A0A096NQV6_PAPAN Loading...

YAE1 maturation factor of ABCE1

AlphaFold DB , UniProt , Accession A0A096NQV6, Species PAPAN (Papio anubis, Olive baboon), Gene YAE1, Length 225 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
1M42Very low47.4Very low248 Ų248165.1 Ų165.1100%1.22289%0.893SS**  0108.60-68.5-161.9165.900107.6
2S46.3Very low46.7Very low110 Ų110155.5 Ų155.577%0.76986%0.861SS**  trans-146.195.3-178.2-173.90000108.2
3W45.3Very low46.8Very low253 Ų253154.2 Ų154.296%0.95886%0.864SS**  trans-12860.6170.6-75100.9000108
4V51.5Low47.2Very low131 Ų131148.7 Ų148.779%0.79486%0.86SS**  trans-147.279167.1-173.20000108.7
5Q50.7Low47.4Very low194 Ų194148.5 Ų148.591%0.90785%0.854SS**  trans-176.1101.1144.6-120.6170.7-25.500110.9
6A45.8Very low47.9Very low110 Ų110152 Ų15291%0.90986%0.856SS**  trans-165.857.2150.300000109.5
7A51.3Low48.2Very low95 Ų95145.8 Ų145.879%0.78583%0.834SS**  trans-120.295.116200000107.2
8S49.3Very low48.6Very low113 Ų113143.4 Ų143.479%0.7982%0.818SS**  trans160.8143.5142.7-73.60000110.3
9L47.6Very low49.2Very low166 Ų166142.7 Ų142.787%0.86982%0.816SS**  trans88.885.2174-55.6151.4000114.4
10V44.2Very low49.6Very low140 Ų140143.7 Ų143.785%0.84881%0.811SS**  -158.1113.689.4166.50000107.9
11R47.4Very low50.2Low256 Ų256143.2 Ų143.297%0.96681%0.807SS**  trans-96.694.3164.5-169.1-179.2-144.2-179.26.2106.6
12G39.7Very low51Low50 Ų50139.8 Ų139.852%0.51579%0.788SS.*  trans-92.2143.7163.300000109.8
13P48.2Very low51.7Low138 Ų138142.8 Ų142.890%0.89679%0.79SS**SBendtrans-79.6121.5179.431.4-29000109.8
14G52.5Low52.6Low78 Ų78133.7 Ų133.780%0.80477%0.769SS**SBendtrans94.168167.700000114.7
15D49.9Very low53.6Low145 Ų145131.5 Ų131.578%0.77575%0.752SS**  -171.890.8126.2-165.119.9000106.9G17D15-G17 PolarHBondContact O-N 3.28Å
16K55Low55Low205 Ų205130 Ų13089%0.89175%0.745SS**  trans-76.185.2158.5-74.1-169.5176.9-175.60103.8D18K16-D18 VanDerWaalsContact C-N 3.3Å; K16-D18 PolarHBondContact O-N 3.14Å
17G53.4Low56.6Low46 Ų46128.2 Ų128.247%0.47473%0.726SS.*  trans-54.2107.8162.500000105.5D15 V19D15-G17 PolarHBondContact O-N 3.28Å; G17-V19 PolarHBondContact O-N 2.91Å
18D54.6Low58Low104 Ų104129.1 Ų129.156%0.55672%0.717SS**  trans-58.3110.7175.7-145.6-13.4000105.6K16 F20K16-D18 VanDerWaalsContact C-N 3.3Å; K16-D18 PolarHBondContact O-N 3.14Å; D18-F20 PolarHBondContact O-N 3.14Å
19V59.8Low59.7Low129 Ų129128 Ų12878%0.78270%0.702SS**SBendtrans-71.9-7.6179.7175.10000109.8G17G17-V19 PolarHBondContact O-N 2.91Å
20F57Low61.6Low162 Ų162122.8 Ų122.871%0.71168%0.683SS**SBendtrans-122.5104.2173-62.5-85.1000107.7D18 E22D18-F20 PolarHBondContact O-N 3.14Å; F20-E22 PolarHBondContact O-N 3.34Å
21D62.9Low63.8Low135 Ų135120.3 Ų120.372%0.72266%0.662SS**  trans-60.2106.7164.3-72.9-33.9000107.2E23 A24D21-E23 PolarHBondContact O-N 3.38Å; D21-A24 PolarHBondContact O-N 3.16Å; D21-A24 VanDerWaalsContact O-N 3.14Å
22E59.1Low65.7Low175 Ų175116.7 Ų116.782%0.81865%0.648SS**THydrogen-bonded Turntrans-63.3-18.2-179.1-168.6170.9-169.300111.9F20F20-E22 PolarHBondContact O-N 3.34Å
23E59.8Low68.3Low173 Ų173120.1 Ų120.181%0.80865%0.651SS**THydrogen-bonded Turntrans-99.147.7167.6-75.592.1-175.500113.6D21 D25D21-E23 PolarHBondContact O-N 3.38Å; E23-D25 PolarHBondContact O-N 2.81Å
24A64.7Low70.4Confident63 Ų63120.2 Ų120.252%0.52163%0.633SS.*  trans-58.5110.316200000108.7D21 E26D21-A24 PolarHBondContact O-N 3.16Å; D21-A24 VanDerWaalsContact O-N 3.14Å; A24-E26 PolarHBondContact O-N 3.06Å
25D73.4Confident72.2Confident84 Ų84121.1 Ų121.145%0.44962%0.617SS.*  trans-65.195-176.2-172.2-4.9000110.3E23 S27 L28 L29E23-D25 PolarHBondContact O-N 2.81Å; D25-S27 VanDerWaalsContact CG-OG 3.23Å; D25-S27 PolarHBondContact O-N 3.32Å; D25-S27 VanDerWaalsContact OD1-CB 3.26Å; D25-S27 WeakPolarHBondContact OD1-CB 3.45Å; D25-S27 PolarHBondContact OD1-N 3.07Å; D25-S27 VanDerWaalsContact OD1-N 3.07Å; D25-S27 PolarHBondContact OD1-OG 3.12Å; D25-S27 PolarHBondContact OD2-OG 3.29Å; D25-L28 HydrophobicContact CB-CB 4.35Å; D25-L28 HydrophobicContact CB-CD1 3.97Å; D25-L28 HydrophobicContact CB-CG 4.02Å; D25-L28 WeakPolarHBondContact O-CB 3.45Å; D25-L28 PolarHBondContact O-N 3.07Å; D25-L28 WeakPolarHBondContact OD2-CG 3.44Å; D25-L29 PolarHBondContact O-N 3.19Å
26E79.3Confident74Confident163 Ų163117 Ų11776%0.76260%0.599SS**Hα-helixtrans-54.8-26.6178.9-64-174.2166.500111.5A24 L29 A30A24-E26 PolarHBondContact O-N 3.06Å; E26-L29 PolarHBondContact O-N 2.89Å; E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 3.4Å
27S79.3Confident75.8Confident72 Ų72111.5 Ų111.550%0.50358%0.576SS.*Hα-helixtrans-70-34.8177.480.90000112.6D25 Q31D25-S27 VanDerWaalsContact CG-OG 3.23Å; D25-S27 PolarHBondContact O-N 3.32Å; D25-S27 VanDerWaalsContact OD1-CB 3.26Å; D25-S27 WeakPolarHBondContact OD1-CB 3.45Å; D25-S27 PolarHBondContact OD1-N 3.07Å; D25-S27 VanDerWaalsContact OD1-N 3.07Å; D25-S27 PolarHBondContact OD1-OG 3.12Å; D25-S27 PolarHBondContact OD2-OG 3.29Å; S27-Q31 VanDerWaalsContact O-CB 3.31Å; S27-Q31 WeakPolarHBondContact O-CB 3.48Å; S27-Q31 PolarHBondContact O-N 3.41Å
28L81.4Confident77.7Confident114 Ų114112.4 Ų112.460%0.59757%0.569SS**Hα-helixtrans-71.2-36.5174.3-67.2179.2000111.7D25 R32D25-L28 HydrophobicContact CB-CB 4.35Å; D25-L28 HydrophobicContact CB-CD1 3.97Å; D25-L28 HydrophobicContact CB-CG 4.02Å; D25-L28 WeakPolarHBondContact O-CB 3.45Å; D25-L28 PolarHBondContact O-N 3.07Å; D25-L28 WeakPolarHBondContact OD2-CG 3.44Å; L28-R32 WeakPolarHBondContact O-CB 3.37Å; L28-R32 PolarHBondContact O-N 3.49Å
29L84.1Confident79.2Confident90 Ų90113.7 Ų113.747%0.47157%0.572SS.*Hα-helixtrans-64.5-48.8173.3-65.4178000110.6D25 E26 Q31 R32 E33D25-L29 PolarHBondContact O-N 3.19Å; E26-L29 PolarHBondContact O-N 2.89Å; L29-Q31 VanDerWaalsContact C-N 3.31Å; L29-Q31 PolarHBondContact O-N 3.31Å; L29-R32 PolarHBondContact O-N 3.5Å; L29-E33 WeakPolarHBondContact O-CG 3.32Å; L29-E33 PolarHBondContact O-N 3.15Å
30A88.3Confident80.5Confident56 Ų56112.2 Ų112.246%0.46355%0.552SS.*Hα-helixtrans-59.1-41.3176.500000112.2E26 E33 W34E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 3.4Å; A30-E33 PolarHBondContact O-N 3.43Å; A30-W34 VanDerWaalsContact O-CB 3.31Å; A30-W34 WeakPolarHBondContact O-CB 3.31Å; A30-W34 PolarHBondContact O-N 3.4Å
31Q89.4Confident82.1Confident89 Ų89111.8 Ų111.842%0.41655%0.546SS..Hα-helixtrans-65.6-42.2177-17663.96.600112.1S27 L29 W34 Q35S27-Q31 VanDerWaalsContact O-CB 3.31Å; S27-Q31 WeakPolarHBondContact O-CB 3.48Å; S27-Q31 PolarHBondContact O-N 3.41Å; L29-Q31 VanDerWaalsContact C-N 3.31Å; L29-Q31 PolarHBondContact O-N 3.31Å; Q31-W34 PolarHBondContact O-N 3.25Å; Q31-Q35 WeakPolarHBondContact O-CB 3.48Å; Q31-Q35 VanDerWaalsContact O-CG 3.32Å; Q31-Q35 WeakPolarHBondContact O-CG 3.4Å; Q31-Q35 PolarHBondContact O-N 3.32Å
32R88.6Confident83.2Confident180 Ų180108.9 Ų108.968%0.67953%0.533SS*.Hα-helixtrans-62.8-45.5176177.7-174.4-72.4-173.8-1.3111.4L28 L29 Q35 S36L28-R32 WeakPolarHBondContact O-CB 3.37Å; L28-R32 PolarHBondContact O-N 3.49Å; L29-R32 PolarHBondContact O-N 3.5Å; R32-Q35 PolarHBondContact O-N 3.49Å; R32-S36 WeakPolarHBondContact O-CB 3.4Å; R32-S36 PolarHBondContact O-N 3.33Å
33E92.6Very high84.4Confident122 Ų122106.5 Ų106.557%0.5752%0.52SS*.Hα-helixtrans-61.9-46.9177.2-73.3-179.7175.900110.6L29 A30 Q35 S36 H37L29-E33 WeakPolarHBondContact O-CG 3.32Å; L29-E33 PolarHBondContact O-N 3.15Å; A30-E33 PolarHBondContact O-N 3.43Å; E33-Q35 PolarHBondContact O-N 3.07Å; E33-S36 PolarHBondContact O-N 3.11Å; E33-H37 WeakPolarHBondContact O-CB 3.43Å; E33-H37 PolarHBondContact O-CD2 3.35Å; E33-H37 PolarHBondContact O-N 3.13Å
34W92.4Very high85.7Confident140 Ų140102.3 Ų102.353%0.5350%0.5SS..Hα-helixtrans-57.3-46.5176.7176.882.7000112.3A30 Q31 S36 H37 M38A30-W34 VanDerWaalsContact O-CB 3.31Å; A30-W34 WeakPolarHBondContact O-CB 3.31Å; A30-W34 PolarHBondContact O-N 3.4Å; Q31-W34 PolarHBondContact O-N 3.25Å; W34-S36 PolarHBondContact O-N 3.47Å; W34-H37 PolarHBondContact O-N 3.39Å; W34-M38 HydrophobicContact CZ2-CE 4Å; W34-M38 WeakPolarHBondContact O-CB 3.06Å; W34-M38 PolarHBondContact O-N 3.38Å
35Q90.6Very high86.9Confident97 Ų97101.3 Ų101.345%0.45350%0.496SS..Hα-helixtrans-61-45.5176.4-74.2177.7-8.800111.8Q31 R32 E33 H37 M38 Q39Q31-Q35 WeakPolarHBondContact O-CB 3.48Å; Q31-Q35 VanDerWaalsContact O-CG 3.32Å; Q31-Q35 WeakPolarHBondContact O-CG 3.4Å; Q31-Q35 PolarHBondContact O-N 3.32Å; R32-Q35 PolarHBondContact O-N 3.49Å; E33-Q35 PolarHBondContact O-N 3.07Å; Q35-H37 PolarHBondContact O-N 3Å; Q35-M38 PolarHBondContact O-N 2.98Å; Q35-Q39 WeakPolarHBondContact O-CG 3.19Å; Q35-Q39 PolarHBondContact O-N 2.91Å
36S89.1Confident87.5Confident58 Ų58102.1 Ų102.141%0.40649%0.493SS..Hα-helixtrans-61.1-44.9176.6-179.40000111.9R32 E33 W34 M38 Q39 R40R32-S36 WeakPolarHBondContact O-CB 3.4Å; R32-S36 PolarHBondContact O-N 3.33Å; E33-S36 PolarHBondContact O-N 3.11Å; W34-S36 PolarHBondContact O-N 3.47Å; S36-M38 VanDerWaalsContact C-N 3.35Å; S36-M38 PolarHBondContact O-N 2.88Å; S36-Q39 PolarHBondContact O-N 3.44Å; S36-R40 WeakPolarHBondContact O-CB 3.49Å; S36-R40 PolarHBondContact O-N 3.23Å
37H92.6Very high87.8Confident89 Ų89101.4 Ų101.441%0.41248%0.483SS..Hα-helixtrans-62.2-42.1176.6-83.1-72.5000111.9E33 W34 Q35 R40 R41E33-H37 WeakPolarHBondContact O-CB 3.43Å; E33-H37 PolarHBondContact O-CD2 3.35Å; E33-H37 PolarHBondContact O-N 3.13Å; W34-H37 PolarHBondContact O-N 3.39Å; Q35-H37 PolarHBondContact O-N 3Å; H37-R40 PolarHBondContact CE1-NH1 2.94Å; H37-R40 VanDerWaalsContact CE1-NH1 3.31Å; H37-R40 PolarHBondContact ND1-NH1 2.86Å; H37-R40 PolarHBondContact ND1-NH2 3.21Å; H37-R40 PolarHBondContact O-N 3.14Å; H37-R41 WeakPolarHBondContact O-CG 3.39Å; H37-R41 PolarHBondContact O-N 3.46Å
38M92.1Very high88.2Confident66 Ų66103.2 Ų103.233%0.32549%0.487SS..Hα-helixtrans-65.8-47179.2-170.758.969.100111.6W34 Q35 S36 R40 R41 V42W34-M38 HydrophobicContact CZ2-CE 4Å; W34-M38 WeakPolarHBondContact O-CB 3.06Å; W34-M38 PolarHBondContact O-N 3.38Å; Q35-M38 PolarHBondContact O-N 2.98Å; S36-M38 VanDerWaalsContact C-N 3.35Å; S36-M38 PolarHBondContact O-N 2.88Å; M38-R40 PolarHBondContact O-N 3.1Å; M38-R41 PolarHBondContact O-N 3.47Å; M38-V42 WeakPolarHBondContact O-CG2 3.49Å; M38-V42 PolarHBondContact O-N 2.99Å; M38-V42 VanDerWaalsContact O-N 3.07Å
39Q86.1Confident88.6Confident131 Ų131100 Ų10061%0.61248%0.482SS*.Hα-helixtrans-58-40.1175.8-74.2-178.9-8.700111.7Q35 S36 V42 K43Q35-Q39 WeakPolarHBondContact O-CG 3.19Å; Q35-Q39 PolarHBondContact O-N 2.91Å; S36-Q39 PolarHBondContact O-N 3.44Å; Q39-V42 PolarHBondContact O-N 3.09Å; Q39-K43 WeakPolarHBondContact O-CG 3.4Å; Q39-K43 PolarHBondContact O-N 3.37Å
40R88.4Confident88.7Confident97 Ų9798.1 Ų98.137%0.36647%0.472SS..Hα-helixtrans-64.6-45.8177.1-156.6-171-43.8118.914.1112S36 H37 M38 V42 K43 E44S36-R40 WeakPolarHBondContact O-CB 3.49Å; S36-R40 PolarHBondContact O-N 3.23Å; H37-R40 PolarHBondContact CE1-NH1 2.94Å; H37-R40 VanDerWaalsContact CE1-NH1 3.31Å; H37-R40 PolarHBondContact ND1-NH1 2.86Å; H37-R40 PolarHBondContact ND1-NH2 3.21Å; H37-R40 PolarHBondContact O-N 3.14Å; M38-R40 PolarHBondContact O-N 3.1Å; R40-V42 VanDerWaalsContact C-N 3.3Å; R40-V42 PolarHBondContact O-N 3.32Å; R40-K43 PolarHBondContact O-N 3.42Å; R40-K43 VanDerWaalsContact O-N 3.16Å; R40-E44 WeakPolarHBondContact CD-OE1 3.31Å; R40-E44 HydrophobicContact CG-CG 4.37Å; R40-E44 VanDerWaalsContact CG-OE1 3.27Å; R40-E44 WeakPolarHBondContact CG-OE1 3.4Å; R40-E44 WeakPolarHBondContact O-CB 3.46Å; R40-E44 VanDerWaalsContact O-CG 3.29Å; R40-E44 WeakPolarHBondContact O-CG 3.43Å; R40-E44 PolarHBondContact O-N 3.12Å
41R89.4Confident88.5Confident153 Ų15399.1 Ų99.158%0.57747%0.469SS*.Hα-helixtrans-61.8-36.2178.5-74.1-143.9-63.9-108.22113.2H37 M38 G45H37-R41 WeakPolarHBondContact O-CG 3.39Å; H37-R41 PolarHBondContact O-N 3.46Å; M38-R41 PolarHBondContact O-N 3.47Å; R41-G45 PolarHBondContact O-N 3.31Å
42V86.8Confident88.5Confident74 Ų7497.6 Ų97.645%0.44847%0.472SS..Hα-helixtrans-64.5-46175.1173.90000110.7M38 Q39 R40 G45 Y46M38-V42 WeakPolarHBondContact O-CG2 3.49Å; M38-V42 PolarHBondContact O-N 2.99Å; M38-V42 VanDerWaalsContact O-N 3.07Å; Q39-V42 PolarHBondContact O-N 3.09Å; R40-V42 VanDerWaalsContact C-N 3.3Å; R40-V42 PolarHBondContact O-N 3.32Å; V42-G45 PolarHBondContact O-N 3.46Å; V42-Y46 PolarHBondContact O-N 3.43Å
43K84.8Confident88.5Confident125 Ų12590.7 Ų90.754%0.54346%0.457SS..Hα-helixtrans-64.1-44.4177.5-69.1-178.3177.9-166.40112.1Q39 R40 Y46 R47Q39-K43 WeakPolarHBondContact O-CG 3.4Å; Q39-K43 PolarHBondContact O-N 3.37Å; R40-K43 PolarHBondContact O-N 3.42Å; R40-K43 VanDerWaalsContact O-N 3.16Å; K43-Y46 PolarHBondContact O-N 3.42Å; K43-R47 WeakPolarHBondContact O-CG 3.25Å; K43-R47 PolarHBondContact O-N 3.25Å; K43-R47 VanDerWaalsContact O-N 3.12Å
44E86.6Confident88.2Confident86 Ų8689.3 Ų89.340%0.40245%0.449SS..Hα-helixtrans-60.2-48.9175.7-72.5166.2176.700110.9R40 Y46 R47 D48R40-E44 WeakPolarHBondContact CD-OE1 3.31Å; R40-E44 HydrophobicContact CG-CG 4.37Å; R40-E44 VanDerWaalsContact CG-OE1 3.27Å; R40-E44 WeakPolarHBondContact CG-OE1 3.4Å; R40-E44 WeakPolarHBondContact O-CB 3.46Å; R40-E44 VanDerWaalsContact O-CG 3.29Å; R40-E44 WeakPolarHBondContact O-CG 3.43Å; R40-E44 PolarHBondContact O-N 3.12Å; E44-Y46 VanDerWaalsContact C-N 3.32Å; E44-Y46 PolarHBondContact O-N 2.77Å; E44-R47 PolarHBondContact O-N 2.92Å; E44-D48 WeakPolarHBondContact O-CB 3.45Å; E44-D48 PolarHBondContact O-N 3.34Å
45G89.2Confident88Confident41 Ų4185.5 Ų85.542%0.42345%0.447SS..Hα-helixtrans-62.4-35.2179.300000113.9R41 V42 G49R41-G45 PolarHBondContact O-N 3.31Å; V42-G45 PolarHBondContact O-N 3.46Å; G45-G49 PolarHBondContact O-N 3.44Å
46Y86.3Confident88Confident102 Ų10284.7 Ų84.740%0.445%0.449SS..Hα-helixtrans-66.4-45.3174.2179.3-105.9000112V42 K43 E44 G49 I50 I142V42-Y46 PolarHBondContact O-N 3.43Å; K43-Y46 PolarHBondContact O-N 3.42Å; E44-Y46 VanDerWaalsContact C-N 3.32Å; E44-Y46 PolarHBondContact O-N 2.77Å; Y46-G49 PolarHBondContact O-N 3.44Å; Y46-I50 HydrophobicContact CD1-CD1 3.89Å; Y46-I50 HydrophobicContact CE1-CD1 3.29Å; Y46-I50 HydrophobicContact CE1-CG1 4.37Å; Y46-I50 HydrophobicContact CE2-CD1 4.13Å; Y46-I50 VanDerWaalsContact CZ-CD1 3.44Å; Y46-I50 PolarHBondContact O-N 3.39Å; Y46-I142 HydrophobicContact CD1-CD1 4.05Å; Y46-I142 HydrophobicContact CD2-CD1 4.34Å; Y46-I142 HydrophobicContact CE1-CD1 3.85Å; Y46-I142 HydrophobicContact CE2-CD1 4.18Å; Y46-I142 HydrophobicContact CG-CD1 4.27Å
47R85.6Confident88Confident147 Ų14786.3 Ų86.356%0.55546%0.456SS*.Hα-helixtrans-61.6-47.5176.7-69.3175.269.9-1600.3111.2K43 E44 G49 I50 D51K43-R47 WeakPolarHBondContact O-CG 3.25Å; K43-R47 PolarHBondContact O-N 3.25Å; K43-R47 VanDerWaalsContact O-N 3.12Å; E44-R47 PolarHBondContact O-N 2.92Å; R47-G49 VanDerWaalsContact C-N 3.28Å; R47-G49 PolarHBondContact O-N 2.89Å; R47-I50 PolarHBondContact O-N 2.95Å; R47-D51 PolarHBondContact O-N 2.9Å
48D88.8Confident87.8Confident110 Ų11088 Ų8859%0.58847%0.468SS*.Hα-helixtrans-59.3-40.8176.9-72.7-4.4000111.4E44 D51 A52E44-D48 WeakPolarHBondContact O-CB 3.45Å; E44-D48 PolarHBondContact O-N 3.34Å; D48-D51 PolarHBondContact O-N 3.25Å; D48-A52 WeakPolarHBondContact O-CB 3.5Å; D48-A52 PolarHBondContact O-N 3.37Å
49G89.4Confident87.9Confident46 Ų4689.3 Ų89.347%0.47447%0.473SS..Hα-helixtrans-63.3-43.2176.600000113.2G45 Y46 R47 G53G45-G49 PolarHBondContact O-N 3.44Å; Y46-G49 PolarHBondContact O-N 3.44Å; R47-G49 VanDerWaalsContact C-N 3.28Å; R47-G49 PolarHBondContact O-N 2.89Å; G49-G53 PolarHBondContact O-N 2.98Å
50I84.9Confident88.1Confident51 Ų5188.8 Ų88.826%0.26247%0.471SS..Hα-helixtrans-62.3-49.6174.8-73.5175.3000110.4Y46 R47 A52 G53 K54Y46-I50 HydrophobicContact CD1-CD1 3.89Å; Y46-I50 HydrophobicContact CE1-CD1 3.29Å; Y46-I50 HydrophobicContact CE1-CG1 4.37Å; Y46-I50 HydrophobicContact CE2-CD1 4.13Å; Y46-I50 VanDerWaalsContact CZ-CD1 3.44Å; Y46-I50 PolarHBondContact O-N 3.39Å; R47-I50 PolarHBondContact O-N 2.95Å; I50-A52 VanDerWaalsContact C-N 3.33Å; I50-A52 PolarHBondContact O-N 3.25Å; I50-G53 PolarHBondContact O-N 3.26Å; I50-G53 VanDerWaalsContact O-N 3.12Å; I50-K54 HydrophobicContact CG2-CD 4.06Å; I50-K54 VanDerWaalsContact CG2-CE 3.44Å; I50-K54 HydrophobicContact CG2-CG 4.35Å; I50-K54 WeakPolarHBondContact O-CG 3.39Å; I50-K54 PolarHBondContact O-N 2.92Å
51D85.1Confident88.1Confident78 Ų7886.4 Ų86.442%0.41748%0.476SS..Hα-helixtrans-66.1-38.1-176.4-72.3-20.2000111.5R47 D48 K54 A55R47-D51 PolarHBondContact O-N 2.9Å; D48-D51 PolarHBondContact O-N 3.25Å; D51-K54 PolarHBondContact O-N 3.4Å; D51-K54 IonicContact OD1-NZ 3.43Å; D51-K54 PolarHBondContact OD1-NZ 2.92Å; D51-A55 WeakPolarHBondContact O-CB 3.29Å; D51-A55 PolarHBondContact O-N 3.43Å
52A90.2Very high88.2Confident56 Ų5685 Ų8546%0.46348%0.475SS..Hα-helixtrans-60.9-44.3170.700000111.6D48 I50 A55 V56D48-A52 WeakPolarHBondContact O-CB 3.5Å; D48-A52 PolarHBondContact O-N 3.37Å; I50-A52 VanDerWaalsContact C-N 3.33Å; I50-A52 PolarHBondContact O-N 3.25Å; A52-A55 PolarHBondContact O-N 2.8Å; A52-V56 WeakPolarHBondContact O-CG2 3.47Å; A52-V56 PolarHBondContact O-N 2.91Å
53G88.6Confident88.6Confident35 Ų3585.6 Ų85.636%0.36148%0.475SS..Hα-helixtrans-62-42.4176.300000113.4G49 I50 V56 T57G49-G53 PolarHBondContact O-N 2.98Å; I50-G53 PolarHBondContact O-N 3.26Å; I50-G53 VanDerWaalsContact O-N 3.12Å; G53-V56 PolarHBondContact O-N 3.47Å; G53-T57 WeakPolarHBondContact O-CB 3.45Å; G53-T57 PolarHBondContact O-N 3.29Å; G53-T57 PolarHBondContact O-OG1 3.31Å
54K85.5Confident88.8Confident93 Ų9384.2 Ų84.240%0.40447%0.471SS..Hα-helixtrans-59.2-50.2173.5-72.6172.9-178.3166.80110.7I50 D51 V56 T57 L58I50-K54 HydrophobicContact CG2-CD 4.06Å; I50-K54 VanDerWaalsContact CG2-CE 3.44Å; I50-K54 HydrophobicContact CG2-CG 4.35Å; I50-K54 WeakPolarHBondContact O-CG 3.39Å; I50-K54 PolarHBondContact O-N 2.92Å; D51-K54 PolarHBondContact O-N 3.4Å; D51-K54 IonicContact OD1-NZ 3.43Å; D51-K54 PolarHBondContact OD1-NZ 2.92Å; K54-V56 PolarHBondContact O-N 3.47Å; K54-T57 PolarHBondContact O-N 3.49Å; K54-L58 VanDerWaalsContact O-CB 3.23Å; K54-L58 WeakPolarHBondContact O-CB 3.42Å; K54-L58 PolarHBondContact O-N 2.88Å
55A87.3Confident88.9Confident60 Ų6082.1 Ų82.150%0.49647%0.472SS..Hα-helixtrans-60.2-45.1-178.800000111.8D51 A52 Q59D51-A55 WeakPolarHBondContact O-CB 3.29Å; D51-A55 PolarHBondContact O-N 3.43Å; A52-A55 PolarHBondContact O-N 2.8Å; A55-Q59 VanDerWaalsContact O-CB 3.29Å; A55-Q59 WeakPolarHBondContact O-CB 3.45Å; A55-Q59 PolarHBondContact O-N 3.46Å
56V92.1Very high89Confident81 Ų8187.7 Ų87.749%0.49148%0.482SS..Hα-helixtrans-63.5-48.2178.7170.80000111.3A52 G53 K54 Q59 Q60A52-V56 WeakPolarHBondContact O-CG2 3.47Å; A52-V56 PolarHBondContact O-N 2.91Å; G53-V56 PolarHBondContact O-N 3.47Å; K54-V56 PolarHBondContact O-N 3.47Å; V56-Q59 PolarHBondContact O-N 3.45Å; V56-Q60 HydrophobicContact CG1-CG 4.5Å; V56-Q60 VanDerWaalsContact O-CG 3.28Å; V56-Q60 WeakPolarHBondContact O-CG 3.42Å; V56-Q60 PolarHBondContact O-N 2.85Å
57T87.9Confident89.3Confident92 Ų9289.1 Ų89.156%0.56449%0.49SS*.Hα-helixtrans-65.1-42.9-178-53.60000111.3G53 K54 Q60 G61G53-T57 WeakPolarHBondContact O-CB 3.45Å; G53-T57 PolarHBondContact O-N 3.29Å; G53-T57 PolarHBondContact O-OG1 3.31Å; K54-T57 PolarHBondContact O-N 3.49Å; T57-Q60 PolarHBondContact O-N 3.31Å; T57-G61 PolarHBondContact O-N 3.47Å
58L89.4Confident89.4Confident125 Ų12586.8 Ų86.865%0.65449%0.485SS*.Hα-helixtrans-62.4-44.4176.4-176.1147.4000111.2K54 Q60 G61 F62K54-L58 VanDerWaalsContact O-CB 3.23Å; K54-L58 WeakPolarHBondContact O-CB 3.42Å; K54-L58 PolarHBondContact O-N 2.88Å; L58-Q60 VanDerWaalsContact C-N 3.33Å; L58-Q60 PolarHBondContact O-N 3.2Å; L58-G61 PolarHBondContact O-N 3Å; L58-F62 WeakPolarHBondContact O-CB 3.48Å; L58-F62 PolarHBondContact O-N 3.46Å
59Q92.9Very high89.4Confident93 Ų9382.6 Ų82.644%0.43547%0.468SS..Hα-helixtrans-64.9-38.5178.3-171.162.553.600111.9A55 V56 F62 N63A55-Q59 VanDerWaalsContact O-CB 3.29Å; A55-Q59 WeakPolarHBondContact O-CB 3.45Å; A55-Q59 PolarHBondContact O-N 3.46Å; V56-Q59 PolarHBondContact O-N 3.45Å; Q59-F62 PolarHBondContact O-N 2.94Å; Q59-N63 PolarHBondContact NE2-OD1 2.96Å; Q59-N63 WeakPolarHBondContact O-CB 3.39Å; Q59-N63 PolarHBondContact O-N 3.42Å; Q59-N63 PolarHBondContact O-ND2 3.49Å; Q59-N63 PolarHBondContact O-OD1 3.18Å
60Q91.1Very high89.5Confident120 Ų12081.5 Ų81.556%0.56145%0.454SS*.Hα-helixtrans-62.7-46.8174.7-74.2172.9-1.900111.4V56 T57 L58 F62 N63 Q64V56-Q60 HydrophobicContact CG1-CG 4.5Å; V56-Q60 VanDerWaalsContact O-CG 3.28Å; V56-Q60 WeakPolarHBondContact O-CG 3.42Å; V56-Q60 PolarHBondContact O-N 2.85Å; T57-Q60 PolarHBondContact O-N 3.31Å; L58-Q60 VanDerWaalsContact C-N 3.33Å; L58-Q60 PolarHBondContact O-N 3.2Å; Q60-F62 VanDerWaalsContact C-N 3.35Å; Q60-F62 PolarHBondContact O-N 2.96Å; Q60-N63 PolarHBondContact O-N 3.09Å; Q60-Q64 WeakPolarHBondContact O-CB 3.36Å; Q60-Q64 PolarHBondContact O-N 3.14Å
61G89.4Confident89.6Confident47 Ų4784.9 Ų84.949%0.48547%0.469SS..Hα-helixtrans-60.1-43.4175.100000112.4T57 L58 Q64 G65T57-G61 PolarHBondContact O-N 3.47Å; L58-G61 PolarHBondContact O-N 3Å; G61-Q64 PolarHBondContact O-N 3.02Å; G61-G65 PolarHBondContact O-N 3.36Å
62F90.7Very high89.7Confident124 Ų12483.6 Ų83.654%0.54446%0.464SS..Hα-helixtrans-61.5-48.4175177.5-90.9000112L58 Q59 Q60 Q64 G65 Y66L58-F62 WeakPolarHBondContact O-CB 3.48Å; L58-F62 PolarHBondContact O-N 3.46Å; Q59-F62 PolarHBondContact O-N 2.94Å; Q60-F62 VanDerWaalsContact C-N 3.35Å; Q60-F62 PolarHBondContact O-N 2.96Å; F62-Q64 VanDerWaalsContact C-N 3.29Å; F62-Q64 PolarHBondContact O-N 3.47Å; F62-G65 PolarHBondContact O-N 2.96Å; F62-Y66 WeakPolarHBondContact O-CB 3.12Å; F62-Y66 PolarHBondContact O-N 3.46Å
63N94.1Very high89.7Confident85 Ų8583.8 Ų83.846%0.45546%0.457SS..Hα-helixtrans-60.7-41.6-179.6-71.6-11.1000111.3Q59 Q60 K67Q59-N63 PolarHBondContact NE2-OD1 2.96Å; Q59-N63 WeakPolarHBondContact O-CB 3.39Å; Q59-N63 PolarHBondContact O-N 3.42Å; Q59-N63 PolarHBondContact O-ND2 3.49Å; Q59-N63 PolarHBondContact O-OD1 3.18Å; Q60-N63 PolarHBondContact O-N 3.09Å; N63-K67 WeakPolarHBondContact O-CB 3.39Å; N63-K67 PolarHBondContact O-N 3.01Å
64Q89.5Confident89.8Confident96 Ų9687.7 Ų87.745%0.44947%0.469SS..Hα-helixtrans-65.6-51.2177.6-173.760.728.900111.2Q60 G61 F62 Y66 K67 E68Q60-Q64 WeakPolarHBondContact O-CB 3.36Å; Q60-Q64 PolarHBondContact O-N 3.14Å; G61-Q64 PolarHBondContact O-N 3.02Å; F62-Q64 VanDerWaalsContact C-N 3.29Å; F62-Q64 PolarHBondContact O-N 3.47Å; Q64-Y66 VanDerWaalsContact C-N 3.3Å; Q64-Y66 PolarHBondContact O-N 3.26Å; Q64-K67 PolarHBondContact O-N 3.41Å; Q64-K67 VanDerWaalsContact O-N 3.16Å; Q64-E68 PolarHBondContact NE2-OE1 3.36Å; Q64-E68 WeakPolarHBondContact O-CG 3.41Å; Q64-E68 PolarHBondContact O-N 3.46Å
65G89.4Confident89.9Confident42 Ų4286.5 Ų86.543%0.43347%0.467SS..Hα-helixtrans-62.1-36.7178.200000112.9G61 F62 G69G61-G65 PolarHBondContact O-N 3.36Å; F62-G65 PolarHBondContact O-N 2.96Å; G65-G69 PolarHBondContact O-N 3.35Å
66Y91.1Very high90Very high159 Ų15985 Ų8562%0.62445%0.448SS*.Hα-helixtrans-63.1-46.6173.7179-94.4000111.3F62 Q64 A70F62-Y66 WeakPolarHBondContact O-CB 3.12Å; F62-Y66 PolarHBondContact O-N 3.46Å; Q64-Y66 VanDerWaalsContact C-N 3.3Å; Q64-Y66 PolarHBondContact O-N 3.26Å; Y66-A70 HydrophobicContact CE1-CB 4.43Å; Y66-A70 WeakPolarHBondContact O-CB 3.43Å; Y66-A70 PolarHBondContact O-N 2.89Å
67K91.8Very high90Very high131 Ų13183 Ų8357%0.5745%0.445SS*.Hα-helixtrans-61-51179.4-176.7-175.5174.7-171.60111.5N63 Q64 A70 E71N63-K67 WeakPolarHBondContact O-CB 3.39Å; N63-K67 PolarHBondContact O-N 3.01Å; Q64-K67 PolarHBondContact O-N 3.41Å; Q64-K67 VanDerWaalsContact O-N 3.16Å; K67-A70 PolarHBondContact O-N 3.35Å; K67-E71 WeakPolarHBondContact O-CB 3.4Å; K67-E71 PolarHBondContact O-N 2.97Å
68E88.2Confident90.1Very high98 Ų9882.3 Ų82.346%0.45843%0.432SS..Hα-helixtrans-63.6-46.5-179.8-68.6175.9-17500111.6Q64 E71 V72Q64-E68 PolarHBondContact NE2-OE1 3.36Å; Q64-E68 WeakPolarHBondContact O-CG 3.41Å; Q64-E68 PolarHBondContact O-N 3.46Å; E68-E71 PolarHBondContact O-N 2.72Å; E68-V72 WeakPolarHBondContact O-CG2 3.21Å; E68-V72 PolarHBondContact O-N 3.4Å
69G89.6Confident90.1Very high23 Ų2376.6 Ų76.624%0.23740%0.402CS..Hα-helixtrans-64.3-41.7178.300000112.6G65 I73G65-G69 PolarHBondContact O-N 3.35Å; G69-I73 WeakPolarHBondContact O-CB 3.47Å; G69-I73 WeakPolarHBondContact O-CG2 3.35Å; G69-I73 PolarHBondContact O-N 2.88Å
70A90.6Very high90Very high22 Ų2278.5 Ų78.518%0.18241%0.405CS..Hα-helixtrans-65-45178.100000111.8Y66 K67 V72 I73 L74Y66-A70 HydrophobicContact CE1-CB 4.43Å; Y66-A70 WeakPolarHBondContact O-CB 3.43Å; Y66-A70 PolarHBondContact O-N 2.89Å; K67-A70 PolarHBondContact O-N 3.35Å; A70-V72 VanDerWaalsContact C-N 3.32Å; A70-V72 PolarHBondContact O-N 3.47Å; A70-I73 PolarHBondContact O-N 3.36Å; A70-L74 WeakPolarHBondContact O-CB 3.34Å; A70-L74 WeakPolarHBondContact O-CD1 3.44Å; A70-L74 WeakPolarHBondContact O-CG 3.21Å; A70-L74 PolarHBondContact O-N 3.24Å
71E87.6Confident90.1Very high123 Ų12374.7 Ų74.758%0.57540%0.398SS*.Hα-helixtrans-58-45.8178.7-177.3171.3-173.200111.4K67 E68 N75K67-E71 WeakPolarHBondContact O-CB 3.4Å; K67-E71 PolarHBondContact O-N 2.97Å; E68-E71 PolarHBondContact O-N 2.72Å; E71-N75 PolarHBondContact O-ND2 2.99Å
72V87.6Confident90.1Very high50 Ų5073.3 Ų73.330%0.30338%0.38SS..Hα-helixtrans-66.5-51.6178.9175.10000111.3E68 A70 L74 N75 Y76 V117E68-V72 WeakPolarHBondContact O-CG2 3.21Å; E68-V72 PolarHBondContact O-N 3.4Å; A70-V72 VanDerWaalsContact C-N 3.32Å; A70-V72 PolarHBondContact O-N 3.47Å; V72-L74 PolarHBondContact O-N 3.03Å; V72-N75 PolarHBondContact O-N 2.86Å; V72-Y76 HydrophobicContact CG1-CD2 4.21Å; V72-Y76 HydrophobicContact CG1-CE2 3.87Å; V72-Y76 WeakPolarHBondContact O-CD2 3.35Å; V72-V117 HydrophobicContact CG1-CG1 3.55Å
73I89.3Confident90.1Very high61 Ų6167.4 Ų67.431%0.31335%0.354SS..Hα-helixtrans-70.3-30.9-173.4-157.763.6000112.9G69 A70 N75 Y76 G77 E114 L118G69-I73 WeakPolarHBondContact O-CB 3.47Å; G69-I73 WeakPolarHBondContact O-CG2 3.35Å; G69-I73 PolarHBondContact O-N 2.88Å; A70-I73 PolarHBondContact O-N 3.36Å; I73-N75 VanDerWaalsContact C-N 3.29Å; I73-N75 PolarHBondContact O-N 3.49Å; I73-Y76 PolarHBondContact O-N 3.48Å; I73-G77 PolarHBondContact O-N 2.95Å; I73-E114 HydrophobicContact CD1-CG 3.69Å; I73-E114 WeakPolarHBondContact CD1-OE1 3.48Å; I73-L118 HydrophobicContact CD1-CD2 4.41Å
74L90.4Very high90Very high117 Ų11765.7 Ų65.761%0.61335%0.349SS*.Hα-helixtrans-62.1-38.3177.6-80.1170.7000111.7A70 V72 G77 R78A70-L74 WeakPolarHBondContact O-CB 3.34Å; A70-L74 WeakPolarHBondContact O-CD1 3.44Å; A70-L74 WeakPolarHBondContact O-CG 3.21Å; A70-L74 PolarHBondContact O-N 3.24Å; V72-L74 PolarHBondContact O-N 3.03Å; L74-G77 PolarHBondContact O-N 3.41Å; L74-R78 WeakPolarHBondContact O-CB 3.46Å; L74-R78 PolarHBondContact O-N 3.13Å
75N88.4Confident90.1Very high68 Ų6864 Ų6436%0.36435%0.352SS..Hα-helixtrans-65.9-45.1179-69.5-17.8000111.4E71 V72 I73 R78 L79 L225E71-N75 PolarHBondContact O-ND2 2.99Å; V72-N75 PolarHBondContact O-N 2.86Å; I73-N75 VanDerWaalsContact C-N 3.29Å; I73-N75 PolarHBondContact O-N 3.49Å; N75-R78 PolarHBondContact O-N 3Å; N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 3.21Å; N75-L225 HydrophobicContact CB-CD2 3.98Å
76Y90.1Very high90Very high27 Ų2762.5 Ų62.511%0.10633%0.334CS..Hα-helixtrans-63.4-41.1174-70.9-74.8000112V72 I73 R78 L79 R80 V110 C113 V117 P198V72-Y76 HydrophobicContact CG1-CD2 4.21Å; V72-Y76 HydrophobicContact CG1-CE2 3.87Å; V72-Y76 WeakPolarHBondContact O-CD2 3.35Å; I73-Y76 PolarHBondContact O-N 3.48Å; Y76-R78 PolarHBondContact O-N 3.41Å; Y76-L79 PolarHBondContact O-N 3.08Å; Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.89Å; Y76-V110 HydrophobicContact CD1-CG1 4.34Å; Y76-C113 HydrophobicContact CE1-CB 3.76Å; Y76-V117 HydrophobicContact CE2-CG2 4.31Å; Y76-P198 HydrophobicContact CE1-CB 4.29Å
77G91.2Very high90Very high41 Ų4156.2 Ų56.242%0.42331%0.31SS..Hα-helixtrans-61-42.7175.700000112.8I73 L74 R80 G81I73-G77 PolarHBondContact O-N 2.95Å; L74-G77 PolarHBondContact O-N 3.41Å; G77-R80 PolarHBondContact O-N 3.2Å; G77-G81 PolarHBondContact O-N 3.3Å
78R89.3Confident89.9Confident77 Ų7753.4 Ų53.429%0.29131%0.308SS..Hα-helixtrans-68.7-39.3177-178.4162.2133.7157.7161.4112.3L74 N75 Y76 G81 T82 H221 L225L74-R78 WeakPolarHBondContact O-CB 3.46Å; L74-R78 PolarHBondContact O-N 3.13Å; N75-R78 PolarHBondContact O-N 3Å; Y76-R78 PolarHBondContact O-N 3.41Å; R78-G81 PolarHBondContact O-N 3.4Å; R78-T82 WeakPolarHBondContact O-CB 3.49Å; R78-T82 PolarHBondContact O-N 2.97Å; R78-T82 PolarHBondContact O-OG1 3.08Å; R78-H221 WeakPolarHBondContact CD-NE2 3.41Å; R78-H221 WeakPolarHBondContact CG-NE2 3.46Å; R78-H221 VanDerWaalsContact CZ-CD2 3.48Å; R78-H221 VanDerWaalsContact CZ-ND1 3.28Å; R78-H221 PolarHBondContact NE-CD2 2.97Å; R78-H221 VanDerWaalsContact NE-CD2 3.25Å; R78-H221 PolarHBondContact NE-CE1 3.14Å; R78-H221 PolarHBondContact NE-NE2 3.21Å; R78-H221 PolarHBondContact NH1-O 3.08Å; R78-H221 PolarHBondContact NH2-CE1 2.99Å; R78-H221 PolarHBondContact NH2-ND1 3.2Å; R78-H221 PolarHBondContact NH2-NE2 3.26Å; R78-L225 HydrophobicContact CB-CD2 3.91Å; R78-L225 HydrophobicContact CG-CD1 4.1Å; R78-L225 HydrophobicContact CG-CD2 3.93Å; R78-L225 HydrophobicContact CG-CG 4.43Å
79L89.4Confident89.9Confident5 Ų552.3 Ų52.33%0.02630%0.299CS..Hα-helixtrans-62.5-47.8174.1-178.355.9000111.4N75 Y76 G81 T82 L83 V110 I201 L202 T205 L222N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 3.21Å; Y76-L79 PolarHBondContact O-N 3.08Å; L79-G81 PolarHBondContact O-N 3.35Å; L79-T82 PolarHBondContact O-N 3.1Å; L79-L83 HydrophobicContact CD1-CD1 4.41Å; L79-L83 HydrophobicContact CG-CD1 4.38Å; L79-L83 PolarHBondContact O-N 2.99Å; L79-V110 HydrophobicContact CD2-CG2 3.75Å; L79-V110 HydrophobicContact CG-CG2 3.93Å; L79-I201 HydrophobicContact CD2-CB 4.36Å; L79-I201 HydrophobicContact CD2-CG2 3.78Å; L79-I201 HydrophobicContact CG-CG2 4.42Å; L79-L202 HydrophobicContact CD1-CD2 3.93Å; L79-L202 HydrophobicContact CD2-CD2 4.38Å; L79-T205 HydrophobicContact CD1-CG2 4.31Å; L79-L222 HydrophobicContact CD1-CD2 4.2Å
80R92.3Very high89.8Confident133 Ų13351.2 Ų51.250%0.50229%0.288SS..Hα-helixtrans-61.1-43.6175.7-169.6178.4179.7-178-0.1111.8Y76 G77 T82 L83 S84 L107 V110Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.89Å; G77-R80 PolarHBondContact O-N 3.2Å; R80-T82 VanDerWaalsContact C-N 3.33Å; R80-T82 PolarHBondContact O-N 3.42Å; R80-L83 PolarHBondContact O-N 3.36Å; R80-S84 WeakPolarHBondContact O-CB 3.4Å; R80-S84 PolarHBondContact O-N 3.44Å; R80-S84 PolarHBondContact O-OG 3.46Å; R80-L107 HydrophobicContact CG-CD2 3.81Å; R80-V110 HydrophobicContact CB-CG1 4.27Å
81G92.3Very high89.6Confident40 Ų4055.2 Ų55.241%0.41230%0.303SS..Hα-helixtrans-60.2-42.3175.600000112.5G77 R78 L79 S84 A85G77-G81 PolarHBondContact O-N 3.3Å; R78-G81 PolarHBondContact O-N 3.4Å; L79-G81 PolarHBondContact O-N 3.35Å; G81-S84 PolarHBondContact O-N 2.83Å; G81-A85 WeakPolarHBondContact O-CB 3.33Å; G81-A85 PolarHBondContact O-N 2.99Å
82T89.9Confident89.5Confident18 Ų1856.4 Ų56.411%0.1131%0.312CS..Hα-helixtrans-64.2-48.4177.1-55.70000111.2R78 L79 R80 S84 A85 L86 V218 L222R78-T82 WeakPolarHBondContact O-CB 3.49Å; R78-T82 PolarHBondContact O-N 2.97Å; R78-T82 PolarHBondContact O-OG1 3.08Å; L79-T82 PolarHBondContact O-N 3.1Å; R80-T82 VanDerWaalsContact C-N 3.33Å; R80-T82 PolarHBondContact O-N 3.42Å; T82-S84 PolarHBondContact O-N 2.95Å; T82-A85 PolarHBondContact O-N 3.41Å; T82-L86 HydrophobicContact CG2-CD1 4.3Å; T82-L86 VanDerWaalsContact O-CG 3.29Å; T82-L86 WeakPolarHBondContact O-CG 3.04Å; T82-L86 PolarHBondContact O-N 2.88Å; T82-V218 HydrophobicContact CG2-CG1 4.21Å; T82-L222 HydrophobicContact CG2-CD2 4.16Å
83L90.9Very high89.3Confident0 Ų059.1 Ų59.10%032%0.321CS..Hα-helixtrans-62.5-41177.3-74.7169000112.2L79 R80 L86 L87 I103 L106 L107 V110 T205L79-L83 HydrophobicContact CD1-CD1 4.41Å; L79-L83 HydrophobicContact CG-CD1 4.38Å; L79-L83 PolarHBondContact O-N 2.99Å; R80-L83 PolarHBondContact O-N 3.36Å; L83-L86 WeakPolarHBondContact O-CB 3.48Å; L83-L86 PolarHBondContact O-N 3.48Å; L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 PolarHBondContact O-N 3.5Å; L83-I103 HydrophobicContact CB-CG2 4.43Å; L83-I103 HydrophobicContact CD2-CG2 4.36Å; L83-I103 WeakPolarHBondContact O-CG2 3.21Å; L83-L106 HydrophobicContact CD1-CB 4Å; L83-L106 HydrophobicContact CD2-CB 4.15Å; L83-L106 HydrophobicContact CD2-CD1 4.1Å; L83-L107 HydrophobicContact CB-CD2 3.64Å; L83-L107 HydrophobicContact CB-CG 3.89Å; L83-L107 HydrophobicContact CD1-CD2 4.29Å; L83-L107 HydrophobicContact CD1-CG 4.4Å; L83-V110 HydrophobicContact CD1-CG2 3.85Å; L83-T205 HydrophobicContact CD2-CG2 3.74Å; L83-T205 HydrophobicContact CG-CG2 4.21Å
84S92.4Very high88.6Confident48 Ų4863.5 Ų63.534%0.33635%0.346SS..Hα-helixtrans-62.8-41.7174.7-670000112.1R80 G81 T82 L87 S88R80-S84 WeakPolarHBondContact O-CB 3.4Å; R80-S84 PolarHBondContact O-N 3.44Å; R80-S84 PolarHBondContact O-OG 3.46Å; G81-S84 PolarHBondContact O-N 2.83Å; T82-S84 PolarHBondContact O-N 2.95Å; S84-L87 WeakPolarHBondContact O-CB 3.46Å; S84-L87 PolarHBondContact O-N 3.3Å; S84-S88 PolarHBondContact O-N 3.43Å; S84-S88 PolarHBondContact O-OG 3.07Å
85A90.6Very high87.9Confident62 Ų6260 Ų6051%0.51233%0.328SS..Hα-helixtrans-64.5-41.8175.400000111.7G81 T82 L87 S88 W89G81-A85 WeakPolarHBondContact O-CB 3.33Å; G81-A85 PolarHBondContact O-N 2.99Å; T82-A85 PolarHBondContact O-N 3.41Å; A85-L87 VanDerWaalsContact C-N 3.33Å; A85-L87 PolarHBondContact O-N 3.22Å; A85-S88 PolarHBondContact O-N 2.9Å; A85-W89 WeakPolarHBondContact O-CB 3.47Å; A85-W89 PolarHBondContact O-N 2.93Å
86L87.6Confident87.5Confident10 Ų1062.5 Ų62.55%0.05234%0.341CS..Hα-helixtrans-61.3-41.8173.6-70.5172.7000111.6T82 L83 W89 C90 I103 T205 V209 L212 L214T82-L86 HydrophobicContact CG2-CD1 4.3Å; T82-L86 VanDerWaalsContact O-CG 3.29Å; T82-L86 WeakPolarHBondContact O-CG 3.04Å; T82-L86 PolarHBondContact O-N 2.88Å; L83-L86 WeakPolarHBondContact O-CB 3.48Å; L83-L86 PolarHBondContact O-N 3.48Å; L86-W89 PolarHBondContact O-N 3.36Å; L86-C90 WeakPolarHBondContact O-CB 3.39Å; L86-C90 PolarHBondContact O-N 3.29Å; L86-C90 PolarHBondContact O-SG 2.99Å; L86-I103 HydrophobicContact CB-CD1 4.18Å; L86-T205 HydrophobicContact CD1-CG2 4.22Å; L86-V209 HydrophobicContact CD1-CG2 3.77Å; L86-V209 HydrophobicContact CD2-CG2 4.2Å; L86-L212 HydrophobicContact CD2-CD1 4.33Å; L86-L214 HydrophobicContact CD2-CD1 3.18Å
87L90.3Very high87.2Confident26 Ų2665.3 Ų65.314%0.13636%0.364CS..Hα-helixtrans-60.5-50176.3-174.761.8000111L83 S84 A85 W89 C90 H91 I100 I103 N104 L107L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 PolarHBondContact O-N 3.5Å; S84-L87 WeakPolarHBondContact O-CB 3.46Å; S84-L87 PolarHBondContact O-N 3.3Å; A85-L87 VanDerWaalsContact C-N 3.33Å; A85-L87 PolarHBondContact O-N 3.22Å; L87-W89 VanDerWaalsContact C-N 3.34Å; L87-W89 PolarHBondContact O-N 3.11Å; L87-C90 WeakPolarHBondContact O-CB 3.35Å; L87-C90 PolarHBondContact O-N 3.13Å; L87-C90 VanDerWaalsContact O-N 3.12Å; L87-H91 PolarHBondContact O-CD2 3.22Å; L87-H91 PolarHBondContact O-N 3.37Å; L87-I100 HydrophobicContact CD1-CG2 3.9Å; L87-I103 HydrophobicContact CB-CG2 3.83Å; L87-I103 HydrophobicContact CD1-CB 4.27Å; L87-I103 HydrophobicContact CD1-CG2 4.11Å; L87-I103 HydrophobicContact CG-CG2 4.44Å; L87-N104 WeakPolarHBondContact CD2-OD1 3.42Å; L87-L107 HydrophobicContact CD2-CD1 4.01Å
88S90.1Very high87Confident73 Ų7367.6 Ų67.651%0.5137%0.37SS..Hα-helixtrans-59.5-43.9176.8-61.40000112.1S84 A85 C90 H91 L92S84-S88 PolarHBondContact O-N 3.43Å; S84-S88 PolarHBondContact O-OG 3.07Å; A85-S88 PolarHBondContact O-N 2.9Å; S88-C90 VanDerWaalsContact C-N 3.3Å; S88-C90 PolarHBondContact O-N 3.2Å; S88-H91 PolarHBondContact O-N 3Å; S88-L92 WeakPolarHBondContact O-CG 3.47Å; S88-L92 PolarHBondContact O-N 3.23Å; S88-L92 VanDerWaalsContact O-N 3.14Å
89W87.5Confident86.8Confident74 Ų7465 Ų6528%0.2836%0.362SS..Hα-helixtrans-60.3-41175-176.985.5000111.4A85 L86 L87 H91 L92 H93 N95 L212 L214A85-W89 WeakPolarHBondContact O-CB 3.47Å; A85-W89 PolarHBondContact O-N 2.93Å; L86-W89 PolarHBondContact O-N 3.36Å; L87-W89 VanDerWaalsContact C-N 3.34Å; L87-W89 PolarHBondContact O-N 3.11Å; W89-H91 PolarHBondContact O-N 3.48Å; W89-L92 PolarHBondContact O-N 2.92Å; W89-H93 AromaticContact CD1-CD2 3.55Å; W89-H93 AromaticContact CD1-NE2 3.68Å; W89-H93 AromaticContact CD2-CD2 3.67Å; W89-H93 AromaticContact CE2-CD2 3.2Å; W89-H93 AromaticContact CE2-NE2 3.57Å; W89-H93 AromaticContact CG-CD2 3.87Å; W89-H93 AromaticContact CZ2-CD2 3.64Å; W89-H93 AromaticContact CZ2-NE2 3.99Å; W89-H93 AromaticContact NE1-CD2 3.12Å; W89-H93 PolarHBondContact NE1-CD2 2.63Å; W89-H93 AromaticContact NE1-NE2 3.07Å; W89-H93 PolarHBondContact NE1-NE2 2.88Å; W89-H93 PolarHBondContact O-CD2 3.42Å; W89-H93 VanDerWaalsContact O-CD2 3.29Å; W89-H93 PolarHBondContact O-N 3.36Å; W89-N95 WeakPolarHBondContact CZ3-ND2 3.36Å; W89-L212 HydrophobicContact CE3-CD1 4.26Å; W89-L212 HydrophobicContact CH2-CB 4.33Å; W89-L212 HydrophobicContact CH2-CD2 4.37Å; W89-L212 HydrophobicContact CZ3-CB 3.99Å; W89-L212 HydrophobicContact CZ3-CD1 3.97Å; W89-L212 HydrophobicContact CZ3-CD2 3.66Å; W89-L212 HydrophobicContact CZ3-CG 4.06Å; W89-L214 HydrophobicContact CD2-CD2 4.11Å; W89-L214 HydrophobicContact CE3-CD1 4.39Å; W89-L214 HydrophobicContact CE3-CD2 4.43Å; W89-L214 HydrophobicContact CH2-CD2 4.14Å; W89-L214 HydrophobicContact CZ2-CD2 3.78Å; W89-L214 HydrophobicContact CZ3-CD2 4.44Å
90C87.3Confident86.7Confident0 Ų065.9 Ų65.90%037%0.367CS..Hα-helixtrans-66-37178.2-690000113.8L86 L87 S88 L92 N94 N95 L99 I100L86-C90 WeakPolarHBondContact O-CB 3.39Å; L86-C90 PolarHBondContact O-N 3.29Å; L86-C90 PolarHBondContact O-SG 2.99Å; L87-C90 WeakPolarHBondContact O-CB 3.35Å; L87-C90 PolarHBondContact O-N 3.13Å; L87-C90 VanDerWaalsContact O-N 3.12Å; S88-C90 VanDerWaalsContact C-N 3.3Å; S88-C90 PolarHBondContact O-N 3.2Å; C90-L92 VanDerWaalsContact C-N 3.34Å; C90-N94 PolarHBondContact O-N 2.69Å; C90-N95 WeakPolarHBondContact CA-ND2 3.21Å; C90-N95 HydrophobicContact CB-CB 4Å; C90-N95 PolarHBondContact O-N 3.16Å; C90-N95 VanDerWaalsContact O-N 3.09Å; C90-N95 PolarHBondContact SG-ND2 3.32Å; C90-L99 HydrophobicContact CB-CD2 4.12Å; C90-L99 WeakPolarHBondContact SG-CD2 3.32Å; C90-I100 HydrophobicContact CB-CG1 4.2Å
91H87.5Confident86.6Confident107 Ų10763.8 Ų63.850%0.49537%0.365SS..Hα-helixtrans-64.6-38173.6-75.2-60.3000112.3L87 S88 W89L87-H91 PolarHBondContact O-CD2 3.22Å; L87-H91 PolarHBondContact O-N 3.37Å; S88-H91 PolarHBondContact O-N 3Å; W89-H91 PolarHBondContact O-N 3.48Å
92L86.2Confident86.5Confident147 Ų14767.1 Ų67.177%0.7737%0.368SS*.Hα-helixtrans-70.7-36.1178.9-70.3169.8000113.1S88 W89 C90 N94S88-L92 WeakPolarHBondContact O-CG 3.47Å; S88-L92 PolarHBondContact O-N 3.23Å; S88-L92 VanDerWaalsContact O-N 3.14Å; W89-L92 PolarHBondContact O-N 2.92Å; C90-L92 VanDerWaalsContact C-N 3.34Å; L92-N94 VanDerWaalsContact C-N 3.3Å; L92-N94 PolarHBondContact O-N 3.34Å
93H81.7Confident86.5Confident107 Ų10766.3 Ų66.350%0.49536%0.363SS..THydrogen-bonded Turntrans-909.6-178.6-73.9-76.9000114.1W89 N95W89-H93 AromaticContact CD1-CD2 3.55Å; W89-H93 AromaticContact CD1-NE2 3.68Å; W89-H93 AromaticContact CD2-CD2 3.67Å; W89-H93 AromaticContact CE2-CD2 3.2Å; W89-H93 AromaticContact CE2-NE2 3.57Å; W89-H93 AromaticContact CG-CD2 3.87Å; W89-H93 AromaticContact CZ2-CD2 3.64Å; W89-H93 AromaticContact CZ2-NE2 3.99Å; W89-H93 AromaticContact NE1-CD2 3.12Å; W89-H93 PolarHBondContact NE1-CD2 2.63Å; W89-H93 AromaticContact NE1-NE2 3.07Å; W89-H93 PolarHBondContact NE1-NE2 2.88Å; W89-H93 PolarHBondContact O-CD2 3.42Å; W89-H93 VanDerWaalsContact O-CD2 3.29Å; W89-H93 PolarHBondContact O-N 3.36Å; H93-N95 PolarHBondContact O-N 2.84Å
94N76.5Confident86.6Confident154 Ų15469 Ų6982%0.82438%0.378SS*.THydrogen-bonded Turntrans5336.3179.8-132.637.9000112.6C90 L92C90-N94 PolarHBondContact O-N 2.69Å; L92-N94 VanDerWaalsContact C-N 3.3Å; L92-N94 PolarHBondContact O-N 3.34Å
95N75.5Confident86.6Confident44 Ų4471.9 Ų71.924%0.23539%0.389CS..  trans-65.6157.3-178-76.2-35.6000111.5W89 C90 H93 S97W89-N95 WeakPolarHBondContact CZ3-ND2 3.36Å; C90-N95 WeakPolarHBondContact CA-ND2 3.21Å; C90-N95 HydrophobicContact CB-CB 4Å; C90-N95 PolarHBondContact O-N 3.16Å; C90-N95 VanDerWaalsContact O-N 3.09Å; C90-N95 PolarHBondContact SG-ND2 3.32Å; H93-N95 PolarHBondContact O-N 2.84Å; N95-S97 PolarHBondContact O-N 2.99Å
96N79.3Confident86.7Confident120 Ų12069.4 Ų69.464%0.64237%0.367SS*.  trans-52.1137.4-175.4-63-33.8000112.8T98 L99 I100N96-T98 PolarHBondContact O-N 2.86Å; N96-T98 VanDerWaalsContact O-N 3.09Å; N96-L99 WeakPolarHBondContact O-CB 3.44Å; N96-L99 PolarHBondContact O-N 3.39Å; N96-I100 PolarHBondContact O-N 3.35Å
97S84.3Confident87Confident86 Ų8670.1 Ų70.160%0.60137%0.371SS*.Hα-helixtrans-58.5-27.1178.3740000113.1N95 L99 I100 N101N95-S97 PolarHBondContact O-N 2.99Å; S97-L99 VanDerWaalsContact C-N 3.32Å; S97-L99 PolarHBondContact O-N 3.44Å; S97-I100 PolarHBondContact O-N 3.49Å; S97-N101 WeakPolarHBondContact O-CB 3.33Å; S97-N101 PolarHBondContact O-N 2.78Å; S97-N101 PolarHBondContact O-ND2 3.36Å
98T86Confident87.1Confident88 Ų8873.7 Ų73.754%0.5439%0.39SS..Hα-helixtrans-64.2-35.117556.10000112.7N96 K102N96-T98 PolarHBondContact O-N 2.86Å; N96-T98 VanDerWaalsContact O-N 3.09Å; T98-K102 WeakPolarHBondContact O-CG 3.41Å; T98-K102 PolarHBondContact O-N 2.93Å; T98-K102 VanDerWaalsContact O-N 3.13Å
99L85.2Confident87.2Confident22 Ų2270.6 Ų70.612%0.11537%0.37CS..Hα-helixtrans-77.4-39.9179.1-173.2143.8000111C90 N96 S97 N101 K102 I103 L208 L212C90-L99 HydrophobicContact CB-CD2 4.12Å; C90-L99 WeakPolarHBondContact SG-CD2 3.32Å; N96-L99 WeakPolarHBondContact O-CB 3.44Å; N96-L99 PolarHBondContact O-N 3.39Å; S97-L99 VanDerWaalsContact C-N 3.32Å; S97-L99 PolarHBondContact O-N 3.44Å; L99-N101 VanDerWaalsContact C-N 3.33Å; L99-N101 PolarHBondContact O-N 2.98Å; L99-K102 WeakPolarHBondContact O-CB 3.29Å; L99-K102 PolarHBondContact O-N 2.9Å; L99-I103 HydrophobicContact CD2-CD1 3.61Å; L99-I103 HydrophobicContact CD2-CG1 4.38Å; L99-I103 WeakPolarHBondContact O-CG1 3.41Å; L99-I103 PolarHBondContact O-N 2.93Å; L99-L208 HydrophobicContact CD1-CD2 4.4Å; L99-L208 HydrophobicContact CG-CD2 4.35Å; L99-L212 HydrophobicContact CD1-CD1 4.46Å; L99-L212 HydrophobicContact CD1-CD2 3.41Å; L99-L212 VanDerWaalsContact CD1-CD2 3.41Å; L99-L212 HydrophobicContact CD1-CG 4.03Å; L99-L212 HydrophobicContact CD2-CD1 4.28Å; L99-L212 HydrophobicContact CD2-CD2 4.09Å; L99-L212 HydrophobicContact CG-CD2 4.42Å
100I88.3Confident87.5Confident25 Ų2567.1 Ų67.113%0.12836%0.356CS..Hα-helixtrans-57.9-47172.1-68.2169.7000110.3L87 C90 N96 S97 K102 I103 N104L87-I100 HydrophobicContact CD1-CG2 3.9Å; C90-I100 HydrophobicContact CB-CG1 4.2Å; N96-I100 PolarHBondContact O-N 3.35Å; S97-I100 PolarHBondContact O-N 3.49Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 3.49Å; I100-I103 PolarHBondContact O-N 2.96Å; I100-N104 PolarHBondContact O-N 3.04Å; I100-N104 PolarHBondContact O-ND2 3.03Å
101N89.8Confident87.7Confident89 Ų8968.5 Ų68.548%0.47637%0.371SS..Hα-helixtrans-62.6-37.8176.9-70.4-13.1000112.6S97 L99 N104 N105S97-N101 WeakPolarHBondContact O-CB 3.33Å; S97-N101 PolarHBondContact O-N 2.78Å; S97-N101 PolarHBondContact O-ND2 3.36Å; L99-N101 VanDerWaalsContact C-N 3.33Å; L99-N101 PolarHBondContact O-N 2.98Å; N101-N104 PolarHBondContact O-N 3.02Å; N101-N105 PolarHBondContact O-N 2.92Å; N101-N105 PolarHBondContact O-ND2 3.45Å
102K89.5Confident87.9Confident110 Ų11068.5 Ų68.548%0.47837%0.371SS..Hα-helixtrans-62.4-43.3173.9-77.2178-178.9-172.60112.2T98 L99 I100 N105 L106 L208T98-K102 WeakPolarHBondContact O-CG 3.41Å; T98-K102 PolarHBondContact O-N 2.93Å; T98-K102 VanDerWaalsContact O-N 3.13Å; L99-K102 WeakPolarHBondContact O-CB 3.29Å; L99-K102 PolarHBondContact O-N 2.9Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 3.49Å; K102-N105 PolarHBondContact O-N 3.39Å; K102-L106 WeakPolarHBondContact O-CG 3.28Å; K102-L106 PolarHBondContact O-N 3.32Å; K102-L208 HydrophobicContact CD-CD2 4.38Å
103I90.6Very high88Confident0 Ų061.8 Ų61.80%034%0.337CS..Hα-helixtrans-64.9-41.9178.1-65.4168.5000110.7L83 L86 L87 L99 I100 L106 L107 L208L83-I103 HydrophobicContact CB-CG2 4.43Å; L83-I103 HydrophobicContact CD2-CG2 4.36Å; L83-I103 WeakPolarHBondContact O-CG2 3.21Å; L86-I103 HydrophobicContact CB-CD1 4.18Å; L87-I103 HydrophobicContact CB-CG2 3.83Å; L87-I103 HydrophobicContact CD1-CB 4.27Å; L87-I103 HydrophobicContact CD1-CG2 4.11Å; L87-I103 HydrophobicContact CG-CG2 4.44Å; L99-I103 HydrophobicContact CD2-CD1 3.61Å; L99-I103 HydrophobicContact CD2-CG1 4.38Å; L99-I103 WeakPolarHBondContact O-CG1 3.41Å; L99-I103 PolarHBondContact O-N 2.93Å; I100-I103 PolarHBondContact O-N 2.96Å; I103-L106 PolarHBondContact O-N 3.3Å; I103-L107 HydrophobicContact CG2-CD1 4.15Å; I103-L107 PolarHBondContact O-N 3.3Å; I103-L208 HydrophobicContact CG1-CD1 3.92Å
104N92.5Very high88.5Confident57 Ų5758.8 Ų58.831%0.30532%0.323SS..Hα-helixtrans-61.5-45.4175.6-72.6-36.3000112L87 I100 N101 L106 L107 D108L87-N104 WeakPolarHBondContact CD2-OD1 3.42Å; I100-N104 PolarHBondContact O-N 3.04Å; I100-N104 PolarHBondContact O-ND2 3.03Å; N101-N104 PolarHBondContact O-N 3.02Å; N104-L106 VanDerWaalsContact C-N 3.27Å; N104-L106 PolarHBondContact O-N 3.04Å; N104-L107 WeakPolarHBondContact O-CB 3.39Å; N104-L107 PolarHBondContact O-N 3.23Å; N104-L107 VanDerWaalsContact O-N 3.11Å; N104-D108 PolarHBondContact O-N 3.11Å
105N93Very high89.1Confident109 Ų10958.3 Ų58.358%0.58332%0.315SS*.Hα-helixtrans-60.4-36.5175.5-68.6-16000112.4N101 K102 A109N101-N105 PolarHBondContact O-N 2.92Å; N101-N105 PolarHBondContact O-ND2 3.45Å; K102-N105 PolarHBondContact O-N 3.39Å; N105-A109 WeakPolarHBondContact O-CB 3.34Å; N105-A109 PolarHBondContact O-N 3.22Å
106L91.9Very high89.8Confident9 Ų962.6 Ų62.65%0.04733%0.329CS..Hα-helixtrans-70.1-39174.8-71.5173.7000112.1L83 K102 I103 N104 D108 A109 V110 W200 I201 Q204 L208L83-L106 HydrophobicContact CD1-CB 4Å; L83-L106 HydrophobicContact CD2-CB 4.15Å; L83-L106 HydrophobicContact CD2-CD1 4.1Å; K102-L106 WeakPolarHBondContact O-CG 3.28Å; K102-L106 PolarHBondContact O-N 3.32Å; I103-L106 PolarHBondContact O-N 3.3Å; N104-L106 VanDerWaalsContact C-N 3.27Å; N104-L106 PolarHBondContact O-N 3.04Å; L106-D108 VanDerWaalsContact C-N 3.32Å; L106-D108 PolarHBondContact O-N 3.46Å; L106-A109 WeakPolarHBondContact O-CB 3.43Å; L106-A109 PolarHBondContact O-N 2.82Å; L106-V110 WeakPolarHBondContact O-CG2 3.36Å; L106-V110 PolarHBondContact O-N 2.91Å; L106-W200 HydrophobicContact CD2-CH2 4.08Å; L106-W200 HydrophobicContact CD2-CZ3 3.81Å; L106-I201 HydrophobicContact CD2-CG2 4.29Å; L106-Q204 HydrophobicContact CD1-CB 4.02Å; L106-Q204 HydrophobicContact CD2-CB 3.67Å; L106-Q204 HydrophobicContact CD2-CG 4.16Å; L106-Q204 HydrophobicContact CG-CB 4.5Å; L106-L208 HydrophobicContact CD1-CD1 3.42Å; L106-L208 VanDerWaalsContact CD1-CD1 3.42Å
107L93.8Very high90.2Very high26 Ų2658.4 Ų58.414%0.13631%0.308CS..Hα-helixtrans-61.3-41.8174-80.6166.4000111.5R80 L83 L87 I103 N104 V110 G111R80-L107 HydrophobicContact CG-CD2 3.81Å; L83-L107 HydrophobicContact CB-CD2 3.64Å; L83-L107 HydrophobicContact CB-CG 3.89Å; L83-L107 HydrophobicContact CD1-CD2 4.29Å; L83-L107 HydrophobicContact CD1-CG 4.4Å; L87-L107 HydrophobicContact CD2-CD1 4.01Å; I103-L107 HydrophobicContact CG2-CD1 4.15Å; I103-L107 PolarHBondContact O-N 3.3Å; N104-L107 WeakPolarHBondContact O-CB 3.39Å; N104-L107 PolarHBondContact O-N 3.23Å; N104-L107 VanDerWaalsContact O-N 3.11Å; L107-V110 PolarHBondContact O-N 2.93Å; L107-G111 PolarHBondContact O-N 3.49Å; L107-G111 VanDerWaalsContact O-N 3.07Å
108D93.8Very high90.3Very high100 Ų10057.7 Ų57.754%0.53530%0.297SS..Hα-helixtrans-65-42175.3-68.2-22.5000111.4N104 L106 V110 G111 Q112N104-D108 PolarHBondContact O-N 3.11Å; L106-D108 VanDerWaalsContact C-N 3.32Å; L106-D108 PolarHBondContact O-N 3.46Å; D108-V110 PolarHBondContact O-N 3.33Å; D108-G111 PolarHBondContact O-N 2.88Å; D108-Q112 WeakPolarHBondContact O-CG 3.36Å; D108-Q112 PolarHBondContact O-N 2.99Å
109A92.1Very high90.4Very high9 Ų961.1 Ų61.17%0.07430%0.304CS..Hα-helixtrans-60.1-43.4174.700000112.1N105 L106 G111 Q112 C113 P196 I201N105-A109 WeakPolarHBondContact O-CB 3.34Å; N105-A109 PolarHBondContact O-N 3.22Å; L106-A109 WeakPolarHBondContact O-CB 3.43Å; L106-A109 PolarHBondContact O-N 2.82Å; A109-G111 VanDerWaalsContact C-N 3.33Å; A109-G111 PolarHBondContact O-N 3.02Å; A109-Q112 PolarHBondContact O-N 3.47Å; A109-C113 PolarHBondContact O-N 2.86Å; A109-C113 PolarHBondContact O-SG 3.32Å; A109-P196 HydrophobicContact CB-CB 3.99Å; A109-P196 HydrophobicContact CB-CG 3.65Å; A109-I201 HydrophobicContact CB-CD1 3.93Å; A109-I201 HydrophobicContact CB-CG1 4.29Å
110V92.8Very high90.4Very high0 Ų065 Ų650%032%0.322CS..Hα-helixtrans-59.5-44.7174.9172.10000110.9Y76 L79 R80 L83 L106 L107 D108 Q112 C113 E114 I201Y76-V110 HydrophobicContact CD1-CG1 4.34Å; L79-V110 HydrophobicContact CD2-CG2 3.75Å; L79-V110 HydrophobicContact CG-CG2 3.93Å; R80-V110 HydrophobicContact CB-CG1 4.27Å; L83-V110 HydrophobicContact CD1-CG2 3.85Å; L106-V110 WeakPolarHBondContact O-CG2 3.36Å; L106-V110 PolarHBondContact O-N 2.91Å; L107-V110 PolarHBondContact O-N 2.93Å; D108-V110 PolarHBondContact O-N 3.33Å; V110-Q112 VanDerWaalsContact C-N 3.33Å; V110-Q112 PolarHBondContact O-N 3.43Å; V110-C113 PolarHBondContact O-N 3.32Å; V110-E114 WeakPolarHBondContact O-CB 3.41Å; V110-E114 PolarHBondContact O-N 3.2Å; V110-I201 HydrophobicContact CG2-CD1 3.98Å; V110-I201 HydrophobicContact CG2-CG2 3.64Å
111G91.3Very high90Very high30 Ų3067.1 Ų67.131%0.30933%0.333SS..Hα-helixtrans-60.8-41.1178.400000112.8L107 D108 A109 E114 E115L107-G111 PolarHBondContact O-N 3.49Å; L107-G111 VanDerWaalsContact O-N 3.07Å; D108-G111 PolarHBondContact O-N 2.88Å; A109-G111 VanDerWaalsContact C-N 3.33Å; A109-G111 PolarHBondContact O-N 3.02Å; G111-E114 PolarHBondContact O-N 3.36Å; G111-E115 PolarHBondContact O-N 3.18Å
112Q91.2Very high89.5Confident106 Ų10671 Ų7150%0.49535%0.346SS..Hα-helixtrans-66.3-41.3176.7-68.9170.938.800112.2D108 A109 V110 Y116D108-Q112 WeakPolarHBondContact O-CG 3.36Å; D108-Q112 PolarHBondContact O-N 2.99Å; A109-Q112 PolarHBondContact O-N 3.47Å; V110-Q112 VanDerWaalsContact C-N 3.33Å; V110-Q112 PolarHBondContact O-N 3.43Å; Q112-Y116 WeakPolarHBondContact O-CB 3.23Å; Q112-Y116 PolarHBondContact O-N 3.41Å
113C89.2Confident88.8Confident7 Ų769.8 Ų69.85%0.04735%0.351CS..Hα-helixtrans-62.3-45.1174.1-62.70000111.9Y76 A109 V110 E115 Y116 V117 P196 I201Y76-C113 HydrophobicContact CE1-CB 3.76Å; A109-C113 PolarHBondContact O-N 2.86Å; A109-C113 PolarHBondContact O-SG 3.32Å; V110-C113 PolarHBondContact O-N 3.32Å; C113-E115 PolarHBondContact O-N 3.49Å; C113-Y116 PolarHBondContact O-N 2.96Å; C113-V117 WeakPolarHBondContact O-CG2 3.22Å; C113-V117 PolarHBondContact O-N 3.46Å; C113-P196 PolarHBondContact SG-O 2.95Å; C113-I201 WeakPolarHBondContact SG-CD1 3.27Å
114E91.1Very high87.6Confident44 Ų4474.1 Ų74.121%0.20638%0.377CS..Hα-helixtrans-58.6-48.1179.8-175.6-177.3169.300110.6I73 V110 G111 Y116 V117 L118I73-E114 HydrophobicContact CD1-CG 3.69Å; I73-E114 WeakPolarHBondContact CD1-OE1 3.48Å; V110-E114 WeakPolarHBondContact O-CB 3.41Å; V110-E114 PolarHBondContact O-N 3.2Å; G111-E114 PolarHBondContact O-N 3.36Å; E114-Y116 PolarHBondContact O-N 3.33Å; E114-V117 PolarHBondContact O-N 2.96Å; E114-L118 HydrophobicContact CG-CD1 4.15Å; E114-L118 WeakPolarHBondContact O-CB 3.29Å; E114-L118 VanDerWaalsContact O-CG 3.29Å; E114-L118 WeakPolarHBondContact O-CG 2.9Å; E114-L118 PolarHBondContact O-N 3.41Å
115E90.9Very high85.9Confident143 Ų14376.8 Ų76.867%0.66840%0.395SS*.Hα-helixtrans-64.1-41.7178.6-172.1172.1-169.300112.3G111 C113 V117 L118 K119G111-E115 PolarHBondContact O-N 3.18Å; C113-E115 PolarHBondContact O-N 3.49Å; E115-V117 PolarHBondContact O-N 3.49Å; E115-L118 PolarHBondContact O-N 3.05Å; E115-K119 WeakPolarHBondContact O-CB 3.44Å; E115-K119 PolarHBondContact O-N 2.92Å
116Y88.7Confident84.1Confident135 Ų13576.3 Ų76.353%0.52940%0.399SS..Hα-helixtrans-59-47.4175.8176.8-94.9000111.8Q112 C113 E114 K119 H120Q112-Y116 WeakPolarHBondContact O-CB 3.23Å; Q112-Y116 PolarHBondContact O-N 3.41Å; C113-Y116 PolarHBondContact O-N 2.96Å; E114-Y116 PolarHBondContact O-N 3.33Å; Y116-K119 PolarHBondContact O-N 3.14Å; Y116-H120 PolarHBondContact O-N 3.03Å
117V87.9Confident82.2Confident32 Ų3282 Ų8219%0.19444%0.436CS..Hα-helixtrans-66.1-43.4179.6171.90000111.2V72 Y76 C113 E114 E115 K119 H120 L121V72-V117 HydrophobicContact CG1-CG1 3.55Å; Y76-V117 HydrophobicContact CE2-CG2 4.31Å; C113-V117 WeakPolarHBondContact O-CG2 3.22Å; C113-V117 PolarHBondContact O-N 3.46Å; E114-V117 PolarHBondContact O-N 2.96Å; E115-V117 PolarHBondContact O-N 3.49Å; V117-K119 VanDerWaalsContact C-N 3.28Å; V117-K119 PolarHBondContact O-N 3.32Å; V117-H120 PolarHBondContact O-N 3.23Å; V117-L121 HydrophobicContact CG1-CD1 4.07Å; V117-L121 HydrophobicContact CG1-CG 4.37Å; V117-L121 WeakPolarHBondContact O-CG 3.4Å; V117-L121 PolarHBondContact O-N 3.03Å
118L87.3Confident80.4Confident70 Ų7084.5 Ų84.537%0.36646%0.456SS..Hα-helixtrans-60.8-38176-74.7173000112.3I73 E114 E115 K122I73-L118 HydrophobicContact CD1-CD2 4.41Å; E114-L118 HydrophobicContact CG-CD1 4.15Å; E114-L118 WeakPolarHBondContact O-CB 3.29Å; E114-L118 VanDerWaalsContact O-CG 3.29Å; E114-L118 WeakPolarHBondContact O-CG 2.9Å; E114-L118 PolarHBondContact O-N 3.41Å; E115-L118 PolarHBondContact O-N 3.05Å; L118-K122 WeakPolarHBondContact O-CG 3.41Å; L118-K122 PolarHBondContact O-N 2.91Å
119K87.7Confident78.6Confident161 Ų16185.8 Ų85.870%0.746%0.458SS*.Hα-helixtrans-66-42.4175.6-171.8177.9-180-179.90111.5E115 Y116 V117 K122 S123E115-K119 WeakPolarHBondContact O-CB 3.44Å; E115-K119 PolarHBondContact O-N 2.92Å; Y116-K119 PolarHBondContact O-N 3.14Å; V117-K119 VanDerWaalsContact C-N 3.28Å; V117-K119 PolarHBondContact O-N 3.32Å; K119-K122 PolarHBondContact O-N 3.28Å; K119-S123 PolarHBondContact O-N 2.99Å
120H84.4Confident77Confident104 Ų10489.4 Ų89.448%0.48148%0.479SS..Hα-helixtrans-63.4-46.2177.2-173.6-90.3000111.7Y116 V117 K122 S123 V124Y116-H120 PolarHBondContact O-N 3.03Å; V117-H120 PolarHBondContact O-N 3.23Å; H120-K122 VanDerWaalsContact C-N 3.26Å; H120-K122 PolarHBondContact O-N 3.36Å; H120-S123 PolarHBondContact O-N 2.76Å; H120-S123 PolarHBondContact O-OG 3.38Å; H120-V124 WeakPolarHBondContact O-CG2 3.45Å; H120-V124 PolarHBondContact O-N 3.12Å
121L81.5Confident75.3Confident68 Ų6893.8 Ų93.836%0.35651%0.506SS..Hα-helixtrans-57.6-38.1177.1-71.2172.5000112.4V117 S123V117-L121 HydrophobicContact CG1-CD1 4.07Å; V117-L121 HydrophobicContact CG1-CG 4.37Å; V117-L121 WeakPolarHBondContact O-CG 3.4Å; V117-L121 PolarHBondContact O-N 3.03Å; L121-S123 VanDerWaalsContact C-N 3.34Å; L121-S123 PolarHBondContact O-N 2.85Å
122K79.4Confident73.6Confident172 Ų17296.9 Ų96.975%0.74852%0.515SS*.Hα-helixtrans-67.2-31.1176-72.9174.1-177.6178.20113.5L118 K119 H120L118-K122 WeakPolarHBondContact O-CG 3.41Å; L118-K122 PolarHBondContact O-N 2.91Å; K119-K122 PolarHBondContact O-N 3.28Å; H120-K122 VanDerWaalsContact C-N 3.26Å; H120-K122 PolarHBondContact O-N 3.36Å
123S74.5Confident72.1Confident84 Ų8496.7 Ų96.759%0.58752%0.517SS*.Hα-helixtrans-82.5-19-176.657.30000115.3K119 H120 L121 T125K119-S123 PolarHBondContact O-N 2.99Å; H120-S123 PolarHBondContact O-N 2.76Å; H120-S123 PolarHBondContact O-OG 3.38Å; L121-S123 VanDerWaalsContact C-N 3.34Å; L121-S123 PolarHBondContact O-N 2.85Å; S123-T125 PolarHBondContact O-N 3.35Å
124V64.7Low70.7Confident91 Ų9199.8 Ų99.855%0.55253%0.533SS*.THydrogen-bonded Turntrans-78-5.7-176173.40000113H120 P126H120-V124 WeakPolarHBondContact O-CG2 3.45Å; H120-V124 PolarHBondContact O-N 3.12Å; V124-P126 WeakPolarHBondContact O-CD 3.47Å
125T57.1Low69.1Low112 Ų112102.3 Ų102.369%0.68755%0.548SS*.  trans-101.680.4177.9-41.20000110.4S123S123-T125 PolarHBondContact O-N 3.35Å
126P54.8Low67.5Low100 Ų10099.4 Ų99.465%0.64954%0.543SS*.  trans-64.9138.7164.928.2-30.5000108V124 S128V124-P126 WeakPolarHBondContact O-CD 3.47Å; P126-S128 PolarHBondContact O-N 2.9Å
127P53Low66.1Low127 Ų12796 Ų9683%0.82553%0.534SS*.  trans-62.8112.3173.325.2-30.3000107.7H129P127-H129 PolarHBondContact O-N 3.37Å
128S55.6Low64.6Low80 Ų80100.6 Ų100.656%0.55955%0.553SS**  trans-63.5118.9172.854.80000108.2P126 V130 V131P126-S128 PolarHBondContact O-N 2.9Å; S128-V130 PolarHBondContact O-N 3.37Å; S128-V131 PolarHBondContact O-N 2.86Å
129H56.3Low63.3Low126 Ų126104.2 Ų104.258%0.58357%0.572SS**THydrogen-bonded Turntrans-54.12.7173.7-168.5-62.4000114P127 V131 D132 L133P127-H129 PolarHBondContact O-N 3.37Å; H129-V131 PolarHBondContact O-N 3.03Å; H129-D132 PolarHBondContact O-N 3.46Å; H129-L133 PolarHBondContact O-N 3.3Å
130V57.3Low62Low85 Ų85102.4 Ų102.452%0.51557%0.568SS.*Hα-helixtrans-63-31176.1-176.80000111.3S128 L133 L134S128-V130 PolarHBondContact O-N 3.37Å; V130-L133 PolarHBondContact O-N 3.43Å; V130-L134 HydrophobicContact CG1-CD1 3.94Å; V130-L134 WeakPolarHBondContact O-CD1 3.39Å; V130-L134 WeakPolarHBondContact O-CG 3.42Å; V130-L134 PolarHBondContact O-N 2.87Å
131V56.8Low60.9Low92 Ų92103.1 Ų103.156%0.55858%0.575SS**Hα-helixtrans-62.8-44.9176.7-178.90000110.9S128 H129 L133 L134 D135S128-V131 PolarHBondContact O-N 2.86Å; H129-V131 PolarHBondContact O-N 3.03Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3Å; V131-L134 PolarHBondContact O-N 3.2Å; V131-D135 PolarHBondContact O-N 2.94Å
132D56.3Low59.9Low95 Ų95104.3 Ų104.351%0.50858%0.581SS.*Hα-helixtrans-71.1-27.7-177.3-56.6-40000113.2H129 S136H129-D132 PolarHBondContact O-N 3.46Å; D132-S136 PolarHBondContact O-OG 3.42Å
133L60.1Low58.5Low103 Ų103100.6 Ų100.654%0.53958%0.575SS.*Hα-helixtrans-75.8-25.8175.7-73170.3000112.7H129 V130 V131 I137H129-L133 PolarHBondContact O-N 3.3Å; V130-L133 PolarHBondContact O-N 3.43Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3Å; L133-I137 PolarHBondContact O-N 3.01Å
134L58.5Low57.3Low72 Ų72103.1 Ų103.138%0.37758%0.578SS.*Hα-helixtrans-80.8-36-178-78.9162.8000112.5V130 V131 S136 I137 E138V130-L134 HydrophobicContact CG1-CD1 3.94Å; V130-L134 WeakPolarHBondContact O-CD1 3.39Å; V130-L134 WeakPolarHBondContact O-CG 3.42Å; V130-L134 PolarHBondContact O-N 2.87Å; V131-L134 PolarHBondContact O-N 3.2Å; L134-S136 PolarHBondContact O-N 3.29Å; L134-I137 HydrophobicContact CD2-CD1 4.31Å; L134-I137 WeakPolarHBondContact O-CA 3.38Å; L134-I137 WeakPolarHBondContact O-CB 3.41Å; L134-I137 PolarHBondContact O-N 3.45Å; L134-E138 PolarHBondContact O-N 3.32Å; L134-E138 VanDerWaalsContact O-N 3.11Å
135D58Low56.6Low97 Ų97105.3 Ų105.352%0.51959%0.591SS.*Hα-helixtrans-61.1-28.5171.6-73.71.4000111.1V131 E138V131-D135 PolarHBondContact O-N 2.94Å; D135-E138 PolarHBondContact O-N 3.43Å
136S58.6Low56Low81 Ų81105.4 Ų105.457%0.56659%0.591SS**THydrogen-bonded Turntrans-74.8-22.4172.8-59.50000113.6D132 L134D132-S136 PolarHBondContact O-OG 3.42Å; L134-S136 PolarHBondContact O-N 3.29Å
137I59.3Low55.5Low65 Ų65105.7 Ų105.733%0.33359%0.593SS.*THydrogen-bonded Turntrans-82.8-25.8175-72.9168.3000111L133 L134 D139 M140L133-I137 PolarHBondContact O-N 3.01Å; L134-I137 HydrophobicContact CD2-CD1 4.31Å; L134-I137 WeakPolarHBondContact O-CA 3.38Å; L134-I137 WeakPolarHBondContact O-CB 3.41Å; L134-I137 PolarHBondContact O-N 3.45Å; I137-D139 PolarHBondContact O-N 3.06Å; I137-M140 HydrophobicContact CG1-CE 4.34Å; I137-M140 HydrophobicContact CG2-CE 4.2Å; I137-M140 PolarHBondContact O-N 2.88Å
138E56.1Low54.9Low127 Ų127104 Ų10459%0.59359%0.59SS**THydrogen-bonded Turntrans-63.4-20.2175.6-154.8168.3-162.100112.5L134 D135L134-E138 PolarHBondContact O-N 3.32Å; L134-E138 VanDerWaalsContact O-N 3.11Å; D135-E138 PolarHBondContact O-N 3.43Å
139D59.6Low54.4Low146 Ų146109.1 Ų109.178%0.78161%0.605SS**THydrogen-bonded Turntrans-98.3-0.2178.1-159.240.5000114.2I137 D141I137-D139 PolarHBondContact O-N 3.06Å; D139-D141 PolarHBondContact O-N 2.97Å; D139-D141 VanDerWaalsContact O-N 3.08Å
140M59.9Low53.7Low123 Ų123112.4 Ų112.461%0.60662%0.617SS**  trans-75.5103.1171.9-79.3-160.5-50.900109.7I137 I142I137-M140 HydrophobicContact CG1-CE 4.34Å; I137-M140 HydrophobicContact CG2-CE 4.2Å; I137-M140 PolarHBondContact O-N 2.88Å; M140-I142 WeakPolarHBondContact O-CG1 3.47Å; M140-I142 PolarHBondContact O-N 3.44Å
141D60.9Low53Low120 Ų120118 Ų11864%0.64264%0.635SS**  trans-59.696.4171.4-163.917.8000109.6D139 C143D139-D141 PolarHBondContact O-N 2.97Å; D139-D141 VanDerWaalsContact O-N 3.08Å; D141-C143 PolarHBondContact O-N 2.88Å; D141-C143 PolarHBondContact OD2-SG 3.18Å
142I61.5Low52Low93 Ų93121.8 Ų121.848%0.47765%0.65SS.*  trans-70.471.1176.3-49.3177000107.9Y46 M140 H144Y46-I142 HydrophobicContact CD1-CD1 4.05Å; Y46-I142 HydrophobicContact CD2-CD1 4.34Å; Y46-I142 HydrophobicContact CE1-CD1 3.85Å; Y46-I142 HydrophobicContact CE2-CD1 4.18Å; Y46-I142 HydrophobicContact CG-CD1 4.27Å; M140-I142 WeakPolarHBondContact O-CG1 3.47Å; M140-I142 PolarHBondContact O-N 3.44Å; I142-H144 PolarHBondContact O-N 3.35Å
143C49.1Very low51Low93 Ų93124.3 Ų124.363%0.62866%0.664SS**  trans-75.5107.9170.7-84.70000108.4D141 V145D141-C143 PolarHBondContact O-N 2.88Å; D141-C143 PolarHBondContact OD2-SG 3.18Å; C143-V145 PolarHBondContact O-N 2.93Å
144H50.4Low50Low138 Ų138127.9 Ų127.964%0.63968%0.678SS**  trans-64.3117.7166.3-75.4-79.3000109.5I142 V146I142-H144 PolarHBondContact O-N 3.35Å; H144-V146 VanDerWaalsContact C-N 3.25Å; H144-V146 HydrophobicContact CB-CG2 4.46Å; H144-V146 PolarHBondContact O-N 3.12Å
145V49.7Very low49Very low137 Ų137128.6 Ų128.683%0.8369%0.694SS**  trans-63.193.8157.8177.60000106.7C143 P147C143-V145 PolarHBondContact O-N 2.93Å; V145-P147 WeakPolarHBondContact O-CD 3.44Å
146V44.3Very low48.1Very low113 Ų113133.7 Ų133.769%0.68571%0.711SS**  trans-83.4114.1157.6-179.70000105.3H144 A148H144-V146 VanDerWaalsContact C-N 3.25Å; H144-V146 HydrophobicContact CB-CG2 4.46Å; H144-V146 PolarHBondContact O-N 3.12Å; V146-A148 PolarHBondContact O-N 3.43Å; V146-A148 VanDerWaalsContact O-N 3.14Å
147P43.4Very low46.9Very low107 Ų107137 Ų13770%0.69572%0.723SS**  trans-60.9122.4168.4-13.427.7000106.9V145 E149V145-P147 WeakPolarHBondContact O-CD 3.44Å; P147-E149 PolarHBondContact O-N 3.31Å
148A40.7Very low45.7Very low91 Ų91141.6 Ų141.675%0.75274%0.743SS**  trans-47125.9175.200000109.7V146 K150V146-A148 PolarHBondContact O-N 3.43Å; V146-A148 VanDerWaalsContact O-N 3.14Å; A148-K150 PolarHBondContact O-N 3.47Å
149E44.7Very low44.7Very low188 Ų188146 Ų14688%0.87975%0.754SS**  trans-51.3104172.6-69.2173.1164.200108.8P147 K151P147-E149 PolarHBondContact O-N 3.31Å; E149-K151 PolarHBondContact O-N 2.76Å
150K42.3Very low43.4Very low194 Ų194146 Ų14684%0.84375%0.753SS**  trans-67.6119.7161.5-87-176.8176.3179.20106.3A148 I152A148-K150 PolarHBondContact O-N 3.47Å; K150-I152 PolarHBondContact O-N 3.4Å; K150-I152 VanDerWaalsContact O-N 3.11Å
151K43.8Very low42.3Very low203 Ų203145 Ų14588%0.88376%0.757SS**  trans-43.4118167.6-63.9-162.7175.3-168.30108.9E149 D153E149-K151 PolarHBondContact O-N 2.76Å; K151-D153 PolarHBondContact O-N 3.33Å
152I35.1Very low41.2Very low172 Ų172147.4 Ų147.488%0.88277%0.765SS**  trans-78105.8173.4-57.8171.5000105.6K150K150-I152 PolarHBondContact O-N 3.4Å; K150-I152 VanDerWaalsContact O-N 3.11Å
153D34.1Very low40Very low148 Ų148150.4 Ų150.479%0.79178%0.781SS**  trans-99.9151156.7-153-1.6000107.9K151K151-D153 PolarHBondContact O-N 3.33Å
154E39.7Very low39.5Very low177 Ų177152 Ų15283%0.82778%0.784SS**  trans-64159-156.8-65.6176.7149.600116.5
155A37.6Very low38.9Very low87 Ų87150.4 Ų150.472%0.71979%0.794SS**  trans95.3108.4148.200000120
156K38.5Very low38.1Very low204 Ų204151 Ų15189%0.88779%0.788SS**  trans73.9109.3136-64.7-174.4-179.7-179.60119.7
157D33.3Very low37.8Very low151 Ų151155.7 Ų155.781%0.80780%0.8SS**  104.5141.7122.3-146.112.8000119.2
158E34.3Very low37.5Very low162 Ų162157.6 Ų157.676%0.75780%0.804SS**  trans74101.7165.9-68.8-170.9153.900121.2
159R36.1Very low37.5Very low220 Ų220160 Ų16083%0.8380%0.804SS**  68.4107.1123.6-123.3-176.1-173.1-168.92.4117.3
160L32.4Very low36.9Very low145 Ų145157 Ų15776%0.75980%0.803SS**  162.3139.1102.8-84.6169.2000113.3
161C35.9Very low36.9Very low101 Ų101152 Ų15268%0.68279%0.792SS**  trans73.196150.4-610000119.6
162E39.1Very low36.6Very low172 Ų172151.3 Ų151.380%0.80479%0.789SS**  trans-39.9133139.4-66.3167.9159.300111.1
163N36.2Very low37.1Very low155 Ų155147.7 Ų147.783%0.82978%0.779SS**  trans-138.6101153-84.2-44.5000108.3A165N163-A165 PolarHBondContact O-N 3.37Å
164N37.3Very low37Very low126 Ų126149.6 Ų149.667%0.67478%0.783SS**  trans-58.3121.5161.6-62.3-52.6000108.2E166N164-E166 HydrophobicContact CB-CG 4.42Å; N164-E166 PolarHBondContact O-N 3.47Å
165A38.1Very low36.8Very low105 Ų105146.1 Ų146.187%0.86878%0.779SS**  trans-76.177.7167.500000108.7N163N163-A165 PolarHBondContact O-N 3.37Å
166E33.7Very low36.9Very low150 Ų150145.6 Ų145.670%0.70178%0.782SS**  trans-65.3130163.6-72.9178.8163.600109.1N164 N168N164-E166 HydrophobicContact CB-CG 4.42Å; N164-E166 PolarHBondContact O-N 3.47Å; E166-N168 PolarHBondContact O-N 3.24Å
167F38Very low36.7Very low211 Ų211144.2 Ų144.293%0.92578%0.782SS**  trans-56.898.5168.5-93.8-97.2000109.6N169F167-N169 PolarHBondContact O-N 3.17Å; F167-N169 VanDerWaalsContact O-N 3.14Å
168N36.3Very low36.4Very low148 Ų148144.1 Ų144.179%0.79178%0.782SS**  trans-82.992.1169.6-97.7-50.8000110.1E166 C170E166-N168 PolarHBondContact O-N 3.24Å; N168-C170 PolarHBondContact O-N 2.95Å
169N41.6Very low36.5Very low140 Ų140142.6 Ų142.675%0.74979%0.787SS**  trans-67.898.4156.1-162.90.2000107.8F167 S171F167-N169 PolarHBondContact O-N 3.17Å; F167-N169 VanDerWaalsContact O-N 3.14Å; N169-S171 PolarHBondContact O-N 3.4Å
170C31.5Very low36.6Very low127 Ų127136.5 Ų136.586%0.85878%0.778SS**  trans-81.789.4179.9-160.40000110.2N168N168-C170 PolarHBondContact O-N 2.95Å
171S42.5Very low36.8Very low87 Ų87139.5 Ų139.561%0.60878%0.781SS**  trans-109.4114.6161-55.10000108N169N169-S171 PolarHBondContact O-N 3.4Å
172K37.8Very low37Very low189 Ų189142.6 Ų142.682%0.82279%0.79SS**  trans171103.7151.6-95.9158.4-175.4-179.50108.5
173S45.4Very low36.5Very low97 Ų97141.8 Ų141.868%0.67879%0.786SS**  59.6101.576.177.40000114.6
174H31.3Very low36.2Very low187 Ų187138.3 Ų138.387%0.86677%0.773SS**  trans160130140-99.3-81.7000106.8
175S36.6Very low35.9Very low105 Ų105138.7 Ų138.773%0.73478%0.784SS**  cis-169134.36.445.90000108.5
176G38.7Very low35.7Very low76 Ų76143.6 Ų143.678%0.78478%0.78SS**  trans79.778.314800000117.5
177I35.1Very low36.2Very low175 Ų175142.5 Ų142.590%0.89778%0.784SS**  trans-136.3125.1134.3-80139.4000105.3C179I177-C179 PolarHBondContact O-N 3.49Å
178D27Very low35.9Very low149 Ų149141.6 Ų141.680%0.79778%0.782SS**  trans-52.4131.2-171.5-101.7-39.2000113.4S180D178-S180 PolarHBondContact O-N 3.47Å; D178-S180 VanDerWaalsContact O-N 3.11Å
179C35.8Very low36.2Very low129 Ų129141.6 Ų141.687%0.87278%0.778SS**  trans-7491.8162.8-173.30000108I177I177-C179 PolarHBondContact O-N 3.49Å
180S38.2Very low36.2Very low92 Ų92143.2 Ų143.264%0.64378%0.78SS**  trans-146.371.916767.50000110.7D178D178-S180 PolarHBondContact O-N 3.47Å; D178-S180 VanDerWaalsContact O-N 3.11Å
181Y36Very low36.3Very low208 Ų208141.4 Ų141.482%0.81678%0.775SS**  trans-142.641.8153.8-138.1-95.1000111.1E183Y181-E183 VanDerWaalsContact C-N 3.26Å
182L40.3Very low36.3Very low166 Ų166147.1 Ų147.187%0.86979%0.792SS**  trans-102.859.9150.9-119.6147.7000105.6C184L182-C184 PolarHBondContact O-N 3.35Å
183E29.5Very low36.4Very low155 Ų155142 Ų14272%0.72478%0.779SS**  trans-7484.6164-163.8149.8-153.500106.1Y181 C185Y181-E183 VanDerWaalsContact C-N 3.26Å; E183-C185 PolarHBondContact O-N 3.07Å
184C29.8Very low36.9Very low83 Ų83146.8 Ų146.856%0.56179%0.791SS**  trans-8113.7143.6-175.30000110L182 R186L182-C184 PolarHBondContact O-N 3.35Å; C184-R186 HydrophobicContact CB-CG 4.41Å; C184-R186 PolarHBondContact O-N 3.2Å
185C30.9Very low38.2Very low133 Ų133141.5 Ų141.590%0.89977%0.769SS**  trans-62.472.9164.7-63.10000108.2E183 T187E183-C185 PolarHBondContact O-N 3.07Å; C185-T187 PolarHBondContact O-N 3.19Å
186R33.3Very low39.8Very low208 Ų208137.9 Ų137.979%0.78574%0.743SS**  trans-64.3113.3161.4-76.9-174.3-177173.32.5104.8C184 Q188C184-R186 HydrophobicContact CB-CG 4.41Å; C184-R186 PolarHBondContact O-N 3.2Å; R186-Q188 PolarHBondContact O-N 2.83Å
187T43.6Very low41.8Very low127 Ų127136.6 Ų136.678%0.77972%0.722SS**  trans1.586.8144.349.40000113.2C185 E189C185-T187 PolarHBondContact O-N 3.19Å; T187-E189 PolarHBondContact O-N 3.31Å; T187-E189 VanDerWaalsContact O-N 3.13Å
188Q32.8Very low43.9Very low192 Ų192131 Ų13190%0.89770%0.697SS**  trans-82.482.7160.8-168.7139.33000106.3R186R186-Q188 PolarHBondContact O-N 2.83Å
189E42.3Very low46.5Very low149 Ų149128.7 Ų128.770%0.69669%0.688SS**  trans-63.8142.1161.5-75.8-173.9140.600109.2T187T187-E189 PolarHBondContact O-N 3.31Å; T187-E189 VanDerWaalsContact O-N 3.13Å
190H40.8Very low49Very low173 Ų173128 Ų12880%0.80167%0.667SS**  trans86.271.4167.8-50.3-56000117.5
191A34.5Very low51.3Low90 Ų90123.6 Ų123.674%0.74464%0.637SS**SBend-127.7133.9123.400000107.6S193A191-S193 PolarHBondContact O-N 3.16Å
192H42.2Very low53.6Low207 Ų207115.5 Ų115.596%0.95861%0.607SS**  trans-51.599.8174.2-70.5-79.2000109.9
193S41.2Very low55.8Low80 Ų80114 Ų11456%0.55960%0.596SS**  trans-94.2124.4174.8-167.90000107.5A191 N195A191-S193 PolarHBondContact O-N 3.16Å; S193-N195 PolarHBondContact O-N 3.42Å
194E55.6Low58.4Low198 Ų198110.4 Ų110.493%0.92558%0.579SS**SBendtrans-59.1-7.4172.1-74.5172.2141.100113.1
195N58.3Low61Low76 Ų76106.4 Ų106.441%0.40655%0.552SS.*SBendtrans-94.3134.7179.8-61.9-43.2000111.3S193 S197S193-N195 PolarHBondContact O-N 3.42Å; N195-S197 PolarHBondContact O-N 2.89Å
196P70Confident63.6Low29 Ų29101.3 Ų101.319%0.18852%0.52CS..PPolyproline II helixtrans-59132.4175.522.6-29000109.7A109 C113 W200 I201A109-P196 HydrophobicContact CB-CB 3.99Å; A109-P196 HydrophobicContact CB-CG 3.65Å; C113-P196 PolarHBondContact SG-O 2.95Å; P196-W200 HydrophobicContact CB-CE3 3.97Å; P196-W200 HydrophobicContact CB-CZ3 4.13Å; P196-I201 HydrophobicContact CB-CD1 4.24Å; P196-I201 HydrophobicContact CB-CG1 4.26Å
197S79.7Confident66Low50 Ų5092.8 Ų92.835%0.3550%0.497SS..PPolyproline II helixtrans-81.3147.4174.668.70000110.1N195 T199 W200 I201N195-S197 PolarHBondContact O-N 2.89Å; S197-T199 PolarHBondContact O-N 3.49Å; S197-T199 PolarHBondContact OG-OG1 2.81Å; S197-T199 VanDerWaalsContact OG-OG1 3.08Å; S197-W200 WeakPolarHBondContact O-CB 3.34Å; S197-W200 PolarHBondContact O-N 3.5Å; S197-W200 VanDerWaalsContact O-N 3.08Å; S197-W200 WeakPolarHBondContact OG-CB 3.31Å; S197-W200 PolarHBondContact OG-N 3.2Å; S197-I201 WeakPolarHBondContact O-CG1 3.2Å; S197-I201 PolarHBondContact O-N 3.07Å; S197-I201 VanDerWaalsContact O-N 3.1Å
198P79.1Confident68Low56 Ų5687.2 Ų87.236%0.36446%0.462SS..Hα-helixtrans-59.6-34.3178.120.4-30.5000112.5Y76 I201 L202Y76-P198 HydrophobicContact CE1-CB 4.29Å; P198-I201 PolarHBondContact O-N 2.86Å; P198-L202 WeakPolarHBondContact O-CG 3.29Å; P198-L202 PolarHBondContact O-N 2.99Å
199T83.4Confident70.4Confident101 Ų10178 Ų7862%0.6242%0.419SS*.Hα-helixtrans-63.7-41174.850.30000112.4S197 L202 E203S197-T199 PolarHBondContact O-N 3.49Å; S197-T199 PolarHBondContact OG-OG1 2.81Å; S197-T199 VanDerWaalsContact OG-OG1 3.08Å; T199-L202 PolarHBondContact O-N 3.33Å; T199-E203 PolarHBondContact O-N 3.03Å
200W87.6Confident72.4Confident114 Ų11478 Ų7843%0.43242%0.417SS..Hα-helixtrans-64.1-43.4175.9177.287.4000111.3L106 P196 S197 L202 E203 Q204L106-W200 HydrophobicContact CD2-CH2 4.08Å; L106-W200 HydrophobicContact CD2-CZ3 3.81Å; P196-W200 HydrophobicContact CB-CE3 3.97Å; P196-W200 HydrophobicContact CB-CZ3 4.13Å; S197-W200 WeakPolarHBondContact O-CB 3.34Å; S197-W200 PolarHBondContact O-N 3.5Å; S197-W200 VanDerWaalsContact O-N 3.08Å; S197-W200 WeakPolarHBondContact OG-CB 3.31Å; S197-W200 PolarHBondContact OG-N 3.2Å; W200-L202 PolarHBondContact O-N 3.37Å; W200-E203 PolarHBondContact O-N 3.31Å; W200-Q204 HydrophobicContact CD2-CG 3.98Å; W200-Q204 HydrophobicContact CE3-CG 4.28Å; W200-Q204 HydrophobicContact CH2-CG 4.02Å; W200-Q204 HydrophobicContact CZ2-CG 3.69Å; W200-Q204 HydrophobicContact CZ3-CG 4.3Å; W200-Q204 WeakPolarHBondContact O-CG 3.39Å; W200-Q204 PolarHBondContact O-N 3.31Å
201I85.4Confident74.4Confident0 Ų076.2 Ų76.20%041%0.409CS..Hα-helixtrans-62.9-43.2178.1-58.8173.7000110.9L79 L106 A109 V110 C113 P196 S197 P198 E203 Q204 T205L79-I201 HydrophobicContact CD2-CB 4.36Å; L79-I201 HydrophobicContact CD2-CG2 3.78Å; L79-I201 HydrophobicContact CG-CG2 4.42Å; L106-I201 HydrophobicContact CD2-CG2 4.29Å; A109-I201 HydrophobicContact CB-CD1 3.93Å; A109-I201 HydrophobicContact CB-CG1 4.29Å; V110-I201 HydrophobicContact CG2-CD1 3.98Å; V110-I201 HydrophobicContact CG2-CG2 3.64Å; C113-I201 WeakPolarHBondContact SG-CD1 3.27Å; P196-I201 HydrophobicContact CB-CD1 4.24Å; P196-I201 HydrophobicContact CB-CG1 4.26Å; S197-I201 WeakPolarHBondContact O-CG1 3.2Å; S197-I201 PolarHBondContact O-N 3.07Å; S197-I201 VanDerWaalsContact O-N 3.1Å; P198-I201 PolarHBondContact O-N 2.86Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.27Å; I201-Q204 PolarHBondContact O-N 2.86Å; I201-T205 WeakPolarHBondContact O-CB 3.35Å; I201-T205 PolarHBondContact O-N 3.23Å; I201-T205 PolarHBondContact O-OG1 3.41Å
202L85.1Confident76.5Confident38 Ų3873.3 Ų73.320%0.19938%0.38CS..Hα-helixtrans-60.4-42.7176.2-75.4168.6000111.8L79 P198 T199 W200 T205 A206 L222 L225L79-L202 HydrophobicContact CD1-CD2 3.93Å; L79-L202 HydrophobicContact CD2-CD2 4.38Å; P198-L202 WeakPolarHBondContact O-CG 3.29Å; P198-L202 PolarHBondContact O-N 2.99Å; T199-L202 PolarHBondContact O-N 3.33Å; W200-L202 PolarHBondContact O-N 3.37Å; L202-T205 PolarHBondContact O-N 3.11Å; L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.18Å; L202-L222 HydrophobicContact CD2-CD2 4.29Å; L202-L225 HydrophobicContact CD2-CB 4.14Å; L202-L225 HydrophobicContact CD2-CD1 4.13Å
203E86.1Confident78.2Confident134 Ų13466.7 Ų66.763%0.62637%0.369SS*.Hα-helixtrans-64.2-45.3177.5-170.7176.9-16800111.8T199 W200 I201 T205 A206 G207T199-E203 PolarHBondContact O-N 3.03Å; W200-E203 PolarHBondContact O-N 3.31Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.27Å; E203-T205 VanDerWaalsContact C-N 3.34Å; E203-T205 PolarHBondContact O-N 2.91Å; E203-A206 PolarHBondContact O-N 3.47Å; E203-G207 PolarHBondContact O-N 3.4Å
204Q85.4Confident79.9Confident80 Ų8064.9 Ų64.937%0.37435%0.352SS..Hα-helixtrans-62.7-41.2175.9-65.3-47.9-5800112L106 W200 I201 G207 L208L106-Q204 HydrophobicContact CD1-CB 4.02Å; L106-Q204 HydrophobicContact CD2-CB 3.67Å; L106-Q204 HydrophobicContact CD2-CG 4.16Å; L106-Q204 HydrophobicContact CG-CB 4.5Å; W200-Q204 HydrophobicContact CD2-CG 3.98Å; W200-Q204 HydrophobicContact CE3-CG 4.28Å; W200-Q204 HydrophobicContact CH2-CG 4.02Å; W200-Q204 HydrophobicContact CZ2-CG 3.69Å; W200-Q204 HydrophobicContact CZ3-CG 4.3Å; W200-Q204 WeakPolarHBondContact O-CG 3.39Å; W200-Q204 PolarHBondContact O-N 3.31Å; I201-Q204 PolarHBondContact O-N 2.86Å; Q204-G207 PolarHBondContact O-N 2.94Å; Q204-L208 WeakPolarHBondContact O-CG 3.43Å; Q204-L208 PolarHBondContact O-N 3.42Å
205T84.2Confident80.9Confident0 Ų058.4 Ų58.40%033%0.329CS..Hα-helixtrans-64.1-43.7177.7-52.30000110.8L79 L83 L86 I201 L202 E203 G207 L208 V209 L222L79-T205 HydrophobicContact CD1-CG2 4.31Å; L83-T205 HydrophobicContact CD2-CG2 3.74Å; L83-T205 HydrophobicContact CG-CG2 4.21Å; L86-T205 HydrophobicContact CD1-CG2 4.22Å; I201-T205 WeakPolarHBondContact O-CB 3.35Å; I201-T205 PolarHBondContact O-N 3.23Å; I201-T205 PolarHBondContact O-OG1 3.41Å; L202-T205 PolarHBondContact O-N 3.11Å; E203-T205 VanDerWaalsContact C-N 3.34Å; E203-T205 PolarHBondContact O-N 2.91Å; T205-G207 VanDerWaalsContact C-N 3.32Å; T205-G207 PolarHBondContact O-N 3.26Å; T205-L208 PolarHBondContact O-N 3.5Å; T205-V209 VanDerWaalsContact O-CG2 3.31Å; T205-V209 WeakPolarHBondContact O-CG2 3.46Å; T205-V209 PolarHBondContact O-N 3.3Å; T205-L222 HydrophobicContact CG2-CD1 3.84Å; T205-L222 HydrophobicContact CG2-CD2 4.13Å
206A85.3Confident81.7Confident25 Ų2559.7 Ų59.721%0.20734%0.34CS..Hα-helixtrans-64-36.9175.400000112.3L202 E203 V209 K210 L219L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.18Å; E203-A206 PolarHBondContact O-N 3.47Å; A206-V209 PolarHBondContact O-N 3.49Å; A206-K210 WeakPolarHBondContact O-CG 3.48Å; A206-K210 PolarHBondContact O-N 3.37Å; A206-K210 VanDerWaalsContact O-N 3.11Å; A206-L219 HydrophobicContact CB-CD2 3.91Å
207G84.4Confident81.9Confident30 Ų3063.6 Ų63.631%0.30936%0.359SS..Hα-helixtrans-60.6-44.6172.800000112.5E203 Q204 T205 K210 Q211E203-G207 PolarHBondContact O-N 3.4Å; Q204-G207 PolarHBondContact O-N 2.94Å; T205-G207 VanDerWaalsContact C-N 3.32Å; T205-G207 PolarHBondContact O-N 3.26Å; G207-K210 PolarHBondContact O-N 2.99Å; G207-Q211 WeakPolarHBondContact O-CG 3.45Å; G207-Q211 PolarHBondContact O-N 2.92Å
208L84.3Confident81.7Confident9 Ų963.4 Ų63.45%0.04736%0.355CS..Hα-helixtrans-64.6-44.6177-73174.9000112.2L99 K102 I103 L106 Q204 T205 K210 Q211 L212L99-L208 HydrophobicContact CD1-CD2 4.4Å; L99-L208 HydrophobicContact CG-CD2 4.35Å; K102-L208 HydrophobicContact CD-CD2 4.38Å; I103-L208 HydrophobicContact CG1-CD1 3.92Å; L106-L208 HydrophobicContact CD1-CD1 3.42Å; L106-L208 VanDerWaalsContact CD1-CD1 3.42Å; Q204-L208 WeakPolarHBondContact O-CG 3.43Å; Q204-L208 PolarHBondContact O-N 3.42Å; T205-L208 PolarHBondContact O-N 3.5Å; L208-K210 VanDerWaalsContact C-N 3.28Å; L208-K210 PolarHBondContact O-N 3.41Å; L208-Q211 PolarHBondContact O-N 2.95Å; L208-Q211 VanDerWaalsContact O-N 3.13Å; L208-L212 WeakPolarHBondContact O-CB 3.32Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.5Å; L208-L212 PolarHBondContact O-N 3.2Å
209V84Confident81.3Confident0 Ų062.2 Ų62.20%035%0.346CS..Hα-helixtrans-59.6-40.6178.2174.90000111L86 T205 A206 L212 G213 L214 V218 L219 L222L86-V209 HydrophobicContact CD1-CG2 3.77Å; L86-V209 HydrophobicContact CD2-CG2 4.2Å; T205-V209 VanDerWaalsContact O-CG2 3.31Å; T205-V209 WeakPolarHBondContact O-CG2 3.46Å; T205-V209 PolarHBondContact O-N 3.3Å; A206-V209 PolarHBondContact O-N 3.49Å; V209-L212 PolarHBondContact O-N 3.27Å; V209-G213 PolarHBondContact O-N 2.57Å; V209-L214 HydrophobicContact CG1-CB 3.98Å; V209-L214 PolarHBondContact O-N 2.92Å; V209-V218 HydrophobicContact CG1-CB 4.09Å; V209-V218 HydrophobicContact CG1-CG1 4.02Å; V209-V218 HydrophobicContact CG2-CG1 4.01Å; V209-L219 HydrophobicContact CB-CD2 4.06Å; V209-L219 HydrophobicContact CB-CG 4.39Å; V209-L219 HydrophobicContact CG1-CD1 4.42Å; V209-L219 HydrophobicContact CG1-CD2 3.98Å; V209-L219 HydrophobicContact CG1-CG 3.74Å; V209-L222 HydrophobicContact CG2-CD1 4.06Å
210K84.4Confident80.9Confident149 Ų14962.7 Ų62.765%0.64834%0.341SS*.Hα-helixtrans-65-43.9173.6-73.1175.3-176.7176.20112.5A206 G207 L208 L212 G213 L219A206-K210 WeakPolarHBondContact O-CG 3.48Å; A206-K210 PolarHBondContact O-N 3.37Å; A206-K210 VanDerWaalsContact O-N 3.11Å; G207-K210 PolarHBondContact O-N 2.99Å; L208-K210 VanDerWaalsContact C-N 3.28Å; L208-K210 PolarHBondContact O-N 3.41Å; K210-L212 VanDerWaalsContact C-N 3.25Å; K210-L212 PolarHBondContact O-N 2.95Å; K210-G213 PolarHBondContact O-N 3.46Å; K210-G213 VanDerWaalsContact O-N 3.16Å; K210-L219 HydrophobicContact CG-CD1 3.86Å; K210-L219 HydrophobicContact CG-CD2 4.16Å
211Q82.5Confident80.4Confident135 Ų13560.6 Ų60.663%0.63134%0.336SS*.Hα-helixtrans-63.5-32.1179-76.4177.5-7.200112.6G207 L208 G213G207-Q211 WeakPolarHBondContact O-CG 3.45Å; G207-Q211 PolarHBondContact O-N 2.92Å; L208-Q211 PolarHBondContact O-N 2.95Å; L208-Q211 VanDerWaalsContact O-N 3.13Å; Q211-G213 VanDerWaalsContact C-N 3.31Å
212L79.1Confident79.9Confident28 Ų2861 Ų6115%0.14734%0.338CS..THydrogen-bonded Turntrans-83.3-5.2177.9-67.1173000113.5L86 W89 L99 L208 V209 K210 L214L86-L212 HydrophobicContact CD2-CD1 4.33Å; W89-L212 HydrophobicContact CE3-CD1 4.26Å; W89-L212 HydrophobicContact CH2-CB 4.33Å; W89-L212 HydrophobicContact CH2-CD2 4.37Å; W89-L212 HydrophobicContact CZ3-CB 3.99Å; W89-L212 HydrophobicContact CZ3-CD1 3.97Å; W89-L212 HydrophobicContact CZ3-CD2 3.66Å; W89-L212 HydrophobicContact CZ3-CG 4.06Å; L99-L212 HydrophobicContact CD1-CD1 4.46Å; L99-L212 HydrophobicContact CD1-CD2 3.41Å; L99-L212 VanDerWaalsContact CD1-CD2 3.41Å; L99-L212 HydrophobicContact CD1-CG 4.03Å; L99-L212 HydrophobicContact CD2-CD1 4.28Å; L99-L212 HydrophobicContact CD2-CD2 4.09Å; L99-L212 HydrophobicContact CG-CD2 4.42Å; L208-L212 WeakPolarHBondContact O-CB 3.32Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.5Å; L208-L212 PolarHBondContact O-N 3.2Å; V209-L212 PolarHBondContact O-N 3.27Å; K210-L212 VanDerWaalsContact C-N 3.25Å; K210-L212 PolarHBondContact O-N 2.95Å; L212-L214 HydrophobicContact CB-CD1 3.77Å; L212-L214 HydrophobicContact CB-CG 3.79Å; L212-L214 HydrophobicContact CD1-CD1 3.92Å; L212-L214 PolarHBondContact O-N 3.07Å
213G76.9Confident79.4Confident69 Ų6967.9 Ų67.971%0.71137%0.366SS*.THydrogen-bonded Turntrans64.525.3-179.100000113.9V209 K210 Q211V209-G213 PolarHBondContact O-N 2.57Å; K210-G213 PolarHBondContact O-N 3.46Å; K210-G213 VanDerWaalsContact O-N 3.16Å; Q211-G213 VanDerWaalsContact C-N 3.31Å
214L77.3Confident78.9Confident41 Ų4167.5 Ų67.522%0.21537%0.365CS..  trans-77.6160.9-176.6-68.3170000112L86 W89 V209 L212L86-L214 HydrophobicContact CD2-CD1 3.18Å; W89-L214 HydrophobicContact CD2-CD2 4.11Å; W89-L214 HydrophobicContact CE3-CD1 4.39Å; W89-L214 HydrophobicContact CE3-CD2 4.43Å; W89-L214 HydrophobicContact CH2-CD2 4.14Å; W89-L214 HydrophobicContact CZ2-CD2 3.78Å; W89-L214 HydrophobicContact CZ3-CD2 4.44Å; V209-L214 HydrophobicContact CG1-CB 3.98Å; V209-L214 PolarHBondContact O-N 2.92Å; L212-L214 HydrophobicContact CB-CD1 3.77Å; L212-L214 HydrophobicContact CB-CG 3.79Å; L212-L214 HydrophobicContact CD1-CD1 3.92Å; L212-L214 PolarHBondContact O-N 3.07Å
215S76.8Confident78.1Confident62 Ų6266.4 Ų66.443%0.43436%0.361SS..  trans-50.6142-172.6-175.40000113.3D217 V218S215-D217 PolarHBondContact O-N 3.4Å; S215-D217 VanDerWaalsContact O-N 3.14Å; S215-D217 PolarHBondContact OG-N 3.31Å; S215-D217 PolarHBondContact OG-OD2 3.25Å; S215-V218 PolarHBondContact O-N 3.11Å
216V74.4Confident77.8Confident104 Ų10469.7 Ų69.763%0.6338%0.379SS*.Hα-helixtrans-56.4-27.2173.4-177.20000111.5V218 L219 Q220V216-V218 VanDerWaalsContact C-N 3.28Å; V216-V218 PolarHBondContact O-N 3.07Å; V216-L219 WeakPolarHBondContact O-CB 3.38Å; V216-L219 PolarHBondContact O-N 2.81Å; V216-L219 VanDerWaalsContact O-N 3.14Å; V216-Q220 PolarHBondContact O-N 2.89Å
217D75.1Confident77.4Confident110 Ų11072.1 Ų72.159%0.58839%0.388SS*.Hα-helixtrans-61.4-35.8177.7-54.5-45.6000112.2S215 Q220 H221S215-D217 PolarHBondContact O-N 3.4Å; S215-D217 VanDerWaalsContact O-N 3.14Å; S215-D217 PolarHBondContact OG-N 3.31Å; S215-D217 PolarHBondContact OG-OD2 3.25Å; D217-Q220 PolarHBondContact O-N 2.97Å; D217-H221 WeakPolarHBondContact O-CB 3.26Å; D217-H221 PolarHBondContact O-N 3.29Å
218V74.8Confident77Confident46 Ų4674.4 Ų74.428%0.27939%0.392SS..Hα-helixtrans-69.2-38.5177.5-177.20000110.4T82 V209 S215 V216 Q220 H221 L222T82-V218 HydrophobicContact CG2-CG1 4.21Å; V209-V218 HydrophobicContact CG1-CB 4.09Å; V209-V218 HydrophobicContact CG1-CG1 4.02Å; V209-V218 HydrophobicContact CG2-CG1 4.01Å; S215-V218 PolarHBondContact O-N 3.11Å; V216-V218 VanDerWaalsContact C-N 3.28Å; V216-V218 PolarHBondContact O-N 3.07Å; V218-Q220 VanDerWaalsContact C-N 3.35Å; V218-H221 WeakPolarHBondContact O-CB 3.31Å; V218-H221 PolarHBondContact O-N 2.73Å; V218-L222 WeakPolarHBondContact O-CG 3.4Å; V218-L222 PolarHBondContact O-N 3.29Å
219L71.4Confident76.6Confident31 Ų3178.2 Ų78.216%0.16241%0.413CS..Hα-helixtrans-67.2-36.9174.1-74166.2000112A206 V209 K210 V216 L222 K223A206-L219 HydrophobicContact CB-CD2 3.91Å; V209-L219 HydrophobicContact CB-CD2 4.06Å; V209-L219 HydrophobicContact CB-CG 4.39Å; V209-L219 HydrophobicContact CG1-CD1 4.42Å; V209-L219 HydrophobicContact CG1-CD2 3.98Å; V209-L219 HydrophobicContact CG1-CG 3.74Å; K210-L219 HydrophobicContact CG-CD1 3.86Å; K210-L219 HydrophobicContact CG-CD2 4.16Å; V216-L219 WeakPolarHBondContact O-CB 3.38Å; V216-L219 PolarHBondContact O-N 2.81Å; V216-L219 VanDerWaalsContact O-N 3.14Å; L219-L222 PolarHBondContact O-N 2.88Å; L219-K223 WeakPolarHBondContact O-CG 3.43Å; L219-K223 PolarHBondContact O-N 3.19Å; L219-K223 VanDerWaalsContact O-N 3.15Å
220Q74.4Confident76.2Confident111 Ų11183.1 Ų83.152%0.51944%0.438SS..Hα-helixtrans-68.9-37.6176.3-171.2168.5-400111.5V216 D217 V218 L222 K223 Q224V216-Q220 PolarHBondContact O-N 2.89Å; D217-Q220 PolarHBondContact O-N 2.97Å; V218-Q220 VanDerWaalsContact C-N 3.35Å; Q220-L222 VanDerWaalsContact C-N 3.34Å; Q220-L222 PolarHBondContact O-N 3.14Å; Q220-K223 PolarHBondContact O-N 2.91Å; Q220-Q224 WeakPolarHBondContact O-CG 3.49Å; Q220-Q224 PolarHBondContact O-N 3.21Å
221H76.3Confident75.6Confident71 Ų7178.7 Ų78.733%0.32942%0.424SS..Hα-helixtrans-62.6-39173.6-165.485.6000112.5R78 D217 V218 Q224R78-H221 WeakPolarHBondContact CD-NE2 3.41Å; R78-H221 WeakPolarHBondContact CG-NE2 3.46Å; R78-H221 VanDerWaalsContact CZ-CD2 3.48Å; R78-H221 VanDerWaalsContact CZ-ND1 3.28Å; R78-H221 PolarHBondContact NE-CD2 2.97Å; R78-H221 VanDerWaalsContact NE-CD2 3.25Å; R78-H221 PolarHBondContact NE-CE1 3.14Å; R78-H221 PolarHBondContact NE-NE2 3.21Å; R78-H221 PolarHBondContact NH1-O 3.08Å; R78-H221 PolarHBondContact NH2-CE1 2.99Å; R78-H221 PolarHBondContact NH2-ND1 3.2Å; R78-H221 PolarHBondContact NH2-NE2 3.26Å; D217-H221 WeakPolarHBondContact O-CB 3.26Å; D217-H221 PolarHBondContact O-N 3.29Å; V218-H221 WeakPolarHBondContact O-CB 3.31Å; V218-H221 PolarHBondContact O-N 2.73Å; H221-Q224 PolarHBondContact O-N 3Å
222L75.6Confident75.1Confident9 Ų974.7 Ų74.75%0.04741%0.41CS..Hα-helixtrans-70.9-30.5176.5-71.9171.5000113.2L79 T82 L202 T205 V209 V218 L219 Q220 Q224 L225L79-L222 HydrophobicContact CD1-CD2 4.2Å; T82-L222 HydrophobicContact CG2-CD2 4.16Å; L202-L222 HydrophobicContact CD2-CD2 4.29Å; T205-L222 HydrophobicContact CG2-CD1 3.84Å; T205-L222 HydrophobicContact CG2-CD2 4.13Å; V209-L222 HydrophobicContact CG2-CD1 4.06Å; V218-L222 WeakPolarHBondContact O-CG 3.4Å; V218-L222 PolarHBondContact O-N 3.29Å; L219-L222 PolarHBondContact O-N 2.88Å; Q220-L222 VanDerWaalsContact C-N 3.34Å; Q220-L222 PolarHBondContact O-N 3.14Å; L222-Q224 PolarHBondContact O-N 2.89Å; L222-L225 HydrophobicContact CD2-CD1 4.03Å; L222-L225 PolarHBondContact O-N 3.06Å
223K73.7Confident74.8Confident181 Ų18178.3 Ų78.379%0.78743%0.43SS*.THydrogen-bonded Turntrans-73.1-15175.6-76.6-178.4178.1-175.10114.3L219 Q220L219-K223 WeakPolarHBondContact O-CG 3.43Å; L219-K223 PolarHBondContact O-N 3.19Å; L219-K223 VanDerWaalsContact O-N 3.15Å; Q220-K223 PolarHBondContact O-N 2.91Å
224Q76Confident74.6Confident127 Ų12779.1 Ų79.159%0.59341%0.406SS*.THydrogen-bonded Turntrans-91.2-5178.2-72.6173.5-12.700112.8Q220 H221 L222Q220-Q224 WeakPolarHBondContact O-CG 3.49Å; Q220-Q224 PolarHBondContact O-N 3.21Å; H221-Q224 PolarHBondContact O-N 3Å; L222-Q224 PolarHBondContact O-N 2.89Å
225L69.8Low74.4Confident56 Ų5682.5 Ų82.529%0.29342%0.424SS..  trans-90.20172.5-70168.3000109.9N75 R78 L202 L222N75-L225 HydrophobicContact CB-CD2 3.98Å; R78-L225 HydrophobicContact CB-CD2 3.91Å; R78-L225 HydrophobicContact CG-CD1 4.1Å; R78-L225 HydrophobicContact CG-CD2 3.93Å; R78-L225 HydrophobicContact CG-CG 4.43Å; L202-L225 HydrophobicContact CD2-CB 4.14Å; L202-L225 HydrophobicContact CD2-CD1 4.13Å; L222-L225 HydrophobicContact CD2-CD1 4.03Å; L222-L225 PolarHBondContact O-N 3.06Å

Retrieved 225 of 225 residues in 1013.6 ms (Link to these results)