V125-F290 HydrophobicContact CG1-CE2 4.01Å; V125-F290 HydrophobicContact CG1-CG 3.75Å; V125-F290 HydrophobicContact CG2-CD2 4.37Å; V125-F290 HydrophobicContact CG2-CE2 4.45Å; V125-F290 HydrophobicContact CG2-CG 4.42Å; F272-F290 AromaticContact CE1-CE2 3.7Å; F272-F290 HydrophobicContact CE1-CE2 3.7Å; F272-F290 HydrophobicContact CE1-CZ 4.15Å; F272-F290 HydrophobicContact CZ-CE2 4.31Å; L286-F290 HydrophobicContact CD2-CE2 4.49Å; L286-F290 WeakPolarHBondContact O-CD2 3.16Å; L286-F290 PolarHBondContact O-N 3.33Å; R287-F290 PolarHBondContact O-N 2.81Å; F290-L293 HydrophobicContact CD1-CD2 4.34Å; F290-L293 PolarHBondContact O-N 3.27Å; F290-E294 VanDerWaalsContact O-CB 3.28Å; F290-E294 WeakPolarHBondContact O-CB 3.06Å; F290-E294 PolarHBondContact O-N 2.95Å
291K93.3Very high92.7Very high98 Ų9867.2 Ų67.243%0.42634%0.341SS..Hα-helixtrans-63.6-41.4173-176.5178.3178.6-176.40112.2R287 F289 S295R287-K291 VanDerWaalsContact O-CB 3.25Å; R287-K291 WeakPolarHBondContact O-CB 3.17Å; R287-K291 PolarHBondContact O-N 2.81Å; F289-K291 VanDerWaalsContact C-N 3.34Å; F289-K291 PolarHBondContact O-N 3.04Å; K291-S295 WeakPolarHBondContact O-CB 3.16Å; K291-S295 PolarHBondContact O-N 3.17Å; K291-S295 PolarHBondContact O-OG 3.18Å
292S96.3Very high92.8Very high73 Ų7362.8 Ų62.851%0.5132%0.324SS..Hα-helixtrans-66.6-45.1176-59.80000111D288 F289 E294 S295 V296D288-S292 WeakPolarHBondContact O-CB 3.46Å; D288-S292 PolarHBondContact O-N 3.12Å; D288-S292 PolarHBondContact O-OG 3.3Å; F289-S292 PolarHBondContact O-N 3.24Å; S292-E294 PolarHBondContact O-N 3.18Å; S292-S295 WeakPolarHBondContact O-CB 3.3Å; S292-S295 PolarHBondContact O-N 2.95Å; S292-V296 WeakPolarHBondContact O-CG2 3.46Å; S292-V296 PolarHBondContact O-N 3.32Å
293L95.7Very high92.8Very high46 Ų4661.1 Ų61.124%0.24132%0.319CS..Hα-helixtrans-58.5-47.1176.2-179.159.5000111.3F289 F290 S295 V296 M297F289-L293 HydrophobicContact CE1-CD2 4.14Å; F289-L293 HydrophobicContact CZ-CD2 4.27Å; F289-L293 WeakPolarHBondContact O-CB 3.19Å; F289-L293 PolarHBondContact O-N 2.97Å; F290-L293 HydrophobicContact CD1-CD2 4.34Å; F290-L293 PolarHBondContact O-N 3.27Å; L293-S295 PolarHBondContact O-N 2.93Å; L293-V296 WeakPolarHBondContact O-CB 3.21Å; L293-V296 PolarHBondContact O-N 3.15Å; L293-M297 HydrophobicContact CD1-CE 3.82Å; L293-M297 HydrophobicContact CD1-CG 4.49Å; L293-M297 WeakPolarHBondContact O-CG 3.31Å; L293-M297 PolarHBondContact O-N 3.01Å
294E91.7Very high92.8Very high17 Ų1761.8 Ų61.88%0.07932%0.323CS..Hα-helixtrans-57.8-47.3176174-92.9132.300111.6S122 T123 F290 S292 V296 M297 M298 R407S122-E294 WeakPolarHBondContact OG-CA 3.27Å; T123-E294 HydrophobicContact CG2-CG 3.73Å; F290-E294 VanDerWaalsContact O-CB 3.28Å; F290-E294 WeakPolarHBondContact O-CB 3.06Å; F290-E294 PolarHBondContact O-N 2.95Å; S292-E294 PolarHBondContact O-N 3.18Å; E294-V296 VanDerWaalsContact C-N 3.28Å; E294-V296 PolarHBondContact O-N 3.43Å; E294-M297 PolarHBondContact O-N 3.1Å; E294-M297 VanDerWaalsContact O-N 3.09Å; E294-M298 WeakPolarHBondContact O-CG 3.13Å; E294-M298 PolarHBondContact O-N 3.22Å; E294-M298 VanDerWaalsContact OE1-CG 3.29Å; E294-M298 WeakPolarHBondContact OE1-CG 3.41Å; E294-R407 VanDerWaalsContact CG-NH1 3.35Å; E294-R407 IonicContact OE1-CZ 3.09Å; E294-R407 VanDerWaalsContact OE1-CZ 3.24Å; E294-R407 IonicContact OE1-NH1 2.93Å; E294-R407 PolarHBondContact OE1-NH1 2.81Å; E294-R407 IonicContact OE1-NH2 2.73Å; E294-R407 PolarHBondContact OE1-NH2 3.38Å; E294-R407 IonicContact OE2-CZ 3.3Å; E294-R407 IonicContact OE2-NH1 3.95Å; E294-R407 PolarHBondContact OE2-NH1 2.79Å; E294-R407 IonicContact OE2-NH2 3.22Å
295S92.3Very high92.6Very high55 Ų5558.9 Ų58.939%0.38531%0.309SS..Hα-helixtrans-59.8-38.1177.6-65.20000112.4K291 S292 L293 K299K291-S295 WeakPolarHBondContact O-CB 3.16Å; K291-S295 PolarHBondContact O-N 3.17Å; K291-S295 PolarHBondContact O-OG 3.18Å; S292-S295 WeakPolarHBondContact O-CB 3.3Å; S292-S295 PolarHBondContact O-N 2.95Å; L293-S295 PolarHBondContact O-N 2.93Å; S295-K299 PolarHBondContact O-N 3.13Å
296V95.4Very high92.4Very high74 Ų7460 Ų6045%0.44830%0.302SS..Hα-helixtrans-67.2-45.1174175.60000110.4S292 L293 E294 M298 K299 L300S292-V296 WeakPolarHBondContact O-CG2 3.46Å; S292-V296 PolarHBondContact O-N 3.32Å; L293-V296 WeakPolarHBondContact O-CB 3.21Å; L293-V296 PolarHBondContact O-N 3.15Å; E294-V296 VanDerWaalsContact C-N 3.28Å; E294-V296 PolarHBondContact O-N 3.43Å; V296-M298 VanDerWaalsContact C-N 3.32Å; V296-M298 PolarHBondContact O-N 3.25Å; V296-K299 WeakPolarHBondContact O-CB 3.27Å; V296-K299 PolarHBondContact O-N 3.32Å; V296-K299 VanDerWaalsContact O-N 3.1Å; V296-L300 HydrophobicContact CG1-CD1 4.32Å; V296-L300 HydrophobicContact CG1-CG 4.45Å; V296-L300 PolarHBondContact O-N 2.85Å
297M93.6Very high92.3Very high16 Ų1659.4 Ų59.48%0.07930%0.295CS..Hα-helixtrans-59.8-42178.6-68-52104.700111.7L115 P118 L119 L293 E294 K299 L300 I301L115-M297 HydrophobicContact CD2-SD 4.05Å; P118-M297 HydrophobicContact CB-CG 4.16Å; P118-M297 HydrophobicContact CB-SD 3.73Å; P118-M297 HydrophobicContact CG-SD 4.45Å; L119-M297 HydrophobicContact CB-CB 4.37Å; L119-M297 HydrophobicContact CD1-CB 3.69Å; L293-M297 HydrophobicContact CD1-CE 3.82Å; L293-M297 HydrophobicContact CD1-CG 4.49Å; L293-M297 WeakPolarHBondContact O-CG 3.31Å; L293-M297 PolarHBondContact O-N 3.01Å; E294-M297 PolarHBondContact O-N 3.1Å; E294-M297 VanDerWaalsContact O-N 3.09Å; M297-K299 VanDerWaalsContact C-N 3.27Å; M297-K299 PolarHBondContact O-N 3.19Å; M297-L300 HydrophobicContact CE-CD1 3.55Å; M297-L300 PolarHBondContact O-N 3.37Å; M297-L300 VanDerWaalsContact O-N 3.13Å; M297-L300 HydrophobicContact SD-CD1 4.07Å; M297-I301 VanDerWaalsContact O-CG1 3.24Å; M297-I301 WeakPolarHBondContact O-CG1 3.26Å; M297-I301 PolarHBondContact O-N 2.92Å
298M89.1Confident92.1Very high19 Ų1957.4 Ų57.49%0.09429%0.288CS..Hα-helixtrans-62.5-33.3176.7-69.3-63.1-91.500113.1L119 E294 V296 I301 T302 K393 E396L119-M298 HydrophobicContact CD1-SD 4.19Å; E294-M298 WeakPolarHBondContact O-CG 3.13Å; E294-M298 PolarHBondContact O-N 3.22Å; E294-M298 VanDerWaalsContact OE1-CG 3.29Å; E294-M298 WeakPolarHBondContact OE1-CG 3.41Å; V296-M298 VanDerWaalsContact C-N 3.32Å; V296-M298 PolarHBondContact O-N 3.25Å; M298-I301 HydrophobicContact SD-CD1 4.16Å; M298-T302 PolarHBondContact O-N 3.37Å; M298-T302 PolarHBondContact O-OG1 3.46Å; M298-K393 HydrophobicContact CE-CB 4.25Å; M298-K393 HydrophobicContact CE-CG 4.3Å; M298-E396 WeakPolarHBondContact CE-OE2 3.43Å
299K92.4Very high92Very high154 Ų15454.9 Ų54.967%0.6728%0.275SS*.Hα-helixtrans-70.4-43.4172.4-70.6179.7179.8-176.80111.7S295 V296 M297 T302 I303S295-K299 PolarHBondContact O-N 3.13Å; V296-K299 WeakPolarHBondContact O-CB 3.27Å; V296-K299 PolarHBondContact O-N 3.32Å; V296-K299 VanDerWaalsContact O-N 3.1Å; M297-K299 VanDerWaalsContact C-N 3.27Å; M297-K299 PolarHBondContact O-N 3.19Å; K299-T302 VanDerWaalsContact O-CB 3.3Å; K299-T302 WeakPolarHBondContact O-CB 3.44Å; K299-T302 PolarHBondContact O-N 3.02Å; K299-T302 VanDerWaalsContact O-N 3.12Å; K299-I303 PolarHBondContact O-N 3.28Å
300L93.4Very high91.9Very high69 Ų6952.8 Ų52.836%0.36127%0.269SS..Hα-helixtrans-62-44.5176.5-67.8178.2000111.9L115 V296 M297 T302 I303 V304L115-L300 HydrophobicContact CD1-CB 4.24Å; L115-L300 HydrophobicContact CD2-CB 3.91Å; L115-L300 HydrophobicContact CD2-CD1 3.91Å; V296-L300 HydrophobicContact CG1-CD1 4.32Å; V296-L300 HydrophobicContact CG1-CG 4.45Å; V296-L300 PolarHBondContact O-N 2.85Å; M297-L300 HydrophobicContact CE-CD1 3.55Å; M297-L300 PolarHBondContact O-N 3.37Å; M297-L300 VanDerWaalsContact O-N 3.13Å; M297-L300 HydrophobicContact SD-CD1 4.07Å; L300-T302 PolarHBondContact O-N 3.49Å; L300-I303 WeakPolarHBondContact O-CB 3.43Å; L300-I303 PolarHBondContact O-N 3.31Å; L300-V304 PolarHBondContact O-N 3.25Å
301I90Very high91.7Very high0 Ų051.8 Ų51.80%027%0.265CS..Hα-helixtrans-56.7-40.1174.3-68164.7000110.1L115 L119 M297 M298 I303 V304 I305 P389 K393L115-I301 HydrophobicContact CB-CG1 4.46Å; L115-I301 HydrophobicContact CD1-CB 4.48Å; L115-I301 HydrophobicContact CD1-CG1 3.73Å; L119-I301 HydrophobicContact CD1-CD1 3.78Å; L119-I301 HydrophobicContact CD2-CD1 3.52Å; L119-I301 HydrophobicContact CG-CD1 4.18Å; M297-I301 VanDerWaalsContact O-CG1 3.24Å; M297-I301 WeakPolarHBondContact O-CG1 3.26Å; M297-I301 PolarHBondContact O-N 2.92Å; M298-I301 HydrophobicContact SD-CD1 4.16Å; I301-I303 VanDerWaalsContact C-N 3.27Å; I301-I303 PolarHBondContact O-N 2.97Å; I301-V304 PolarHBondContact O-N 3.3Å; I301-I305 HydrophobicContact CG2-CD1 3.45Å; I301-I305 VanDerWaalsContact CG2-CD1 3.45Å; I301-I305 HydrophobicContact CG2-CG1 4.07Å; I301-I305 VanDerWaalsContact O-CB 3.31Å; I301-I305 WeakPolarHBondContact O-CB 3.5Å; I301-I305 WeakPolarHBondContact O-CD1 3.42Å; I301-I305 WeakPolarHBondContact O-CG1 3.28Å; I301-I305 PolarHBondContact O-N 2.75Å; I301-P389 HydrophobicContact CD1-CB 3.83Å; I301-P389 HydrophobicContact CG1-CB 4.12Å; I301-K393 HydrophobicContact CG2-CB 4.33Å; I301-K393 HydrophobicContact CG2-CD 3.84Å
302T88.7Confident91.6Very high54 Ų5447.2 Ų47.233%0.33125%0.245SC..Hα-helixtrans-60.5-36.2176.8-58.20000113M298 K299 L300 K393M298-T302 PolarHBondContact O-N 3.37Å; M298-T302 PolarHBondContact O-OG1 3.46Å; K299-T302 VanDerWaalsContact O-CB 3.3Å; K299-T302 WeakPolarHBondContact O-CB 3.44Å; K299-T302 PolarHBondContact O-N 3.02Å; K299-T302 VanDerWaalsContact O-N 3.12Å; L300-T302 PolarHBondContact O-N 3.49Å; T302-K393 VanDerWaalsContact CA-NZ 3.33Å; T302-K393 WeakPolarHBondContact OG1-CE 3.49Å; T302-K393 PolarHBondContact OG1-NZ 3.42Å
303I91.4Very high91.5Very high121 Ų12145.3 Ų45.362%0.62123%0.228SC*.Hα-helixtrans-72.1-49.7175.9-61.5167.3000110.4K299 L300 I301 I305 W306K299-I303 PolarHBondContact O-N 3.28Å; L300-I303 WeakPolarHBondContact O-CB 3.43Å; L300-I303 PolarHBondContact O-N 3.31Å; I301-I303 VanDerWaalsContact C-N 3.27Å; I301-I303 PolarHBondContact O-N 2.97Å; I303-I305 PolarHBondContact O-N 3.32Å; I303-W306 PolarHBondContact O-N 3.48Å; I303-W306 VanDerWaalsContact O-N 3.07Å
304V90.5Very high91.4Very high14 Ų1446 Ų469%0.08523%0.23CC..Hα-helixtrans-58.3-37.9-178.4171.30000111.9F108 M111 L112 L115 L300 I301 W306 Y307F108-V304 HydrophobicContact CD2-CG1 4.35Å; F108-V304 HydrophobicContact CE2-CG1 4.19Å; M111-V304 HydrophobicContact CB-CB 4.49Å; M111-V304 HydrophobicContact CB-CG1 3.64Å; M111-V304 HydrophobicContact CB-CG2 3.98Å; M111-V304 HydrophobicContact CE-CG1 4.36Å; M111-V304 HydrophobicContact SD-CG2 4.3Å; L112-V304 HydrophobicContact CD2-CG1 3.82Å; L112-V304 HydrophobicContact CG-CG1 4.2Å; L115-V304 HydrophobicContact CD1-CB 4.32Å; L115-V304 HydrophobicContact CD1-CG2 3.76Å; L300-V304 PolarHBondContact O-N 3.25Å; I301-V304 PolarHBondContact O-N 3.3Å; V304-W306 PolarHBondContact O-N 3.06Å; V304-Y307 WeakPolarHBondContact O-CB 3.33Å; V304-Y307 PolarHBondContact O-N 3.23Å
305I86.6Confident91.3Very high5 Ų545.3 Ų45.33%0.02623%0.226CC..Hα-helixtrans-61.3-30.3179.1-76.5171.5000112.8L68 I301 I303 Y307 A308 L390 K393L68-I305 HydrophobicContact CD1-CG2 3.64Å; L68-I305 WeakPolarHBondContact CD1-O 3.37Å; L68-I305 HydrophobicContact CD2-CG2 3.13Å; L68-I305 HydrophobicContact CG-CG2 3.92Å; I301-I305 HydrophobicContact CG2-CD1 3.45Å; I301-I305 VanDerWaalsContact CG2-CD1 3.45Å; I301-I305 HydrophobicContact CG2-CG1 4.07Å; I301-I305 VanDerWaalsContact O-CB 3.31Å; I301-I305 WeakPolarHBondContact O-CB 3.5Å; I301-I305 WeakPolarHBondContact O-CD1 3.42Å; I301-I305 WeakPolarHBondContact O-CG1 3.28Å; I301-I305 PolarHBondContact O-N 2.75Å; I303-I305 PolarHBondContact O-N 3.32Å; I305-Y307 PolarHBondContact O-N 2.88Å; I305-A308 WeakPolarHBondContact O-CB 3.47Å; I305-A308 PolarHBondContact O-N 3.37Å; I305-L390 HydrophobicContact CD1-CD1 3.35Å; I305-L390 HydrophobicContact CG1-CD1 3.78Å; I305-K393 HydrophobicContact CD1-CD 3.6Å
306W90Very high91Very high115 Ų11543.3 Ų43.344%0.43621%0.212SC..Hα-helixtrans-67.7-19.7175.8-81.596.4000113.3K64 L67 F71 I303 V304 A308 P309K64-W306 HydrophobicContact CB-CZ2 4.35Å; L67-W306 HydrophobicContact CD2-CH2 4.19Å; F71-W306 HydrophobicContact CD2-CZ3 4.29Å; F71-W306 HydrophobicContact CE2-CZ3 4.21Å; I303-W306 PolarHBondContact O-N 3.48Å; I303-W306 VanDerWaalsContact O-N 3.07Å; V304-W306 PolarHBondContact O-N 3.06Å; W306-A308 VanDerWaalsContact C-N 3.33Å; W306-P309 WeakPolarHBondContact O-CD 3.24Å
307Y91.6Very high90.8Very high62 Ų6239.8 Ų39.824%0.24319%0.19CC..THydrogen-bonded Turntrans-82.3-13.2171.3-169.7-92.6000112.5P104 I107 F108 M111 V304 I305 P309 I310 G311P104-Y307 WeakPolarHBondContact O-CE1 3.41Å; P104-Y307 PolarHBondContact O-OH 3.18Å; I107-Y307 HydrophobicContact CG2-CE1 4.29Å; F108-Y307 HydrophobicContact CB-CD1 3.73Å; F108-Y307 HydrophobicContact CB-CE1 3.77Å; F108-Y307 AromaticContact CD2-CD1 3.95Å; F108-Y307 HydrophobicContact CD2-CD1 3.95Å; F108-Y307 HydrophobicContact CG-CD1 4.2Å; M111-Y307 HydrophobicContact CE-CD1 3.25Å; M111-Y307 HydrophobicContact CE-CD2 4.28Å; M111-Y307 HydrophobicContact CE-CE1 3.84Å; M111-Y307 HydrophobicContact CE-CG 3.5Å; V304-Y307 WeakPolarHBondContact O-CB 3.33Å; V304-Y307 PolarHBondContact O-N 3.23Å; I305-Y307 PolarHBondContact O-N 2.88Å; Y307-P309 VanDerWaalsContact C-CD 3.46Å; Y307-I310 HydrophobicContact CD2-CD1 4.33Å; Y307-I310 HydrophobicContact CE2-CB 4.43Å; Y307-I310 HydrophobicContact CE2-CD1 4.31Å; Y307-I310 HydrophobicContact CE2-CG2 4.27Å; Y307-I310 PolarHBondContact O-N 2.85Å; Y307-I310 VanDerWaalsContact O-N 3.11Å; Y307-G311 PolarHBondContact O-N 2.97Å
308A87.8Confident90.6Very high3 Ų339.5 Ų39.53%0.02519%0.189CC..Hα-helixtrans-54.2-41.7-177.400000114.3F108 I305 W306 I310 G311 I312F108-A308 HydrophobicContact CE1-CB 4.19Å; F108-A308 HydrophobicContact CE2-CB 3.6Å; F108-A308 HydrophobicContact CZ-CB 3.4Å; I305-A308 WeakPolarHBondContact O-CB 3.47Å; I305-A308 PolarHBondContact O-N 3.37Å; W306-A308 VanDerWaalsContact C-N 3.33Å; A308-I310 VanDerWaalsContact C-N 3.31Å; A308-I310 PolarHBondContact O-N 3.22Å; A308-G311 PolarHBondContact O-N 3.39Å; A308-I312 HydrophobicContact CB-CD1 4.21Å; A308-I312 VanDerWaalsContact O-CB 3.3Å; A308-I312 WeakPolarHBondContact O-CB 3.43Å; A308-I312 WeakPolarHBondContact O-CD1 3.2Å; A308-I312 WeakPolarHBondContact O-CG1 3.44Å; A308-I312 PolarHBondContact O-N 3.05Å
309P90.9Very high90.1Very high17 Ų1740.1 Ų40.111%0.1119%0.192CC..Hα-helixtrans-55.5-45176.6-27.737.1000112.9F71 W306 Y307 I313F71-P309 HydrophobicContact CB-CB 4.11Å; F71-P309 HydrophobicContact CB-CG 3.64Å; W306-P309 WeakPolarHBondContact O-CD 3.24Å; Y307-P309 VanDerWaalsContact C-CD 3.46Å; P309-I313 WeakPolarHBondContact O-CD1 3.19Å; P309-I313 WeakPolarHBondContact O-CG1 3.44Å; P309-I313 PolarHBondContact O-N 3.47Å; P309-I313 VanDerWaalsContact O-N 3.09Å
310I93.7Very high89.6Confident76 Ų7634.7 Ų34.739%0.3917%0.169SC..Hα-helixtrans-66.6-50.7177.1-60.8173000109.4P104 Y307 A308 I312 I313 F314P104-I310 HydrophobicContact CB-CG2 4.43Å; Y307-I310 HydrophobicContact CD2-CD1 4.33Å; Y307-I310 HydrophobicContact CE2-CB 4.43Å; Y307-I310 HydrophobicContact CE2-CD1 4.31Å; Y307-I310 HydrophobicContact CE2-CG2 4.27Å; Y307-I310 PolarHBondContact O-N 2.85Å; Y307-I310 VanDerWaalsContact O-N 3.11Å; A308-I310 VanDerWaalsContact C-N 3.31Å; A308-I310 PolarHBondContact O-N 3.22Å; I310-I312 VanDerWaalsContact C-N 3.28Å; I310-I312 PolarHBondContact O-N 2.85Å; I310-I313 PolarHBondContact O-N 3.26Å; I310-F314 HydrophobicContact CG2-CD2 3.96Å; I310-F314 HydrophobicContact CG2-CE2 3.98Å; I310-F314 VanDerWaalsContact O-CD2 3.31Å; I310-F314 WeakPolarHBondContact O-CD2 3.37Å; I310-F314 PolarHBondContact O-N 3.48Å
311G92.4Very high89.2Confident0 Ų032.3 Ų32.30%016%0.158CC..Hα-helixtrans-53.1-46.1178.800000112.5Y307 A308 F314 L315Y307-G311 PolarHBondContact O-N 2.97Å; A308-G311 PolarHBondContact O-N 3.39Å; G311-F314 PolarHBondContact O-N 3.33Å; G311-L315 WeakPolarHBondContact O-CB 3.49Å; G311-L315 WeakPolarHBondContact O-CG 3.49Å; G311-L315 PolarHBondContact O-N 2.92Å
312I89.5Confident88.6Confident1 Ų136.1 Ų36.11%0.00518%0.177CC..Hα-helixtrans-69.3-37.7-178.5-68.4165.3000111.8T72 C76 F108 A308 I310 F314 T316T72-I312 HydrophobicContact CG2-CD1 3.34Å; C76-I312 HydrophobicContact CB-CG2 3.97Å; F108-I312 HydrophobicContact CE1-CG1 4.43Å; A308-I312 HydrophobicContact CB-CD1 4.21Å; A308-I312 VanDerWaalsContact O-CB 3.3Å; A308-I312 WeakPolarHBondContact O-CB 3.43Å; A308-I312 WeakPolarHBondContact O-CD1 3.2Å; A308-I312 WeakPolarHBondContact O-CG1 3.44Å; A308-I312 PolarHBondContact O-N 3.05Å; I310-I312 VanDerWaalsContact C-N 3.28Å; I310-I312 PolarHBondContact O-N 2.85Å; I312-F314 PolarHBondContact O-N 3Å; I312-T316 WeakPolarHBondContact O-CB 3.47Å; I312-T316 PolarHBondContact O-N 3.11Å; I312-T316 PolarHBondContact O-OG1 3.25Å
313I94Very high87.4Confident33 Ų3336 Ų3617%0.16917%0.173CC..Hα-helixtrans-54.5-54.5174-70.9161.1000110G75 L78 G79 L82 P309 I310 A317G75-I313 VanDerWaalsContact CA-CG1 3.41Å; G75-I313 WeakPolarHBondContact O-CA 3.37Å; G75-I313 WeakPolarHBondContact O-CG1 3.11Å; L78-I313 HydrophobicContact CB-CD1 4.41Å; L78-I313 HydrophobicContact CB-CG1 4.09Å; L78-I313 HydrophobicContact CD1-CD1 4.35Å; G79-I313 WeakPolarHBondContact CA-O 3.41Å; L82-I313 HydrophobicContact CD2-CG2 4.17Å; P309-I313 WeakPolarHBondContact O-CD1 3.19Å; P309-I313 WeakPolarHBondContact O-CG1 3.44Å; P309-I313 PolarHBondContact O-N 3.47Å; P309-I313 VanDerWaalsContact O-N 3.09Å; I310-I313 PolarHBondContact O-N 3.26Å; I313-A317 VanDerWaalsContact O-CB 3.23Å; I313-A317 WeakPolarHBondContact O-CB 3.3Å; I313-A317 PolarHBondContact O-N 3.01Å
314F94.5Very high86.1Confident62 Ų6239 Ų3927%0.27218%0.181SC..Hα-helixtrans-75.7-35.5-173-74.7-79.7000113L101 P104 I310 G311 I312 H318L101-F314 HydrophobicContact CD1-CD1 4.2Å; L101-F314 WeakPolarHBondContact O-CD1 3.47Å; P104-F314 HydrophobicContact CB-CB 4Å; P104-F314 HydrophobicContact CB-CD1 4.38Å; P104-F314 HydrophobicContact CB-CD2 3.52Å; P104-F314 HydrophobicContact CB-CE2 4.07Å; P104-F314 HydrophobicContact CB-CG 3.71Å; P104-F314 HydrophobicContact CG-CB 4.3Å; P104-F314 HydrophobicContact CG-CD1 3.89Å; P104-F314 HydrophobicContact CG-CD2 3.84Å; P104-F314 HydrophobicContact CG-CE1 4.14Å; P104-F314 HydrophobicContact CG-CE2 4.1Å; P104-F314 HydrophobicContact CG-CG 3.74Å; P104-F314 HydrophobicContact CG-CZ 4.24Å; I310-F314 HydrophobicContact CG2-CD2 3.96Å; I310-F314 HydrophobicContact CG2-CE2 3.98Å; I310-F314 VanDerWaalsContact O-CD2 3.31Å; I310-F314 WeakPolarHBondContact O-CD2 3.37Å; I310-F314 PolarHBondContact O-N 3.48Å; G311-F314 PolarHBondContact O-N 3.33Å; I312-F314 PolarHBondContact O-N 3Å; F314-H318 WeakPolarHBondContact O-CB 3.16Å; F314-H318 PolarHBondContact O-N 3.24Å
315L89.7Confident84.7Confident1 Ų144.4 Ų44.41%0.00521%0.209CC..Hα-helixtrans-57.7-59.3169.8-74.5173.1000109.2F108 L109 G311 A317 H318 Q319 T381F108-L315 HydrophobicContact CD1-CD1 4.18Å; L109-L315 HydrophobicContact CD1-CD1 4.45Å; L109-L315 HydrophobicContact CD1-CD2 3.84Å; L109-L315 HydrophobicContact CG-CD1 4.28Å; L109-L315 HydrophobicContact CG-CD2 4.44Å; G311-L315 WeakPolarHBondContact O-CB 3.49Å; G311-L315 WeakPolarHBondContact O-CG 3.49Å; G311-L315 PolarHBondContact O-N 2.92Å; L315-A317 VanDerWaalsContact C-N 3.35Å; L315-A317 PolarHBondContact O-N 3.46Å; L315-H318 PolarHBondContact O-N 3.05Å; L315-Q319 WeakPolarHBondContact O-CG 3.48Å; L315-Q319 PolarHBondContact O-N 3.25Å; L315-T381 HydrophobicContact CD1-CG2 3.73Å
316T86.6Confident83.1Confident13 Ų1345.3 Ų45.38%0.0822%0.215CC..Hα-helixtrans-59.5-42.9-176.4-58.80000112.2L80 I312 Q319 I320L80-T316 HydrophobicContact CB-CG2 4.42Å; L80-T316 HydrophobicContact CD2-CG2 3.56Å; L80-T316 HydrophobicContact CG-CG2 3.65Å; I312-T316 WeakPolarHBondContact O-CB 3.47Å; I312-T316 PolarHBondContact O-N 3.11Å; I312-T316 PolarHBondContact O-OG1 3.25Å; T316-Q319 PolarHBondContact O-N 2.89Å; T316-I320 WeakPolarHBondContact O-CG1 3.45Å; T316-I320 PolarHBondContact O-N 2.77Å; T316-I320 VanDerWaalsContact O-N 3.16Å
317A91Very high81.8Confident0 Ų044.8 Ų44.80%023%0.225CC..Hα-helixtrans-61.9-49.4176.900000112.3G79 L82 L101 I313 L315 Q319 I320 V321G79-A317 VanDerWaalsContact O-CA 3.24Å; G79-A317 WeakPolarHBondContact O-CA 3.33Å; G79-A317 WeakPolarHBondContact O-CB 3.48Å; G79-A317 PolarHBondContact O-N 3.43Å; L82-A317 HydrophobicContact CB-CB 4.11Å; L82-A317 HydrophobicContact CD2-CB 3.81Å; L82-A317 HydrophobicContact CG-CB 3.93Å; L101-A317 HydrophobicContact CD1-CB 4.35Å; I313-A317 VanDerWaalsContact O-CB 3.23Å; I313-A317 WeakPolarHBondContact O-CB 3.3Å; I313-A317 PolarHBondContact O-N 3.01Å; L315-A317 VanDerWaalsContact C-N 3.35Å; L315-A317 PolarHBondContact O-N 3.46Å; A317-Q319 PolarHBondContact O-N 3Å; A317-I320 PolarHBondContact O-N 3.07Å; A317-V321 WeakPolarHBondContact O-CG2 3.44Å; A317-V321 PolarHBondContact O-N 2.8Å; A317-V321 VanDerWaalsContact O-N 3.17Å
318H89.1Confident80.2Confident11 Ų1149 Ų495%0.05124%0.244CC..Hα-helixtrans-55.9-41.3175.8170.2-92.5000111.9L98 L101 K102 F314 L315 I320 V321 I322L98-H318 PolarHBondContact O-CD2 3.35Å; L101-H318 HydrophobicContact CD2-CB 4.24Å; L101-H318 HydrophobicContact CG-CB 4.13Å; K102-H318 HydrophobicContact CB-CB 4.38Å; K102-H318 VanDerWaalsContact CB-CD2 3.43Å; K102-H318 WeakPolarHBondContact CB-CD2 3.16Å; F314-H318 WeakPolarHBondContact O-CB 3.16Å; F314-H318 PolarHBondContact O-N 3.24Å; L315-H318 PolarHBondContact O-N 3.05Å; H318-I320 PolarHBondContact O-N 3.25Å; H318-V321 PolarHBondContact O-N 2.93Å; H318-I322 WeakPolarHBondContact CE1-CD1 3.24Å; H318-I322 VanDerWaalsContact NE2-CD1 3.3Å; H318-I322 WeakPolarHBondContact NE2-CD1 3.4Å; H318-I322 PolarHBondContact O-N 3.32Å; H318-I322 VanDerWaalsContact O-N 3.12Å
319Q79.3Confident78.9Confident31 Ų3152.4 Ų52.415%0.14526%0.26CS..Hα-helixtrans-64.5-39.9179.6-56.9-44.1-1100113.1L315 T316 A317 V321 G380 R496L315-Q319 WeakPolarHBondContact O-CG 3.48Å; L315-Q319 PolarHBondContact O-N 3.25Å; T316-Q319 PolarHBondContact O-N 2.89Å; A317-Q319 PolarHBondContact O-N 3Å; Q319-V321 VanDerWaalsContact C-N 3.31Å; Q319-V321 PolarHBondContact O-N 3.46Å; Q319-G380 PolarHBondContact NE2-O 2.98Å; Q319-R496 VanDerWaalsContact CG-CZ 3.44Å; Q319-R496 VanDerWaalsContact CG-NH2 3.29Å
320I81.9Confident77.8Confident40 Ų4054.8 Ų54.821%0.20527%0.271CS..Hα-helixtrans-68.6-33.2178.7-62-63.2000111.4L80 G83 V84 T316 A317 H318 F323L80-I320 HydrophobicContact CD2-CD1 3.97Å; L80-I320 HydrophobicContact CD2-CG1 4.15Å; G83-I320 VanDerWaalsContact C-CG2 3.4Å; V84-I320 HydrophobicContact CG2-CG2 4.02Å; T316-I320 WeakPolarHBondContact O-CG1 3.45Å; T316-I320 PolarHBondContact O-N 2.77Å; T316-I320 VanDerWaalsContact O-N 3.16Å; A317-I320 PolarHBondContact O-N 3.07Å; H318-I320 PolarHBondContact O-N 3.25Å; I320-F323 WeakPolarHBondContact O-CB 3.49Å; I320-F323 PolarHBondContact O-N 3.33Å
321V84.9Confident76.6Confident19 Ų1958 Ų5812%0.11529%0.285CS..Hα-helixtrans-74-36.4-179.7177.60000112.3L86 F93 L98 L101 A317 H318 Q319 F323L86-V321 HydrophobicContact CB-CG2 3.66Å; L86-V321 HydrophobicContact CD1-CG2 4.23Å; F93-V321 HydrophobicContact CB-CG1 4.33Å; F93-V321 HydrophobicContact CD1-CG1 4.43Å; F93-V321 HydrophobicContact CD2-CG1 3.29Å; F93-V321 HydrophobicContact CE2-CG1 3.63Å; F93-V321 HydrophobicContact CG-CG1 3.77Å; F93-V321 HydrophobicContact CZ-CG1 4.35Å; L98-V321 HydrophobicContact CD2-CB 4.33Å; L98-V321 HydrophobicContact CD2-CG1 3.65Å; L101-V321 HydrophobicContact CD2-CB 4.2Å; L101-V321 HydrophobicContact CD2-CG2 3.88Å; A317-V321 WeakPolarHBondContact O-CG2 3.44Å; A317-V321 PolarHBondContact O-N 2.8Å; A317-V321 VanDerWaalsContact O-N 3.17Å; H318-V321 PolarHBondContact O-N 2.93Å; Q319-V321 VanDerWaalsContact C-N 3.31Å; Q319-V321 PolarHBondContact O-N 3.46Å; V321-F323 PolarHBondContact O-N 2.97Å
322I76.3Confident75.5Confident80 Ų8060.7 Ų60.741%0.4130%0.295SS..Hα-helixtrans-65.1-21176.1-74.5-169.6000112.3L98 H318 K324L98-I322 HydrophobicContact CD1-CG1 4.27Å; L98-I322 HydrophobicContact CD2-CG1 4.16Å; H318-I322 WeakPolarHBondContact CE1-CD1 3.24Å; H318-I322 VanDerWaalsContact NE2-CD1 3.3Å; H318-I322 WeakPolarHBondContact NE2-CD1 3.4Å; H318-I322 PolarHBondContact O-N 3.32Å; H318-I322 VanDerWaalsContact O-N 3.12Å; I322-K324 PolarHBondContact O-N 2.96Å
323F64.7Low75.2Confident53 Ų5360.7 Ų60.723%0.23230%0.295CS..  trans-66.897.8-179.9-169.7-127.1000111.8R87 I320 V321 P326 W492R87-F323 VanDerWaalsContact CZ-O 3.29Å; R87-F323 PolarHBondContact NE-O 3.5Å; R87-F323 PolarHBondContact NH2-O 3.46Å; I320-F323 WeakPolarHBondContact O-CB 3.49Å; I320-F323 PolarHBondContact O-N 3.33Å; V321-F323 PolarHBondContact O-N 2.97Å; F323-P326 HydrophobicContact CE1-CG 3.7Å; F323-P326 HydrophobicContact CE2-CG 3.62Å; F323-P326 HydrophobicContact CZ-CG 3.16Å; F323-W492 HydrophobicContact CB-CH2 4.13Å; F323-W492 HydrophobicContact CB-CZ2 4.05Å; F323-W492 HydrophobicContact CD1-CZ2 4.37Å; F323-W492 HydrophobicContact CD2-CD2 4.47Å; F323-W492 AromaticContact CD2-CE2 3.28Å; F323-W492 AromaticContact CD2-CH2 3.84Å; F323-W492 HydrophobicContact CD2-CH2 3.84Å; F323-W492 AromaticContact CD2-CZ2 2.92Å; F323-W492 HydrophobicContact CD2-CZ2 2.92Å; F323-W492 AromaticContact CD2-NE1 3.43Å; F323-W492 AromaticContact CE2-CE2 3.53Å; F323-W492 HydrophobicContact CE2-CH2 4.37Å; F323-W492 AromaticContact CE2-CZ2 3.2Å; F323-W492 HydrophobicContact CE2-CZ2 3.2Å; F323-W492 AromaticContact CE2-NE1 3.38Å; F323-W492 HydrophobicContact CG-CH2 4.05Å; F323-W492 AromaticContact CG-CZ2 3.55Å; F323-W492 HydrophobicContact CG-CZ2 3.55Å; F323-W492 HydrophobicContact CZ-CZ2 4.03Å
324K64Low74.8Confident184 Ų18461.7 Ų61.780%0.830%0.302SS*.  trans-63.4133.4171.5-68.2-177.4178.1178.60109.3I322 P326I322-K324 PolarHBondContact O-N 2.96Å; K324-P326 WeakPolarHBondContact O-CD 3.27Å; K324-P326 WeakPolarHBondContact O-CG 3.34Å; K324-P326 VanDerWaalsContact O-N 3.11Å
325D60.5Low74.5Confident126 Ų12658.9 Ų58.967%0.67429%0.291SS*.  trans-50.8110.8179.5-83.4-48.4000112.8R87R87-D325 IonicContact CZ-OD1 3.98Å; R87-D325 IonicContact NE-OD1 3.39Å; R87-D325 IonicContact NH1-OD1 2.81Å; R87-D325 VanDerWaalsContact NH2-CA 3.34Å; R87-D325 VanDerWaalsContact NH2-CG 3.34Å; R87-D325 IonicContact NH2-OD1 3.71Å; R87-D325 PolarHBondContact NH2-OD1 3.23Å; R87-D325 IonicContact NH2-OD2 3.15Å
326P53.4Low74.6Confident24 Ų2458.8 Ų58.816%0.15629%0.29CS..  trans-109.731.4-174.832.3-16.2000111.5F323 K324 K328 E329 L330F323-P326 HydrophobicContact CE1-CG 3.7Å; F323-P326 HydrophobicContact CE2-CG 3.62Å; F323-P326 HydrophobicContact CZ-CG 3.16Å; K324-P326 WeakPolarHBondContact O-CD 3.27Å; K324-P326 WeakPolarHBondContact O-CG 3.34Å; K324-P326 VanDerWaalsContact O-N 3.11Å; P326-K328 PolarHBondContact O-N 2.89Å; P326-E329 HydrophobicContact CB-CB 4.38Å; P326-E329 PolarHBondContact O-N 2.97Å; P326-E329 VanDerWaalsContact O-N 3.16Å; P326-L330 HydrophobicContact CB-CB 4.49Å; P326-L330 WeakPolarHBondContact O-CA 3.38Å; P326-L330 WeakPolarHBondContact O-CB 3.06Å; P326-L330 PolarHBondContact O-N 3.42Å
327V61.9Low74.8Confident104 Ų10459.4 Ų59.463%0.6329%0.293SS*.Hα-helixtrans-55.4-33.8-174.5-178.40000111.9Q331V327-Q331 WeakPolarHBondContact O-CG 3.46Å
328K57.5Low74.9Confident150 Ų15063 Ų6365%0.65231%0.311SS*.Hα-helixtrans-80.9-41177.4-158.8178.7-178.8-175.70113.8P326P326-K328 PolarHBondContact O-N 2.89Å
329E62.4Low75.3Confident76 Ų7662.4 Ų62.436%0.35531%0.308SS..Hα-helixtrans-75-33.9178-65.2-51.2133.500112.5P326 Q331 R332 L333P326-E329 HydrophobicContact CB-CB 4.38Å; P326-E329 PolarHBondContact O-N 2.97Å; P326-E329 VanDerWaalsContact O-N 3.16Å; E329-Q331 VanDerWaalsContact C-N 3.34Å; E329-Q331 PolarHBondContact O-N 3.42Å; E329-R332 PolarHBondContact O-N 3.31Å; E329-R332 IonicContact OE1-NH1 2.64Å; E329-L333 PolarHBondContact O-N 3.42Å
330L67Low76.1Confident66 Ų6661 Ų6135%0.34630%0.302SS..Hα-helixtrans-60.9-44.3177.6-177.361.4000110.1P326 R332 L333 V334 M337P326-L330 HydrophobicContact CB-CB 4.49Å; P326-L330 WeakPolarHBondContact O-CA 3.38Å; P326-L330 WeakPolarHBondContact O-CB 3.06Å; P326-L330 PolarHBondContact O-N 3.42Å; L330-R332 PolarHBondContact O-N 3.02Å; L330-L333 CarbonylContact O-C 3.45Å; L330-L333 PolarHBondContact O-N 3.49Å; L330-V334 HydrophobicContact CD1-CG2 4.35Å; L330-V334 HydrophobicContact CG-CG2 4.04Å; L330-V334 WeakPolarHBondContact O-CG2 3.44Å; L330-V334 PolarHBondContact O-N 3.3Å; L330-M337 HydrophobicContact CD1-CE 4.3Å; L330-M337 HydrophobicContact CD1-SD 3.31Å; L330-M337 WeakPolarHBondContact CD1-SD 3.48Å
331Q69Low76.8Confident145 Ų14560.6 Ų60.668%0.67830%0.3SS*.Hα-helixtrans-52-40.5177.9-79.6178.5-7.400112.6V327 E329V327-Q331 WeakPolarHBondContact O-CG 3.46Å; E329-Q331 VanDerWaalsContact C-N 3.34Å; E329-Q331 PolarHBondContact O-N 3.42Å
332R69.2Low77.4Confident55 Ų5561.6 Ų61.621%0.20831%0.308CS..Hα-helixtrans-74.1-33179.7-63.6175.7174.2172.9-9.1112.7D173 E329 L330D173-R332 IonicContact OD2-NH2 3.25Å; D173-R332 PolarHBondContact OD2-NH2 2.9Å; E329-R332 PolarHBondContact O-N 3.31Å; E329-R332 IonicContact OE1-NH1 2.64Å; L330-R332 PolarHBondContact O-N 3.02Å
333L82.8Confident78.4Confident1 Ų157.8 Ų57.81%0.00529%0.288CS..Hα-helixtrans-100-0.1-174.7-61.9171.9000113.8E329 L330 G335 Y336 M337 Y431 L486 P489 V490E329-L333 PolarHBondContact O-N 3.42Å; L330-L333 CarbonylContact O-C 3.45Å; L330-L333 PolarHBondContact O-N 3.49Å; L333-G335 VanDerWaalsContact C-N 3.32Å; L333-G335 PolarHBondContact O-N 3.23Å; L333-Y336 PolarHBondContact O-N 2.91Å; L333-M337 WeakPolarHBondContact O-CG 3.46Å; L333-M337 PolarHBondContact O-N 3.42Å; L333-Y431 HydrophobicContact CD2-CE1 4.24Å; L333-L486 VanDerWaalsContact CD1-O 3.28Å; L333-L486 WeakPolarHBondContact CD1-O 3.44Å; L333-L486 HydrophobicContact CD2-CD1 4.2Å; L333-L486 HydrophobicContact CD2-CG 4.04Å; L333-L486 WeakPolarHBondContact CD2-O 3.39Å; L333-P489 HydrophobicContact CD1-CB 4.33Å; L333-P489 HydrophobicContact CD1-CG 4.44Å; L333-V490 HydrophobicContact CB-CG1 4.09Å; L333-V490 HydrophobicContact CD1-CG1 3.67Å; L333-V490 HydrophobicContact CD1-CG2 4.13Å
334V85Confident80Confident54 Ų5455.3 Ų55.333%0.32728%0.277SS..Hα-helixtrans-56.1-47.3-177.5169.80000110.8L330 Y336 M337 I338L330-V334 HydrophobicContact CD1-CG2 4.35Å; L330-V334 HydrophobicContact CG-CG2 4.04Å; L330-V334 WeakPolarHBondContact O-CG2 3.44Å; L330-V334 PolarHBondContact O-N 3.3Å; V334-Y336 PolarHBondContact O-N 3.24Å; V334-M337 PolarHBondContact O-N 3.13Å; V334-I338 HydrophobicContact CG1-CD1 3.45Å; V334-I338 VanDerWaalsContact CG1-CD1 3.45Å; V334-I338 HydrophobicContact CG1-CG1 4.07Å; V334-I338 WeakPolarHBondContact O-CB 3.36Å; V334-I338 VanDerWaalsContact O-CG1 3.27Å; V334-I338 WeakPolarHBondContact O-CG1 3.5Å; V334-I338 PolarHBondContact O-N 3.17Å
335G89.2Confident81.6Confident3 Ų351.2 Ų51.23%0.03126%0.26CS..Hα-helixtrans-58.4-49.9-179.600000111.8P167 L333 M337 I338 T339P167-G335 VanDerWaalsContact CB-C 3.41Å; L333-G335 VanDerWaalsContact C-N 3.32Å; L333-G335 PolarHBondContact O-N 3.23Å; G335-M337 PolarHBondContact O-N 3.27Å; G335-I338 PolarHBondContact O-N 2.92Å; G335-T339 PolarHBondContact O-N 3.03Å; G335-T339 PolarHBondContact O-OG1 2.87Å
336Y91.9Very high83.5Confident0 Ų048.4 Ų48.40%024%0.244CC..Hα-helixtrans-57.4-49.6176.3169.7-109.7000112.3L333 V334 I338 T339 V340 Y424 V427 A428 Y431 I487 V490 L494L333-Y336 PolarHBondContact O-N 2.91Å; V334-Y336 PolarHBondContact O-N 3.24Å; Y336-I338 PolarHBondContact O-N 3.31Å; Y336-T339 PolarHBondContact O-N 3.47Å; Y336-V340 HydrophobicContact CD2-CG2 4.09Å; Y336-V340 HydrophobicContact CE1-CG2 4.36Å; Y336-V340 HydrophobicContact CE2-CG2 3.52Å; Y336-V340 WeakPolarHBondContact O-CG2 3.37Å; Y336-V340 PolarHBondContact O-N 2.9Å; Y336-Y424 VanDerWaalsContact OH-CD2 3.27Å; Y336-Y424 WeakPolarHBondContact OH-CD2 3.28Å; Y336-Y424 WeakPolarHBondContact OH-CE2 3.37Å; Y336-V427 HydrophobicContact CD2-CG1 4.11Å; Y336-V427 HydrophobicContact CE2-CG1 3.97Å; Y336-A428 HydrophobicContact CE2-CB 4Å; Y336-Y431 AromaticContact CD2-CD1 3.63Å; Y336-Y431 HydrophobicContact CD2-CD1 3.63Å; Y336-Y431 HydrophobicContact CD2-CD2 4.36Å; Y336-Y431 HydrophobicContact CD2-CE1 4.29Å; Y336-Y431 AromaticContact CD2-CG 3.66Å; Y336-Y431 HydrophobicContact CD2-CG 3.66Å; Y336-Y431 HydrophobicContact CE2-CD1 4.31Å; Y336-Y431 AromaticContact CG-CD1 3.86Å; Y336-Y431 HydrophobicContact CG-CD1 3.86Å; Y336-Y431 HydrophobicContact CG-CE1 4.05Å; Y336-Y431 HydrophobicContact CG-CG 4.12Å; Y336-I487 HydrophobicContact CD1-CB 4.45Å; Y336-I487 HydrophobicContact CD1-CG2 4.03Å; Y336-I487 HydrophobicContact CE1-CB 3.85Å; Y336-I487 HydrophobicContact CE1-CG2 3.77Å; Y336-I487 HydrophobicContact CE2-CG2 4.43Å; Y336-I487 HydrophobicContact CG-CG2 4.45Å; Y336-V490 HydrophobicContact CD1-CG2 3.93Å; Y336-V490 HydrophobicContact CE1-CG2 3.8Å; Y336-L494 HydrophobicContact CD1-CD1 4.35Å; Y336-L494 HydrophobicContact CE1-CD1 3.56Å
337M90.9Very high85.6Confident25 Ų2547.3 Ų47.312%0.12324%0.237CC..Hα-helixtrans-60.1-44.5178.1-73.5-173.970.100112L330 L333 V334 G335 T339 V340 L341 V490 F493L330-M337 HydrophobicContact CD1-CE 4.3Å; L330-M337 HydrophobicContact CD1-SD 3.31Å; L330-M337 WeakPolarHBondContact CD1-SD 3.48Å; L333-M337 WeakPolarHBondContact O-CG 3.46Å; L333-M337 PolarHBondContact O-N 3.42Å; V334-M337 PolarHBondContact O-N 3.13Å; G335-M337 PolarHBondContact O-N 3.27Å; M337-T339 VanDerWaalsContact C-N 3.33Å; M337-T339 PolarHBondContact O-N 3.31Å; M337-V340 PolarHBondContact O-N 3.14Å; M337-L341 VanDerWaalsContact O-CB 3.25Å; M337-L341 WeakPolarHBondContact O-CB 3.16Å; M337-L341 WeakPolarHBondContact O-CG 3.34Å; M337-L341 PolarHBondContact O-N 2.92Å; M337-V490 HydrophobicContact CE-CB 4.44Å; M337-V490 HydrophobicContact CE-CG1 4.48Å; M337-V490 HydrophobicContact CG-CB 3.91Å; M337-V490 HydrophobicContact CG-CG1 3.98Å; M337-V490 HydrophobicContact CG-CG2 3.98Å; M337-V490 HydrophobicContact SD-CB 3.77Å; M337-V490 HydrophobicContact SD-CG1 3.39Å; M337-V490 WeakPolarHBondContact SD-CG1 3.35Å; M337-V490 HydrophobicContact SD-CG2 4.45Å; M337-F493 HydrophobicContact CE-CD1 3.6Å; M337-F493 HydrophobicContact CE-CE1 3.92Å
338I93Very high87.3Confident75 Ų7542.9 Ų42.939%0.38521%0.211SC..Hα-helixtrans-61-44.5177.5-72.2174.1000110.1V334 G335 Y336 S342V334-I338 HydrophobicContact CG1-CD1 3.45Å; V334-I338 VanDerWaalsContact CG1-CD1 3.45Å; V334-I338 HydrophobicContact CG1-CG1 4.07Å; V334-I338 WeakPolarHBondContact O-CB 3.36Å; V334-I338 VanDerWaalsContact O-CG1 3.27Å; V334-I338 WeakPolarHBondContact O-CG1 3.5Å; V334-I338 PolarHBondContact O-N 3.17Å; G335-I338 PolarHBondContact O-N 2.92Å; Y336-I338 PolarHBondContact O-N 3.31Å; I338-S342 WeakPolarHBondContact O-CB 3.43Å; I338-S342 PolarHBondContact O-N 2.93Å; I338-S342 PolarHBondContact O-OG 2.97Å
339T96Very high89.2Confident0 Ų042.8 Ų42.80%021%0.211CC..Hα-helixtrans-61.5-49.6179-58.20000111.5L161 V162 I165 P167 G335 Y336 M337 S342 G343 V427L161-T339 HydrophobicContact CB-CG2 4.05Å; V162-T339 HydrophobicContact CB-CG2 4.06Å; I165-T339 HydrophobicContact CD1-CG2 4.28Å; P167-T339 HydrophobicContact CG-CG2 4.44Å; P167-T339 WeakPolarHBondContact CG-OG1 3.42Å; G335-T339 PolarHBondContact O-N 3.03Å; G335-T339 PolarHBondContact O-OG1 2.87Å; Y336-T339 PolarHBondContact O-N 3.47Å; M337-T339 VanDerWaalsContact C-N 3.33Å; M337-T339 PolarHBondContact O-N 3.31Å; T339-S342 PolarHBondContact O-N 2.95Å; T339-G343 PolarHBondContact O-N 3.21Å; T339-V427 HydrophobicContact CG2-CG1 3.62Å; T339-V427 HydrophobicContact CG2-CG2 4.27Å
340V96.5Very high90.9Very high0 Ų043 Ų430%022%0.218CC..Hα-helixtrans-62.5-49.2178.5174.90000110.8Y336 M337 S342 G343 L344 Y424 V427 L494Y336-V340 HydrophobicContact CD2-CG2 4.09Å; Y336-V340 HydrophobicContact CE1-CG2 4.36Å; Y336-V340 HydrophobicContact CE2-CG2 3.52Å; Y336-V340 WeakPolarHBondContact O-CG2 3.37Å; Y336-V340 PolarHBondContact O-N 2.9Å; M337-V340 PolarHBondContact O-N 3.14Å; V340-S342 VanDerWaalsContact C-N 3.34Å; V340-S342 PolarHBondContact O-N 3.05Å; V340-G343 PolarHBondContact O-N 2.95Å; V340-L344 HydrophobicContact CG1-CD1 3.81Å; V340-L344 HydrophobicContact CG1-CG 4.18Å; V340-L344 WeakPolarHBondContact O-CG 3.5Å; V340-L344 PolarHBondContact O-N 2.85Å; V340-Y424 HydrophobicContact CG1-CD2 4.11Å; V340-Y424 HydrophobicContact CG2-CD2 4.36Å; V340-V427 HydrophobicContact CG2-CB 4.05Å; V340-V427 HydrophobicContact CG2-CG1 3.6Å; V340-L494 HydrophobicContact CB-CD1 4.26Å; V340-L494 HydrophobicContact CB-CD2 4.2Å; V340-L494 HydrophobicContact CG1-CD1 4.16Å; V340-L494 HydrophobicContact CG1-CD2 3.92Å; V340-L494 HydrophobicContact CG1-CG 4.44Å; V340-L494 HydrophobicContact CG2-CD1 4.33Å
341L96.6Very high92.4Very high32 Ų3241.3 Ų41.317%0.16821%0.21CC..Hα-helixtrans-62.7-42.3-179-70.3171.2000111.6M337 G343 L344 F345 F493 L494 I497M337-L341 VanDerWaalsContact O-CB 3.25Å; M337-L341 WeakPolarHBondContact O-CB 3.16Å; M337-L341 WeakPolarHBondContact O-CG 3.34Å; M337-L341 PolarHBondContact O-N 2.92Å; L341-G343 VanDerWaalsContact C-N 3.31Å; L341-G343 PolarHBondContact O-N 2.83Å; L341-L344 PolarHBondContact O-N 3.33Å; L341-F345 HydrophobicContact CB-CD2 4.22Å; L341-F345 HydrophobicContact CB-CE2 4.12Å; L341-F345 HydrophobicContact CD2-CE2 4.42Å; L341-F345 WeakPolarHBondContact O-CB 3.28Å; L341-F345 WeakPolarHBondContact O-CD2 3.48Å; L341-F345 WeakPolarHBondContact O-CG 3.31Å; L341-F345 PolarHBondContact O-N 2.03Å; L341-F493 HydrophobicContact CD1-CE1 4.04Å; L341-F493 HydrophobicContact CD2-CE1 3.96Å; L341-L494 HydrophobicContact CD2-CD2 3.83Å; L341-L494 HydrophobicContact CG-CD2 3.87Å; L341-I497 HydrophobicContact CD2-CB 4.48Å; L341-I497 HydrophobicContact CD2-CG1 4.11Å; L341-I497 HydrophobicContact CD2-CG2 4.4Å
342S97.6Very high93.7Very high41 Ų4134.4 Ų34.429%0.28718%0.178SC..Hα-helixtrans-59.7-44.3176.9-59.70000110.9I338 T339 V340 F345 I346I338-S342 WeakPolarHBondContact O-CB 3.43Å; I338-S342 PolarHBondContact O-N 2.93Å; I338-S342 PolarHBondContact O-OG 2.97Å; T339-S342 PolarHBondContact O-N 2.95Å; V340-S342 VanDerWaalsContact C-N 3.34Å; V340-S342 PolarHBondContact O-N 3.05Å; S342-F345 PolarHBondContact O-N 3.32Å; S342-I346 WeakPolarHBondContact O-CB 3.5Å; S342-I346 WeakPolarHBondContact O-CD1 3.13Å; S342-I346 VanDerWaalsContact O-CG1 3.25Å; S342-I346 WeakPolarHBondContact O-CG1 3.26Å; S342-I346 PolarHBondContact O-N 3.36Å
343G98.3Very high95.1Very high0 Ų032.6 Ų32.60%017%0.173CC..Hα-helixtrans-64.3-48.117500000112.6T339 V340 L341 F345 I346 H347T339-G343 PolarHBondContact O-N 3.21Å; V340-G343 PolarHBondContact O-N 2.95Å; L341-G343 VanDerWaalsContact C-N 3.31Å; L341-G343 PolarHBondContact O-N 2.83Å; G343-F345 PolarHBondContact O-N 2.93Å; G343-I346 PolarHBondContact O-N 3.04Å; G343-H347 VanDerWaalsContact O-CB 3.25Å; G343-H347 WeakPolarHBondContact O-CB 3.45Å; G343-H347 PolarHBondContact O-N 3.16Å
344L98Very high95.8Very high0 Ų034.9 Ų34.90%019%0.189CC..Hα-helixtrans-58.7-37.2176.4-68.5177.2000112.2V340 L341 A348 G420 L423 I497 R498 V501V340-L344 HydrophobicContact CG1-CD1 3.81Å; V340-L344 HydrophobicContact CG1-CG 4.18Å; V340-L344 WeakPolarHBondContact O-CG 3.5Å; V340-L344 PolarHBondContact O-N 2.85Å; L341-L344 PolarHBondContact O-N 3.33Å; L344-A348 WeakPolarHBondContact O-CB 3.25Å; L344-A348 PolarHBondContact O-N 2.73Å; L344-G420 VanDerWaalsContact CD2-CA 3.46Å; L344-L423 HydrophobicContact CD2-CD2 4.4Å; L344-L423 HydrophobicContact CG-CD2 4.44Å; L344-I497 HydrophobicContact CB-CG2 4.14Å; L344-I497 HydrophobicContact CD1-CB 4.02Å; L344-I497 HydrophobicContact CD1-CG2 3.77Å; L344-R498 HydrophobicContact CD1-CB 4.4Å; L344-V501 HydrophobicContact CB-CG2 4.19Å; L344-V501 HydrophobicContact CD2-CB 4.41Å; L344-V501 HydrophobicContact CD2-CG2 4.29Å
345F98.1Very high96.4Very high98 Ų9834 Ų3443%0.4318%0.182SC..Hα-helixtrans-74.6-42.7178.2-74.8-50.5000113.5L341 S342 G343 H347 A348 F349L341-F345 HydrophobicContact CB-CD2 4.22Å; L341-F345 HydrophobicContact CB-CE2 4.12Å; L341-F345 HydrophobicContact CD2-CE2 4.42Å; L341-F345 WeakPolarHBondContact O-CB 3.28Å; L341-F345 WeakPolarHBondContact O-CD2 3.48Å; L341-F345 WeakPolarHBondContact O-CG 3.31Å; L341-F345 PolarHBondContact O-N 2.03Å; S342-F345 PolarHBondContact O-N 3.32Å; G343-F345 PolarHBondContact O-N 2.93Å; F345-H347 VanDerWaalsContact C-N 3.3Å; F345-A348 PolarHBondContact O-N 3.14Å; F345-F349 HydrophobicContact CB-CD2 4.29Å; F345-F349 AromaticContact CD1-CD2 3.86Å; F345-F349 HydrophobicContact CD1-CD2 3.86Å; F345-F349 AromaticContact CD1-CE2 3.52Å; F345-F349 HydrophobicContact CD1-CE2 3.52Å; F345-F349 HydrophobicContact CE1-CE2 4.01Å; F345-F349 VanDerWaalsContact O-CB 3.32Å; F345-F349 WeakPolarHBondContact O-CB 3.37Å; F345-F349 WeakPolarHBondContact O-CD2 3.5Å; F345-F349 PolarHBondContact O-N 3.15Å
346I98.4Very high96.8Very high68 Ų6833.9 Ų33.935%0.34918%0.181SC..Hα-helixtrans-62.5-43.4174.5-69.2163.2000108.9E157 L161 S342 G343 A348 V350 V351E157-I346 WeakPolarHBondContact OE1-CB 3.45Å; E157-I346 WeakPolarHBondContact OE1-CG2 3.34Å; L161-I346 HydrophobicContact CD1-CD1 4.25Å; L161-I346 HydrophobicContact CD2-CD1 4.22Å; S342-I346 WeakPolarHBondContact O-CB 3.5Å; S342-I346 WeakPolarHBondContact O-CD1 3.13Å; S342-I346 VanDerWaalsContact O-CG1 3.25Å; S342-I346 WeakPolarHBondContact O-CG1 3.26Å; S342-I346 PolarHBondContact O-N 3.36Å; G343-I346 PolarHBondContact O-N 3.04Å; I346-A348 PolarHBondContact O-N 2.93Å; I346-V350 HydrophobicContact CG2-CB 4.28Å; I346-V350 HydrophobicContact CG2-CG2 4.38Å; I346-V350 VanDerWaalsContact O-CA 3.3Å; I346-V350 WeakPolarHBondContact O-CA 3.46Å; I346-V350 WeakPolarHBondContact O-CB 3.28Å; I346-V350 PolarHBondContact O-N 3.46Å; I346-V351 PolarHBondContact O-N 2.87Å; I346-V351 VanDerWaalsContact O-N 3.11Å
347H98.2Very high97Very high1 Ų138.4 Ų38.41%0.00521%0.205CC..Iπ-helixtrans-59.4-49.5175.4-156.572.7000112.6E157 G343 F345 V351 L352 D419E157-H347 PolarHBondContact OE1-N 2.73Å; E157-H347 WeakPolarHBondContact OE2-CB 3.48Å; E157-H347 IonicContact OE2-CG 3.96Å; E157-H347 IonicContact OE2-ND1 3.91Å; E157-H347 PolarHBondContact OE2-ND1 3.25Å; G343-H347 VanDerWaalsContact O-CB 3.25Å; G343-H347 WeakPolarHBondContact O-CB 3.45Å; G343-H347 PolarHBondContact O-N 3.16Å; F345-H347 VanDerWaalsContact C-N 3.3Å; H347-V351 PolarHBondContact O-N 3.25Å; H347-L352 WeakPolarHBondContact O-CG 3.36Å; H347-L352 PolarHBondContact O-N 2.93Å; H347-D419 IonicContact NE2-OD2 3.25Å
348A97.9Very high97.3Very high11 Ų1143.6 Ų43.69%0.09123%0.232CC..Iπ-helixtrans-72.8-33.8-17700000114.5L344 F345 I346 P353 V501 F504L344-A348 WeakPolarHBondContact O-CB 3.25Å; L344-A348 PolarHBondContact O-N 2.73Å; F345-A348 PolarHBondContact O-N 3.14Å; I346-A348 PolarHBondContact O-N 2.93Å; A348-P353 WeakPolarHBondContact O-CD 3.35Å; A348-P353 WeakPolarHBondContact O-CG 3.47Å; A348-V501 HydrophobicContact CB-CG2 3.97Å; A348-F504 HydrophobicContact CB-CD1 4.41Å; A348-F504 WeakPolarHBondContact O-CE1 3.46Å
349F97.6Very high97.5Very high148 Ų14842.8 Ų42.865%0.64923%0.23SC*.Iπ-helixtrans-105.3-16-174.3-68.6-67.5000114.1F345F345-F349 HydrophobicContact CB-CD2 4.29Å; F345-F349 AromaticContact CD1-CD2 3.86Å; F345-F349 HydrophobicContact CD1-CD2 3.86Å; F345-F349 AromaticContact CD1-CE2 3.52Å; F345-F349 HydrophobicContact CD1-CE2 3.52Å; F345-F349 HydrophobicContact CE1-CE2 4.01Å; F345-F349 VanDerWaalsContact O-CB 3.32Å; F345-F349 WeakPolarHBondContact O-CB 3.37Å; F345-F349 WeakPolarHBondContact O-CD2 3.5Å; F345-F349 PolarHBondContact O-N 3.15Å
350V97.7Very high97.5Very high81 Ų8142.8 Ų42.849%0.49123%0.231SC..Iπ-helixtrans-116.8-61.5179.9-172.10000110.8I346 S354I346-V350 HydrophobicContact CG2-CB 4.28Å; I346-V350 HydrophobicContact CG2-CG2 4.38Å; I346-V350 VanDerWaalsContact O-CA 3.3Å; I346-V350 WeakPolarHBondContact O-CA 3.46Å; I346-V350 WeakPolarHBondContact O-CB 3.28Å; I346-V350 PolarHBondContact O-N 3.46Å; V350-S354 WeakPolarHBondContact O-CB 3.4Å; V350-S354 PolarHBondContact O-N 3.37Å; V350-S354 PolarHBondContact O-OG 3.01Å
351V97.9Very high97.4Very high30 Ų3052.1 Ų52.118%0.18227%0.266CS..Iπ-helixtrans-66.5-58.2-170.4-178.30000111.7L153 I346 H347 S354 L355L153-V351 HydrophobicContact CB-CG1 4.45Å; L153-V351 HydrophobicContact CD1-CG1 4.15Å; I346-V351 PolarHBondContact O-N 2.87Å; I346-V351 VanDerWaalsContact O-N 3.11Å; H347-V351 PolarHBondContact O-N 3.25Å; V351-S354 PolarHBondContact O-N 2.84Å; V351-L355 HydrophobicContact CG1-CD1 4.39Å; V351-L355 WeakPolarHBondContact O-CG 3.31Å; V351-L355 PolarHBondContact O-N 3.12Å
352L97.7Very high97.3Very high0 Ų054.2 Ų54.20%027%0.272CS..Hα-helixtrans-63.2-45.1-177.9-64.5172.2000112.6T150 H347 S354 L355 M356 V501 F504 L508T150-L352 HydrophobicContact CG2-CD2 4.06Å; H347-L352 WeakPolarHBondContact O-CG 3.36Å; H347-L352 PolarHBondContact O-N 2.93Å; L352-S354 VanDerWaalsContact C-N 3.33Å; L352-S354 PolarHBondContact O-N 3.09Å; L352-L355 PolarHBondContact O-N 3.1Å; L352-M356 PolarHBondContact O-N 3.38Å; L352-V501 HydrophobicContact CD1-CG1 4.4Å; L352-F504 HydrophobicContact CB-CD1 4.42Å; L352-F504 HydrophobicContact CB-CE1 4.12Å; L352-F504 HydrophobicContact CD1-CD1 3.72Å; L352-F504 HydrophobicContact CD1-CE1 4.25Å; L352-L508 HydrophobicContact CB-CD2 3.81Å
353P97.7Very high97.2Very high17 Ų1756.8 Ų56.811%0.1128%0.282CS..Hα-helixtrans-63-35.5174.6-28.240.4000113.5A348 M356 L357 P364 F504A348-P353 WeakPolarHBondContact O-CD 3.35Å; A348-P353 WeakPolarHBondContact O-CG 3.47Å; P353-M356 PolarHBondContact O-N 2.95Å; P353-L357 WeakPolarHBondContact O-CG 3.05Å; P353-L357 PolarHBondContact O-N 3.01Å; P353-P364 HydrophobicContact CB-CB 3.77Å; P353-P364 HydrophobicContact CB-CG 3.94Å; P353-F504 HydrophobicContact CG-CE1 4.47Å
354S97.6Very high97.1Very high49 Ų4957.3 Ų57.334%0.34329%0.286SS..Hα-helixtrans-64.5-43.9175.8-63.80000111.3V350 V351 L352 M356 L357 L358V350-S354 WeakPolarHBondContact O-CB 3.4Å; V350-S354 PolarHBondContact O-N 3.37Å; V350-S354 PolarHBondContact O-OG 3.01Å; V351-S354 PolarHBondContact O-N 2.84Å; L352-S354 VanDerWaalsContact C-N 3.33Å; L352-S354 PolarHBondContact O-N 3.09Å; S354-M356 VanDerWaalsContact C-N 3.3Å; S354-M356 PolarHBondContact O-N 3.09Å; S354-L357 PolarHBondContact O-N 3.27Å; S354-L358 WeakPolarHBondContact O-CB 3.35Å; S354-L358 VanDerWaalsContact O-CG 3.25Å; S354-L358 WeakPolarHBondContact O-CG 3.48Å; S354-L358 PolarHBondContact O-N 3.36Å
355L96.9Very high97Very high36 Ų3663.9 Ų63.919%0.18832%0.32CS..Hα-helixtrans-61-40.4174.1-70.1173.1000111.8Y146 T150 V351 L352 L357 V359 G360 I512Y146-L355 HydrophobicContact CE2-CD1 4.45Å; T150-L355 HydrophobicContact CG2-CD1 3.7Å; V351-L355 HydrophobicContact CG1-CD1 4.39Å; V351-L355 WeakPolarHBondContact O-CG 3.31Å; V351-L355 PolarHBondContact O-N 3.12Å; L352-L355 PolarHBondContact O-N 3.1Å; L355-L357 PolarHBondContact O-N 3.27Å; L355-V359 WeakPolarHBondContact O-CB 3.07Å; L355-V359 PolarHBondContact O-N 3.34Å; L355-G360 PolarHBondContact O-N 3.31Å; L355-I512 HydrophobicContact CB-CD1 4Å
356M97.5Very high96.8Very high0 Ų067 Ų670%033%0.333CS..Hα-helixtrans-65.5-37176.5-176.653.6149.200112.7L352 P353 S354 G360 R361 R362 P364 Y367 L508 I512L352-M356 PolarHBondContact O-N 3.38Å; P353-M356 PolarHBondContact O-N 2.95Å; S354-M356 VanDerWaalsContact C-N 3.3Å; S354-M356 PolarHBondContact O-N 3.09Å; M356-G360 CarbonylContact O-C 3.18Å; M356-G360 VanDerWaalsContact O-C 3.22Å; M356-G360 WeakPolarHBondContact O-CA 3.04Å; M356-G360 PolarHBondContact O-N 2.9Å; M356-R361 PolarHBondContact O-N 3.24Å; M356-R362 HydrophobicContact CE-CB 3.59Å; M356-R362 HydrophobicContact CE-CG 4.3Å; M356-R362 HydrophobicContact CG-CB 4.45Å; M356-R362 PolarHBondContact O-N 3.32Å; M356-R362 HydrophobicContact SD-CB 3.93Å; M356-P364 HydrophobicContact CB-CB 4.35Å; M356-P364 HydrophobicContact CG-CB 4.24Å; M356-Y367 HydrophobicContact CE-CD1 3.92Å; M356-Y367 HydrophobicContact CE-CD2 3.17Å; M356-Y367 HydrophobicContact CE-CE1 4.2Å; M356-Y367 HydrophobicContact CE-CE2 3.51Å; M356-Y367 HydrophobicContact CE-CG 3.38Å; M356-L508 HydrophobicContact CB-CD2 4.27Å; M356-L508 HydrophobicContact CB-CG 4.46Å; M356-I512 HydrophobicContact CB-CD1 4.48Å; M356-I512 HydrophobicContact SD-CG1 3.93Å
357L97.5Very high96.8Very high95 Ų9564 Ų6450%0.49732%0.317SS..Hα-helixtrans-70.8-48.5175.5-75.8169.9000112.2P353 S354 L355 R361 P364P353-L357 WeakPolarHBondContact O-CG 3.05Å; P353-L357 PolarHBondContact O-N 3.01Å; S354-L357 PolarHBondContact O-N 3.27Å; L355-L357 PolarHBondContact O-N 3.27Å; L357-R361 WeakPolarHBondContact O-CA 3.42Å; L357-R361 PolarHBondContact O-N 3.02Å; L357-P364 HydrophobicContact CD1-CG 4.12Å; L357-P364 HydrophobicContact CD2-CG 4.13Å; L357-P364 HydrophobicContact CG-CG 3.87Å
358L97Very high96.7Very high133 Ų13365.6 Ų65.670%0.69633%0.327SS*.Hα-helixtrans-76-48.4-172.7-65.6173.2000112.3S354S354-L358 WeakPolarHBondContact O-CB 3.35Å; S354-L358 VanDerWaalsContact O-CG 3.25Å; S354-L358 WeakPolarHBondContact O-CG 3.48Å; S354-L358 PolarHBondContact O-N 3.36Å
359V96.9Very high96.5Very high58 Ų5871.3 Ų71.335%0.35235%0.348SS..THydrogen-bonded Turntrans-97-51.7-174.7-170.30000110.7L355 R361 I512 L516L355-V359 WeakPolarHBondContact O-CB 3.07Å; L355-V359 PolarHBondContact O-N 3.34Å; V359-R361 VanDerWaalsContact C-N 3.25Å; V359-R361 PolarHBondContact O-N 3.35Å; V359-I512 HydrophobicContact CB-CG2 4.07Å; V359-I512 HydrophobicContact CG1-CG2 3.69Å; V359-L516 HydrophobicContact CG1-CD1 4.18Å; V359-L516 HydrophobicContact CG1-CD2 3.83Å; V359-L516 HydrophobicContact CG1-CG 4.18Å
360G95.2Very high96.3Very high1 Ų164.5 Ų64.51%0.0132%0.32CS..SBendtrans-68.3-22.6-179.300000113.9L355 M356 R362 K515L355-G360 PolarHBondContact O-N 3.31Å; M356-G360 CarbonylContact O-C 3.18Å; M356-G360 VanDerWaalsContact O-C 3.22Å; M356-G360 WeakPolarHBondContact O-CA 3.04Å; M356-G360 PolarHBondContact O-N 2.9Å; G360-R362 PolarHBondContact O-N 2.98Å; G360-R362 VanDerWaalsContact O-N 3.16Å; G360-K515 WeakPolarHBondContact O-CG 3.42Å
361R95.2Very high96.2Very high196 Ų19660.7 Ų60.774%0.7430%0.296SS*.  trans48.337.5-176.4-61.4-172.8175.8178.7-0112.9M356 L357 V359M356-R361 PolarHBondContact O-N 3.24Å; L357-R361 WeakPolarHBondContact O-CA 3.42Å; L357-R361 PolarHBondContact O-N 3.02Å; V359-R361 VanDerWaalsContact C-N 3.25Å; V359-R361 PolarHBondContact O-N 3.35Å
362R94.5Very high96Very high76 Ų7661.7 Ų61.729%0.28730%0.3SS..SBendtrans-123.8149.7177-75-179.3173.8-154.6-2.2109.2M356 G360 P364 N399 N400M356-R362 HydrophobicContact CE-CB 3.59Å; M356-R362 HydrophobicContact CE-CG 4.3Å; M356-R362 HydrophobicContact CG-CB 4.45Å; M356-R362 PolarHBondContact O-N 3.32Å; M356-R362 HydrophobicContact SD-CB 3.93Å; G360-R362 PolarHBondContact O-N 2.98Å; G360-R362 VanDerWaalsContact O-N 3.16Å; R362-P364 VanDerWaalsContact O-CD 3.31Å; R362-P364 WeakPolarHBondContact O-CD 3.41Å; R362-N399 PolarHBondContact NH1-O 3.15Å; R362-N400 PolarHBondContact NH2-O 3.42Å
363N96.3Very high95.6Very high95 Ų9562 Ų6251%0.50830%0.302SS..  trans-69.8116.7176.1-178.8-32.4000109.5L365 K366 Y367N363-L365 PolarHBondContact O-N 2.99Å; N363-L365 WeakPolarHBondContact OD1-CB 3.43Å; N363-L365 PolarHBondContact OD1-N 2.91Å; N363-K366 HydrophobicContact CB-CB 4.22Å; N363-K366 PolarHBondContact O-N 3.14Å; N363-K366 PolarHBondContact OD1-N 3.26Å; N363-Y367 WeakPolarHBondContact O-CB 3.44Å; N363-Y367 PolarHBondContact O-N 3.27Å; N363-Y367 VanDerWaalsContact O-N 3.07Å
364P95.9Very high95.3Very high11 Ų1161.2 Ų61.27%0.07130%0.297CS..Hα-helixtrans-67.8-33.9-174.427-34.9000112.2P353 M356 L357 R362 Y367 T368P353-P364 HydrophobicContact CB-CB 3.77Å; P353-P364 HydrophobicContact CB-CG 3.94Å; M356-P364 HydrophobicContact CB-CB 4.35Å; M356-P364 HydrophobicContact CG-CB 4.24Å; L357-P364 HydrophobicContact CD1-CG 4.12Å; L357-P364 HydrophobicContact CD2-CG 4.13Å; L357-P364 HydrophobicContact CG-CG 3.87Å; R362-P364 VanDerWaalsContact O-CD 3.31Å; R362-P364 WeakPolarHBondContact O-CD 3.41Å; P364-Y367 PolarHBondContact O-N 3.4Å; P364-T368 VanDerWaalsContact O-CB 3.32Å; P364-T368 WeakPolarHBondContact O-CB 3.03Å; P364-T368 PolarHBondContact O-N 3.39Å; P364-T368 PolarHBondContact O-OG1 2.86Å
365L95.1Very high95.2Very high137 Ų13759.7 Ų59.772%0.71729%0.285SS*.Hα-helixtrans-66.3-45.2179.7-62.7177.8000111.2N363 Y367 T368 Y369N363-L365 PolarHBondContact O-N 2.99Å; N363-L365 WeakPolarHBondContact OD1-CB 3.43Å; N363-L365 PolarHBondContact OD1-N 2.91Å; L365-Y367 VanDerWaalsContact C-N 3.3Å; L365-Y367 PolarHBondContact O-N 3.47Å; L365-T368 PolarHBondContact O-N 2.81Å; L365-Y369 PolarHBondContact O-N 3.01Å
366K95.1Very high94.9Very high163 Ų16359.1 Ų59.171%0.70928%0.282SS*.Hα-helixtrans-62.5-41.3175.4-174.6179.6178.7-177.60111N363 Y369 G370N363-K366 HydrophobicContact CB-CB 4.22Å; N363-K366 PolarHBondContact O-N 3.14Å; N363-K366 PolarHBondContact OD1-N 3.26Å; K366-Y369 PolarHBondContact O-N 3.32Å; K366-G370 PolarHBondContact O-N 2.85Å
367Y97.1Very high94.4Very high5 Ų559.2 Ų59.22%0.0228%0.283CS..Hα-helixtrans-64.4-45.1178.5-165.4-87000111.8M356 N363 P364 L365 Y369 G370 I371 N399 V401 S507 L508 G511M356-Y367 HydrophobicContact CE-CD1 3.92Å; M356-Y367 HydrophobicContact CE-CD2 3.17Å; M356-Y367 HydrophobicContact CE-CE1 4.2Å; M356-Y367 HydrophobicContact CE-CE2 3.51Å; M356-Y367 HydrophobicContact CE-CG 3.38Å; N363-Y367 WeakPolarHBondContact O-CB 3.44Å; N363-Y367 PolarHBondContact O-N 3.27Å; N363-Y367 VanDerWaalsContact O-N 3.07Å; P364-Y367 PolarHBondContact O-N 3.4Å; L365-Y367 VanDerWaalsContact C-N 3.3Å; L365-Y367 PolarHBondContact O-N 3.47Å; Y367-Y369 VanDerWaalsContact C-N 3.32Å; Y367-Y369 PolarHBondContact O-N 3.33Å; Y367-G370 PolarHBondContact O-N 3.32Å; Y367-I371 HydrophobicContact CD1-CD1 4.31Å; Y367-I371 HydrophobicContact CE1-CD1 4.32Å; Y367-I371 HydrophobicContact CE1-CG2 4.47Å; Y367-I371 PolarHBondContact O-N 2.67Å; Y367-N399 WeakPolarHBondContact CA-OD1 3.39Å; Y367-N399 HydrophobicContact CD2-CB 3.84Å; Y367-N399 VanDerWaalsContact CD2-CG 3.49Å; Y367-N399 HydrophobicContact CE2-CB 3.52Å; Y367-N399 PolarHBondContact O-ND2 3.4Å; Y367-N399 PolarHBondContact O-OD1 3Å; Y367-V401 HydrophobicContact CE2-CG2 3.94Å; Y367-V401 WeakPolarHBondContact OH-CG2 3.47Å; Y367-S507 WeakPolarHBondContact CE1-O 3.28Å; Y367-S507 WeakPolarHBondContact CE1-OG 3.48Å; Y367-S507 PolarHBondContact OH-O 3.41Å; Y367-L508 HydrophobicContact CD1-CD1 3.63Å; Y367-L508 HydrophobicContact CD1-CG 4.27Å; Y367-L508 HydrophobicContact CE1-CD1 3.8Å; Y367-L508 HydrophobicContact CE1-CG 4.4Å; Y367-G511 PolarHBondContact OH-N 3.19Å
368T96.6Very high94.1Very high35 Ų3554.7 Ų54.722%0.21526%0.259CS..Hα-helixtrans-59.2-42.4177.8-55.10000111.2P364 L365 G370 I371 L372 L375 F504P364-T368 VanDerWaalsContact O-CB 3.32Å; P364-T368 WeakPolarHBondContact O-CB 3.03Å; P364-T368 PolarHBondContact O-N 3.39Å; P364-T368 PolarHBondContact O-OG1 2.86Å; L365-T368 PolarHBondContact O-N 2.81Å; T368-G370 PolarHBondContact O-N 3.47Å; T368-I371 VanDerWaalsContact O-CG1 3.26Å; T368-I371 WeakPolarHBondContact O-CG1 3.45Å; T368-I371 PolarHBondContact O-N 3.38Å; T368-I371 VanDerWaalsContact O-N 3.13Å; T368-L372 PolarHBondContact O-N 3Å; T368-L375 HydrophobicContact CG2-CD1 4.03Å; T368-F504 HydrophobicContact CG2-CD2 4.48Å; T368-F504 HydrophobicContact CG2-CE2 3.72Å; T368-F504 HydrophobicContact CG2-CZ 4.37Å; T368-F504 VanDerWaalsContact OG1-CE2 3.25Å; T368-F504 WeakPolarHBondContact OG1-CE2 3.42Å; T368-F504 WeakPolarHBondContact OG1-CZ 3.11Å
369Y94.4Very high93.7Very high131 Ų13151 Ų5151%0.51424%0.24SC..Hα-helixtrans-58.4-37.5175.4-174.6-95.7000112.4L69 L365 K366 Y367 I371 L372L69-Y369 HydrophobicContact CD2-CD1 4.37Å; L69-Y369 HydrophobicContact CD2-CD2 4.1Å; L69-Y369 HydrophobicContact CD2-CE1 3.82Å; L69-Y369 HydrophobicContact CD2-CE2 3.5Å; L365-Y369 PolarHBondContact O-N 3.01Å; K366-Y369 PolarHBondContact O-N 3.32Å; Y367-Y369 VanDerWaalsContact C-N 3.32Å; Y367-Y369 PolarHBondContact O-N 3.33Å; Y369-I371 VanDerWaalsContact C-N 3.29Å; Y369-I371 PolarHBondContact O-N 2.92Å; Y369-L372 PolarHBondContact O-N 2.71Å
370G93.5Very high93Very high6 Ų648.4 Ų48.46%0.06223%0.225CC..Hα-helixtrans-66.5-2617800000114.4K366 Y367 T368 N398K366-G370 PolarHBondContact O-N 2.85Å; Y367-G370 PolarHBondContact O-N 3.32Å; T368-G370 PolarHBondContact O-N 3.47Å; G370-N398 WeakPolarHBondContact O-CB 3.3Å; G370-N398 PolarHBondContact O-ND2 2.81Å
371I95.1Very high92.4Very high1 Ų148.8 Ų48.81%0.00523%0.227CC..Hα-helixtrans-107.93-177.959.3170.9000113.2Y367 T368 Y369 P373 A374 L375 C394 N399 F504 S507 L508Y367-I371 HydrophobicContact CD1-CD1 4.31Å; Y367-I371 HydrophobicContact CE1-CD1 4.32Å; Y367-I371 HydrophobicContact CE1-CG2 4.47Å; Y367-I371 PolarHBondContact O-N 2.67Å; T368-I371 VanDerWaalsContact O-CG1 3.26Å; T368-I371 WeakPolarHBondContact O-CG1 3.45Å; T368-I371 PolarHBondContact O-N 3.38Å; T368-I371 VanDerWaalsContact O-N 3.13Å; Y369-I371 VanDerWaalsContact C-N 3.29Å; Y369-I371 PolarHBondContact O-N 2.92Å; I371-P373 VanDerWaalsContact C-N 3.31Å; I371-A374 WeakPolarHBondContact O-CA 3.11Å; I371-A374 VanDerWaalsContact O-CB 3.31Å; I371-A374 WeakPolarHBondContact O-CB 3.41Å; I371-A374 PolarHBondContact O-N 3.32Å; I371-L375 HydrophobicContact CD1-CD1 4.33Å; I371-L375 HydrophobicContact CD1-CD2 4.43Å; I371-L375 HydrophobicContact CD1-CG 4.46Å; I371-L375 HydrophobicContact CG1-CD1 4.21Å; I371-L375 HydrophobicContact CG1-CG 4.35Å; I371-L375 PolarHBondContact O-N 2.8Å; I371-L375 VanDerWaalsContact O-N 3.07Å; I371-C394 HydrophobicContact CB-CB 4.43Å; I371-C394 HydrophobicContact CG2-CB 3.95Å; I371-N399 VanDerWaalsContact CG2-ND2 3.28Å; I371-N399 WeakPolarHBondContact CG2-ND2 3.49Å; I371-F504 HydrophobicContact CD1-CD2 3.65Å; I371-F504 HydrophobicContact CD1-CE2 3.96Å; I371-S507 VanDerWaalsContact CD1-OG 3.28Å; I371-S507 WeakPolarHBondContact CD1-OG 2.98Å; I371-S507 WeakPolarHBondContact CG2-OG 3.21Å; I371-L508 HydrophobicContact CD1-CD1 3.98Å
372L92.9Very high91.9Very high50 Ų5039.6 Ų39.626%0.26219%0.192SC..Hα-helixtrans-53.4-37-177.9-173.256.5000114.3L69 V73 T368 Y369 A374 L375 L376L69-L372 HydrophobicContact CD1-CB 3.76Å; L69-L372 HydrophobicContact CD1-CD2 3.73Å; L69-L372 HydrophobicContact CD1-CG 3.71Å; L69-L372 HydrophobicContact CD2-CD2 4.31Å; L69-L372 HydrophobicContact CG-CD2 4.48Å; V73-L372 HydrophobicContact CG2-CD2 4.29Å; T368-L372 PolarHBondContact O-N 3Å; Y369-L372 PolarHBondContact O-N 2.71Å; L372-A374 VanDerWaalsContact C-N 3.31Å; L372-A374 PolarHBondContact O-N 2.98Å; L372-L375 PolarHBondContact O-N 3.3Å; L372-L376 HydrophobicContact CD1-CG 4.26Å; L372-L376 HydrophobicContact CG-CD1 4.29Å; L372-L376 WeakPolarHBondContact O-CG 3.41Å; L372-L376 PolarHBondContact O-N 3.2Å
373P89.2Confident91.6Very high7 Ų736.3 Ų36.35%0.04518%0.181CC..Hα-helixtrans-61.6-37.6173.8-22.835.1000113.3L69 I371 T377 L390L69-P373 HydrophobicContact CD1-CG 3.87Å; I371-P373 VanDerWaalsContact C-N 3.31Å; P373-T377 WeakPolarHBondContact O-CB 3.29Å; P373-T377 PolarHBondContact O-N 2.8Å; P373-T377 VanDerWaalsContact O-N 3.1Å; P373-T377 PolarHBondContact O-OG1 3.44Å; P373-L390 HydrophobicContact CB-CD1 4.37Å; P373-L390 HydrophobicContact CB-CD2 4.47Å
374A92.8Very high91.3Very high0 Ų032.1 Ų32.10%016%0.159CC..Hα-helixtrans-67.3-44.217500000110.6I371 L372 L376 T377 A378 T387 L390I371-A374 WeakPolarHBondContact O-CA 3.11Å; I371-A374 VanDerWaalsContact O-CB 3.31Å; I371-A374 WeakPolarHBondContact O-CB 3.41Å; I371-A374 PolarHBondContact O-N 3.32Å; L372-A374 VanDerWaalsContact C-N 3.31Å; L372-A374 PolarHBondContact O-N 2.98Å; A374-L376 PolarHBondContact O-N 3.26Å; A374-T377 WeakPolarHBondContact O-CB 3.5Å; A374-T377 PolarHBondContact O-N 3.04Å; A374-T377 VanDerWaalsContact O-N 3.17Å; A374-A378 WeakPolarHBondContact O-CB 3.43Å; A374-A378 PolarHBondContact O-N 3.44Å; A374-T387 HydrophobicContact CB-CG2 3.96Å; A374-T387 WeakPolarHBondContact O-CG2 3.28Å; A374-L390 HydrophobicContact CB-CD2 4.48Å; A374-L390 HydrophobicContact CB-CG 4.08Å
375L94.9Very high90.9Very high18 Ų1832.2 Ų32.29%0.09416%0.16CC..Hα-helixtrans-61.3-43.2178.2-59.6-179.4000112.6T368 I371 L372 T377 A378 L379 T500 V503 F504T368-L375 HydrophobicContact CG2-CD1 4.03Å; I371-L375 HydrophobicContact CD1-CD1 4.33Å; I371-L375 HydrophobicContact CD1-CD2 4.43Å; I371-L375 HydrophobicContact CD1-CG 4.46Å; I371-L375 HydrophobicContact CG1-CD1 4.21Å; I371-L375 HydrophobicContact CG1-CG 4.35Å; I371-L375 PolarHBondContact O-N 2.8Å; I371-L375 VanDerWaalsContact O-N 3.07Å; L372-L375 PolarHBondContact O-N 3.3Å; L375-T377 VanDerWaalsContact C-N 3.31Å; L375-T377 PolarHBondContact O-N 2.76Å; L375-A378 PolarHBondContact O-N 3.01Å; L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 PolarHBondContact O-N 3.47Å; L375-T500 HydrophobicContact CB-CG2 4.11Å; L375-T500 HydrophobicContact CD2-CG2 4.21Å; L375-V503 HydrophobicContact CD2-CG1 4.25Å; L375-F504 HydrophobicContact CD1-CD2 3.93Å; L375-F504 HydrophobicContact CD2-CB 3.76Å; L375-F504 HydrophobicContact CD2-CD2 4.1Å; L375-F504 HydrophobicContact CD2-CG 4.41Å
376L89.7Confident90.4Very high24 Ų2425.7 Ų25.713%0.12613%0.126CC..Hα-helixtrans-65.6-35.6176.1-69.2172.7000112.2T72 V73 C76 L372 A374 G380T72-L376 HydrophobicContact CG2-CB 4.13Å; T72-L376 HydrophobicContact CG2-CD1 3.68Å; V73-L376 HydrophobicContact CG2-CD1 3.79Å; C76-L376 HydrophobicContact CB-CD2 4.28Å; L372-L376 HydrophobicContact CD1-CG 4.26Å; L372-L376 HydrophobicContact CG-CD1 4.29Å; L372-L376 WeakPolarHBondContact O-CG 3.41Å; L372-L376 PolarHBondContact O-N 3.2Å; A374-L376 PolarHBondContact O-N 3.26Å; L376-G380 PolarHBondContact O-N 3.3Å
377T87Confident90.2Very high1 Ų118 Ų181%0.0069%0.093CC..Hα-helixtrans-68.1-43.6174.2-580000110.9F108 L112 P373 A374 L375 L379 G380 T381 T387 L390F108-T377 HydrophobicContact CE1-CG2 3.9Å; F108-T377 HydrophobicContact CZ-CG2 4.29Å; L112-T377 HydrophobicContact CD1-CG2 4.04Å; P373-T377 WeakPolarHBondContact O-CB 3.29Å; P373-T377 PolarHBondContact O-N 2.8Å; P373-T377 VanDerWaalsContact O-N 3.1Å; P373-T377 PolarHBondContact O-OG1 3.44Å; A374-T377 WeakPolarHBondContact O-CB 3.5Å; A374-T377 PolarHBondContact O-N 3.04Å; A374-T377 VanDerWaalsContact O-N 3.17Å; L375-T377 VanDerWaalsContact C-N 3.31Å; L375-T377 PolarHBondContact O-N 2.76Å; T377-L379 VanDerWaalsContact C-N 3.31Å; T377-L379 PolarHBondContact O-N 3.43Å; T377-G380 PolarHBondContact O-N 3.16Å; T377-T381 HydrophobicContact CG2-CG2 4Å; T377-T381 VanDerWaalsContact O-CB 3.28Å; T377-T381 WeakPolarHBondContact O-CB 3.5Å; T377-T381 WeakPolarHBondContact O-CG2 3.33Å; T377-T381 PolarHBondContact O-N 2.97Å; T377-T381 PolarHBondContact O-OG1 2.97Å; T377-T387 HydrophobicContact CG2-CG2 4.14Å; T377-L390 HydrophobicContact CG2-CD2 4.29Å; T377-L390 VanDerWaalsContact OG1-CD2 3.24Å; T377-L390 WeakPolarHBondContact OG1-CD2 3.41Å
378A91Very high89.9Confident0 Ų017.9 Ų17.90%09%0.093CC..Hα-helixtrans-59.7-42.4175.100000111.4A374 L375 T381 S382 T387 T499 V503A374-A378 WeakPolarHBondContact O-CB 3.43Å; A374-A378 PolarHBondContact O-N 3.44Å; L375-A378 PolarHBondContact O-N 3.01Å; A378-T381 PolarHBondContact O-N 3.41Å; A378-S382 VanDerWaalsContact O-CA 3.31Å; A378-S382 WeakPolarHBondContact O-CA 3.25Å; A378-S382 PolarHBondContact O-N 3.28Å; A378-T387 HydrophobicContact CB-CG2 4.29Å; A378-T387 PolarHBondContact N-OG1 2.96Å; A378-T499 HydrophobicContact CB-CG2 4.3Å; A378-V503 HydrophobicContact CB-CB 4.1Å; A378-V503 HydrophobicContact CB-CG1 4.38Å; A378-V503 HydrophobicContact CB-CG2 3.83Å
379L89.7Confident89.6Confident56 Ų5616.3 Ų16.329%0.2938%0.083SC..Hα-helixtrans-62.4-44.3176.9-175.368.7000112.6L375 T377 R496 I497 T500L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 PolarHBondContact O-N 3.47Å; T377-L379 VanDerWaalsContact C-N 3.31Å; T377-L379 PolarHBondContact O-N 3.43Å; L379-R496 HydrophobicContact CD1-CB 3.96Å; L379-R496 PolarHBondContact O-NH1 3.39Å; L379-R496 VanDerWaalsContact O-NH1 3.13Å; L379-I497 HydrophobicContact CD1-CD1 3.79Å; L379-T500 WeakPolarHBondContact CA-OG1 3.27Å; L379-T500 PolarHBondContact N-OG1 3.23Å
380G81.2Confident89.4Confident3 Ų310.2 Ų10.23%0.0316%0.059CC..Hα-helixtrans-72.3-33.6-179.800000113.6Q319 L376 T377 R496Q319-G380 PolarHBondContact NE2-O 2.98Å; L376-G380 PolarHBondContact O-N 3.3Å; T377-G380 PolarHBondContact O-N 3.16Å; G380-R496 PolarHBondContact O-NH1 2.99Å
381T82.4Confident89.5Confident9 Ų910.1 Ų10.16%0.0556%0.058CC..Hα-helixtrans-97.7-23.6-172.463.40000114.3L109 L315 T377 A378 S383L109-T381 HydrophobicContact CD1-CG2 4.34Å; L109-T381 HydrophobicContact CD2-CG2 3.21Å; L109-T381 HydrophobicContact CG-CG2 3.96Å; L315-T381 HydrophobicContact CD1-CG2 3.73Å; T377-T381 HydrophobicContact CG2-CG2 4Å; T377-T381 VanDerWaalsContact O-CB 3.28Å; T377-T381 WeakPolarHBondContact O-CB 3.5Å; T377-T381 WeakPolarHBondContact O-CG2 3.33Å; T377-T381 PolarHBondContact O-N 2.97Å; T377-T381 PolarHBondContact O-OG1 2.97Å; A378-T381 PolarHBondContact O-N 3.41Å; T381-S383 PolarHBondContact O-N 3.36Å; T381-S383 PolarHBondContact OG1-N 2.99Å
382S85.9Confident89.4Confident3 Ų310.1 Ų10.12%0.0216%0.057CC..  trans53.430-168.7-48.30000113.5A378 D495 R496 T499A378-S382 VanDerWaalsContact O-CA 3.31Å; A378-S382 WeakPolarHBondContact O-CA 3.25Å; A378-S382 PolarHBondContact O-N 3.28Å; S382-D495 WeakPolarHBondContact CB-OD2 3.17Å; S382-R496 WeakPolarHBondContact OG-CG 3.17Å; S382-R496 PolarHBondContact OG-NH1 3.35Å; S382-R496 VanDerWaalsContact OG-NH1 3.1Å; S382-T499 VanDerWaalsContact C-CG2 3.46Å; S382-T499 PolarHBondContact O-OG1 3.16Å
383S87.9Confident89.4Confident8 Ų88.9 Ų8.96%0.0565%0.05CC..  trans-135.8117.6-179.9176.60000112.5T381 A386 T387 G461T381-S383 PolarHBondContact O-N 3.36Å; T381-S383 PolarHBondContact OG1-N 2.99Å; S383-A386 WeakPolarHBondContact OG-CB 3.28Å; S383-A386 PolarHBondContact OG-N 3.41Å; S383-A386 VanDerWaalsContact OG-N 3.08Å; S383-T387 WeakPolarHBondContact O-CB 3.23Å; S383-T387 PolarHBondContact O-N 3.19Å; S383-T387 PolarHBondContact O-OG1 3.18Å; S383-G461 PolarHBondContact OG-O 3.46Å
384S91Very high89.6Confident6 Ų68.8 Ų8.84%0.0425%0.05CC..Hα-helixtrans-63.4-44.4171.9-56.40000110.9A386 T387 L388S384-A386 PolarHBondContact O-N 2.91Å; S384-T387 PolarHBondContact O-N 3.44Å; S384-L388 PolarHBondContact O-N 2.98Å
385S87Confident89.7Confident13 Ų138.8 Ų8.89%0.0915%0.05CC..Hα-helixtrans-65.7-40.5-178.7-51.70000112.5I116 I262 T387 L388 G461I116-S385 WeakPolarHBondContact CD1-O 3.3Å; I262-S385 WeakPolarHBondContact CD1-OG 3.24Å; S385-T387 PolarHBondContact O-N 3.3Å; S385-L388 WeakPolarHBondContact O-CB 3.42Å; S385-L388 PolarHBondContact O-N 2.62Å; S385-G461 PolarHBondContact N-O 3.26Å; S385-G461 PolarHBondContact OG-O 3.42Å
386A85Confident89.7Confident1 Ų18.8 Ų8.81%0.0085%0.049CC..Hα-helixtrans-64.9-31.7175.600000112.5L109 L112 S383 S384L109-A386 HydrophobicContact CD2-CB 3.89Å; L112-A386 WeakPolarHBondContact CB-O 3.36Å; L112-A386 WeakPolarHBondContact CD1-O 3.39Å; S383-A386 WeakPolarHBondContact OG-CB 3.28Å; S383-A386 PolarHBondContact OG-N 3.41Å; S383-A386 VanDerWaalsContact OG-N 3.08Å; S384-A386 PolarHBondContact O-N 2.91Å
387T89.5Confident89.8Confident0 Ų013.4 Ų13.40%07%0.068CC..Hα-helixtrans-84.4-19.1-178.8-53.40000112.5A374 T377 A378 S383 S384 S385 L390 T391 V503A374-T387 HydrophobicContact CB-CG2 3.96Å; A374-T387 WeakPolarHBondContact O-CG2 3.28Å; T377-T387 HydrophobicContact CG2-CG2 4.14Å; A378-T387 HydrophobicContact CB-CG2 4.29Å; A378-T387 PolarHBondContact N-OG1 2.96Å; S383-T387 WeakPolarHBondContact O-CB 3.23Å; S383-T387 PolarHBondContact O-N 3.19Å; S383-T387 PolarHBondContact O-OG1 3.18Å; S384-T387 PolarHBondContact O-N 3.44Å; S385-T387 PolarHBondContact O-N 3.3Å; T387-L390 WeakPolarHBondContact O-CA 3.4Å; T387-L390 WeakPolarHBondContact O-CB 3.5Å; T387-L390 PolarHBondContact O-N 3.48Å; T387-T391 PolarHBondContact O-N 3.37Å; T387-T391 PolarHBondContact O-OG1 3.34Å; T387-V503 HydrophobicContact CG2-CG1 4.37Å
388L91.7Very high90.1Very high4 Ų415.6 Ų15.62%0.0218%0.08CC..Hα-helixtrans-50.2-46.8-171.617664.4000115.1I120 S384 S385 L390 T391 I392 L410 P411I120-L388 HydrophobicContact CD1-CD2 3.65Å; I120-L388 HydrophobicContact CG1-CD2 3.94Å; S384-L388 PolarHBondContact O-N 2.98Å; S385-L388 WeakPolarHBondContact O-CB 3.42Å; S385-L388 PolarHBondContact O-N 2.62Å; L388-L390 VanDerWaalsContact C-N 3.28Å; L388-L390 PolarHBondContact O-N 3.42Å; L388-T391 PolarHBondContact O-N 3.19Å; L388-T391 VanDerWaalsContact O-N 3.15Å; L388-I392 HydrophobicContact CD1-CD1 3.96Å; L388-I392 HydrophobicContact CD1-CG1 4.05Å; L388-I392 HydrophobicContact CG-CD1 4.05Å; L388-I392 WeakPolarHBondContact O-CG1 3.37Å; L388-I392 PolarHBondContact O-N 3.18Å; L388-L410 HydrophobicContact CD1-CB 3.66Å; L388-P411 HydrophobicContact CD1-CG 4.29Å; L388-P411 HydrophobicContact CD2-CB 4.03Å; L388-P411 HydrophobicContact CD2-CG 4.16Å
389P90.5Very high90.3Very high1 Ų116.3 Ų16.31%0.0068%0.084CC..Hα-helixtrans-57.3-40.3177-28.238000113.6I116 L119 I301 K393I116-P389 HydrophobicContact CB-CG 4.46Å; I116-P389 HydrophobicContact CG1-CG 3.83Å; L119-P389 HydrophobicContact CD2-CB 3.67Å; L119-P389 HydrophobicContact CD2-CG 4.11Å; I301-P389 HydrophobicContact CD1-CB 3.83Å; I301-P389 HydrophobicContact CG1-CB 4.12Å; P389-K393 PolarHBondContact O-N 3.26Å
390L89.7Confident90.6Very high3 Ų319.2 Ų19.22%0.01610%0.099CC..Hα-helixtrans-71.1-41.5177.2171.757.8000110.8I305 P373 A374 T377 T387 L388 I392 K393 C394I305-L390 HydrophobicContact CD1-CD1 3.35Å; I305-L390 HydrophobicContact CG1-CD1 3.78Å; P373-L390 HydrophobicContact CB-CD1 4.37Å; P373-L390 HydrophobicContact CB-CD2 4.47Å; A374-L390 HydrophobicContact CB-CD2 4.48Å; A374-L390 HydrophobicContact CB-CG 4.08Å; T377-L390 HydrophobicContact CG2-CD2 4.29Å; T377-L390 VanDerWaalsContact OG1-CD2 3.24Å; T377-L390 WeakPolarHBondContact OG1-CD2 3.41Å; T387-L390 WeakPolarHBondContact O-CA 3.4Å; T387-L390 WeakPolarHBondContact O-CB 3.5Å; T387-L390 PolarHBondContact O-N 3.48Å; L388-L390 VanDerWaalsContact C-N 3.28Å; L388-L390 PolarHBondContact O-N 3.42Å; L390-I392 PolarHBondContact O-N 2.89Å; L390-K393 PolarHBondContact O-N 3.49Å; L390-C394 WeakPolarHBondContact O-CB 3.3Å; L390-C394 PolarHBondContact O-N 3.13Å
391T94.7Very high91.3Very high5 Ų519.2 Ų19.23%0.03110%0.099CC..Hα-helixtrans-58.3-47.8176-50.90000111.7T387 L388 K393 C394 C395 L410 V503T387-T391 PolarHBondContact O-N 3.37Å; T387-T391 PolarHBondContact O-OG1 3.34Å; L388-T391 PolarHBondContact O-N 3.19Å; L388-T391 VanDerWaalsContact O-N 3.15Å; T391-K393 VanDerWaalsContact C-N 3.34Å; T391-K393 PolarHBondContact O-N 3.09Å; T391-C394 PolarHBondContact O-N 3.29Å; T391-C395 PolarHBondContact O-N 3.33Å; T391-C395 PolarHBondContact O-SG 3.47Å; T391-C395 VanDerWaalsContact O-SG 3.32Å; T391-L410 HydrophobicContact CG2-CD1 4.09Å; T391-L410 HydrophobicContact CG2-CD2 4.06Å; T391-V503 HydrophobicContact CG2-CG1 4.2Å
392I94.5Very high91.9Very high0 Ų020.1 Ų20.10%010%0.103CC..Hα-helixtrans-56.1-50.4177-70166.2000110.1L119 L388 L390 C394 C395 E396 R407 L410 P411L119-I392 HydrophobicContact CD2-CD1 3.98Å; L388-I392 HydrophobicContact CD1-CD1 3.96Å; L388-I392 HydrophobicContact CD1-CG1 4.05Å; L388-I392 HydrophobicContact CG-CD1 4.05Å; L388-I392 WeakPolarHBondContact O-CG1 3.37Å; L388-I392 PolarHBondContact O-N 3.18Å; L390-I392 PolarHBondContact O-N 2.89Å; I392-C394 PolarHBondContact O-N 3.46Å; I392-C395 PolarHBondContact O-N 2.95Å; I392-E396 HydrophobicContact CG2-CG 4.47Å; I392-E396 VanDerWaalsContact CG2-OE1 3.3Å; I392-E396 WeakPolarHBondContact CG2-OE1 3.36Å; I392-E396 WeakPolarHBondContact O-CG 3.36Å; I392-E396 PolarHBondContact O-N 2.99Å; I392-R407 HydrophobicContact CG2-CG 4.3Å; I392-L410 HydrophobicContact CB-CD1 4.27Å; I392-L410 HydrophobicContact CG1-CB 4.16Å; I392-L410 HydrophobicContact CG1-CD1 3.72Å; I392-P411 HydrophobicContact CD1-CG 4.26Å
393K91.5Very high92.2Very high25 Ų2522.3 Ų22.311%0.10912%0.117CC..Hα-helixtrans-61.9-44.9-179.5-176-177.7165.6-1740112.5M298 I301 T302 I305 P389 L390 T391 C395 E396 K397M298-K393 HydrophobicContact CE-CB 4.25Å; M298-K393 HydrophobicContact CE-CG 4.3Å; I301-K393 HydrophobicContact CG2-CB 4.33Å; I301-K393 HydrophobicContact CG2-CD 3.84Å; T302-K393 VanDerWaalsContact CA-NZ 3.33Å; T302-K393 WeakPolarHBondContact OG1-CE 3.49Å; T302-K393 PolarHBondContact OG1-NZ 3.42Å; I305-K393 HydrophobicContact CD1-CD 3.6Å; P389-K393 PolarHBondContact O-N 3.26Å; L390-K393 PolarHBondContact O-N 3.49Å; T391-K393 VanDerWaalsContact C-N 3.34Å; T391-K393 PolarHBondContact O-N 3.09Å; K393-C395 VanDerWaalsContact C-N 3.34Å; K393-C395 PolarHBondContact O-N 3.05Å; K393-E396 PolarHBondContact O-N 3.17Å; K393-K397 HydrophobicContact CG-CG 4.08Å; K393-K397 WeakPolarHBondContact O-CB 3.44Å; K393-K397 PolarHBondContact O-N 3.47Å
394C93.4Very high92.3Very high5 Ų522.8 Ų22.83%0.03412%0.118CC..Iπ-helixtrans-61.2-42.5177.8-78.30000111.9I371 L390 T391 I392 N398 N399I371-C394 HydrophobicContact CB-CB 4.43Å; I371-C394 HydrophobicContact CG2-CB 3.95Å; L390-C394 WeakPolarHBondContact O-CB 3.3Å; L390-C394 PolarHBondContact O-N 3.13Å; T391-C394 PolarHBondContact O-N 3.29Å; I392-C394 PolarHBondContact O-N 3.46Å; C394-N398 WeakPolarHBondContact O-CA 3.35Å; C394-N398 VanDerWaalsContact O-CB 3.26Å; C394-N398 WeakPolarHBondContact O-CB 3.48Å; C394-N398 PolarHBondContact O-N 3.33Å; C394-N399 PolarHBondContact O-N 3.28Å
395C96.5Very high92.5Very high0 Ų022.5 Ų22.50%012%0.116CC..Iπ-helixtrans-63.7-44.7176.7-700000112.1T391 I392 K393 N399 N400 V401 T406 L410 S507T391-C395 PolarHBondContact O-N 3.33Å; T391-C395 PolarHBondContact O-SG 3.47Å; T391-C395 VanDerWaalsContact O-SG 3.32Å; I392-C395 PolarHBondContact O-N 2.95Å; K393-C395 VanDerWaalsContact C-N 3.34Å; K393-C395 PolarHBondContact O-N 3.05Å; C395-N399 CarbonylContact O-C 3.57Å; C395-N399 WeakPolarHBondContact O-CB 3.45Å; C395-N400 PolarHBondContact O-N 3.37Å; C395-V401 HydrophobicContact CB-CB 4.38Å; C395-V401 HydrophobicContact CB-CG2 4.34Å; C395-V401 WeakPolarHBondContact O-CB 3.46Å; C395-V401 WeakPolarHBondContact O-CG2 3.38Å; C395-V401 PolarHBondContact O-N 3.21Å; C395-T406 HydrophobicContact CB-CG2 3.52Å; C395-L410 HydrophobicContact CB-CD1 4.15Å; C395-S507 PolarHBondContact SG-OG 2.92Å
396E94.4Very high92.9Very high18 Ų1821.9 Ų21.98%0.08411%0.112CC..Iπ-helixtrans-70.8-50.3-179.1-71-178.9-16400112.6M298 I392 K393 N400 P403 T406 R407M298-E396 WeakPolarHBondContact CE-OE2 3.43Å; I392-E396 HydrophobicContact CG2-CG 4.47Å; I392-E396 VanDerWaalsContact CG2-OE1 3.3Å; I392-E396 WeakPolarHBondContact CG2-OE1 3.36Å; I392-E396 WeakPolarHBondContact O-CG 3.36Å; I392-E396 PolarHBondContact O-N 2.99Å; K393-E396 PolarHBondContact O-N 3.17Å; E396-N400 WeakPolarHBondContact O-CA 3.43Å; E396-N400 PolarHBondContact O-N 3.17Å; E396-P403 HydrophobicContact CG-CB 4.4Å; E396-P403 HydrophobicContact CG-CG 4.24Å; E396-T406 HydrophobicContact CG-CG2 4.02Å; E396-T406 VanDerWaalsContact CG-OG1 3.29Å; E396-T406 WeakPolarHBondContact CG-OG1 3.47Å; E396-T406 PolarHBondContact OE1-OG1 2.64Å; E396-R407 WeakPolarHBondContact OE1-CG 3.23Å; E396-R407 IonicContact OE1-CZ 2.77Å; E396-R407 IonicContact OE1-NE 3.53Å; E396-R407 PolarHBondContact OE1-NE 3.36Å; E396-R407 IonicContact OE1-NH2 2.84Å; E396-R407 IonicContact OE2-CZ 3.96Å; E396-R407 IonicContact OE2-NE 2.87Å; E396-R407 IonicContact OE2-NH2 3.59Å; E396-R407 PolarHBondContact OE2-NH2 3.26Å
397K92Very high93.1Very high121 Ų12122.5 Ų22.553%0.52611%0.114SC..Iπ-helixtrans-82.3-50.2-172.8-65.9-62.5-177.6-172.70112.9K393K393-K397 HydrophobicContact CG-CG 4.08Å; K393-K397 WeakPolarHBondContact O-CB 3.44Å; K393-K397 PolarHBondContact O-N 3.47Å
398N92.9Very high93Very high47 Ų4723.6 Ų23.625%0.25112%0.118SC..Iπ-helixtrans-85.1-36.8-170-52.99000110.4E65 G370 C394E65-N398 PolarHBondContact OE2-OD1 3.31Å; G370-N398 WeakPolarHBondContact O-CB 3.3Å; G370-N398 PolarHBondContact O-ND2 2.81Å; C394-N398 WeakPolarHBondContact O-CA 3.35Å; C394-N398 VanDerWaalsContact O-CB 3.26Å; C394-N398 WeakPolarHBondContact O-CB 3.48Å; C394-N398 PolarHBondContact O-N 3.33Å
399N95.8Very high93.1Very high15 Ų1523.4 Ų23.48%0.0812%0.117CC..SBendtrans-104.8-0.6-175.9-76.2-28.9000114.7R362 Y367 I371 C394 C395 V401R362-N399 PolarHBondContact NH1-O 3.15Å; Y367-N399 WeakPolarHBondContact CA-OD1 3.39Å; Y367-N399 HydrophobicContact CD2-CB 3.84Å; Y367-N399 VanDerWaalsContact CD2-CG 3.49Å; Y367-N399 HydrophobicContact CE2-CB 3.52Å; Y367-N399 PolarHBondContact O-ND2 3.4Å; Y367-N399 PolarHBondContact O-OD1 3Å; I371-N399 VanDerWaalsContact CG2-ND2 3.28Å; I371-N399 WeakPolarHBondContact CG2-ND2 3.49Å; C394-N399 PolarHBondContact O-N 3.28Å; C395-N399 CarbonylContact O-C 3.57Å; C395-N399 WeakPolarHBondContact O-CB 3.45Å; N399-V401 VanDerWaalsContact C-N 3.25Å; N399-V401 HydrophobicContact CB-CG2 4.09Å; N399-V401 PolarHBondContact O-N 3.29Å
400N94.9Very high93.3Very high116 Ų11623.3 Ų23.362%0.6212%0.117SC*.  trans49.648.2177.4-58.9-82.3000111.8R362 C395 E396R362-N400 PolarHBondContact NH2-O 3.42Å; C395-N400 PolarHBondContact O-N 3.37Å; E396-N400 WeakPolarHBondContact O-CA 3.43Å; E396-N400 PolarHBondContact O-N 3.17Å
401V96.5Very high93.4Very high3 Ų323.2 Ų23.22%0.01812%0.116CC..  trans-88137.6171-172.20000108.3Y367 C395 N399 V405 T406 A510 H514Y367-V401 HydrophobicContact CE2-CG2 3.94Å; Y367-V401 WeakPolarHBondContact OH-CG2 3.47Å; C395-V401 HydrophobicContact CB-CB 4.38Å; C395-V401 HydrophobicContact CB-CG2 4.34Å; C395-V401 WeakPolarHBondContact O-CB 3.46Å; C395-V401 WeakPolarHBondContact O-CG2 3.38Å; C395-V401 PolarHBondContact O-N 3.21Å; N399-V401 VanDerWaalsContact C-N 3.25Å; N399-V401 HydrophobicContact CB-CG2 4.09Å; N399-V401 PolarHBondContact O-N 3.29Å; V401-V405 HydrophobicContact CG1-CB 4.44Å; V401-V405 HydrophobicContact CG1-CG1 4.49Å; V401-T406 HydrophobicContact CB-CG2 3.57Å; V401-T406 HydrophobicContact CG1-CG2 3.47Å; V401-T406 VanDerWaalsContact CG1-CG2 3.47Å; V401-A510 HydrophobicContact CG1-CB 4.41Å; V401-A510 WeakPolarHBondContact CG1-O 3.38Å; V401-H514 WeakPolarHBondContact CA-ND1 3.44Å; V401-H514 HydrophobicContact CG1-CB 3.73Å
402D94.3Very high93.2Very high29 Ų2923.8 Ų23.816%0.15512%0.119CC..  trans-57.9127.5-178.1-169.5-57.3000110.1R404 V405 T406 H514 L521D402-R404 PolarHBondContact O-N 3.3Å; D402-R404 VanDerWaalsContact O-N 3.15Å; D402-R404 WeakPolarHBondContact OD1-CB 3.16Å; D402-R404 WeakPolarHBondContact OD1-CG 3.45Å; D402-R404 IonicContact OD1-CZ 2.75Å; D402-R404 PolarHBondContact OD1-N 2.88Å; D402-R404 IonicContact OD1-NE 2.7Å; D402-R404 PolarHBondContact OD1-NE 3.32Å; D402-R404 IonicContact OD1-NH2 3.57Å; D402-R404 IonicContact OD2-CZ 3.18Å; D402-R404 IonicContact OD2-NE 3.31Å; D402-R404 PolarHBondContact OD2-NE 3.5Å; D402-R404 IonicContact OD2-NH2 3.55Å; D402-R404 PolarHBondContact OD2-NH2 2.89Å; D402-V405 HydrophobicContact CB-CG2 4.08Å; D402-V405 WeakPolarHBondContact O-CA 3.11Å; D402-V405 WeakPolarHBondContact O-CB 3.36Å; D402-V405 PolarHBondContact O-N 2.92Å; D402-T406 PolarHBondContact O-N 3Å; D402-T406 VanDerWaalsContact O-N 3.1Å; D402-H514 PolarHBondContact N-CE1 3.49Å; D402-H514 PolarHBondContact N-ND1 3.25Å; D402-L521 HydrophobicContact CB-CD1 4.04Å
403P91.9Very high93.1Very high48 Ų4823.8 Ų23.831%0.31212%0.119SC..Hα-helixtrans-52.8-34.4178.2-2936000113.7S127 E396 V405 T406 R407S127-P403 PolarHBondContact OG-O 3.13Å; E396-P403 HydrophobicContact CG-CB 4.4Å; E396-P403 HydrophobicContact CG-CG 4.24Å; P403-V405 PolarHBondContact O-N 2.86Å; P403-T406 WeakPolarHBondContact CA-OG1 3.39Å; P403-T406 PolarHBondContact O-N 2.78Å; P403-T406 PolarHBondContact O-OG1 2.84Å; P403-R407 WeakPolarHBondContact O-CB 3.38Å; P403-R407 WeakPolarHBondContact O-CD 3.37Å; P403-R407 WeakPolarHBondContact O-CG 3.47Å; P403-R407 PolarHBondContact O-N 3.16Å
404R90.7Very high93.1Very high19 Ų1922.7 Ų22.77%0.07212%0.115CC..Hα-helixtrans-63.1-27.7178.7-60.7170.2-68.4-173.5-10.3112.2S127 L131 L139 D402 L521 D525S127-R404 WeakPolarHBondContact OG-CA 3.48Å; L131-R404 HydrophobicContact CD1-CB 4.35Å; L131-R404 HydrophobicContact CD2-CB 4.34Å; L131-R404 HydrophobicContact CD2-CG 4.44Å; L131-R404 HydrophobicContact CG-CB 4.48Å; L139-R404 WeakPolarHBondContact CD2-O 3.37Å; D402-R404 PolarHBondContact O-N 3.3Å; D402-R404 VanDerWaalsContact O-N 3.15Å; D402-R404 WeakPolarHBondContact OD1-CB 3.16Å; D402-R404 WeakPolarHBondContact OD1-CG 3.45Å; D402-R404 IonicContact OD1-CZ 2.75Å; D402-R404 PolarHBondContact OD1-N 2.88Å; D402-R404 IonicContact OD1-NE 2.7Å; D402-R404 PolarHBondContact OD1-NE 3.32Å; D402-R404 IonicContact OD1-NH2 3.57Å; D402-R404 IonicContact OD2-CZ 3.18Å; D402-R404 IonicContact OD2-NE 3.31Å; D402-R404 PolarHBondContact OD2-NE 3.5Å; D402-R404 IonicContact OD2-NH2 3.55Å; D402-R404 PolarHBondContact OD2-NH2 2.89Å; R404-L521 HydrophobicContact CB-CD2 4.38Å; R404-D525 IonicContact CZ-OD1 3.6Å; R404-D525 IonicContact CZ-OD2 2.69Å; R404-D525 IonicContact NH1-OD1 3.14Å; R404-D525 PolarHBondContact NH1-OD1 3.25Å; R404-D525 IonicContact NH1-OD2 3.36Å; R404-D525 PolarHBondContact NH1-OD2 3.26Å; R404-D525 IonicContact NH2-OD1 2.96Å; R404-D525 IonicContact NH2-OD2 3.41Å; R404-D525 PolarHBondContact NH2-OD2 3.33Å
405V94.9Very high92.6Very high0 Ų023.2 Ų23.20%012%0.118CC..Hα-helixtrans-84.5-57176-178.40000110.5L139 V401 D402 P403 R407 F408 V409 A510 V513 H514 L521L139-V405 HydrophobicContact CD1-CB 4.26Å; L139-V405 HydrophobicContact CD1-CG1 4.13Å; L139-V405 HydrophobicContact CD1-CG2 3.83Å; V401-V405 HydrophobicContact CG1-CB 4.44Å; V401-V405 HydrophobicContact CG1-CG1 4.49Å; D402-V405 HydrophobicContact CB-CG2 4.08Å; D402-V405 WeakPolarHBondContact O-CA 3.11Å; D402-V405 WeakPolarHBondContact O-CB 3.36Å; D402-V405 PolarHBondContact O-N 2.92Å; P403-V405 PolarHBondContact O-N 2.86Å; V405-R407 PolarHBondContact O-N 2.73Å; V405-R407 VanDerWaalsContact O-N 3.17Å; V405-F408 PolarHBondContact O-N 2.89Å; V405-F408 VanDerWaalsContact O-N 3.1Å; V405-V409 HydrophobicContact CG1-CB 4.38Å; V405-V409 HydrophobicContact CG1-CG2 3.61Å; V405-V409 VanDerWaalsContact O-CB 3.28Å; V405-V409 WeakPolarHBondContact O-CB 3.43Å; V405-V409 VanDerWaalsContact O-CG2 3.22Å; V405-V409 WeakPolarHBondContact O-CG2 3.5Å; V405-V409 PolarHBondContact O-N 3Å; V405-A510 WeakPolarHBondContact CG1-O 3.41Å; V405-V513 HydrophobicContact CG1-CB 4.17Å; V405-V513 HydrophobicContact CG1-CG1 3.97Å; V405-H514 HydrophobicContact CB-CB 4.29Å; V405-H514 HydrophobicContact CG1-CB 4.06Å; V405-H514 HydrophobicContact CG2-CB 4.03Å; V405-L521 HydrophobicContact CG2-CD1 3.8Å
406T94.7Very high92.1Very high0 Ų024.6 Ų24.60%013%0.125CC..Hα-helixtrans-56.4-38.9-174.850.10000112.5C395 E396 V401 D402 P403 F408 L410 P411 A510C395-T406 HydrophobicContact CB-CG2 3.52Å; E396-T406 HydrophobicContact CG-CG2 4.02Å; E396-T406 VanDerWaalsContact CG-OG1 3.29Å; E396-T406 WeakPolarHBondContact CG-OG1 3.47Å; E396-T406 PolarHBondContact OE1-OG1 2.64Å; V401-T406 HydrophobicContact CB-CG2 3.57Å; V401-T406 HydrophobicContact CG1-CG2 3.47Å; V401-T406 VanDerWaalsContact CG1-CG2 3.47Å; D402-T406 PolarHBondContact O-N 3Å; D402-T406 VanDerWaalsContact O-N 3.1Å; P403-T406 WeakPolarHBondContact CA-OG1 3.39Å; P403-T406 PolarHBondContact O-N 2.78Å; P403-T406 PolarHBondContact O-OG1 2.84Å; T406-F408 VanDerWaalsContact C-N 3.28Å; T406-F408 PolarHBondContact O-N 3.38Å; T406-L410 HydrophobicContact CG2-CD1 4.28Å; T406-L410 VanDerWaalsContact O-CB 3.23Å; T406-L410 WeakPolarHBondContact O-CB 3.46Å; T406-L410 VanDerWaalsContact O-CG 3.28Å; T406-L410 WeakPolarHBondContact O-CG 3.47Å; T406-L410 PolarHBondContact O-N 3.06Å; T406-P411 WeakPolarHBondContact O-CD 3.25Å; T406-A510 HydrophobicContact CG2-CB 4.44Å
407R89.5Confident91.7Very high14 Ų1423.8 Ų23.85%0.05312%0.121CC..Hα-helixtrans-76.7-13-175.6-66.5172.7-176.7-173.65.3114.6T123 I124 S127 E294 I392 E396 P403 V405 P411T123-R407 HydrophobicContact CG2-CG 3.85Å; I124-R407 WeakPolarHBondContact CG1-O 3.46Å; S127-R407 WeakPolarHBondContact OG-CB 3.38Å; S127-R407 WeakPolarHBondContact OG-CD 3.2Å; E294-R407 VanDerWaalsContact CG-NH1 3.35Å; E294-R407 IonicContact OE1-CZ 3.09Å; E294-R407 VanDerWaalsContact OE1-CZ 3.24Å; E294-R407 IonicContact OE1-NH1 2.93Å; E294-R407 PolarHBondContact OE1-NH1 2.81Å; E294-R407 IonicContact OE1-NH2 2.73Å; E294-R407 PolarHBondContact OE1-NH2 3.38Å; E294-R407 IonicContact OE2-CZ 3.3Å; E294-R407 IonicContact OE2-NH1 3.95Å; E294-R407 PolarHBondContact OE2-NH1 2.79Å; E294-R407 IonicContact OE2-NH2 3.22Å; I392-R407 HydrophobicContact CG2-CG 4.3Å; E396-R407 WeakPolarHBondContact OE1-CG 3.23Å; E396-R407 IonicContact OE1-CZ 2.77Å; E396-R407 IonicContact OE1-NE 3.53Å; E396-R407 PolarHBondContact OE1-NE 3.36Å; E396-R407 IonicContact OE1-NH2 2.84Å; E396-R407 IonicContact OE2-CZ 3.96Å; E396-R407 IonicContact OE2-NE 2.87Å; E396-R407 IonicContact OE2-NH2 3.59Å; E396-R407 PolarHBondContact OE2-NH2 3.26Å; P403-R407 WeakPolarHBondContact O-CB 3.38Å; P403-R407 WeakPolarHBondContact O-CD 3.37Å; P403-R407 WeakPolarHBondContact O-CG 3.47Å; P403-R407 PolarHBondContact O-N 3.16Å; V405-R407 PolarHBondContact O-N 2.73Å; V405-R407 VanDerWaalsContact O-N 3.17Å; R407-P411 WeakPolarHBondContact O-CG 3.26Å
408F88.6Confident91.5Very high22 Ų2218.3 Ų18.310%0.09610%0.097CC..Hα-helixtrans-103.8-50.7172.4174.5-99.3000110.5I128 L139 T143 V270 V405 T406 L412I128-F408 HydrophobicContact CD1-CD2 3.92Å; I128-F408 HydrophobicContact CD1-CE2 4.44Å; L139-F408 HydrophobicContact CD2-CB 4Å; L139-F408 HydrophobicContact CD2-CD1 3.88Å; L139-F408 HydrophobicContact CD2-CG 4.07Å; L139-F408 HydrophobicContact CG-CD1 3.96Å; T143-F408 HydrophobicContact CG2-CE1 4.35Å; V270-F408 HydrophobicContact CG2-CD2 4.22Å; V270-F408 HydrophobicContact CG2-CE2 3.89Å; V405-F408 PolarHBondContact O-N 2.89Å; V405-F408 VanDerWaalsContact O-N 3.1Å; T406-F408 VanDerWaalsContact C-N 3.28Å; T406-F408 PolarHBondContact O-N 3.38Å; F408-L412 HydrophobicContact CE1-CD2 4.17Å; F408-L412 HydrophobicContact CZ-CD2 4.08Å; F408-L412 WeakPolarHBondContact O-CB 3.49Å; F408-L412 PolarHBondContact O-N 3.36Å
409V93.6Very high91.6Very high0 Ų016 Ų160%09%0.085CC..Hα-helixtrans-63.5-52.6-174.3177.70000110.9L139 T143 Y147 V405 L412 G413 A510 V513L139-V409 HydrophobicContact CD1-CG2 4.5Å; T143-V409 HydrophobicContact CG2-CB 4.42Å; T143-V409 HydrophobicContact CG2-CG1 4.13Å; T143-V409 HydrophobicContact CG2-CG2 4.15Å; T143-V409 WeakPolarHBondContact OG1-CG2 3.43Å; Y147-V409 HydrophobicContact CE1-CG1 4.46Å; Y147-V409 VanDerWaalsContact OH-C 3.29Å; Y147-V409 WeakPolarHBondContact OH-CG1 3.14Å; Y147-V409 PolarHBondContact OH-O 3.38Å; V405-V409 HydrophobicContact CG1-CB 4.38Å; V405-V409 HydrophobicContact CG1-CG2 3.61Å; V405-V409 VanDerWaalsContact O-CB 3.28Å; V405-V409 WeakPolarHBondContact O-CB 3.43Å; V405-V409 VanDerWaalsContact O-CG2 3.22Å; V405-V409 WeakPolarHBondContact O-CG2 3.5Å; V405-V409 PolarHBondContact O-N 3Å; V409-L412 PolarHBondContact O-N 2.91Å; V409-G413 PolarHBondContact O-N 2.78Å; V409-A510 HydrophobicContact CB-CB 4.33Å; V409-A510 HydrophobicContact CG1-CB 4.02Å; V409-V513 HydrophobicContact CG2-CB 4.28Å; V409-V513 HydrophobicContact CG2-CG1 3.95Å
410L95Very high91.6Very high0 Ų015.3 Ų15.30%08%0.082CC..Hα-helixtrans-67.7-43.7-171.9-58.4169.1000113.7L388 T391 I392 C395 T406 L412 G413 A414 D506 A510L388-L410 HydrophobicContact CD1-CB 3.66Å; T391-L410 HydrophobicContact CG2-CD1 4.09Å; T391-L410 HydrophobicContact CG2-CD2 4.06Å; I392-L410 HydrophobicContact CB-CD1 4.27Å; I392-L410 HydrophobicContact CG1-CB 4.16Å; I392-L410 HydrophobicContact CG1-CD1 3.72Å; C395-L410 HydrophobicContact CB-CD1 4.15Å; T406-L410 HydrophobicContact CG2-CD1 4.28Å; T406-L410 VanDerWaalsContact O-CB 3.23Å; T406-L410 WeakPolarHBondContact O-CB 3.46Å; T406-L410 VanDerWaalsContact O-CG 3.28Å; T406-L410 WeakPolarHBondContact O-CG 3.47Å; T406-L410 PolarHBondContact O-N 3.06Å; L410-L412 VanDerWaalsContact C-N 3.28Å; L410-L412 PolarHBondContact O-N 3.17Å; L410-G413 PolarHBondContact O-N 3.3Å; L410-A414 PolarHBondContact O-N 2.72Å; L410-D506 HydrophobicContact CD2-CB 4.02Å; L410-D506 VanDerWaalsContact CD2-O 3.24Å; L410-D506 WeakPolarHBondContact CD2-O 2.91Å; L410-A510 HydrophobicContact CD2-CB 3.83Å; L410-A510 HydrophobicContact CG-CB 4.09Å
411P91.3Very high91.6Very high0 Ų010 Ų100%05%0.054CC..Hα-helixtrans-60.6-39.2174.7-26.436.8000112.8I120 I266 L388 I392 T406 R407I120-P411 HydrophobicContact CD1-CB 4.5Å; I120-P411 HydrophobicContact CG1-CB 4.44Å; I120-P411 HydrophobicContact CG1-CG 4.49Å; I266-P411 VanDerWaalsContact CD1-C 3.44Å; I266-P411 HydrophobicContact CD1-CB 3.74Å; I266-P411 WeakPolarHBondContact CD1-O 2.83Å; I266-P411 HydrophobicContact CG1-CB 4.18Å; L388-P411 HydrophobicContact CD1-CG 4.29Å; L388-P411 HydrophobicContact CD2-CB 4.03Å; L388-P411 HydrophobicContact CD2-CG 4.16Å; I392-P411 HydrophobicContact CD1-CG 4.26Å; T406-P411 WeakPolarHBondContact O-CD 3.25Å; R407-P411 WeakPolarHBondContact O-CG 3.26Å
412L90.4Very high91.5Very high18 Ų189.9 Ų9.99%0.0945%0.053CC..Hα-helixtrans-65.8-47.7176.6-174.762000110.5T143 Y147 L263 I266 F408 V409 L410 A414 T415 I416T143-L412 HydrophobicContact CG2-CD2 3.89Å; Y147-L412 HydrophobicContact CE2-CB 4.39Å; Y147-L412 HydrophobicContact CE2-CD2 4.32Å; Y147-L412 HydrophobicContact CE2-CG 4.18Å; L263-L412 HydrophobicContact CD1-CD1 4.3Å; I266-L412 HydrophobicContact CD1-CB 4.36Å; F408-L412 HydrophobicContact CE1-CD2 4.17Å; F408-L412 HydrophobicContact CZ-CD2 4.08Å; F408-L412 WeakPolarHBondContact O-CB 3.49Å; F408-L412 PolarHBondContact O-N 3.36Å; V409-L412 PolarHBondContact O-N 2.91Å; L410-L412 VanDerWaalsContact C-N 3.28Å; L410-L412 PolarHBondContact O-N 3.17Å; L412-A414 VanDerWaalsContact C-N 3.33Å; L412-A414 PolarHBondContact O-N 3.23Å; L412-T415 PolarHBondContact O-N 3.39Å; L412-T415 PolarHBondContact O-OG1 2.84Å; L412-I416 HydrophobicContact CD1-CD1 3.71Å; L412-I416 HydrophobicContact CD1-CG1 4.11Å; L412-I416 HydrophobicContact CD1-CG2 4.35Å; L412-I416 HydrophobicContact CD2-CD1 3.98Å; L412-I416 HydrophobicContact CG-CD1 3.59Å; L412-I416 HydrophobicContact CG-CG1 3.93Å; L412-I416 WeakPolarHBondContact O-CG1 3.17Å; L412-I416 PolarHBondContact O-N 3.23Å
413G92.8Very high91.6Very high0 Ų08.6 Ų8.60%05%0.046CC..Hα-helixtrans-56.6-43.9179.400000113Y147 V409 L410 T415 I416 N417 D506Y147-G413 VanDerWaalsContact CZ-CA 3.46Å; Y147-G413 VanDerWaalsContact OH-CA 3.28Å; Y147-G413 WeakPolarHBondContact OH-CA 3.32Å; Y147-G413 PolarHBondContact OH-N 2.9Å; V409-G413 PolarHBondContact O-N 2.78Å; L410-G413 PolarHBondContact O-N 3.3Å; G413-T415 PolarHBondContact O-N 3.36Å; G413-I416 PolarHBondContact O-N 2.93Å; G413-N417 WeakPolarHBondContact O-CA 3.17Å; G413-N417 PolarHBondContact O-N 2.66Å; G413-D506 WeakPolarHBondContact CA-OD1 3.26Å
414A90Very high91.8Very high2 Ų26.3 Ų6.32%0.0173%0.031CC..Hα-helixtrans-61.2-7.8177.200000114.8L410 L412 D506L410-A414 PolarHBondContact O-N 2.72Å; L412-A414 VanDerWaalsContact C-N 3.33Å; L412-A414 PolarHBondContact O-N 3.23Å; A414-D506 PolarHBondContact N-OD2 3.07Å
415T84.8Confident91.9Very high16 Ų165.4 Ų5.410%0.0983%0.027CC..Hα-helixtrans-113.3-45.1174.658.40000113.6I262 L412 G413I262-T415 HydrophobicContact CB-CG2 3.59Å; I262-T415 HydrophobicContact CD1-CG2 4.47Å; I262-T415 HydrophobicContact CG2-CG2 3.5Å; L412-T415 PolarHBondContact O-N 3.39Å; L412-T415 PolarHBondContact O-OG1 2.84Å; G413-T415 PolarHBondContact O-N 3.36Å
416I86Confident92Very high29 Ų295.4 Ų5.415%0.1493%0.027CC..Hα-helixtrans-107.3-18.6-170.868.6171000114.4Y147 L263 L412 G413 I457Y147-I416 HydrophobicContact CD2-CD1 3.83Å; Y147-I416 HydrophobicContact CD2-CG1 3.88Å; Y147-I416 HydrophobicContact CE2-CD1 4.42Å; Y147-I416 HydrophobicContact CE2-CG1 4.3Å; L263-I416 HydrophobicContact CD1-CG2 4.28Å; L412-I416 HydrophobicContact CD1-CD1 3.71Å; L412-I416 HydrophobicContact CD1-CG1 4.11Å; L412-I416 HydrophobicContact CD1-CG2 4.35Å; L412-I416 HydrophobicContact CD2-CD1 3.98Å; L412-I416 HydrophobicContact CG-CD1 3.59Å; L412-I416 HydrophobicContact CG-CG1 3.93Å; L412-I416 WeakPolarHBondContact O-CG1 3.17Å; L412-I416 PolarHBondContact O-N 3.23Å; G413-I416 PolarHBondContact O-N 2.93Å; I416-I457 HydrophobicContact CB-CG2 4.16Å; I416-I457 HydrophobicContact CG2-CG2 4.04Å
417N84.5Confident92Very high0 Ų05.4 Ų5.40%03%0.027CC..  trans-107.986.6-174.4-173.554.9000110.3Y147 T150 T151 G413 D419 D506Y147-N417 WeakPolarHBondContact CA-OD1 3.5Å; Y147-N417 WeakPolarHBondContact CB-OD1 3.01Å; Y147-N417 HydrophobicContact CD1-CB 3.39Å; Y147-N417 WeakPolarHBondContact CD1-ND2 3.44Å; Y147-N417 WeakPolarHBondContact CD1-OD1 3.45Å; Y147-N417 HydrophobicContact CD2-CB 3.91Å; Y147-N417 HydrophobicContact CE1-CB 3.72Å; Y147-N417 HydrophobicContact CE2-CB 4.16Å; Y147-N417 HydrophobicContact CG-CB 3.51Å; T150-N417 PolarHBondContact OG1-OD1 2.79Å; T151-N417 PolarHBondContact OG1-OD1 2.82Å; G413-N417 WeakPolarHBondContact O-CA 3.17Å; G413-N417 PolarHBondContact O-N 2.66Å; N417-D419 PolarHBondContact OD1-OD1 2.76Å; N417-D506 WeakPolarHBondContact CB-OD1 2.98Å; N417-D506 PolarHBondContact ND2-OD1 2.98Å
418M89.1Confident92.2Very high6 Ų64.7 Ų4.73%0.033%0.025CC..  trans-12063-178.6-59.3-156.7-169.300112.2G420 T421 A422 A459 N502M418-G420 VanDerWaalsContact C-N 3.29Å; M418-G420 PolarHBondContact O-N 3.04Å; M418-T421 WeakPolarHBondContact CB-OG1 3.33Å; M418-T421 WeakPolarHBondContact O-CA 3.45Å; M418-T421 WeakPolarHBondContact O-CB 3.36Å; M418-T421 PolarHBondContact O-N 3.35Å; M418-A422 PolarHBondContact O-N 3.43Å; M418-A459 HydrophobicContact CE-CB 3.98Å; M418-A459 WeakPolarHBondContact CE-O 3.18Å; M418-A459 HydrophobicContact SD-CB 3.52Å; M418-A459 VanDerWaalsContact SD-CB 3.52Å; M418-N502 VanDerWaalsContact C-OD1 3.27Å
419D95.2Very high92.5Very high0 Ų03.7 Ų3.70%02%0.02CC..Hα-helixtrans-47.4-49.3-178.7-60.7-25.4000113T150 T151 A154 H347 N417 T421 A422 L423 N502T150-D419 VanDerWaalsContact C-OD1 3.27Å; T150-D419 WeakPolarHBondContact CB-OD2 3.32Å; T150-D419 PolarHBondContact OG1-OD1 2.75Å; T150-D419 PolarHBondContact OG1-OD2 3.45Å; T151-D419 WeakPolarHBondContact CA-OD1 3.5Å; T151-D419 PolarHBondContact N-OD1 3.21Å; T151-D419 PolarHBondContact OG1-OD1 3.25Å; A154-D419 HydrophobicContact CB-CB 3.92Å; A154-D419 WeakPolarHBondContact CB-O 3.28Å; H347-D419 IonicContact NE2-OD2 3.25Å; N417-D419 PolarHBondContact OD1-OD1 2.76Å; D419-T421 VanDerWaalsContact C-N 3.28Å; D419-T421 PolarHBondContact O-N 3.17Å; D419-A422 PolarHBondContact O-N 3.46Å; D419-L423 WeakPolarHBondContact O-CB 3.49Å; D419-L423 PolarHBondContact O-N 3.09Å; D419-N502 PolarHBondContact N-OD1 2.89Å
420G94.9Very high92.5Very high0 Ų03.7 Ų3.70%02%0.02CC..Hα-helixtrans-66.5-28.3178.300000113.5L344 M418 Y424 R498 N502L344-G420 VanDerWaalsContact CD2-CA 3.46Å; M418-G420 VanDerWaalsContact C-N 3.29Å; M418-G420 PolarHBondContact O-N 3.04Å; G420-Y424 WeakPolarHBondContact O-CB 3.21Å; G420-Y424 PolarHBondContact O-N 3.21Å; G420-Y424 VanDerWaalsContact O-N 3.13Å; G420-R498 VanDerWaalsContact C-CG 3.44Å; G420-R498 WeakPolarHBondContact O-CD 3.32Å; G420-N502 WeakPolarHBondContact CA-OD1 3.34Å; G420-N502 PolarHBondContact N-OD1 3.4Å
421T94.1Very high92.4Very high5 Ų53.7 Ų3.73%0.0312%0.02CC..Hα-helixtrans-73.7-47.8175-52.50000110.5M418 D419 L423 Y424 E425 A459 R498 N502M418-T421 WeakPolarHBondContact CB-OG1 3.33Å; M418-T421 WeakPolarHBondContact O-CA 3.45Å; M418-T421 WeakPolarHBondContact O-CB 3.36Å; M418-T421 PolarHBondContact O-N 3.35Å; D419-T421 VanDerWaalsContact C-N 3.28Å; D419-T421 PolarHBondContact O-N 3.17Å; T421-L423 PolarHBondContact O-N 3.44Å; T421-Y424 PolarHBondContact O-N 3.12Å; T421-E425 HydrophobicContact CG2-CG 4.32Å; T421-E425 WeakPolarHBondContact CG2-OE1 3.5Å; T421-E425 WeakPolarHBondContact O-CB 3.48Å; T421-E425 VanDerWaalsContact O-CG 3.27Å; T421-E425 WeakPolarHBondContact O-CG 3.13Å; T421-E425 PolarHBondContact O-N 3.01Å; T421-A459 HydrophobicContact CG2-CB 4.41Å; T421-R498 WeakPolarHBondContact OG1-CD 3.44Å; T421-N502 PolarHBondContact OG1-ND2 3.28Å
422A95Very high92.3Very high0 Ų03.7 Ų3.70%02%0.02CC..Hα-helixtrans-60.8-44.8178.600000111.8T151 V155 M418 D419 E425 A426T151-A422 HydrophobicContact CG2-CB 3.62Å; V155-A422 HydrophobicContact CG2-CB 3.45Å; V155-A422 VanDerWaalsContact CG2-CB 3.45Å; M418-A422 PolarHBondContact O-N 3.43Å; D419-A422 PolarHBondContact O-N 3.46Å; A422-E425 PolarHBondContact O-N 2.86Å; A422-A426 WeakPolarHBondContact O-CB 3.45Å; A422-A426 PolarHBondContact O-N 2.65Å
423L96.6Very high92.4Very high1 Ų13 Ų31%0.0052%0.017CC..Hα-helixtrans-59.8-50.1175.3-175.2156.6000111.2A154 E157 L344 D419 T421 E425 A426 V427A154-L423 HydrophobicContact CB-CB 4.18Å; A154-L423 HydrophobicContact CB-CD1 4.49Å; A154-L423 WeakPolarHBondContact O-CD1 3.38Å; A154-L423 WeakPolarHBondContact O-CG 3.45Å; E157-L423 HydrophobicContact CG-CD1 4.46Å; L344-L423 HydrophobicContact CD2-CD2 4.4Å; L344-L423 HydrophobicContact CG-CD2 4.44Å; D419-L423 WeakPolarHBondContact O-CB 3.49Å; D419-L423 PolarHBondContact O-N 3.09Å; T421-L423 PolarHBondContact O-N 3.44Å; L423-E425 PolarHBondContact O-N 3.36Å; L423-A426 PolarHBondContact O-N 3.12Å; L423-V427 HydrophobicContact CD2-CG2 4.09Å; L423-V427 VanDerWaalsContact O-CG2 3.3Å; L423-V427 WeakPolarHBondContact O-CG2 3.18Å; L423-V427 PolarHBondContact O-N 3.33Å
424Y95.4Very high92.3Very high0 Ų03.6 Ų3.60%02%0.02CC..Hα-helixtrans-58.1-46.6179.1163.8-89.7000112.1Y336 V340 G420 T421 V427 A428 M470 I487 D491 L494 R498Y336-Y424 VanDerWaalsContact OH-CD2 3.27Å; Y336-Y424 WeakPolarHBondContact OH-CD2 3.28Å; Y336-Y424 WeakPolarHBondContact OH-CE2 3.37Å; V340-Y424 HydrophobicContact CG1-CD2 4.11Å; V340-Y424 HydrophobicContact CG2-CD2 4.36Å; G420-Y424 WeakPolarHBondContact O-CB 3.21Å; G420-Y424 PolarHBondContact O-N 3.21Å; G420-Y424 VanDerWaalsContact O-N 3.13Å; T421-Y424 PolarHBondContact O-N 3.12Å; Y424-V427 PolarHBondContact O-N 3.36Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 3.32Å; Y424-M470 HydrophobicContact CE1-SD 4.23Å; Y424-I487 WeakPolarHBondContact OH-CD1 3.48Å; Y424-D491 VanDerWaalsContact CZ-OD1 3.3Å; Y424-D491 PolarHBondContact OH-OD1 2.98Å; Y424-L494 HydrophobicContact CD2-CB 4.37Å; Y424-L494 HydrophobicContact CD2-CD1 4.25Å; Y424-L494 HydrophobicContact CE2-CB 4.27Å; Y424-L494 HydrophobicContact CE2-CD1 3.95Å; Y424-R498 VanDerWaalsContact CE1-NH1 3.26Å; Y424-R498 VanDerWaalsContact CE2-NH1 3.34Å
425E94.8Very high92.2Very high0 Ų04.2 Ų4.20%02%0.023CC..Hα-helixtrans-64.3-43.2-178.6-74.5172.9167.700111.6T421 A422 L423 A428 A429 A452 A455 T469 M470 V473T421-E425 HydrophobicContact CG2-CG 4.32Å; T421-E425 WeakPolarHBondContact CG2-OE1 3.5Å; T421-E425 WeakPolarHBondContact O-CB 3.48Å; T421-E425 VanDerWaalsContact O-CG 3.27Å; T421-E425 WeakPolarHBondContact O-CG 3.13Å; T421-E425 PolarHBondContact O-N 3.01Å; A422-E425 PolarHBondContact O-N 2.86Å; L423-E425 PolarHBondContact O-N 3.36Å; E425-A428 PolarHBondContact O-N 3.21Å; E425-A429 WeakPolarHBondContact O-CB 3.28Å; E425-A429 PolarHBondContact O-N 2.98Å; E425-A452 HydrophobicContact CB-CB 4.11Å; E425-A455 WeakPolarHBondContact OE2-CB 3.13Å; E425-T469 WeakPolarHBondContact OE1-CB 3.26Å; E425-T469 PolarHBondContact OE1-OG1 3.45Å; E425-M470 HydrophobicContact CG-CB 4.11Å; E425-V473 HydrophobicContact CB-CG2 4.33Å
426A95.5Very high92.4Very high0 Ų05.5 Ų5.50%03%0.029CC..Hα-helixtrans-62.4-46.7176.600000111.6V155 I159 A422 L423 L430 V448 A452V155-A426 HydrophobicContact CG1-CB 4.3Å; I159-A426 HydrophobicContact CG1-CB 4.19Å; A422-A426 WeakPolarHBondContact O-CB 3.45Å; A422-A426 PolarHBondContact O-N 2.65Å; L423-A426 PolarHBondContact O-N 3.12Å; A426-L430 WeakPolarHBondContact O-CB 3.2Å; A426-L430 VanDerWaalsContact O-CG 3.3Å; A426-L430 WeakPolarHBondContact O-CG 3.36Å; A426-L430 PolarHBondContact O-N 3.32Å; A426-V448 HydrophobicContact CB-CG1 3.89Å; A426-A452 HydrophobicContact CB-CB 4.11Å
427V95.8Very high92.4Very high0 Ų014.1 Ų14.10%06%0.06CC..Hα-helixtrans-63.5-43.1176.9174.60000110.9G158 V162 Y336 T339 V340 L423 Y424 Y431G158-V427 WeakPolarHBondContact O-CG2 3.46Å; V162-V427 HydrophobicContact CB-CG1 4.23Å; V162-V427 HydrophobicContact CB-CG2 4.42Å; V162-V427 HydrophobicContact CG2-CG1 4.22Å; Y336-V427 HydrophobicContact CD2-CG1 4.11Å; Y336-V427 HydrophobicContact CE2-CG1 3.97Å; T339-V427 HydrophobicContact CG2-CG1 3.62Å; T339-V427 HydrophobicContact CG2-CG2 4.27Å; V340-V427 HydrophobicContact CG2-CB 4.05Å; V340-V427 HydrophobicContact CG2-CG1 3.6Å; L423-V427 HydrophobicContact CD2-CG2 4.09Å; L423-V427 VanDerWaalsContact O-CG2 3.3Å; L423-V427 WeakPolarHBondContact O-CG2 3.18Å; L423-V427 PolarHBondContact O-N 3.33Å; Y424-V427 PolarHBondContact O-N 3.36Å; V427-Y431 WeakPolarHBondContact O-CB 3.42Å; V427-Y431 PolarHBondContact O-N 2.97Å
428A93.7Very high92.4Very high0 Ų018.6 Ų18.60%08%0.083CC..Hα-helixtrans-63.7-48.4-179.100000112.6Y336 Y424 E425 L430 Y431 I432 M470 I487Y336-A428 HydrophobicContact CE2-CB 4Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 3.32Å; E425-A428 PolarHBondContact O-N 3.21Å; A428-L430 VanDerWaalsContact C-N 3.34Å; A428-L430 PolarHBondContact O-N 3.13Å; A428-Y431 PolarHBondContact O-N 2.9Å; A428-I432 VanDerWaalsContact O-CG1 3.3Å; A428-I432 WeakPolarHBondContact O-CG1 3.44Å; A428-I432 PolarHBondContact O-N 3.47Å; A428-M470 HydrophobicContact CB-CG 4.38Å; A428-M470 HydrophobicContact CB-SD 3.47Å; A428-M470 WeakPolarHBondContact CB-SD 3.42Å; A428-I487 HydrophobicContact CB-CD1 3.73Å
429A93.5Very high92Very high0 Ų027.1 Ų27.10%012%0.123CC..Hα-helixtrans-60.6-44.5179.200000111.7E425 I432 A433 V448 V473 L474 I477E425-A429 WeakPolarHBondContact O-CB 3.28Å; E425-A429 PolarHBondContact O-N 2.98Å; A429-I432 PolarHBondContact O-N 2.87Å; A429-A433 PolarHBondContact O-N 3.06Å; A429-V448 HydrophobicContact CB-CG1 4.36Å; A429-V448 HydrophobicContact CB-CG2 4.34Å; A429-V473 HydrophobicContact CB-CG1 3.63Å; A429-L474 HydrophobicContact CB-CD2 4.16Å; A429-I477 HydrophobicContact CB-CD1 4.1Å
430L94.1Very high91.4Very high0 Ų029.2 Ų29.20%013%0.134CC..Hα-helixtrans-72.7-35.5179.3-64.7174.1000112.4I159 V162 M163 A426 A428 A433 Q434 L440 V448I159-L430 HydrophobicContact CB-CD1 4.37Å; I159-L430 HydrophobicContact CG1-CD1 3.87Å; I159-L430 HydrophobicContact CG2-CD1 4.32Å; V162-L430 HydrophobicContact CG1-CB 3.67Å; V162-L430 HydrophobicContact CG1-CD1 3.44Å; V162-L430 VanDerWaalsContact CG1-CD1 3.44Å; V162-L430 HydrophobicContact CG1-CG 4.19Å; V162-L430 HydrophobicContact CG2-CB 4.02Å; M163-L430 HydrophobicContact CE-CD1 3.73Å; M163-L430 HydrophobicContact CE-CD2 3.76Å; M163-L430 HydrophobicContact CE-CG 4.21Å; A426-L430 WeakPolarHBondContact O-CB 3.2Å; A426-L430 VanDerWaalsContact O-CG 3.3Å; A426-L430 WeakPolarHBondContact O-CG 3.36Å; A426-L430 PolarHBondContact O-N 3.32Å; A428-L430 VanDerWaalsContact C-N 3.34Å; A428-L430 PolarHBondContact O-N 3.13Å; L430-A433 PolarHBondContact O-N 2.61Å; L430-Q434 WeakPolarHBondContact O-CB 3.3Å; L430-Q434 VanDerWaalsContact O-CG 3.24Å; L430-Q434 WeakPolarHBondContact O-CG 3.08Å; L430-Q434 PolarHBondContact O-N 2.95Å; L430-L440 HydrophobicContact CD2-CD1 3.97Å; L430-L440 HydrophobicContact CD2-CD2 3.61Å; L430-L440 HydrophobicContact CD2-CG 4.39Å; L430-V448 HydrophobicContact CD1-CG1 4.36Å; L430-V448 HydrophobicContact CD2-CB 4.46Å; L430-V448 HydrophobicContact CD2-CG2 3.89Å; L430-V448 HydrophobicContact CG-CG1 4.19Å; L430-V448 HydrophobicContact CG-CG2 4.33Å
431Y92.5Very high91.1Very high1 Ų132.1 Ų32.10%0.00415%0.154CC..Hα-helixtrans-60.7-45.7172.4166.2-109.5000111.6P167 L333 Y336 V427 A428 Q434 T435 L486 I487P167-Y431 HydrophobicContact CB-CD2 3.99Å; P167-Y431 HydrophobicContact CB-CE2 4.37Å; P167-Y431 HydrophobicContact CG-CD2 3.93Å; L333-Y431 HydrophobicContact CD2-CE1 4.24Å; Y336-Y431 AromaticContact CD2-CD1 3.63Å; Y336-Y431 HydrophobicContact CD2-CD1 3.63Å; Y336-Y431 HydrophobicContact CD2-CD2 4.36Å; Y336-Y431 HydrophobicContact CD2-CE1 4.29Å; Y336-Y431 AromaticContact CD2-CG 3.66Å; Y336-Y431 HydrophobicContact CD2-CG 3.66Å; Y336-Y431 HydrophobicContact CE2-CD1 4.31Å; Y336-Y431 AromaticContact CG-CD1 3.86Å; Y336-Y431 HydrophobicContact CG-CD1 3.86Å; Y336-Y431 HydrophobicContact CG-CE1 4.05Å; Y336-Y431 HydrophobicContact CG-CG 4.12Å; V427-Y431 WeakPolarHBondContact O-CB 3.42Å; V427-Y431 PolarHBondContact O-N 2.97Å; A428-Y431 PolarHBondContact O-N 2.9Å; Y431-Q434 PolarHBondContact O-N 3.24Å; Y431-T435 WeakPolarHBondContact O-CB 3.45Å; Y431-T435 PolarHBondContact O-N 3.03Å; Y431-T435 PolarHBondContact O-OG1 2.81Å; Y431-L486 HydrophobicContact CE1-CD2 3.68Å; Y431-L486 HydrophobicContact CE1-CG 4.28Å; Y431-I487 HydrophobicContact CD1-CG2 3.97Å; Y431-I487 HydrophobicContact CE1-CG2 3.9Å
432I90.7Very high90.8Very high0 Ų038.3 Ų38.30%019%0.187CC..Hα-helixtrans-62.8-46.3176.9-67.9166.4000109.9A428 A429 Q434 T435 L436 L474 L479 Y483A428-I432 VanDerWaalsContact O-CG1 3.3Å; A428-I432 WeakPolarHBondContact O-CG1 3.44Å; A428-I432 PolarHBondContact O-N 3.47Å; A429-I432 PolarHBondContact O-N 2.87Å; I432-Q434 PolarHBondContact O-N 3.3Å; I432-T435 PolarHBondContact O-N 2.71Å; I432-L436 HydrophobicContact CG2-CD1 3.94Å; I432-L436 HydrophobicContact CG2-CG 4.49Å; I432-L436 WeakPolarHBondContact O-CG 3.33Å; I432-L436 PolarHBondContact O-N 3.37Å; I432-L474 HydrophobicContact CD1-CD1 4.19Å; I432-L474 HydrophobicContact CD1-CD2 3.93Å; I432-L479 HydrophobicContact CB-CD1 4.2Å; I432-L479 HydrophobicContact CG2-CD1 3.85Å; I432-Y483 HydrophobicContact CG2-CD2 4.37Å; I432-Y483 HydrophobicContact CG2-CG 4.19Å
433A91.8Very high90.5Very high2 Ų240.5 Ų40.52%0.01721%0.209CC..Hα-helixtrans-58.2-44.6176.600000112.8A429 L430 T435 L436 R437 L438 L440 L479A429-A433 PolarHBondContact O-N 3.06Å; L430-A433 PolarHBondContact O-N 2.61Å; A433-T435 VanDerWaalsContact C-N 3.35Å; A433-L436 PolarHBondContact O-N 2.81Å; A433-R437 PolarHBondContact O-N 3.47Å; A433-L438 PolarHBondContact O-N 2.78Å; A433-L440 HydrophobicContact CB-CD1 4.16Å; A433-L440 HydrophobicContact CB-CD2 3.58Å; A433-L440 HydrophobicContact CB-CG 4.07Å; A433-L479 HydrophobicContact CB-CD1 4.11Å
434Q91.6Very high90.2Very high13 Ų1343.7 Ų43.76%0.06122%0.224CC..Hα-helixtrans-61.5-43.1176.1-75.3172.9-1.700111.5V162 G168 L430 Y431 I432 L436 R437 L440V162-Q434 PolarHBondContact O-NE2 3.41Å; G168-Q434 VanDerWaalsContact N-OE1 3.15Å; L430-Q434 WeakPolarHBondContact O-CB 3.3Å; L430-Q434 VanDerWaalsContact O-CG 3.24Å; L430-Q434 WeakPolarHBondContact O-CG 3.08Å; L430-Q434 PolarHBondContact O-N 2.95Å; Y431-Q434 PolarHBondContact O-N 3.24Å; I432-Q434 PolarHBondContact O-N 3.3Å; Q434-L436 VanDerWaalsContact C-N 3.28Å; Q434-L436 PolarHBondContact O-N 3.19Å; Q434-R437 WeakPolarHBondContact O-CA 3.17Å; Q434-R437 PolarHBondContact O-N 3.38Å; Q434-L440 HydrophobicContact CG-CD1 3.81Å
435T87.9Confident89.9Confident15 Ų1544.9 Ų44.99%0.09223%0.231CC..Hα-helixtrans-65.2-34.7-179.4-51.30000112G168 S171 F174 Y431 I432 A433 R437G168-T435 WeakPolarHBondContact CA-OG1 3.01Å; S171-T435 WeakPolarHBondContact OG-CG2 3.42Å; S171-T435 PolarHBondContact OG-OG1 3.25Å; F174-T435 HydrophobicContact CD2-CG2 3.34Å; F174-T435 HydrophobicContact CE2-CG2 3.22Å; F174-T435 HydrophobicContact CZ-CG2 4.44Å; Y431-T435 WeakPolarHBondContact O-CB 3.45Å; Y431-T435 PolarHBondContact O-N 3.03Å; Y431-T435 PolarHBondContact O-OG1 2.81Å; I432-T435 PolarHBondContact O-N 2.71Å; A433-T435 VanDerWaalsContact C-N 3.35Å; T435-R437 PolarHBondContact O-N 2.67Å
436L87.1Confident89.8Confident43 Ų4350 Ų5023%0.22526%0.257CS..THydrogen-bonded Turntrans-792173.1-61.7172.2000113.3F174 I432 A433 Q434 L438 L479 Y483F174-L436 HydrophobicContact CE1-CD2 4.15Å; F174-L436 HydrophobicContact CZ-CD2 3.92Å; I432-L436 HydrophobicContact CG2-CD1 3.94Å; I432-L436 HydrophobicContact CG2-CG 4.49Å; I432-L436 WeakPolarHBondContact O-CG 3.33Å; I432-L436 PolarHBondContact O-N 3.37Å; A433-L436 PolarHBondContact O-N 2.81Å; Q434-L436 VanDerWaalsContact C-N 3.28Å; Q434-L436 PolarHBondContact O-N 3.19Å; L436-L438 HydrophobicContact CB-CG 4.11Å; L436-L438 PolarHBondContact O-N 2.85Å; L436-L479 HydrophobicContact CD1-CD2 3.67Å; L436-Y483 HydrophobicContact CD1-CD2 3.51Å; L436-Y483 HydrophobicContact CD1-CE2 3.41Å; L436-Y483 VanDerWaalsContact CD1-CE2 3.41Å; L436-Y483 HydrophobicContact CD1-CG 4.16Å; L436-Y483 HydrophobicContact CD2-CD1 4.24Å; L436-Y483 HydrophobicContact CD2-CD2 4.31Å; L436-Y483 HydrophobicContact CD2-CE1 3.8Å; L436-Y483 HydrophobicContact CD2-CE2 3.8Å; L436-Y483 HydrophobicContact CD2-CG 4.48Å; L436-Y483 HydrophobicContact CG-CD2 4.45Å; L436-Y483 HydrophobicContact CG-CE2 4.24Å
437R86.6Confident89.7Confident211 Ų21153.1 Ų53.180%0.79627%0.274SS*.THydrogen-bonded Turntrans56.132.9-178.2-54.4-177.3179179.10.4113.5A433 Q434 T435A433-R437 PolarHBondContact O-N 3.47Å; Q434-R437 WeakPolarHBondContact O-CA 3.17Å; Q434-R437 PolarHBondContact O-N 3.38Å; T435-R437 PolarHBondContact O-N 2.67Å
438L85.5Confident89.6Confident93 Ų9353.1 Ų53.149%0.48727%0.274SS..  trans-76.7136.6173.5-63.2-178.7000110.2A433 L436 L440 L479A433-L438 PolarHBondContact O-N 2.78Å; L436-L438 HydrophobicContact CB-CG 4.11Å; L436-L438 PolarHBondContact O-N 2.85Å; L438-L440 PolarHBondContact O-N 3.32Å; L438-L440 VanDerWaalsContact O-N 3.1Å; L438-L479 HydrophobicContact CD1-CD2 3.32Å; L438-L479 HydrophobicContact CD1-CG 4.5Å
439E80.3Confident89.6Confident186 Ų18654 Ų5487%0.86928%0.279SS*.  trans-71.1106.1174.2-66.4-162.4162.700110.3S441E439-S441 PolarHBondContact O-N 3.22Å
440L82.2Confident89.5Confident43 Ų4358.9 Ų58.923%0.22531%0.305CS..  trans-75.990.6177.5-72.1166.4000110.2M163 L430 A433 Q434 L438 H444M163-L440 HydrophobicContact CE-CB 4.18Å; M163-L440 HydrophobicContact CE-CD1 3.74Å; M163-L440 HydrophobicContact CE-CG 4.48Å; M163-L440 HydrophobicContact SD-CD1 4.43Å; L430-L440 HydrophobicContact CD2-CD1 3.97Å; L430-L440 HydrophobicContact CD2-CD2 3.61Å; L430-L440 HydrophobicContact CD2-CG 4.39Å; A433-L440 HydrophobicContact CB-CD1 4.16Å; A433-L440 HydrophobicContact CB-CD2 3.58Å; A433-L440 HydrophobicContact CB-CG 4.07Å; Q434-L440 HydrophobicContact CG-CD1 3.81Å; L438-L440 PolarHBondContact O-N 3.32Å; L438-L440 VanDerWaalsContact O-N 3.1Å; L440-H444 HydrophobicContact CD2-CB 4.19Å
441S87.7Confident89.3Confident61 Ų6159 Ų5943%0.42731%0.306SS..  trans-65.8159.4171.4790000111.5E439 G443 H444 V445E439-S441 PolarHBondContact O-N 3.22Å; S441-G443 PolarHBondContact O-N 3.49Å; S441-G443 VanDerWaalsContact O-N 3.11Å; S441-G443 PolarHBondContact OG-N 3.07Å; S441-H444 PolarHBondContact O-N 3.07Å; S441-H444 PolarHBondContact OG-ND1 2.84Å; S441-V445 PolarHBondContact O-N 3.4Å
442L88.4Confident89.4Confident136 Ų13659 Ų5971%0.71231%0.306SS*.Hα-helixtrans-53.7-33.3174.2-177.564.3000112.2V445 I446L442-V445 PolarHBondContact O-N 2.61Å; L442-I446 HydrophobicContact CG-CD1 4.09Å; L442-I446 WeakPolarHBondContact O-CG1 3.34Å; L442-I446 PolarHBondContact O-N 3.15Å; L442-I446 VanDerWaalsContact O-N 3.09Å
443G89Confident89.4Confident45 Ų4559.4 Ų59.446%0.46431%0.308SS..Hα-helixtrans-62.4-42.717600000113.1S441 V445 I446 L447S441-G443 PolarHBondContact O-N 3.49Å; S441-G443 VanDerWaalsContact O-N 3.11Å; S441-G443 PolarHBondContact OG-N 3.07Å; G443-V445 VanDerWaalsContact C-N 3.34Å; G443-V445 PolarHBondContact O-N 2.92Å; G443-I446 PolarHBondContact O-N 2.83Å; G443-L447 WeakPolarHBondContact O-CB 3.29Å; G443-L447 PolarHBondContact O-N 2.8Å
444H89.8Confident89.2Confident69 Ų6961.6 Ų61.632%0.31932%0.32SS..Hα-helixtrans-63.6-41.1175.9-68.890.4000111.3L440 S441 I446 L447 V448L440-H444 HydrophobicContact CD2-CB 4.19Å; S441-H444 PolarHBondContact O-N 3.07Å; S441-H444 PolarHBondContact OG-ND1 2.84Å; H444-I446 PolarHBondContact O-N 3.41Å; H444-L447 PolarHBondContact O-N 3.1Å; H444-V448 WeakPolarHBondContact O-CG2 3.39Å; H444-V448 PolarHBondContact O-N 3.17Å
445V90.3Very high89Confident25 Ų2561 Ų6115%0.15232%0.317CS..Hα-helixtrans-62.1-44.2178.81800000111.8I159 M163 S441 L442 G443 S449I159-V445 HydrophobicContact CD1-CG1 4.13Å; I159-V445 HydrophobicContact CG2-CG1 3.45Å; I159-V445 VanDerWaalsContact CG2-CG1 3.45Å; M163-V445 HydrophobicContact CE-CG2 3.47Å; M163-V445 VanDerWaalsContact CE-CG2 3.47Å; S441-V445 PolarHBondContact O-N 3.4Å; L442-V445 PolarHBondContact O-N 2.61Å; G443-V445 VanDerWaalsContact C-N 3.34Å; G443-V445 PolarHBondContact O-N 2.92Å; V445-S449 WeakPolarHBondContact O-CB 3.08Å; V445-S449 PolarHBondContact O-N 3.1Å
446I92.4Very high89Confident107 Ų10760.3 Ų60.355%0.54931%0.312SS..Hα-helixtrans-64.1-43176.3-66.6167.8000110.5L442 G443 H444 S449 L450L442-I446 HydrophobicContact CG-CD1 4.09Å; L442-I446 WeakPolarHBondContact O-CG1 3.34Å; L442-I446 PolarHBondContact O-N 3.15Å; L442-I446 VanDerWaalsContact O-N 3.09Å; G443-I446 PolarHBondContact O-N 2.83Å; H444-I446 PolarHBondContact O-N 3.41Å; I446-S449 WeakPolarHBondContact O-CB 3.35Å; I446-S449 PolarHBondContact O-N 3.01Å; I446-L450 PolarHBondContact O-N 3.32Å
447L92.4Very high89Confident66 Ų6660.4 Ų60.435%0.34631%0.313SS..Hα-helixtrans-64.9-43.5179.7-174.154.8000112.1G443 H444 S449 L450 T451 A476 I477G443-L447 WeakPolarHBondContact O-CB 3.29Å; G443-L447 PolarHBondContact O-N 2.8Å; H444-L447 PolarHBondContact O-N 3.1Å; L447-S449 VanDerWaalsContact C-N 3.31Å; L447-S449 PolarHBondContact O-N 3.43Å; L447-L450 PolarHBondContact O-N 3.01Å; L447-T451 HydrophobicContact CD1-CG2 3.84Å; L447-T451 HydrophobicContact CG-CG2 4.39Å; L447-T451 WeakPolarHBondContact O-CB 3.02Å; L447-T451 VanDerWaalsContact O-CG2 3.25Å; L447-T451 WeakPolarHBondContact O-CG2 3.46Å; L447-T451 PolarHBondContact O-N 3.49Å; L447-T451 PolarHBondContact O-OG1 3.03Å; L447-A476 WeakPolarHBondContact CD2-O 3.44Å; L447-I477 HydrophobicContact CB-CG2 4.36Å; L447-I477 HydrophobicContact CD2-CG2 4.12Å; L447-I477 HydrophobicContact CG-CG2 4.11Å
448V93.8Very high88.4Confident0 Ų051.7 Ų51.70%029%0.289CS..Hα-helixtrans-58.6-45.4171.8171.50000110.4A426 A429 L430 H444 L450 T451 A452 V473 I477A426-V448 HydrophobicContact CB-CG1 3.89Å; A429-V448 HydrophobicContact CB-CG1 4.36Å; A429-V448 HydrophobicContact CB-CG2 4.34Å; L430-V448 HydrophobicContact CD1-CG1 4.36Å; L430-V448 HydrophobicContact CD2-CB 4.46Å; L430-V448 HydrophobicContact CD2-CG2 3.89Å; L430-V448 HydrophobicContact CG-CG1 4.19Å; L430-V448 HydrophobicContact CG-CG2 4.33Å; H444-V448 WeakPolarHBondContact O-CG2 3.39Å; H444-V448 PolarHBondContact O-N 3.17Å; V448-L450 PolarHBondContact O-N 3.47Å; V448-T451 WeakPolarHBondContact CA-OG1 3.38Å; V448-T451 PolarHBondContact O-N 3.16Å; V448-T451 PolarHBondContact O-OG1 3.5Å; V448-A452 WeakPolarHBondContact O-CB 3.48Å; V448-A452 PolarHBondContact O-N 2.94Å; V448-V473 HydrophobicContact CG1-CG1 4.3Å; V448-I477 HydrophobicContact CG2-CD1 4.05Å; V448-I477 HydrophobicContact CG2-CG2 3.61Å
449S93.2Very high88Confident17 Ų1747.5 Ų47.512%0.11927%0.267CS..Hα-helixtrans-58.4-49.1-179.2-177.50000112.3V155 V445 I446 L447 T453V155-S449 WeakPolarHBondContact CG1-OG 3.44Å; V445-S449 WeakPolarHBondContact O-CB 3.08Å; V445-S449 PolarHBondContact O-N 3.1Å; I446-S449 WeakPolarHBondContact O-CB 3.35Å; I446-S449 PolarHBondContact O-N 3.01Å; L447-S449 VanDerWaalsContact C-N 3.31Å; L447-S449 PolarHBondContact O-N 3.43Å; S449-T453 WeakPolarHBondContact O-CB 3.42Å; S449-T453 PolarHBondContact O-N 3.37Å; S449-T453 VanDerWaalsContact O-N 3.16Å; S449-T453 PolarHBondContact O-OG1 2.99Å
450L91.6Very high87.5Confident103 Ų10339.9 Ų39.954%0.53924%0.236SC..Hα-helixtrans-66.1-45.2179.3-178.461.6000111.9I446 L447 V448 T453 L454I446-L450 PolarHBondContact O-N 3.32Å; L447-L450 PolarHBondContact O-N 3.01Å; V448-L450 PolarHBondContact O-N 3.47Å; L450-T453 PolarHBondContact O-N 3.36Å; L450-L454 HydrophobicContact CD1-CD1 4.36Å; L450-L454 HydrophobicContact CG-CD1 4.13Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.28Å; L450-L454 PolarHBondContact O-N 3.43Å
451T91.6Very high86.7Confident4 Ų438.3 Ų38.33%0.02523%0.23CC..Hα-helixtrans-74.4-35.9-174.654.30000112.6L447 V448 L454 A455 M472 A476L447-T451 HydrophobicContact CD1-CG2 3.84Å; L447-T451 HydrophobicContact CG-CG2 4.39Å; L447-T451 WeakPolarHBondContact O-CB 3.02Å; L447-T451 VanDerWaalsContact O-CG2 3.25Å; L447-T451 WeakPolarHBondContact O-CG2 3.46Å; L447-T451 PolarHBondContact O-N 3.49Å; L447-T451 PolarHBondContact O-OG1 3.03Å; V448-T451 WeakPolarHBondContact CA-OG1 3.38Å; V448-T451 PolarHBondContact O-N 3.16Å; V448-T451 PolarHBondContact O-OG1 3.5Å; T451-L454 PolarHBondContact O-N 2.99Å; T451-A455 VanDerWaalsContact O-CB 3.27Å; T451-A455 WeakPolarHBondContact O-CB 3.3Å; T451-A455 PolarHBondContact O-N 2.84Å; T451-M472 WeakPolarHBondContact O-CE 2.91Å; T451-A476 HydrophobicContact CG2-CB 3.54Å
452A93.2Very high85.8Confident0 Ų039 Ų390%023%0.228CC..Hα-helixtrans-65.3-40.1171.800000111.6V155 E425 A426 V448 L454 A455 S456 V473V155-A452 HydrophobicContact CG2-CB 4.42Å; E425-A452 HydrophobicContact CB-CB 4.11Å; A426-A452 HydrophobicContact CB-CB 4.11Å; V448-A452 WeakPolarHBondContact O-CB 3.48Å; V448-A452 PolarHBondContact O-N 2.94Å; A452-L454 PolarHBondContact O-N 3.37Å; A452-A455 PolarHBondContact O-N 3.34Å; A452-S456 WeakPolarHBondContact O-CB 3.42Å; A452-S456 PolarHBondContact O-N 3.37Å; A452-V473 HydrophobicContact CB-CG2 4.38Å
453T91.3Very high84.6Confident9 Ų935.8 Ų35.86%0.05522%0.215CC..Hα-helixtrans-59.5-47.8172.9-56.20000110.6F148 T151 S449 L450 S456 I457F148-T453 HydrophobicContact CE2-CG2 4.43Å; T151-T453 HydrophobicContact CG2-CG2 4.1Å; S449-T453 WeakPolarHBondContact O-CB 3.42Å; S449-T453 PolarHBondContact O-N 3.37Å; S449-T453 VanDerWaalsContact O-N 3.16Å; S449-T453 PolarHBondContact O-OG1 2.99Å; L450-T453 PolarHBondContact O-N 3.36Å; T453-S456 PolarHBondContact O-N 3.15Å; T453-S456 PolarHBondContact O-OG 3.34Å; T453-I457 WeakPolarHBondContact O-CG1 3.22Å; T453-I457 PolarHBondContact O-N 2.99Å
454L87.8Confident83.6Confident48 Ų4839 Ų3925%0.25122%0.219SC..Hα-helixtrans-65-40.6178.3-70.7169.1000113.1I194 L450 T451 A452 S456 I457 G458 M472I194-L454 HydrophobicContact CD1-CD1 4.22Å; I194-L454 HydrophobicContact CD1-CD2 4.3Å; I194-L454 HydrophobicContact CG1-CD2 4.33Å; L450-L454 HydrophobicContact CD1-CD1 4.36Å; L450-L454 HydrophobicContact CG-CD1 4.13Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.28Å; L450-L454 PolarHBondContact O-N 3.43Å; T451-L454 PolarHBondContact O-N 2.99Å; A452-L454 PolarHBondContact O-N 3.37Å; L454-S456 VanDerWaalsContact C-N 3.32Å; L454-S456 PolarHBondContact O-N 2.98Å; L454-I457 PolarHBondContact O-N 2.67Å; L454-G458 PolarHBondContact O-N 3.43Å; L454-M472 HydrophobicContact CB-CE 4.37Å
455A87.4Confident82.7Confident0 Ų036.2 Ų36.20%021%0.207CC..Hα-helixtrans-60.7-42.9177.600000111.2E425 T451 A452 I457 G458 A459 M472 V473E425-A455 WeakPolarHBondContact OE2-CB 3.13Å; T451-A455 VanDerWaalsContact O-CB 3.27Å; T451-A455 WeakPolarHBondContact O-CB 3.3Å; T451-A455 PolarHBondContact O-N 2.84Å; A452-A455 PolarHBondContact O-N 3.34Å; A455-I457 VanDerWaalsContact C-N 3.28Å; A455-I457 PolarHBondContact O-N 3.4Å; A455-G458 CarbonylContact O-C 3.02Å; A455-G458 PolarHBondContact O-N 3.47Å; A455-G458 VanDerWaalsContact O-N 3.14Å; A455-A459 PolarHBondContact O-N 2.78Å; A455-M472 HydrophobicContact CB-CE 3.47Å; A455-M472 VanDerWaalsContact CB-CE 3.47Å; A455-M472 HydrophobicContact CB-SD 4.38Å; A455-V473 HydrophobicContact CB-CG2 3.98Å
456S88.3Confident82.1Confident0 Ų035.1 Ų35.10%020%0.201CC..Hα-helixtrans-64-28.9178.8780000114.1T151 A452 T453 L454T151-S456 WeakPolarHBondContact CG2-OG 3.37Å; A452-S456 WeakPolarHBondContact O-CB 3.42Å; A452-S456 PolarHBondContact O-N 3.37Å; T453-S456 PolarHBondContact O-N 3.15Å; T453-S456 PolarHBondContact O-OG 3.34Å; L454-S456 VanDerWaalsContact C-N 3.32Å; L454-S456 PolarHBondContact O-N 2.98Å
457I85.9Confident81.5Confident46 Ų4630.8 Ų30.824%0.23618%0.179CC..Hα-helixtrans-75.2-34.6175.3-64.1168.1000111.2L197 I416 T453 L454 A455L197-I457 HydrophobicContact CD1-CG2 3.91Å; L197-I457 HydrophobicContact CD2-CG2 3.74Å; I416-I457 HydrophobicContact CB-CG2 4.16Å; I416-I457 HydrophobicContact CG2-CG2 4.04Å; T453-I457 WeakPolarHBondContact O-CG1 3.22Å; T453-I457 PolarHBondContact O-N 2.99Å; L454-I457 PolarHBondContact O-N 2.67Å; A455-I457 VanDerWaalsContact C-N 3.28Å; A455-I457 PolarHBondContact O-N 3.4Å
458G74.7Confident80.9Confident28 Ų2829.5 Ų29.529%0.28917%0.174SC..Hα-helixtrans-84.6-9.6177.900000114.2L454 A455L454-G458 PolarHBondContact O-N 3.43Å; A455-G458 CarbonylContact O-C 3.02Å; A455-G458 PolarHBondContact O-N 3.47Å; A455-G458 VanDerWaalsContact O-N 3.14Å
459A76.9Confident80.5Confident4 Ų430.2 Ų30.23%0.03318%0.178CC..  trans-67.4134.2179.800000110.5M418 T421 A455 T469M418-A459 HydrophobicContact CE-CB 3.98Å; M418-A459 WeakPolarHBondContact CE-O 3.18Å; M418-A459 HydrophobicContact SD-CB 3.52Å; M418-A459 VanDerWaalsContact SD-CB 3.52Å; T421-A459 HydrophobicContact CG2-CB 4.41Å; A455-A459 PolarHBondContact O-N 2.78Å; A459-T469 HydrophobicContact CB-CG2 4.02Å
460A69.3Low80.3Confident27 Ų2729.4 Ų29.422%0.22317%0.173CC..  trans-80.6142.2172.600000109.4I462 A465A460-I462 HydrophobicContact CB-CD1 3.98Å; A460-I462 HydrophobicContact CB-CG1 3.8Å; A460-I462 PolarHBondContact O-N 3.01Å; A460-A465 WeakPolarHBondContact O-CB 3.35Å
461G66.8Low80.1Confident9 Ų924.5 Ų24.59%0.09315%0.147CC..SBendtrans-70.433.1177.600000114.9S383 S385S383-G461 PolarHBondContact OG-O 3.46Å; S385-G461 PolarHBondContact N-O 3.26Å; S385-G461 PolarHBondContact OG-O 3.42Å
462I67.3Low79.9Confident75 Ų7524.3 Ų24.339%0.38515%0.146SC..SBendtrans-106.4156.2-179.864.8179.8000110.2A460 A465A460-I462 HydrophobicContact CB-CD1 3.98Å; A460-I462 HydrophobicContact CB-CG1 3.8Å; A460-I462 PolarHBondContact O-N 3.01Å; I462-A465 HydrophobicContact CG1-CB 3.95Å; I462-A465 WeakPolarHBondContact O-CB 3.46Å; I462-A465 PolarHBondContact O-N 3.47Å
463P64Low79.8Confident69 Ų6924.3 Ų24.345%0.44815%0.146SC..THydrogen-bonded Turntrans-57.6145.5179.8-24.135000112.5A465P463-A465 PolarHBondContact O-N 3.19Å; P463-A465 VanDerWaalsContact O-N 3.08Å
464Q67.1Low79.7Confident113 Ų11323.9 Ų23.953%0.52814%0.143SC..THydrogen-bonded Turntrans59.512.8177.1-59.5177.3-37.100115.8G466 I467 D495Q464-G466 PolarHBondContact O-N 3.34Å; Q464-I467 PolarHBondContact O-N 2.76Å; Q464-D495 PolarHBondContact N-OD2 2.9Å
465A72.2Confident79.8Confident10 Ų1023.2 Ų23.28%0.08314%0.14CC..Hα-helixtrans-62-31.2176.800000112.9A460 I462 P463 I467 V468 T469A460-A465 WeakPolarHBondContact O-CB 3.35Å; I462-A465 HydrophobicContact CG1-CB 3.95Å; I462-A465 WeakPolarHBondContact O-CB 3.46Å; I462-A465 PolarHBondContact O-N 3.47Å; P463-A465 PolarHBondContact O-N 3.19Å; P463-A465 VanDerWaalsContact O-N 3.08Å; A465-I467 VanDerWaalsContact C-N 3.31Å; A465-I467 PolarHBondContact O-N 2.83Å; A465-V468 PolarHBondContact O-N 2.95Å; A465-V468 VanDerWaalsContact O-N 3.12Å; A465-T469 PolarHBondContact O-N 3.12Å; A465-T469 PolarHBondContact O-OG1 3.42Å
466G76Confident79.8Confident3 Ų324.9 Ų24.93%0.03115%0.153CC..Hα-helixtrans-61.8-30.1-177.100000114.7Q464 T469 M470Q464-G466 PolarHBondContact O-N 3.34Å; G466-T469 WeakPolarHBondContact CA-OG1 3.36Å; G466-T469 PolarHBondContact O-OG1 3.22Å; G466-M470 WeakPolarHBondContact O-CB 3.21Å; G466-M470 PolarHBondContact O-N 2.87Å
467I80.6Confident79.9Confident15 Ų1525.7 Ų25.78%0.07716%0.157CC..Hα-helixtrans-66.6-42.2174.8-72.3176.3000110.6Q464 A465 T469 M470 L471 F484 M488 D491Q464-I467 PolarHBondContact O-N 2.76Å; A465-I467 VanDerWaalsContact C-N 3.31Å; A465-I467 PolarHBondContact O-N 2.83Å; I467-T469 VanDerWaalsContact C-N 3.33Å; I467-T469 PolarHBondContact O-N 3.44Å; I467-M470 HydrophobicContact CG2-CE 4.46Å; I467-M470 WeakPolarHBondContact O-CB 3.45Å; I467-M470 PolarHBondContact O-N 3.36Å; I467-L471 PolarHBondContact O-N 2.88Å; I467-F484 HydrophobicContact CG2-CD2 3.48Å; I467-F484 VanDerWaalsContact CG2-CD2 3.48Å; I467-F484 HydrophobicContact CG2-CE2 3.61Å; I467-M488 HydrophobicContact CD1-CG 4.22Å; I467-D491 HydrophobicContact CD1-CB 3.76Å; I467-D491 WeakPolarHBondContact CD1-OD2 3.32Å; I467-D491 HydrophobicContact CG1-CB 4.14Å; I467-D491 WeakPolarHBondContact CG1-OD2 3.13Å
468V79.2Confident79.8Confident40 Ų4025.3 Ų25.324%0.24217%0.165CC..Hα-helixtrans-64.1-43.1-176.9-178.20000110.1P185 C186 A465 L471P185-V468 HydrophobicContact CB-CG2 4.08Å; C186-V468 HydrophobicContact CB-CG1 4.25Å; A465-V468 PolarHBondContact O-N 2.95Å; A465-V468 VanDerWaalsContact O-N 3.12Å; V468-L471 PolarHBondContact O-N 3.19Å
469T86.6Confident80.4Confident14 Ų1424.2 Ų24.29%0.08615%0.153CC..Hα-helixtrans-75.8-28.117948.90000112.7E425 A459 A465 G466 I467 L471 M472E425-T469 WeakPolarHBondContact OE1-CB 3.26Å; E425-T469 PolarHBondContact OE1-OG1 3.45Å; A459-T469 HydrophobicContact CB-CG2 4.02Å; A465-T469 PolarHBondContact O-N 3.12Å; A465-T469 PolarHBondContact O-OG1 3.42Å; G466-T469 WeakPolarHBondContact CA-OG1 3.36Å; G466-T469 PolarHBondContact O-OG1 3.22Å; I467-T469 VanDerWaalsContact C-N 3.33Å; I467-T469 PolarHBondContact O-N 3.44Å; T469-L471 VanDerWaalsContact C-N 3.28Å; T469-L471 PolarHBondContact O-N 3.46Å; T469-M472 WeakPolarHBondContact O-CB 3.37Å; T469-M472 PolarHBondContact O-N 3.48Å
470M88.6Confident80.7Confident0 Ų025.7 Ų25.70%016%0.162CC..Hα-helixtrans-60.9-33.8170.8-178.6-174.262.600113.1Y424 E425 A428 G466 I467 M472 V473 L474 F484 I487Y424-M470 HydrophobicContact CE1-SD 4.23Å; E425-M470 HydrophobicContact CG-CB 4.11Å; A428-M470 HydrophobicContact CB-CG 4.38Å; A428-M470 HydrophobicContact CB-SD 3.47Å; A428-M470 WeakPolarHBondContact CB-SD 3.42Å; G466-M470 WeakPolarHBondContact O-CB 3.21Å; G466-M470 PolarHBondContact O-N 2.87Å; I467-M470 HydrophobicContact CG2-CE 4.46Å; I467-M470 WeakPolarHBondContact O-CB 3.45Å; I467-M470 PolarHBondContact O-N 3.36Å; M470-M472 PolarHBondContact O-N 3Å; M470-V473 WeakPolarHBondContact O-CA 3.35Å; M470-V473 WeakPolarHBondContact O-CB 3.35Å; M470-V473 PolarHBondContact O-N 3.04Å; M470-L474 PolarHBondContact O-N 3.42Å; M470-F484 HydrophobicContact CE-CB 3.6Å; M470-I487 HydrophobicContact CE-CD1 3.52Å; M470-I487 HydrophobicContact CE-CG1 4.16Å; M470-I487 HydrophobicContact SD-CD1 3.23Å; M470-I487 WeakPolarHBondContact SD-CD1 3.03Å; M470-I487 HydrophobicContact SD-CG1 4.42Å
471L88.1Confident81.3Confident0 Ų024.8 Ų24.80%015%0.154CC..Hα-helixtrans-59.3-36.5177.1-62.4174.8000112P185 L187 M238 I467 V468 T469 V473 L474 I475 T481 F484P185-L471 HydrophobicContact CB-CD1 3.71Å; P185-L471 HydrophobicContact CG-CD1 3.51Å; L187-L471 HydrophobicContact CD1-CB 3.96Å; L187-L471 HydrophobicContact CD1-CD1 4.06Å; M238-L471 HydrophobicContact CE-CD1 4.04Å; I467-L471 PolarHBondContact O-N 2.88Å; V468-L471 PolarHBondContact O-N 3.19Å; T469-L471 VanDerWaalsContact C-N 3.28Å; T469-L471 PolarHBondContact O-N 3.46Å; L471-V473 VanDerWaalsContact C-N 3.28Å; L471-V473 PolarHBondContact O-N 3.47Å; L471-L474 HydrophobicContact CD2-CD1 4.4Å; L471-L474 PolarHBondContact O-N 3.19Å; L471-I475 VanDerWaalsContact O-CG1 3.24Å; L471-I475 WeakPolarHBondContact O-CG1 3.31Å; L471-I475 PolarHBondContact O-N 3.41Å; L471-T481 HydrophobicContact CD2-CG2 4.38Å; L471-F484 HydrophobicContact CD2-CB 3.74Å; L471-F484 HydrophobicContact CD2-CD1 3.84Å; L471-F484 HydrophobicContact CD2-CD2 4.44Å; L471-F484 HydrophobicContact CD2-CE1 4.49Å; L471-F484 HydrophobicContact CD2-CG 3.76Å
472M86.1Confident82Confident0 Ų027 Ų270%016%0.16CC..Hα-helixtrans-60.2-41.1174.5-170.5-160.784.600111.2A190 T193 T451 L454 A455 T469 M470 A476A190-M472 VanDerWaalsContact CA-SD 3.58Å; A190-M472 HydrophobicContact CB-CE 4.23Å; A190-M472 HydrophobicContact CB-CG 4.28Å; A190-M472 HydrophobicContact CB-SD 4.22Å; T193-M472 VanDerWaalsContact CB-SD 3.57Å; T193-M472 HydrophobicContact CG2-SD 3.94Å; T193-M472 PolarHBondContact OG1-SD 3.33Å; T451-M472 WeakPolarHBondContact O-CE 2.91Å; L454-M472 HydrophobicContact CB-CE 4.37Å; A455-M472 HydrophobicContact CB-CE 3.47Å; A455-M472 VanDerWaalsContact CB-CE 3.47Å; A455-M472 HydrophobicContact CB-SD 4.38Å; T469-M472 WeakPolarHBondContact O-CB 3.37Å; T469-M472 PolarHBondContact O-N 3.48Å; M470-M472 PolarHBondContact O-N 3Å; M472-A476 WeakPolarHBondContact O-CB 3.29Å; M472-A476 PolarHBondContact O-N 3.43Å
473V91Very high82.7Confident0 Ų025.4 Ų25.40%015%0.15CC..Hα-helixtrans-66.2-43.9176.9-176.40000110.6E425 A429 V448 A452 A455 M470 L471 A476 I477E425-V473 HydrophobicContact CB-CG2 4.33Å; A429-V473 HydrophobicContact CB-CG1 3.63Å; V448-V473 HydrophobicContact CG1-CG1 4.3Å; A452-V473 HydrophobicContact CB-CG2 4.38Å; A455-V473 HydrophobicContact CB-CG2 3.98Å; M470-V473 WeakPolarHBondContact O-CA 3.35Å; M470-V473 WeakPolarHBondContact O-CB 3.35Å; M470-V473 PolarHBondContact O-N 3.04Å; L471-V473 VanDerWaalsContact C-N 3.28Å; L471-V473 PolarHBondContact O-N 3.47Å; V473-A476 PolarHBondContact O-N 2.81Å; V473-I477 WeakPolarHBondContact O-CG1 3.33Å; V473-I477 PolarHBondContact O-N 3.36Å
474L90.6Very high83.6Confident0 Ų022.3 Ų22.30%013%0.129CC..Hα-helixtrans-60.4-47.6176.2-64.4-179000111.9A429 I432 M470 L471 A476 I477 G478 L479 F484A429-L474 HydrophobicContact CB-CD2 4.16Å; I432-L474 HydrophobicContact CD1-CD1 4.19Å; I432-L474 HydrophobicContact CD1-CD2 3.93Å; M470-L474 PolarHBondContact O-N 3.42Å; L471-L474 HydrophobicContact CD2-CD1 4.4Å; L471-L474 PolarHBondContact O-N 3.19Å; L474-A476 VanDerWaalsContact C-N 3.28Å; L474-A476 PolarHBondContact O-N 2.92Å; L474-I477 WeakPolarHBondContact O-CG1 3.45Å; L474-I477 PolarHBondContact O-N 3.4Å; L474-G478 PolarHBondContact O-N 2.95Å; L474-L479 HydrophobicContact CB-CB 4.09Å; L474-L479 HydrophobicContact CD2-CB 4.08Å; L474-L479 HydrophobicContact CD2-CD1 3.71Å; L474-L479 PolarHBondContact O-N 3.29Å; L474-F484 HydrophobicContact CD1-CB 4.16Å
475I88.5Confident84.1Confident35 Ų3517.8 Ų17.818%0.17911%0.109CC..Hα-helixtrans-60.1-41.5177.4-66.4163000110.9L187 N189 L471 I477 G478 T481L187-I475 HydrophobicContact CD1-CD1 3.45Å; L187-I475 VanDerWaalsContact CD1-CD1 3.45Å; L187-I475 HydrophobicContact CD1-CG1 4.39Å; L187-I475 HydrophobicContact CD2-CD1 3.92Å; L187-I475 HydrophobicContact CG-CD1 3.54Å; N189-I475 WeakPolarHBondContact OD1-CG2 3.33Å; L471-I475 VanDerWaalsContact O-CG1 3.24Å; L471-I475 WeakPolarHBondContact O-CG1 3.31Å; L471-I475 PolarHBondContact O-N 3.41Å; I475-I477 PolarHBondContact O-N 2.91Å; I475-G478 PolarHBondContact O-N 3.12Å; I475-T481 HydrophobicContact CD1-CG2 4.2Å; I475-T481 HydrophobicContact CG1-CG2 3.7Å
476A88.6Confident84.4Confident34 Ų3419.2 Ų19.228%0.28112%0.115SC..Hα-helixtrans-60.8-34.8-177.700000112.7L447 T451 M472 V473 L474L447-A476 WeakPolarHBondContact CD2-O 3.44Å; T451-A476 HydrophobicContact CG2-CB 3.54Å; M472-A476 WeakPolarHBondContact O-CB 3.29Å; M472-A476 PolarHBondContact O-N 3.43Å; V473-A476 PolarHBondContact O-N 2.81Å; L474-A476 VanDerWaalsContact C-N 3.28Å; L474-A476 PolarHBondContact O-N 2.92Å
477I89.2Confident84.7Confident17 Ų1719 Ų199%0.08711%0.113CC..THydrogen-bonded Turntrans-93.17.2176.561.9172.8000114.2A429 L447 V448 V473 L474 I475 L479A429-I477 HydrophobicContact CB-CD1 4.1Å; L447-I477 HydrophobicContact CB-CG2 4.36Å; L447-I477 HydrophobicContact CD2-CG2 4.12Å; L447-I477 HydrophobicContact CG-CG2 4.11Å; V448-I477 HydrophobicContact CG2-CD1 4.05Å; V448-I477 HydrophobicContact CG2-CG2 3.61Å; V473-I477 WeakPolarHBondContact O-CG1 3.33Å; V473-I477 PolarHBondContact O-N 3.36Å; L474-I477 WeakPolarHBondContact O-CG1 3.45Å; L474-I477 PolarHBondContact O-N 3.4Å; I475-I477 PolarHBondContact O-N 2.91Å; I477-L479 HydrophobicContact CD1-CD1 3.5Å; I477-L479 VanDerWaalsContact CD1-CD1 3.5Å; I477-L479 HydrophobicContact CD1-CG 3.82Å; I477-L479 HydrophobicContact CG1-CB 4.23Å; I477-L479 HydrophobicContact CG1-CD1 4.11Å; I477-L479 HydrophobicContact CG1-CG 3.91Å
478G85.3Confident84.7Confident39 Ų3921.4 Ų21.440%0.40212%0.124SC..THydrogen-bonded Turntrans71.428.718000000114L474 I475L474-G478 PolarHBondContact O-N 2.95Å; I475-G478 PolarHBondContact O-N 3.12Å
479L85.8Confident84.6Confident5 Ų522.1 Ų22.13%0.02613%0.13CC..  trans-89.8133.3173.1-79.9-174.9000111.4I432 A433 L436 L438 L474 I477 T481I432-L479 HydrophobicContact CB-CD1 4.2Å; I432-L479 HydrophobicContact CG2-CD1 3.85Å; A433-L479 HydrophobicContact CB-CD1 4.11Å; L436-L479 HydrophobicContact CD1-CD2 3.67Å; L438-L479 HydrophobicContact CD1-CD2 3.32Å; L438-L479 HydrophobicContact CD1-CG 4.5Å; L474-L479 HydrophobicContact CB-CB 4.09Å; L474-L479 HydrophobicContact CD2-CB 4.08Å; L474-L479 HydrophobicContact CD2-CD1 3.71Å; L474-L479 PolarHBondContact O-N 3.29Å; I477-L479 HydrophobicContact CD1-CD1 3.5Å; I477-L479 VanDerWaalsContact CD1-CD1 3.5Å; I477-L479 HydrophobicContact CD1-CG 3.82Å; I477-L479 HydrophobicContact CG1-CB 4.23Å; I477-L479 HydrophobicContact CG1-CD1 4.11Å; I477-L479 HydrophobicContact CG1-CG 3.91Å; L479-T481 PolarHBondContact O-N 3.22Å
480P82.7Confident84.4Confident35 Ų3521.8 Ų21.823%0.22713%0.128CC..  trans-57.6128.9173.1-26.334.9000111.5K482 Y483P480-K482 VanDerWaalsContact C-N 3.28Å; P480-K482 HydrophobicContact CB-CG 4.09Å; P480-K482 PolarHBondContact O-N 2.9Å; P480-Y483 HydrophobicContact CB-CD2 3.88Å; P480-Y483 HydrophobicContact CB-CE2 3.68Å; P480-Y483 HydrophobicContact CG-CD2 4.25Å; P480-Y483 HydrophobicContact CG-CE2 3.71Å; P480-Y483 VanDerWaalsContact O-CD2 3.27Å; P480-Y483 WeakPolarHBondContact O-CD2 3.24Å; P480-Y483 PolarHBondContact O-N 2.79Å
481T82.7Confident84.2Confident8 Ų821.8 Ų21.85%0.04913%0.128CC..G310 helixtrans-63-32.3-172.854.40000112.5L187 L471 I475 L479 Y483 F484L187-T481 HydrophobicContact CD1-CG2 3.71Å; L471-T481 HydrophobicContact CD2-CG2 4.38Å; I475-T481 HydrophobicContact CD1-CG2 4.2Å; I475-T481 HydrophobicContact CG1-CG2 3.7Å; L479-T481 PolarHBondContact O-N 3.22Å; T481-Y483 PolarHBondContact O-N 2.95Å; T481-F484 WeakPolarHBondContact O-CB 3.34Å; T481-F484 WeakPolarHBondContact O-CD1 3.34Å; T481-F484 PolarHBondContact O-N 2.91Å
482K81Confident83.9Confident54 Ų5424.3 Ų24.324%0.23514%0.138CC..G310 helixtrans-45.4-31.617751.6-173.5-178.3-168.40115.5M238 P480 F484 I485M238-K482 WeakPolarHBondContact O-CB 3.24Å; P480-K482 VanDerWaalsContact C-N 3.28Å; P480-K482 HydrophobicContact CB-CG 4.09Å; P480-K482 PolarHBondContact O-N 2.9Å; K482-F484 PolarHBondContact O-N 3.23Å; K482-F484 VanDerWaalsContact O-N 3.17Å; K482-I485 WeakPolarHBondContact O-CB 3.26Å; K482-I485 WeakPolarHBondContact O-CG1 3.25Å; K482-I485 PolarHBondContact O-N 2.68Å
483Y83.5Confident83.8Confident43 Ų4327.6 Ų27.617%0.16915%0.152CC..G310 helixtrans-70-10.7-176.7-60.5-56.6000113.7F174 V176 I432 L436 P480 T481 I485 L486F174-Y483 AromaticContact CE1-CD1 3.65Å; F174-Y483 HydrophobicContact CE1-CD1 3.65Å; F174-Y483 AromaticContact CE1-CE1 3.47Å; F174-Y483 HydrophobicContact CE1-CE1 3.47Å; F174-Y483 VanDerWaalsContact CE1-CE1 3.47Å; F174-Y483 AromaticContact CZ-CD1 3.58Å; F174-Y483 HydrophobicContact CZ-CD1 3.58Å; F174-Y483 AromaticContact CZ-CE1 3.84Å; F174-Y483 HydrophobicContact CZ-CE1 3.84Å; V176-Y483 HydrophobicContact CG2-CD1 4.07Å; V176-Y483 HydrophobicContact CG2-CE1 4.11Å; I432-Y483 HydrophobicContact CG2-CD2 4.37Å; I432-Y483 HydrophobicContact CG2-CG 4.19Å; L436-Y483 HydrophobicContact CD1-CD2 3.51Å; L436-Y483 HydrophobicContact CD1-CE2 3.41Å; L436-Y483 VanDerWaalsContact CD1-CE2 3.41Å; L436-Y483 HydrophobicContact CD1-CG 4.16Å; L436-Y483 HydrophobicContact CD2-CD1 4.24Å; L436-Y483 HydrophobicContact CD2-CD2 4.31Å; L436-Y483 HydrophobicContact CD2-CE1 3.8Å; L436-Y483 HydrophobicContact CD2-CE2 3.8Å; L436-Y483 HydrophobicContact CD2-CG 4.48Å; L436-Y483 HydrophobicContact CG-CD2 4.45Å; L436-Y483 HydrophobicContact CG-CE2 4.24Å; P480-Y483 HydrophobicContact CB-CD2 3.88Å; P480-Y483 HydrophobicContact CB-CE2 3.68Å; P480-Y483 HydrophobicContact CG-CD2 4.25Å; P480-Y483 HydrophobicContact CG-CE2 3.71Å; P480-Y483 VanDerWaalsContact O-CD2 3.27Å; P480-Y483 WeakPolarHBondContact O-CD2 3.24Å; P480-Y483 PolarHBondContact O-N 2.79Å; T481-Y483 PolarHBondContact O-N 2.95Å; Y483-I485 PolarHBondContact O-N 2.91Å; Y483-L486 WeakPolarHBondContact O-CB 3.1Å; Y483-L486 PolarHBondContact O-N 2.97Å; Y483-L486 VanDerWaalsContact O-N 3.12Å
484F81.4Confident83.8Confident3 Ų327.6 Ų27.61%0.01315%0.152CC..G310 helixtrans-58.9-28.5170.395-88.7000113P181 P185 M238 I467 M470 L471 L474 T481 K482 L486 I487 M488P181-F484 HydrophobicContact CG-CE1 4.11Å; P181-F484 HydrophobicContact CG-CE2 4.48Å; P181-F484 HydrophobicContact CG-CZ 3.52Å; P185-F484 HydrophobicContact CG-CE1 4.3Å; P185-F484 HydrophobicContact CG-CE2 4.17Å; P185-F484 HydrophobicContact CG-CZ 3.7Å; M238-F484 HydrophobicContact SD-CE1 3.86Å; M238-F484 HydrophobicContact SD-CZ 4.44Å; I467-F484 HydrophobicContact CG2-CD2 3.48Å; I467-F484 VanDerWaalsContact CG2-CD2 3.48Å; I467-F484 HydrophobicContact CG2-CE2 3.61Å; M470-F484 HydrophobicContact CE-CB 3.6Å; L471-F484 HydrophobicContact CD2-CB 3.74Å; L471-F484 HydrophobicContact CD2-CD1 3.84Å; L471-F484 HydrophobicContact CD2-CD2 4.44Å; L471-F484 HydrophobicContact CD2-CE1 4.49Å; L471-F484 HydrophobicContact CD2-CG 3.76Å; L474-F484 HydrophobicContact CD1-CB 4.16Å; T481-F484 WeakPolarHBondContact O-CB 3.34Å; T481-F484 WeakPolarHBondContact O-CD1 3.34Å; T481-F484 PolarHBondContact O-N 2.91Å; K482-F484 PolarHBondContact O-N 3.23Å; K482-F484 VanDerWaalsContact O-N 3.17Å; F484-L486 PolarHBondContact O-N 2.93Å; F484-I487 VanDerWaalsContact O-CG1 3.3Å; F484-I487 WeakPolarHBondContact O-CG1 3.43Å; F484-I487 PolarHBondContact O-N 2.85Å; F484-M488 HydrophobicContact CD2-CE 4.31Å; F484-M488 HydrophobicContact CE2-CE 3.5Å; F484-M488 HydrophobicContact CZ-CE 3.86Å; F484-M488 PolarHBondContact O-N 2.72Å
485I79Confident83.7Confident18 Ų1827.9 Ų27.99%0.09215%0.154CC..G310 helixtrans-61.1-27.4179.1-61.6170.1000110.7P181 K482 Y483 I487 M488 P489P181-I485 HydrophobicContact CG-CD1 4.46Å; P181-I485 HydrophobicContact CG-CG1 4.46Å; K482-I485 WeakPolarHBondContact O-CB 3.26Å; K482-I485 WeakPolarHBondContact O-CG1 3.25Å; K482-I485 PolarHBondContact O-N 2.68Å; Y483-I485 PolarHBondContact O-N 2.91Å; I485-I487 VanDerWaalsContact C-N 3.29Å; I485-I487 PolarHBondContact O-N 2.89Å; I485-M488 HydrophobicContact CG1-CE 4.12Å; I485-M488 WeakPolarHBondContact O-CB 3.34Å; I485-M488 PolarHBondContact O-N 3.34Å; I485-P489 WeakPolarHBondContact O-CD 3.49Å
486L78.3Confident83.7Confident40 Ų4027.6 Ų27.621%0.20915%0.15CC..G310 helixtrans-56.8-40.9178.5-178.763000112.6F174 L333 Y431 Y483 F484F174-L486 HydrophobicContact CE2-CD2 3.87Å; F174-L486 HydrophobicContact CZ-CD2 4.32Å; L333-L486 VanDerWaalsContact CD1-O 3.28Å; L333-L486 WeakPolarHBondContact CD1-O 3.44Å; L333-L486 HydrophobicContact CD2-CD1 4.2Å; L333-L486 HydrophobicContact CD2-CG 4.04Å; L333-L486 WeakPolarHBondContact CD2-O 3.39Å; Y431-L486 HydrophobicContact CE1-CD2 3.68Å; Y431-L486 HydrophobicContact CE1-CG 4.28Å; Y483-L486 WeakPolarHBondContact O-CB 3.1Å; Y483-L486 PolarHBondContact O-N 2.97Å; Y483-L486 VanDerWaalsContact O-N 3.12Å; F484-L486 PolarHBondContact O-N 2.93Å
487I83.1Confident84Confident0 Ų027.4 Ų27.40%014%0.144CC..THydrogen-bonded Turntrans-97.6-11.3-174.765.9171.6000112.9Y336 Y424 A428 Y431 M470 F484 I485 P489 V490 D491Y336-I487 HydrophobicContact CD1-CB 4.45Å; Y336-I487 HydrophobicContact CD1-CG2 4.03Å; Y336-I487 HydrophobicContact CE1-CB 3.85Å; Y336-I487 HydrophobicContact CE1-CG2 3.77Å; Y336-I487 HydrophobicContact CE2-CG2 4.43Å; Y336-I487 HydrophobicContact CG-CG2 4.45Å; Y424-I487 WeakPolarHBondContact OH-CD1 3.48Å; A428-I487 HydrophobicContact CB-CD1 3.73Å; Y431-I487 HydrophobicContact CD1-CG2 3.97Å; Y431-I487 HydrophobicContact CE1-CG2 3.9Å; M470-I487 HydrophobicContact CE-CD1 3.52Å; M470-I487 HydrophobicContact CE-CG1 4.16Å; M470-I487 HydrophobicContact SD-CD1 3.23Å; M470-I487 WeakPolarHBondContact SD-CD1 3.03Å; M470-I487 HydrophobicContact SD-CG1 4.42Å; F484-I487 VanDerWaalsContact O-CG1 3.3Å; F484-I487 WeakPolarHBondContact O-CG1 3.43Å; F484-I487 PolarHBondContact O-N 2.85Å; I485-I487 VanDerWaalsContact C-N 3.29Å; I485-I487 PolarHBondContact O-N 2.89Å; I487-P489 VanDerWaalsContact C-N 3.3Å; I487-V490 VanDerWaalsContact O-CG2 3.22Å; I487-V490 WeakPolarHBondContact O-CG2 3.1Å; I487-V490 PolarHBondContact O-N 3.25Å; I487-D491 PolarHBondContact O-N 2.99Å
488M79.8Confident84.3Confident64 Ų6426.6 Ų26.632%0.31514%0.14SC..Hα-helixtrans-52.7-38.6-179.7-167-160.8-63.800113.5P181 I467 F484 I485 V490 D491P181-M488 HydrophobicContact CB-CE 3.98Å; P181-M488 HydrophobicContact CG-CE 3.89Å; I467-M488 HydrophobicContact CD1-CG 4.22Å; F484-M488 HydrophobicContact CD2-CE 4.31Å; F484-M488 HydrophobicContact CE2-CE 3.5Å; F484-M488 HydrophobicContact CZ-CE 3.86Å; F484-M488 PolarHBondContact O-N 2.72Å; I485-M488 HydrophobicContact CG1-CE 4.12Å; I485-M488 WeakPolarHBondContact O-CB 3.34Å; I485-M488 PolarHBondContact O-N 3.34Å; M488-V490 PolarHBondContact O-N 2.64Å; M488-V490 VanDerWaalsContact O-N 3.13Å; M488-D491 PolarHBondContact O-N 2.97Å
489P77.8Confident84.7Confident55 Ų5525.1 Ų25.136%0.35712%0.123SC..Hα-helixtrans-60.3-23.9178.6-26.536.1000114.7L333 I485 I487 W492L333-P489 HydrophobicContact CD1-CB 4.33Å; L333-P489 HydrophobicContact CD1-CG 4.44Å; I485-P489 WeakPolarHBondContact O-CD 3.49Å; I487-P489 VanDerWaalsContact C-N 3.3Å; P489-W492 PolarHBondContact O-NE1 3.23Å; P489-W492 VanDerWaalsContact O-NE1 3.14Å
490V80.9Confident85.1Confident7 Ų726.2 Ų26.24%0.04213%0.13CC..Hα-helixtrans-111.1-16.8-177.4-58.90000113.1L333 Y336 M337 I487 M488 W492 F493 L494L333-V490 HydrophobicContact CB-CG1 4.09Å; L333-V490 HydrophobicContact CD1-CG1 3.67Å; L333-V490 HydrophobicContact CD1-CG2 4.13Å; Y336-V490 HydrophobicContact CD1-CG2 3.93Å; Y336-V490 HydrophobicContact CE1-CG2 3.8Å; M337-V490 HydrophobicContact CE-CB 4.44Å; M337-V490 HydrophobicContact CE-CG1 4.48Å; M337-V490 HydrophobicContact CG-CB 3.91Å; M337-V490 HydrophobicContact CG-CG1 3.98Å; M337-V490 HydrophobicContact CG-CG2 3.98Å; M337-V490 HydrophobicContact SD-CB 3.77Å; M337-V490 HydrophobicContact SD-CG1 3.39Å; M337-V490 WeakPolarHBondContact SD-CG1 3.35Å; M337-V490 HydrophobicContact SD-CG2 4.45Å; I487-V490 VanDerWaalsContact O-CG2 3.22Å; I487-V490 WeakPolarHBondContact O-CG2 3.1Å; I487-V490 PolarHBondContact O-N 3.25Å; M488-V490 PolarHBondContact O-N 2.64Å; M488-V490 VanDerWaalsContact O-N 3.13Å; V490-W492 VanDerWaalsContact C-N 3.27Å; V490-W492 PolarHBondContact O-N 3.32Å; V490-F493 WeakPolarHBondContact O-CB 3.47Å; V490-F493 PolarHBondContact O-N 2.98Å; V490-L494 HydrophobicContact CG2-CD1 4.06Å; V490-L494 PolarHBondContact O-N 3.28Å; V490-L494 VanDerWaalsContact O-N 3.13Å
491D84.4Confident85.8Confident1 Ų124.9 Ų24.91%0.00512%0.121CC..Hα-helixtrans-56-41.6179.5173.768.1000111.8Y424 I467 I487 M488 F493 L494 D495 R498Y424-D491 VanDerWaalsContact CZ-OD1 3.3Å; Y424-D491 PolarHBondContact OH-OD1 2.98Å; I467-D491 HydrophobicContact CD1-CB 3.76Å; I467-D491 WeakPolarHBondContact CD1-OD2 3.32Å; I467-D491 HydrophobicContact CG1-CB 4.14Å; I467-D491 WeakPolarHBondContact CG1-OD2 3.13Å; I487-D491 PolarHBondContact O-N 2.99Å; M488-D491 PolarHBondContact O-N 2.97Å; D491-F493 PolarHBondContact O-N 2.91Å; D491-L494 PolarHBondContact O-N 3.44Å; D491-L494 VanDerWaalsContact O-N 3.1Å; D491-D495 WeakPolarHBondContact O-CB 3.19Å; D491-D495 PolarHBondContact O-N 3.14Å; D491-R498 IonicContact OD1-CZ 3.37Å; D491-R498 IonicContact OD1-NH1 2.81Å; D491-R498 PolarHBondContact OD1-NH1 3.31Å; D491-R498 VanDerWaalsContact OD1-NH1 3.14Å; D491-R498 IonicContact OD1-NH2 2.81Å; D491-R498 PolarHBondContact OD1-NH2 3.03Å; D491-R498 IonicContact OD2-NH2 3.59Å
492W81.5Confident86.5Confident52 Ų5224.6 Ų24.620%0.19712%0.119CC..Hα-helixtrans-54.9-30.5-179.979.2-85.8000113.1F323 P489 V490 R496F323-W492 HydrophobicContact CB-CH2 4.13Å; F323-W492 HydrophobicContact CB-CZ2 4.05Å; F323-W492 HydrophobicContact CD1-CZ2 4.37Å; F323-W492 HydrophobicContact CD2-CD2 4.47Å; F323-W492 AromaticContact CD2-CE2 3.28Å; F323-W492 AromaticContact CD2-CH2 3.84Å; F323-W492 HydrophobicContact CD2-CH2 3.84Å; F323-W492 AromaticContact CD2-CZ2 2.92Å; F323-W492 HydrophobicContact CD2-CZ2 2.92Å; F323-W492 AromaticContact CD2-NE1 3.43Å; F323-W492 AromaticContact CE2-CE2 3.53Å; F323-W492 HydrophobicContact CE2-CH2 4.37Å; F323-W492 AromaticContact CE2-CZ2 3.2Å; F323-W492 HydrophobicContact CE2-CZ2 3.2Å; F323-W492 AromaticContact CE2-NE1 3.38Å; F323-W492 HydrophobicContact CG-CH2 4.05Å; F323-W492 AromaticContact CG-CZ2 3.55Å; F323-W492 HydrophobicContact CG-CZ2 3.55Å; F323-W492 HydrophobicContact CZ-CZ2 4.03Å; P489-W492 PolarHBondContact O-NE1 3.23Å; P489-W492 VanDerWaalsContact O-NE1 3.14Å; V490-W492 VanDerWaalsContact C-N 3.27Å; V490-W492 PolarHBondContact O-N 3.32Å; W492-R496 VanDerWaalsContact O-CG 3.29Å; W492-R496 WeakPolarHBondContact O-CG 3.49Å
493F84.6Confident87.2Confident69 Ų6922.2 Ų22.230%0.30311%0.109SC..Hα-helixtrans-83.4-48.2177.2172.5-105000111M337 L341 V490 D491 D495 R496 I497M337-F493 HydrophobicContact CE-CD1 3.6Å; M337-F493 HydrophobicContact CE-CE1 3.92Å; L341-F493 HydrophobicContact CD1-CE1 4.04Å; L341-F493 HydrophobicContact CD2-CE1 3.96Å; V490-F493 WeakPolarHBondContact O-CB 3.47Å; V490-F493 PolarHBondContact O-N 2.98Å; D491-F493 PolarHBondContact O-N 2.91Å; F493-D495 VanDerWaalsContact C-N 3.25Å; F493-D495 PolarHBondContact O-N 3.3Å; F493-R496 WeakPolarHBondContact O-CB 3.48Å; F493-R496 WeakPolarHBondContact O-CG 3.4Å; F493-R496 PolarHBondContact O-N 3.1Å; F493-R496 VanDerWaalsContact O-N 3.17Å; F493-I497 HydrophobicContact CZ-CG1 4.49Å
494L90.4Very high87.9Confident0 Ų020.8 Ų20.80%010%0.104CC..Hα-helixtrans-61.6-35.8179.7-64.3175.6000111.5Y336 V340 L341 Y424 V490 D491 R496 I497 R498Y336-L494 HydrophobicContact CD1-CD1 4.35Å; Y336-L494 HydrophobicContact CE1-CD1 3.56Å; V340-L494 HydrophobicContact CB-CD1 4.26Å; V340-L494 HydrophobicContact CB-CD2 4.2Å; V340-L494 HydrophobicContact CG1-CD1 4.16Å; V340-L494 HydrophobicContact CG1-CD2 3.92Å; V340-L494 HydrophobicContact CG1-CG 4.44Å; V340-L494 HydrophobicContact CG2-CD1 4.33Å; L341-L494 HydrophobicContact CD2-CD2 3.83Å; L341-L494 HydrophobicContact CG-CD2 3.87Å; Y424-L494 HydrophobicContact CD2-CB 4.37Å; Y424-L494 HydrophobicContact CD2-CD1 4.25Å; Y424-L494 HydrophobicContact CE2-CB 4.27Å; Y424-L494 HydrophobicContact CE2-CD1 3.95Å; V490-L494 HydrophobicContact CG2-CD1 4.06Å; V490-L494 PolarHBondContact O-N 3.28Å; V490-L494 VanDerWaalsContact O-N 3.13Å; D491-L494 PolarHBondContact O-N 3.44Å; D491-L494 VanDerWaalsContact O-N 3.1Å; L494-R496 PolarHBondContact O-N 2.96Å; L494-I497 PolarHBondContact O-N 3.48Å; L494-R498 VanDerWaalsContact O-CB 3.22Å; L494-R498 WeakPolarHBondContact O-CB 3.35Å; L494-R498 PolarHBondContact O-N 2.87Å
495D89.5Confident88.7Confident7 Ų720.6 Ų20.64%0.03710%0.103CC..Hα-helixtrans-55.1-35.6176.2-169.937.5000112.8S382 Q464 D491 F493 R498 T499S382-D495 WeakPolarHBondContact CB-OD2 3.17Å; Q464-D495 PolarHBondContact N-OD2 2.9Å; D491-D495 WeakPolarHBondContact O-CB 3.19Å; D491-D495 PolarHBondContact O-N 3.14Å; F493-D495 VanDerWaalsContact C-N 3.25Å; F493-D495 PolarHBondContact O-N 3.3Å; D495-R498 VanDerWaalsContact CB-NH2 3.26Å; D495-R498 IonicContact OD1-CZ 3.91Å; D495-R498 VanDerWaalsContact OD1-CZ 3.31Å; D495-R498 IonicContact OD1-NE 2.97Å; D495-R498 PolarHBondContact OD1-NE 2.75Å; D495-R498 IonicContact OD1-NH2 3.33Å; D495-R498 PolarHBondContact OD1-NH2 3.34Å; D495-T499 VanDerWaalsContact O-CB 3.29Å; D495-T499 WeakPolarHBondContact O-CB 3.43Å; D495-T499 PolarHBondContact O-N 3.47Å; D495-T499 PolarHBondContact O-OG1 3.43Å
496R89.6Confident89.6Confident29 Ų2920 Ų2011%0.10910%0.1CC..Hα-helixtrans-69.4-46.7-179.8-44.2-168.1159.8-76.5-13.6111.4Q319 L379 G380 S382 W492 F493 L494 T500Q319-R496 VanDerWaalsContact CG-CZ 3.44Å; Q319-R496 VanDerWaalsContact CG-NH2 3.29Å; L379-R496 HydrophobicContact CD1-CB 3.96Å; L379-R496 PolarHBondContact O-NH1 3.39Å; L379-R496 VanDerWaalsContact O-NH1 3.13Å; G380-R496 PolarHBondContact O-NH1 2.99Å; S382-R496 WeakPolarHBondContact OG-CG 3.17Å; S382-R496 PolarHBondContact OG-NH1 3.35Å; S382-R496 VanDerWaalsContact OG-NH1 3.1Å; W492-R496 VanDerWaalsContact O-CG 3.29Å; W492-R496 WeakPolarHBondContact O-CG 3.49Å; F493-R496 WeakPolarHBondContact O-CB 3.48Å; F493-R496 WeakPolarHBondContact O-CG 3.4Å; F493-R496 PolarHBondContact O-N 3.1Å; F493-R496 VanDerWaalsContact O-N 3.17Å; L494-R496 PolarHBondContact O-N 2.96Å; R496-T500 WeakPolarHBondContact O-CB 3.31Å; R496-T500 PolarHBondContact O-N 2.98Å; R496-T500 PolarHBondContact O-OG1 3.47Å
497I94.1Very high90.5Very high29 Ų2918.1 Ų18.115%0.1499%0.09CC..Hα-helixtrans-68-46.7179.8-53-56.4000108.8L341 L344 L379 F493 L494 T499 T500 V501L341-I497 HydrophobicContact CD2-CB 4.48Å; L341-I497 HydrophobicContact CD2-CG1 4.11Å; L341-I497 HydrophobicContact CD2-CG2 4.4Å; L344-I497 HydrophobicContact CB-CG2 4.14Å; L344-I497 HydrophobicContact CD1-CB 4.02Å; L344-I497 HydrophobicContact CD1-CG2 3.77Å; L379-I497 HydrophobicContact CD1-CD1 3.79Å; F493-I497 HydrophobicContact CZ-CG1 4.49Å; L494-I497 PolarHBondContact O-N 3.48Å; I497-T499 PolarHBondContact O-N 2.84Å; I497-T500 WeakPolarHBondContact O-CA 3.08Å; I497-T500 WeakPolarHBondContact O-CB 3.32Å; I497-T500 PolarHBondContact O-N 3.45Å; I497-T500 VanDerWaalsContact O-N 3.09Å; I497-V501 HydrophobicContact CG2-CG2 4.47Å; I497-V501 WeakPolarHBondContact O-CG2 3.41Å; I497-V501 PolarHBondContact O-N 2.91Å
498R95.3Very high91.2Very high1 Ų118.1 Ų18.10%0.0049%0.09CC..Hα-helixtrans-50.6-53.6173.3165.1170.970.6-141.910.2112.1L344 G420 T421 Y424 D491 L494 D495 T500 V501 N502L344-R498 HydrophobicContact CD1-CB 4.4Å; G420-R498 VanDerWaalsContact C-CG 3.44Å; G420-R498 WeakPolarHBondContact O-CD 3.32Å; T421-R498 WeakPolarHBondContact OG1-CD 3.44Å; Y424-R498 VanDerWaalsContact CE1-NH1 3.26Å; Y424-R498 VanDerWaalsContact CE2-NH1 3.34Å; D491-R498 IonicContact OD1-CZ 3.37Å; D491-R498 IonicContact OD1-NH1 2.81Å; D491-R498 PolarHBondContact OD1-NH1 3.31Å; D491-R498 VanDerWaalsContact OD1-NH1 3.14Å; D491-R498 IonicContact OD1-NH2 2.81Å; D491-R498 PolarHBondContact OD1-NH2 3.03Å; D491-R498 IonicContact OD2-NH2 3.59Å; L494-R498 VanDerWaalsContact O-CB 3.22Å; L494-R498 WeakPolarHBondContact O-CB 3.35Å; L494-R498 PolarHBondContact O-N 2.87Å; D495-R498 VanDerWaalsContact CB-NH2 3.26Å; D495-R498 IonicContact OD1-CZ 3.91Å; D495-R498 VanDerWaalsContact OD1-CZ 3.31Å; D495-R498 IonicContact OD1-NE 2.97Å; D495-R498 PolarHBondContact OD1-NE 2.75Å; D495-R498 IonicContact OD1-NH2 3.33Å; D495-R498 PolarHBondContact OD1-NH2 3.34Å; R498-T500 VanDerWaalsContact C-N 3.28Å; R498-T500 PolarHBondContact O-N 3.14Å; R498-V501 PolarHBondContact O-N 2.95Å; R498-V501 VanDerWaalsContact O-N 3.15Å; R498-N502 VanDerWaalsContact O-CG 3.23Å; R498-N502 PolarHBondContact O-N 3.14Å; R498-N502 PolarHBondContact O-OD1 3.39Å
499T93.4Very high92Very high8 Ų815 Ų155%0.0498%0.075CC..Hα-helixtrans-62.4-38.6179.5-59.20000111.7A378 S382 D495 I497 V501 N502 V503A378-T499 HydrophobicContact CB-CG2 4.3Å; S382-T499 VanDerWaalsContact C-CG2 3.46Å; S382-T499 PolarHBondContact O-OG1 3.16Å; D495-T499 VanDerWaalsContact O-CB 3.29Å; D495-T499 WeakPolarHBondContact O-CB 3.43Å; D495-T499 PolarHBondContact O-N 3.47Å; D495-T499 PolarHBondContact O-OG1 3.43Å; I497-T499 PolarHBondContact O-N 2.84Å; T499-V501 VanDerWaalsContact C-N 3.35Å; T499-V501 PolarHBondContact O-N 2.99Å; T499-N502 PolarHBondContact O-N 3.14Å; T499-V503 HydrophobicContact CG2-CG2 4.49Å; T499-V503 WeakPolarHBondContact O-CG2 3.48Å; T499-V503 PolarHBondContact O-N 3.25Å
500T95.6Very high93Very high27 Ų2712.4 Ų12.417%0.1666%0.058CC..Hα-helixtrans-63.5-41.6176-54.30000111.5L375 L379 R496 I497 R498 F504L375-T500 HydrophobicContact CB-CG2 4.11Å; L375-T500 HydrophobicContact CD2-CG2 4.21Å; L379-T500 WeakPolarHBondContact CA-OG1 3.27Å; L379-T500 PolarHBondContact N-OG1 3.23Å; R496-T500 WeakPolarHBondContact O-CB 3.31Å; R496-T500 PolarHBondContact O-N 2.98Å; R496-T500 PolarHBondContact O-OG1 3.47Å; I497-T500 WeakPolarHBondContact O-CA 3.08Å; I497-T500 WeakPolarHBondContact O-CB 3.32Å; I497-T500 PolarHBondContact O-N 3.45Å; I497-T500 VanDerWaalsContact O-N 3.09Å; R498-T500 VanDerWaalsContact C-N 3.28Å; R498-T500 PolarHBondContact O-N 3.14Å; T500-F504 VanDerWaalsContact O-CB 3.24Å; T500-F504 WeakPolarHBondContact O-CB 3.43Å; T500-F504 PolarHBondContact O-N 3.38Å
501V97.3Very high93.8Very high7 Ų712.1 Ų12.14%0.0426%0.056CC..Hα-helixtrans-65.5-41.3175.3175.60000111.3L344 A348 L352 I497 R498 T499 F504 G505L344-V501 HydrophobicContact CB-CG2 4.19Å; L344-V501 HydrophobicContact CD2-CB 4.41Å; L344-V501 HydrophobicContact CD2-CG2 4.29Å; A348-V501 HydrophobicContact CB-CG2 3.97Å; L352-V501 HydrophobicContact CD1-CG1 4.4Å; I497-V501 HydrophobicContact CG2-CG2 4.47Å; I497-V501 WeakPolarHBondContact O-CG2 3.41Å; I497-V501 PolarHBondContact O-N 2.91Å; R498-V501 PolarHBondContact O-N 2.95Å; R498-V501 VanDerWaalsContact O-N 3.15Å; T499-V501 VanDerWaalsContact C-N 3.35Å; T499-V501 PolarHBondContact O-N 2.99Å; V501-F504 WeakPolarHBondContact O-CB 3.27Å; V501-F504 PolarHBondContact O-N 2.93Å; V501-G505 PolarHBondContact O-N 2.92Å
502N96.3Very high94.4Very high2 Ų212.2 Ų12.21%0.0116%0.057CC..Hα-helixtrans-60.6-51.2176.2-64.7-15000111.2M418 D419 G420 T421 R498 T499 F504 G505 D506M418-N502 VanDerWaalsContact C-OD1 3.27Å; D419-N502 PolarHBondContact N-OD1 2.89Å; G420-N502 WeakPolarHBondContact CA-OD1 3.34Å; G420-N502 PolarHBondContact N-OD1 3.4Å; T421-N502 PolarHBondContact OG1-ND2 3.28Å; R498-N502 VanDerWaalsContact O-CG 3.23Å; R498-N502 PolarHBondContact O-N 3.14Å; R498-N502 PolarHBondContact O-OD1 3.39Å; T499-N502 PolarHBondContact O-N 3.14Å; N502-F504 PolarHBondContact O-N 2.95Å; N502-G505 PolarHBondContact O-N 2.98Å; N502-D506 VanDerWaalsContact O-CG 3.32Å; N502-D506 PolarHBondContact O-N 3.32Å
503V96.8Very high95.2Very high4 Ų49.7 Ų9.72%0.0245%0.047CC..Hα-helixtrans-61.5-35.5177.4172.80000111.6L375 A378 T387 T391 T499 S507L375-V503 HydrophobicContact CD2-CG1 4.25Å; A378-V503 HydrophobicContact CB-CB 4.1Å; A378-V503 HydrophobicContact CB-CG1 4.38Å; A378-V503 HydrophobicContact CB-CG2 3.83Å; T387-V503 HydrophobicContact CG2-CG1 4.37Å; T391-V503 HydrophobicContact CG2-CG1 4.2Å; T499-V503 HydrophobicContact CG2-CG2 4.49Å; T499-V503 WeakPolarHBondContact O-CG2 3.48Å; T499-V503 PolarHBondContact O-N 3.25Å; V503-S507 VanDerWaalsContact O-CB 3.28Å; V503-S507 WeakPolarHBondContact O-CB 3.15Å; V503-S507 PolarHBondContact O-N 2.94Å
504F97.9Very high95.8Very high13 Ų137.4 Ų7.46%0.0574%0.037CC..Hα-helixtrans-65-49.5174.3-174.7-117.8000111.7A348 L352 P353 T368 I371 L375 T500 V501 N502 S507 L508A348-F504 HydrophobicContact CB-CD1 4.41Å; A348-F504 WeakPolarHBondContact O-CE1 3.46Å; L352-F504 HydrophobicContact CB-CD1 4.42Å; L352-F504 HydrophobicContact CB-CE1 4.12Å; L352-F504 HydrophobicContact CD1-CD1 3.72Å; L352-F504 HydrophobicContact CD1-CE1 4.25Å; P353-F504 HydrophobicContact CG-CE1 4.47Å; T368-F504 HydrophobicContact CG2-CD2 4.48Å; T368-F504 HydrophobicContact CG2-CE2 3.72Å; T368-F504 HydrophobicContact CG2-CZ 4.37Å; T368-F504 VanDerWaalsContact OG1-CE2 3.25Å; T368-F504 WeakPolarHBondContact OG1-CE2 3.42Å; T368-F504 WeakPolarHBondContact OG1-CZ 3.11Å; I371-F504 HydrophobicContact CD1-CD2 3.65Å; I371-F504 HydrophobicContact CD1-CE2 3.96Å; L375-F504 HydrophobicContact CD1-CD2 3.93Å; L375-F504 HydrophobicContact CD2-CB 3.76Å; L375-F504 HydrophobicContact CD2-CD2 4.1Å; L375-F504 HydrophobicContact CD2-CG 4.41Å; T500-F504 VanDerWaalsContact O-CB 3.24Å; T500-F504 WeakPolarHBondContact O-CB 3.43Å; T500-F504 PolarHBondContact O-N 3.38Å; V501-F504 WeakPolarHBondContact O-CB 3.27Å; V501-F504 PolarHBondContact O-N 2.93Å; N502-F504 PolarHBondContact O-N 2.95Å; F504-S507 PolarHBondContact O-N 3.44Å; F504-L508 HydrophobicContact CD1-CD1 4.5Å; F504-L508 HydrophobicContact CD1-CD2 4.26Å; F504-L508 HydrophobicContact CD2-CD1 3.63Å; F504-L508 HydrophobicContact CE1-CD1 4.19Å; F504-L508 HydrophobicContact CE1-CD2 3.56Å; F504-L508 HydrophobicContact CE2-CD1 3.26Å; F504-L508 HydrophobicContact CE2-CD2 4.08Å; F504-L508 HydrophobicContact CE2-CG 4.34Å; F504-L508 HydrophobicContact CG-CD1 4.24Å; F504-L508 HydrophobicContact CZ-CD1 3.59Å; F504-L508 HydrophobicContact CZ-CD2 3.46Å; F504-L508 VanDerWaalsContact CZ-CD2 3.46Å; F504-L508 HydrophobicContact CZ-CG 4.2Å; F504-L508 VanDerWaalsContact O-CD1 3.31Å; F504-L508 WeakPolarHBondContact O-CD1 3.26Å; F504-L508 PolarHBondContact O-N 3.43Å
505G97.5Very high96.1Very high0 Ų011.2 Ų11.20%05%0.054CC..Hα-helixtrans-56-50.9175.400000112Y146 V501 N502 S507 L508 G509Y146-G505 PolarHBondContact OH-O 3.09Å; Y146-G505 VanDerWaalsContact OH-O 3.07Å; V501-G505 PolarHBondContact O-N 2.92Å; N502-G505 PolarHBondContact O-N 2.98Å; G505-S507 VanDerWaalsContact C-N 3.31Å; G505-S507 PolarHBondContact O-N 2.69Å; G505-L508 PolarHBondContact O-N 3.47Å; G505-G509 PolarHBondContact O-N 3.19Å
506D97.2Very high96.4Very high5 Ų513.9 Ų13.93%0.0277%0.068CC..Hα-helixtrans-57-44.4176.9-69.6-18.1000112.2L410 G413 A414 N417 N502 G509 A510L410-D506 HydrophobicContact CD2-CB 4.02Å; L410-D506 VanDerWaalsContact CD2-O 3.24Å; L410-D506 WeakPolarHBondContact CD2-O 2.91Å; G413-D506 WeakPolarHBondContact CA-OD1 3.26Å; A414-D506 PolarHBondContact N-OD2 3.07Å; N417-D506 WeakPolarHBondContact CB-OD1 2.98Å; N417-D506 PolarHBondContact ND2-OD1 2.98Å; N502-D506 VanDerWaalsContact O-CG 3.32Å; N502-D506 PolarHBondContact O-N 3.32Å; D506-G509 PolarHBondContact O-N 3.25Å; D506-A510 PolarHBondContact O-N 2.98Å
507S98Very high96.7Very high0 Ų012.5 Ų12.50%06%0.063CC..Hα-helixtrans-64.9-45.2179.9-174.30000112.1Y367 I371 C395 V503 F504 G505 G509 A510 G511Y367-S507 WeakPolarHBondContact CE1-O 3.28Å; Y367-S507 WeakPolarHBondContact CE1-OG 3.48Å; Y367-S507 PolarHBondContact OH-O 3.41Å; I371-S507 VanDerWaalsContact CD1-OG 3.28Å; I371-S507 WeakPolarHBondContact CD1-OG 2.98Å; I371-S507 WeakPolarHBondContact CG2-OG 3.21Å; C395-S507 PolarHBondContact SG-OG 2.92Å; V503-S507 VanDerWaalsContact O-CB 3.28Å; V503-S507 WeakPolarHBondContact O-CB 3.15Å; V503-S507 PolarHBondContact O-N 2.94Å; F504-S507 PolarHBondContact O-N 3.44Å; G505-S507 VanDerWaalsContact C-N 3.31Å; G505-S507 PolarHBondContact O-N 2.69Å; S507-G509 VanDerWaalsContact C-N 3.33Å; S507-A510 PolarHBondContact O-N 3.02Å; S507-G511 PolarHBondContact O-N 3.49Å
508L97.8Very high96.7Very high0 Ų013.9 Ų13.90%07%0.07CC..Hα-helixtrans-65.9-40.3176.1-90.659.7000110.7L352 M356 Y367 I371 F504 G505 A510 G511 I512L352-L508 HydrophobicContact CB-CD2 3.81Å; M356-L508 HydrophobicContact CB-CD2 4.27Å; M356-L508 HydrophobicContact CB-CG 4.46Å; Y367-L508 HydrophobicContact CD1-CD1 3.63Å; Y367-L508 HydrophobicContact CD1-CG 4.27Å; Y367-L508 HydrophobicContact CE1-CD1 3.8Å; Y367-L508 HydrophobicContact CE1-CG 4.4Å; I371-L508 HydrophobicContact CD1-CD1 3.98Å; F504-L508 HydrophobicContact CD1-CD1 4.5Å; F504-L508 HydrophobicContact CD1-CD2 4.26Å; F504-L508 HydrophobicContact CD2-CD1 3.63Å; F504-L508 HydrophobicContact CE1-CD1 4.19Å; F504-L508 HydrophobicContact CE1-CD2 3.56Å; F504-L508 HydrophobicContact CE2-CD1 3.26Å; F504-L508 HydrophobicContact CE2-CD2 4.08Å; F504-L508 HydrophobicContact CE2-CG 4.34Å; F504-L508 HydrophobicContact CG-CD1 4.24Å; F504-L508 HydrophobicContact CZ-CD1 3.59Å; F504-L508 HydrophobicContact CZ-CD2 3.46Å; F504-L508 VanDerWaalsContact CZ-CD2 3.46Å; F504-L508 HydrophobicContact CZ-CG 4.2Å; F504-L508 VanDerWaalsContact O-CD1 3.31Å; F504-L508 WeakPolarHBondContact O-CD1 3.26Å; F504-L508 PolarHBondContact O-N 3.43Å; G505-L508 PolarHBondContact O-N 3.47Å; L508-A510 PolarHBondContact O-N 3.31Å; L508-G511 CarbonylContact O-C 3.59Å; L508-G511 WeakPolarHBondContact O-CA 3.47Å; L508-G511 PolarHBondContact O-N 3.43Å; L508-I512 WeakPolarHBondContact O-CG1 3.43Å; L508-I512 PolarHBondContact O-N 2.9Å
509G97.2Very high96.7Very high0 Ų018.9 Ų18.90%010%0.096CC..Hα-helixtrans-53.1-48.7172.600000112.6Y146 G505 D506 S507 G511 I512 V513Y146-G509 PolarHBondContact OH-N 3.04Å; G505-G509 PolarHBondContact O-N 3.19Å; D506-G509 PolarHBondContact O-N 3.25Å; S507-G509 VanDerWaalsContact C-N 3.33Å; G509-G511 VanDerWaalsContact C-N 3.26Å; G509-G511 PolarHBondContact O-N 3Å; G509-I512 PolarHBondContact O-N 3.45Å; G509-I512 VanDerWaalsContact O-N 3.13Å; G509-V513 WeakPolarHBondContact O-CB 3.43Å; G509-V513 VanDerWaalsContact O-CG2 3.3Å; G509-V513 WeakPolarHBondContact O-CG2 3.43Å; G509-V513 PolarHBondContact O-N 3.04Å
510A97.5Very high96.6Very high0 Ų021.2 Ų21.20%011%0.105CC..Hα-helixtrans-58.5-38.8174.400000112.5V401 V405 T406 V409 L410 D506 S507 L508 H514V401-A510 HydrophobicContact CG1-CB 4.41Å; V401-A510 WeakPolarHBondContact CG1-O 3.38Å; V405-A510 WeakPolarHBondContact CG1-O 3.41Å; T406-A510 HydrophobicContact CG2-CB 4.44Å; V409-A510 HydrophobicContact CB-CB 4.33Å; V409-A510 HydrophobicContact CG1-CB 4.02Å; L410-A510 HydrophobicContact CD2-CB 3.83Å; L410-A510 HydrophobicContact CG-CB 4.09Å; D506-A510 PolarHBondContact O-N 2.98Å; S507-A510 PolarHBondContact O-N 3.02Å; L508-A510 PolarHBondContact O-N 3.31Å; A510-H514 WeakPolarHBondContact O-CB 3.43Å; A510-H514 PolarHBondContact O-N 3.3Å
511G97.8Very high96.4Very high0 Ų020.1 Ų20.10%010%0.098CC..Hα-helixtrans-66.1-41.1174.800000113.4Y367 S507 L508 G509 K515Y367-G511 PolarHBondContact OH-N 3.19Å; S507-G511 PolarHBondContact O-N 3.49Å; L508-G511 CarbonylContact O-C 3.59Å; L508-G511 WeakPolarHBondContact O-CA 3.47Å; L508-G511 PolarHBondContact O-N 3.43Å; G509-G511 VanDerWaalsContact C-N 3.26Å; G509-G511 PolarHBondContact O-N 3Å; G511-K515 PolarHBondContact O-N 3.21Å; G511-K515 VanDerWaalsContact O-N 3.15Å
512I97.9Very high96.2Very high3 Ų324.7 Ų24.72%0.01512%0.12CC..Hα-helixtrans-70.3-50.2179.1-68.5165000110.6Y146 L355 M356 V359 L508 G509 H514 K515 L516Y146-I512 HydrophobicContact CD2-CD1 4.32Å; Y146-I512 HydrophobicContact CD2-CG2 4.35Å; Y146-I512 HydrophobicContact CE2-CD1 3.58Å; L355-I512 HydrophobicContact CB-CD1 4Å; M356-I512 HydrophobicContact CB-CD1 4.48Å; M356-I512 HydrophobicContact SD-CG1 3.93Å; V359-I512 HydrophobicContact CB-CG2 4.07Å; V359-I512 HydrophobicContact CG1-CG2 3.69Å; L508-I512 WeakPolarHBondContact O-CG1 3.43Å; L508-I512 PolarHBondContact O-N 2.9Å; G509-I512 PolarHBondContact O-N 3.45Å; G509-I512 VanDerWaalsContact O-N 3.13Å; I512-H514 VanDerWaalsContact C-N 3.29Å; I512-H514 PolarHBondContact O-N 3.49Å; I512-K515 WeakPolarHBondContact O-CA 3.42Å; I512-K515 WeakPolarHBondContact O-CB 3.46Å; I512-K515 PolarHBondContact O-N 3.46Å; I512-L516 HydrophobicContact CG2-CD1 4.14Å; I512-L516 WeakPolarHBondContact O-CG 3.19Å; I512-L516 PolarHBondContact O-N 3.41Å
513V97.3Very high96Very high0 Ų030.1 Ų30.10%014%0.144CC..Hα-helixtrans-59-42.4176.9173.50000110.2L139 V405 V409 G509 K515 L516 C517L139-V513 HydrophobicContact CD1-CG1 3.65Å; V405-V513 HydrophobicContact CG1-CB 4.17Å; V405-V513 HydrophobicContact CG1-CG1 3.97Å; V409-V513 HydrophobicContact CG2-CB 4.28Å; V409-V513 HydrophobicContact CG2-CG1 3.95Å; G509-V513 WeakPolarHBondContact O-CB 3.43Å; G509-V513 VanDerWaalsContact O-CG2 3.3Å; G509-V513 WeakPolarHBondContact O-CG2 3.43Å; G509-V513 PolarHBondContact O-N 3.04Å; V513-K515 VanDerWaalsContact C-N 3.29Å; V513-K515 PolarHBondContact O-N 3.33Å; V513-L516 PolarHBondContact O-N 3.45Å; V513-L516 VanDerWaalsContact O-N 3.15Å; V513-C517 WeakPolarHBondContact O-CB 3.25Å; V513-C517 PolarHBondContact O-N 3.14Å; V513-C517 PolarHBondContact O-SG 3.21Å; V513-C517 VanDerWaalsContact O-SG 3.37Å
514H97.1Very high95.6Very high20 Ų2030.1 Ų30.19%0.09314%0.144CC..Hα-helixtrans-57.1-44.1173.1173.6-162.5000111.7V401 D402 V405 A510 I512 L516 C517 I518V401-H514 WeakPolarHBondContact CA-ND1 3.44Å; V401-H514 HydrophobicContact CG1-CB 3.73Å; D402-H514 PolarHBondContact N-CE1 3.49Å; D402-H514 PolarHBondContact N-ND1 3.25Å; V405-H514 HydrophobicContact CB-CB 4.29Å; V405-H514 HydrophobicContact CG1-CB 4.06Å; V405-H514 HydrophobicContact CG2-CB 4.03Å; A510-H514 WeakPolarHBondContact O-CB 3.43Å; A510-H514 PolarHBondContact O-N 3.3Å; I512-H514 VanDerWaalsContact C-N 3.29Å; I512-H514 PolarHBondContact O-N 3.49Å; H514-L516 VanDerWaalsContact C-N 3.33Å; H514-L516 PolarHBondContact O-N 3.13Å; H514-C517 PolarHBondContact O-N 3.01Å; H514-I518 PolarHBondContact O-N 2.96Å
515K97Very high95.2Very high80 Ų8032.7 Ų32.735%0.34816%0.158SC..Hα-helixtrans-62-40.9177.5178.959.9-176.4171.40112.4G360 G511 I512 V513 I518G360-K515 WeakPolarHBondContact O-CG 3.42Å; G511-K515 PolarHBondContact O-N 3.21Å; G511-K515 VanDerWaalsContact O-N 3.15Å; I512-K515 WeakPolarHBondContact O-CA 3.42Å; I512-K515 WeakPolarHBondContact O-CB 3.46Å; I512-K515 PolarHBondContact O-N 3.46Å; V513-K515 VanDerWaalsContact C-N 3.29Å; V513-K515 PolarHBondContact O-N 3.33Å; K515-I518 WeakPolarHBondContact O-CG2 3.3Å
516L96.5Very high94.8Very high63 Ų6337.7 Ų37.733%0.3318%0.181SC..Hα-helixtrans-68.8-37.9178.5-65.8173.6000111.9Y142 V359 I512 V513 H514Y142-L516 HydrophobicContact CD1-CB 4.21Å; Y142-L516 HydrophobicContact CD1-CD1 3.84Å; Y142-L516 HydrophobicContact CD2-CB 4.4Å; Y142-L516 HydrophobicContact CE1-CB 4.4Å; Y142-L516 HydrophobicContact CE1-CD1 4.41Å; Y142-L516 HydrophobicContact CG-CB 4.21Å; Y142-L516 HydrophobicContact CG-CD1 4.3Å; V359-L516 HydrophobicContact CG1-CD1 4.18Å; V359-L516 HydrophobicContact CG1-CD2 3.83Å; V359-L516 HydrophobicContact CG1-CG 4.18Å; I512-L516 HydrophobicContact CG2-CD1 4.14Å; I512-L516 WeakPolarHBondContact O-CG 3.19Å; I512-L516 PolarHBondContact O-N 3.41Å; V513-L516 PolarHBondContact O-N 3.45Å; V513-L516 VanDerWaalsContact O-N 3.15Å; H514-L516 VanDerWaalsContact C-N 3.33Å; H514-L516 PolarHBondContact O-N 3.13Å
517C95.4Very high94.4Very high0 Ų040.9 Ų40.90%020%0.196CC..Hα-helixtrans-87.5-6.7-176.6-64.60000114.6L139 Y142 V513 H514 N519 Y520 L521L139-C517 HydrophobicContact CD1-CB 4.41Å; Y142-C517 VanDerWaalsContact CD2-SG 3.52Å; V513-C517 WeakPolarHBondContact O-CB 3.25Å; V513-C517 PolarHBondContact O-N 3.14Å; V513-C517 PolarHBondContact O-SG 3.21Å; V513-C517 VanDerWaalsContact O-SG 3.37Å; H514-C517 PolarHBondContact O-N 3.01Å; C517-N519 VanDerWaalsContact C-N 3.27Å; C517-N519 PolarHBondContact O-N 2.93Å; C517-N519 VanDerWaalsContact O-N 3.1Å; C517-Y520 WeakPolarHBondContact O-CA 3.24Å; C517-Y520 WeakPolarHBondContact O-CB 3.25Å; C517-Y520 PolarHBondContact O-N 2.92Å; C517-L521 HydrophobicContact CB-CD1 4.32Å; C517-L521 HydrophobicContact CB-CG 4.32Å; C517-L521 WeakPolarHBondContact O-CG 3.39Å; C517-L521 PolarHBondContact O-N 3.28Å
518I94.7Very high93.7Very high59 Ų5946 Ų4630%0.30322%0.215SC..Hα-helixtrans-52.7-41.1-169.7-163169000113.7H514 K515 Y520 L521 M522H514-I518 PolarHBondContact O-N 2.96Å; K515-I518 WeakPolarHBondContact O-CG2 3.3Å; I518-Y520 VanDerWaalsContact C-N 3.34Å; I518-Y520 PolarHBondContact O-N 3.49Å; I518-L521 PolarHBondContact O-N 2.79Å; I518-M522 HydrophobicContact CG1-SD 4.49Å; I518-M522 VanDerWaalsContact O-CG 3.32Å; I518-M522 WeakPolarHBondContact O-CG 3.39Å; I518-M522 PolarHBondContact O-N 3.01Å
519N94Very high93.1Very high105 Ų10549 Ų4956%0.56124%0.24SC*.Hα-helixtrans-69.2-33.7179.9-66.9-24.4000112.2C517 K523C517-N519 VanDerWaalsContact C-N 3.27Å; C517-N519 PolarHBondContact O-N 2.93Å; C517-N519 VanDerWaalsContact O-N 3.1Å; N519-K523 VanDerWaalsContact O-CG 3.25Å; N519-K523 WeakPolarHBondContact O-CG 3.34Å; N519-K523 PolarHBondContact O-N 3.2Å; N519-K523 VanDerWaalsContact O-N 3.14Å
520Y92.3Very high92.6Very high57 Ų5755.4 Ų55.422%0.22427%0.265CS..Hα-helixtrans-73.2-40.3177.1-60.3-89.3000110.8T135 E138 Y142 C517 I518 K523 S524T135-Y520 PolarHBondContact OG1-O 3.16Å; E138-Y520 HydrophobicContact CB-CD1 4.4Å; E138-Y520 HydrophobicContact CB-CE1 4.43Å; E138-Y520 HydrophobicContact CG-CD1 3.93Å; E138-Y520 HydrophobicContact CG-CE1 3.71Å; Y142-Y520 HydrophobicContact CE2-CE2 4.06Å; C517-Y520 WeakPolarHBondContact O-CA 3.24Å; C517-Y520 WeakPolarHBondContact O-CB 3.25Å; C517-Y520 PolarHBondContact O-N 2.92Å; I518-Y520 VanDerWaalsContact C-N 3.34Å; I518-Y520 PolarHBondContact O-N 3.49Å; Y520-K523 PolarHBondContact O-N 3.04Å; Y520-S524 WeakPolarHBondContact O-CB 2.98Å; Y520-S524 PolarHBondContact O-N 2.59Å
521L91.7Very high91.9Very high4 Ų462.3 Ų62.32%0.02129%0.291CS..Hα-helixtrans-60.6-47.2174.7-64.5172.9000111.4L131 T135 D402 R404 V405 C517 I518 K523 S524 D525L131-L521 HydrophobicContact CD2-CD2 3.82Å; T135-L521 HydrophobicContact CG2-CD2 4.07Å; D402-L521 HydrophobicContact CB-CD1 4.04Å; R404-L521 HydrophobicContact CB-CD2 4.38Å; V405-L521 HydrophobicContact CG2-CD1 3.8Å; C517-L521 HydrophobicContact CB-CD1 4.32Å; C517-L521 HydrophobicContact CB-CG 4.32Å; C517-L521 WeakPolarHBondContact O-CG 3.39Å; C517-L521 PolarHBondContact O-N 3.28Å; I518-L521 PolarHBondContact O-N 2.79Å; L521-K523 PolarHBondContact O-N 3.16Å; L521-S524 WeakPolarHBondContact O-CB 3.31Å; L521-S524 PolarHBondContact O-N 3.43Å; L521-D525 PolarHBondContact O-N 3.04Å
522M93.3Very high91Very high104 Ų10464.8 Ų64.851%0.51231%0.311SS..Hα-helixtrans-60.3-44.3176.1-71.7178.267.800112.3I518 S524 D525 E526I518-M522 HydrophobicContact CG1-SD 4.49Å; I518-M522 VanDerWaalsContact O-CG 3.32Å; I518-M522 WeakPolarHBondContact O-CG 3.39Å; I518-M522 PolarHBondContact O-N 3.01Å; M522-S524 VanDerWaalsContact C-N 3.33Å; M522-S524 PolarHBondContact O-N 3.36Å; M522-D525 PolarHBondContact O-N 2.88Å; M522-E526 WeakPolarHBondContact O-CG 3.46Å; M522-E526 PolarHBondContact O-N 3.08Å
523K91.4Very high90.3Very high116 Ų11668.1 Ų68.150%0.50433%0.334SS..Hα-helixtrans-61.6-41.1175.5-75.3174.1-178.4-178.20112.3N519 Y520 L521 D525 E526 E527N519-K523 VanDerWaalsContact O-CG 3.25Å; N519-K523 WeakPolarHBondContact O-CG 3.34Å; N519-K523 PolarHBondContact O-N 3.2Å; N519-K523 VanDerWaalsContact O-N 3.14Å; Y520-K523 PolarHBondContact O-N 3.04Å; L521-K523 PolarHBondContact O-N 3.16Å; K523-D525 VanDerWaalsContact C-N 3.28Å; K523-D525 PolarHBondContact O-N 3.26Å; K523-E526 PolarHBondContact O-N 2.94Å; K523-E527 WeakPolarHBondContact O-CB 3.43Å; K523-E527 WeakPolarHBondContact O-CG 3.36Å; K523-E527 PolarHBondContact O-N 3.18Å
524S87.9Confident89.4Confident4 Ų473.7 Ų73.73%0.02836%0.363CS..Hα-helixtrans-61.3-38.2175.8-169.50000111.5N132 Y520 L521 M522 R528N132-S524 PolarHBondContact N-OG 3.02Å; Y520-S524 WeakPolarHBondContact O-CB 2.98Å; Y520-S524 PolarHBondContact O-N 2.59Å; L521-S524 WeakPolarHBondContact O-CB 3.31Å; L521-S524 PolarHBondContact O-N 3.43Å; M522-S524 VanDerWaalsContact C-N 3.33Å; M522-S524 PolarHBondContact O-N 3.36Å; S524-R528 WeakPolarHBondContact O-CB 3.38Å; S524-R528 PolarHBondContact O-N 3.04Å; S524-R528 VanDerWaalsContact O-N 3.08Å
525D89.4Confident88.1Confident67 Ų6776.7 Ų76.736%0.35838%0.383SS..Hα-helixtrans-68.6-42.4176.3-67.6-30.1000112R404 L521 M522 K523 R528 A529R404-D525 IonicContact CZ-OD1 3.6Å; R404-D525 IonicContact CZ-OD2 2.69Å; R404-D525 IonicContact NH1-OD1 3.14Å; R404-D525 PolarHBondContact NH1-OD1 3.25Å; R404-D525 IonicContact NH1-OD2 3.36Å; R404-D525 PolarHBondContact NH1-OD2 3.26Å; R404-D525 IonicContact NH2-OD1 2.96Å; R404-D525 IonicContact NH2-OD2 3.41Å; R404-D525 PolarHBondContact NH2-OD2 3.33Å; L521-D525 PolarHBondContact O-N 3.04Å; M522-D525 PolarHBondContact O-N 2.88Å; K523-D525 VanDerWaalsContact C-N 3.28Å; K523-D525 PolarHBondContact O-N 3.26Å; D525-R528 PolarHBondContact O-N 2.94Å; D525-A529 WeakPolarHBondContact O-CB 3.34Å; D525-A529 PolarHBondContact O-N 3.49Å
526E90.4Very high86.6Confident104 Ų10478.5 Ų78.549%0.48640%0.396SS..Hα-helixtrans-63.8-41.2175.8-71.5172.7-17300112.8M522 K523 R530M522-E526 WeakPolarHBondContact O-CG 3.46Å; M522-E526 PolarHBondContact O-N 3.08Å; K523-E526 PolarHBondContact O-N 2.94Å; E526-R530 WeakPolarHBondContact O-CB 3.4Å; E526-R530 WeakPolarHBondContact O-CG 3.5Å; E526-R530 PolarHBondContact O-N 2.96Å; E526-R530 PolarHBondContact O-NE 2.93Å
527E87Confident84.6Confident72 Ų7277.1 Ų77.134%0.33640%0.397SS..Hα-helixtrans-63.5-42.8174.7-75.9174.3-167.200111.4N132 K523 R530 R531N132-E527 PolarHBondContact ND2-OE2 3.33Å; K523-E527 WeakPolarHBondContact O-CB 3.43Å; K523-E527 WeakPolarHBondContact O-CG 3.36Å; K523-E527 PolarHBondContact O-N 3.18Å; E527-R530 PolarHBondContact O-N 3.12Å; E527-R531 WeakPolarHBondContact O-CG 3.42Å; E527-R531 PolarHBondContact O-N 2.77Å
528R83Confident82.5Confident107 Ų10781.4 Ų81.440%0.40443%0.425SS..Hα-helixtrans-65.3-44.6177.3-173.1178.9-177.9-177.34112.1S524 D525 R530 R531 A532S524-R528 WeakPolarHBondContact O-CB 3.38Å; S524-R528 PolarHBondContact O-N 3.04Å; S524-R528 VanDerWaalsContact O-N 3.08Å; D525-R528 PolarHBondContact O-N 2.94Å; R528-R530 VanDerWaalsContact C-N 3.29Å; R528-R530 PolarHBondContact O-N 2.96Å; R528-R531 PolarHBondContact O-N 3.17Å; R528-A532 PolarHBondContact O-N 3.08Å
529A86.4Confident80.1Confident63 Ų6383.3 Ų83.352%0.52144%0.439SS..Hα-helixtrans-60.6-40.5176.200000111.5D525 A532 S533D525-A529 WeakPolarHBondContact O-CB 3.34Å; D525-A529 PolarHBondContact O-N 3.49Å; A529-A532 PolarHBondContact O-N 3.37Å; A529-S533 PolarHBondContact O-N 3.24Å
530R87.4Confident77.5Confident136 Ų13688.3 Ų88.351%0.51345%0.45SS..Hα-helixtrans-62.3-47.7173.4-79.8-179.6-76.1-162.8-2.6112.2E526 E527 R528 A532 S533 I534E526-R530 WeakPolarHBondContact O-CB 3.4Å; E526-R530 WeakPolarHBondContact O-CG 3.5Å; E526-R530 PolarHBondContact O-N 2.96Å; E526-R530 PolarHBondContact O-NE 2.93Å; E527-R530 PolarHBondContact O-N 3.12Å; R528-R530 VanDerWaalsContact C-N 3.29Å; R528-R530 PolarHBondContact O-N 2.96Å; R530-A532 PolarHBondContact O-N 3.46Å; R530-S533 PolarHBondContact O-N 2.94Å; R530-S533 PolarHBondContact O-OG 3.36Å; R530-I534 WeakPolarHBondContact O-CG1 3.44Å; R530-I534 PolarHBondContact O-N 3.12Å; R530-I534 VanDerWaalsContact O-N 3.07Å
531R81.2Confident74.7Confident145 Ų14593.6 Ų93.655%0.54748%0.475SS..Hα-helixtrans-58.7-46.5176.9-72.7-178-174.3-150.20.5111.9E280 E527 R528 S533 I534 V535E280-R531 IonicContact OE1-NH1 2.96Å; E280-R531 PolarHBondContact OE1-NH1 3.28Å; E527-R531 WeakPolarHBondContact O-CG 3.42Å; E527-R531 PolarHBondContact O-N 2.77Å; R528-R531 PolarHBondContact O-N 3.17Å; R531-S533 VanDerWaalsContact C-N 3.3Å; R531-S533 PolarHBondContact O-N 3.13Å; R531-I534 PolarHBondContact O-N 3.4Å; R531-I534 VanDerWaalsContact O-N 3.13Å; R531-V535 WeakPolarHBondContact O-CG2 3.01Å; R531-V535 PolarHBondContact O-N 2.7Å; R531-V535 VanDerWaalsContact O-N 3.08Å
532A79.4Confident71.8Confident52 Ų52103.7 Ų103.743%0.4351%0.512SS..Hα-helixtrans-58.2-42.7176.600000111.9R528 A529 R530 I534 V535 D536R528-A532 PolarHBondContact O-N 3.08Å; A529-A532 PolarHBondContact O-N 3.37Å; R530-A532 PolarHBondContact O-N 3.46Å; A532-I534 VanDerWaalsContact C-N 3.31Å; A532-I534 PolarHBondContact O-N 3.49Å; A532-V535 PolarHBondContact O-N 3.2Å; A532-D536 PolarHBondContact O-N 3.23Å; A532-D536 VanDerWaalsContact O-N 3.13Å
533S83.5Confident69.1Low72 Ų72106.6 Ų106.650%0.50353%0.527SS..Hα-helixtrans-67-2817872.90000114.4A529 R530 R531 G537A529-S533 PolarHBondContact O-N 3.24Å; R530-S533 PolarHBondContact O-N 2.94Å; R530-S533 PolarHBondContact O-OG 3.36Å; R531-S533 VanDerWaalsContact C-N 3.3Å; R531-S533 PolarHBondContact O-N 3.13Å; S533-G537 WeakPolarHBondContact O-CA 3.39Å; S533-G537 PolarHBondContact O-N 3.13Å; S533-G537 VanDerWaalsContact O-N 3.12Å
534I78.8Confident66.4Low118 Ų118106.4 Ų106.461%0.60554%0.536SS*.Hα-helixtrans-76.7-41.1177.6-67.5165000110.5R530 R531 A532 G537 P538R530-I534 WeakPolarHBondContact O-CG1 3.44Å; R530-I534 PolarHBondContact O-N 3.12Å; R530-I534 VanDerWaalsContact O-N 3.07Å; R531-I534 PolarHBondContact O-N 3.4Å; R531-I534 VanDerWaalsContact O-N 3.13Å; A532-I534 VanDerWaalsContact C-N 3.31Å; A532-I534 PolarHBondContact O-N 3.49Å; I534-G537 PolarHBondContact O-N 3.07Å; I534-P538 WeakPolarHBondContact O-CD 3.35Å
535V69.3Low63.7Low83 Ų83110.3 Ų110.350%0.50356%0.563SS.*Hα-helixtrans-65.1-40.6177.8176.90000111R531 A532 G537R531-V535 WeakPolarHBondContact O-CG2 3.01Å; R531-V535 PolarHBondContact O-N 2.7Å; R531-V535 VanDerWaalsContact O-N 3.08Å; A532-V535 PolarHBondContact O-N 3.2Å; V535-G537 VanDerWaalsContact C-N 3.31Å; V535-G537 PolarHBondContact O-N 3.47Å
536D64.6Low61Low117 Ų117112.1 Ų112.163%0.62658%0.58SS**Hα-helixtrans-77.5-15.5176.4-70.6-27.1000113.6A532A532-D536 PolarHBondContact O-N 3.23Å; A532-D536 VanDerWaalsContact O-N 3.13Å
537G56.2Low58.3Low34 Ų34113.1 Ų113.135%0.35159%0.594SS.*Hα-helixtrans-71-46.3-165.400000116.7S533 I534 V535S533-G537 WeakPolarHBondContact O-CA 3.39Å; S533-G537 PolarHBondContact O-N 3.13Å; S533-G537 VanDerWaalsContact O-N 3.12Å; I534-G537 PolarHBondContact O-N 3.07Å; V535-G537 VanDerWaalsContact C-N 3.31Å; V535-G537 PolarHBondContact O-N 3.47Å
538P49.8Very low55.7Low91 Ų91115.5 Ų115.559%0.59162%0.616SS**Hα-helixtrans-93.8-22.1-177.630.3-27.7000113.6I534I534-P538 WeakPolarHBondContact O-CD 3.35Å
539T44.4Very low53.2Low98 Ų98116.9 Ų116.960%0.60164%0.636SS**Hα-helixtrans-77.3-33.9-177.3-280000111.8
540R40.2Very low50.5Low210 Ų210119 Ų11979%0.79265%0.645SS**Hα-helixtrans-79-28.1179.8-158.5171.4-176.4177.51.2114
541K33.6Very low47.7Very low169 Ų169119.3 Ų119.374%0.73566%0.657SS**Hα-helixtrans-76.1-22.7176.1-80-173.7177.6179.40113.6T544K541-T544 PolarHBondContact O-OG1 3.47Å
542R31.4Very low45.3Very low215 Ų215122.5 Ų122.581%0.81168%0.675SS**Hα-helixtrans-83.9-19.6178-135.1175.3-171.8-176.21.3113.6
543M34.7Very low42.7Very low166 Ų166126.3 Ų126.382%0.81869%0.686SS**THydrogen-bonded Turntrans-85.2-9.9175.1-89.6-179.1157.800114.5
544T35.4Very low40Very low112 Ų112127.6 Ų127.669%0.68770%0.696SS**THydrogen-bonded Turntrans-100.46.2178.357.20000114.4K541K541-T544 PolarHBondContact O-OG1 3.47Å
545S32.6Very low37.8Very low86 Ų86127.3 Ų127.360%0.60170%0.704SS**  trans-102.957.8167.968.30000110.5T547S545-T547 PolarHBondContact O-N 3.23Å
546S32.8Very low35.7Very low104 Ų104131.4 Ų131.473%0.72772%0.718SS**  trans-75.895.8160.454.50000107.8
547T31.9Very low34Very low126 Ų126133.5 Ų133.577%0.77372%0.723SS**  trans-61128.9158-3.80000107.5S545 T549S545-T547 PolarHBondContact O-N 3.23Å; T547-T549 PolarHBondContact O-N 3.4Å
548P32.8Very low33.3Very low122 Ų122136.8 Ų136.879%0.79274%0.738SS**  trans-74.8111.3-176.729.6-31.4000108.7
549T30.7Very low32.2Very low135 Ų135139.1 Ų139.183%0.82875%0.751SS**  trans-79.5131.4162.940.90000108.9T547T547-T549 PolarHBondContact O-N 3.4Å
550P30.2Very low31.5Very low109 Ų109139.6 Ų139.671%0.70876%0.758SS**  trans-84.5147.1-165.328.6-22.2000112.5F552P550-F552 PolarHBondContact O-N 3.19Å
551D27.6Very low30.8Very low142 Ų142134.7 Ų134.776%0.75976%0.756SS**  trans11.198.6151.8-60.3-27.6000116.5
552F31.1Very low30.8Very low212 Ų212138.5 Ų138.593%0.9378%0.783SS**  trans-102.392.4150.8-119-91.7000108.8P550P550-F552 PolarHBondContact O-N 3.19Å
553I25.8Very low30.8Very low131 Ų131134.7 Ų134.767%0.67278%0.782SS**  trans-80.5144.3165.8-67.5170.2000108.5
554S26.2Very low30.6Very low100 Ų100133 Ų13370%0.69978%0.78SS**  trans89.7108.2159.877.10000119.5
555S32.2Very low30.3Very low111 Ų111134.2 Ų134.278%0.77679%0.785SS**  161.5100.7112470000107.2
556Q25.3Very low30.2Very low170 Ų170137 Ų13779%0.79480%0.796SS**  4510489-83.1-165.6-13.800114.7
557H29.6Very low30Very low161 Ų161139.1 Ų139.175%0.74580%0.8SS**  141.9152.1123.4-84.8-57.8000114.8
558P41.4Very low29.9Very low102 Ų102139.9 Ų139.966%0.66280%0.802SS**  trans-113.1166.2-131.141-31.8000114.5
559V25.6Very low29.7Very low140 Ų140141.2 Ų141.285%0.84880%0.802SS**  trans15.5112.5142.1-171.40000116.5
560S29.9Very low29.6Very low108 Ų108141.7 Ų141.776%0.75580%0.8SS**  -169.4137.5126.544.10000112.1
561S26.2Very low29.5Very low108 Ų108144.4 Ų144.476%0.75581%0.808SS**  trans-25.1131.5161.350.40000117.8
562L33.7Very low29.7Very low248 Ų248144.6 Ų144.6100%1.29881%0.812SS**  -157.10116.5-108.1157.5000109.4

Retrieved 562 of 562 residues in 1364.3 ms (Link to these results)