A0A096N2E9_PAPAN Loading...

Scavenger receptor class A member 3

AlphaFold DB , UniProt , Accession A0A096N2E9, Species PAPAN (Papio anubis, Olive baboon), Gene SCARA3, Length 606 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
1M37.8Very low32.7Very low254 Ų254147.7 Ų147.7100%1.25189%0.885SS**  0130.80-134.5157.8164.200107.3
2K32.5Very low32.6Very low200 Ų200144.2 Ų144.287%0.8788%0.884SS**  trans-35.1129.7-176.3-80.8163.4162.9169.60114.8
3V30.5Very low32.5Very low130 Ų130145.2 Ų145.279%0.78888%0.88SS**  71.7113.369.3-179.90000115.5
4R33.7Very low32Very low238 Ų238142.9 Ų142.990%0.89887%0.871SS**  trans157.4116.1139.7-92.7178174.2173.7-2.8107.3
5S34.6Very low31.8Very low122 Ų122141.1 Ų141.185%0.85386%0.86SS**  cis67.5110.631.6-153.10000117
6A33.2Very low31.8Very low98 Ų98139.7 Ų139.781%0.8185%0.851SS**  trans158.9111.8143.600000106.9
7G30.2Very low31.7Very low85 Ų85142.5 Ų142.588%0.87685%0.853SS**  88.1130.16800000108.3
8G31.5Very low31.8Very low70 Ų70143.7 Ų143.772%0.72285%0.848SS**  cis147.5131.213.500000106.8
9D31Very low31.6Very low177 Ų177145.5 Ų145.595%0.94785%0.853SS**  trans43.9143.1156.5-63.1-20.3000124.3
10G30.9Very low31.5Very low77 Ų77145.8 Ų145.879%0.79485%0.851SS**  trans160.780.9151.500000115.8
11D33.8Very low31.5Very low174 Ų174146 Ų14693%0.9385%0.853SS**  trans-58.6145.3162.5-82.2-40.8000112.5
12A31.8Very low31.1Very low105 Ų105137.1 Ų137.187%0.86883%0.827SS**  trans-147106.9155.700000110.3
13L30.7Very low31.2Very low158 Ų158135 Ų13583%0.82783%0.825SS**  trans-84.4172.1168.9-147.888.2000110.5
14C26.5Very low31.3Very low112 Ų112136.3 Ų136.376%0.75783%0.828SS**  trans112.7108.4167.7-62.50000113.1
15V28.8Very low31.9Very low117 Ų117133.7 Ų133.771%0.70983%0.826SS**  cis59121.848.3-167.80000108.7
16T31Very low31.9Very low118 Ų118135.5 Ų135.572%0.72483%0.826SS**  cis-169.4160.228.214.20000107.1
17E30.3Very low32.4Very low187 Ų187139.2 Ų139.287%0.87483%0.828SS**  172.6151.7104.8-115.7-179.9175.100112.2
18E32.9Very low32.9Very low164 Ų164140 Ų14077%0.76682%0.818SS**  trans-87.2158.4-166.1-58171127.600112
19D28.9Very low33.3Very low178 Ų178142 Ų14295%0.95282%0.822SS**  trans-152.1136.4139.8-102.4-30.5000109.9
20L30.3Very low33.2Very low152 Ų152143.3 Ų143.380%0.79682%0.819SS**  trans-93.6163.1-168.2-81.9154.1000113.5
21V30Very low33.7Very low150 Ų150145 Ų14591%0.90982%0.816SS**  trans88.1122.7154.2-161.50000118.3
22G30.1Very low33.8Very low68 Ų68143.2 Ų143.270%0.70182%0.815SS**  trans152.499.6151.600000113.1
23D34.9Very low33.8Very low155 Ų155145 Ų14583%0.82982%0.816SS**  trans-52.6166.1169.8-79-52.2000114.2
24D32.3Very low34.5Very low158 Ų158146.5 Ų146.585%0.84582%0.819SS**  trans105122.2155.6-66.2-50000118.5D26D24-D26 PolarHBondContact O-N 3.19Å
25E46.5Very low35Very low183 Ų183151.3 Ų151.386%0.85583%0.827SS**  trans-46.8128165.6-60.6-163.5128.100110.9
26D33.8Very low35.4Very low159 Ų159149.7 Ų149.785%0.8583%0.834SS**  trans-167.2130.3137.7-100-36.9000111.4D24 P28D24-D26 PolarHBondContact O-N 3.19Å; D26-P28 WeakPolarHBondContact O-CD 3.39Å
27M44.6Very low35.5Very low176 Ų176155.6 Ų155.687%0.86784%0.843SS**PPolyproline II helixtrans-60.3122.2172.9175.988.381.700110.9
28P39.3Very low36.2Very low102 Ų102153.1 Ų153.166%0.66284%0.843SS**PPolyproline II helixtrans-95.4123.5168.123.2-8.5000111.1D26D26-P28 WeakPolarHBondContact O-CD 3.39Å
29S40.2Very low36.9Very low113 Ų113148 Ų14879%0.7984%0.835SS**PPolyproline II helixtrans-63.8128.6164.229.50000110.4
30F29.8Very low37.7Very low204 Ų204146.1 Ų146.190%0.89583%0.832SS**PPolyproline II helixtrans-78.5127.9175.5-81.8-83.9000111.6
31P41.7Very low38.4Very low111 Ų111148.8 Ų148.872%0.72183%0.831SS**PPolyproline II helixtrans-82.4129170.330.7-28.8000111T33P31-T33 PolarHBondContact O-N 3.32Å
32C35.4Very low39.5Very low137 Ų137145.3 Ų145.393%0.92681%0.813SS**PPolyproline II helixtrans-65120.4169.7-85.70000110.6
33T31.8Very low40.7Very low142 Ų142146.3 Ų146.387%0.87181%0.809SS**  trans-106.3125.8160.741.90000110.3P31P31-T33 PolarHBondContact O-N 3.32Å
34Q46.5Very low41.6Very low191 Ų191149 Ų14989%0.89381%0.808SS**  trans-94.6120.2-174.9-168.5-178.736.200108.9
35K35.2Very low42.6Very low213 Ų213145.7 Ų145.793%0.92680%0.796SS**  trans-166.4127.4153.2-111.2167-174.2177.80110.3
36G37.3Very low43Very low83 Ų83142.4 Ų142.486%0.85678%0.781SS**  trans-94.6153.4-159.400000117.5
37R33Very low44.1Very low241 Ų241141.9 Ų141.991%0.90977%0.771SS**  trans-167.7139.6133.8-132.8179.5-173.1-156.62.1107.8G39R37-G39 PolarHBondContact O-N 2.94Å
38P46.8Very low44.7Very low135 Ų135138.9 Ų138.988%0.87776%0.759SS**  trans-84.7107.2-174.531.2-28.7000111.1
39G46.1Very low45.8Very low58 Ų58140.3 Ų140.360%0.59876%0.76SS**PPolyproline II helixtrans-92.6162162.500000111.3R37 R41R37-G39 PolarHBondContact O-N 2.94Å; G39-R41 PolarHBondContact O-N 3.5Å
40P45.8Very low46.9Very low138 Ų138137.7 Ų137.790%0.89674%0.742SS**PPolyproline II helixtrans-63.3126.4-158.327.2-33.2000111.4C42P40-C42 PolarHBondContact O-N 2.98Å
41R44.5Very low48.8Very low207 Ų207133.3 Ų133.378%0.78173%0.727SS**PPolyproline II helixtrans-56.6120.8-177.8-65.7178.6-174.4175.42109.8G39 S43G39-R41 PolarHBondContact O-N 3.5Å; R41-S43 PolarHBondContact O-N 3.17Å
42C53.3Low50.1Low78 Ų78132.8 Ų132.853%0.52772%0.715SS.*  trans-56.7110.3168.7179.60000109P40 R44 C45 Q46P40-C42 PolarHBondContact O-N 2.98Å; C42-R44 PolarHBondContact O-N 2.99Å; C42-C45 PolarHBondContact O-N 2.89Å; C42-C45 VanDerWaalsContact O-N 3.1Å; C42-Q46 PolarHBondContact O-N 3.38Å
43S57Low52Low89 Ų89129.5 Ų129.562%0.62269%0.69SS**Hα-helixtrans-59.4-17-178.658.50000113.2R41 K47R41-S43 PolarHBondContact O-N 3.17Å; S43-K47 WeakPolarHBondContact O-CG 3.2Å; S43-K47 PolarHBondContact O-N 3.45Å
44R53Low54.1Low210 Ų210126.1 Ų126.179%0.79267%0.672SS**Hα-helixtrans-80.2-35.7177.8-141.4172.1-174.1174.10.4112.8C42 N48C42-R44 PolarHBondContact O-N 2.99Å; R44-N48 PolarHBondContact O-N 3.46Å
45C54.1Low55.8Low90 Ų90119.9 Ų119.961%0.60865%0.648SS**Hα-helixtrans-77.1-34177.9-69.80000112.6C42 N48 L49C42-C45 PolarHBondContact O-N 2.89Å; C42-C45 VanDerWaalsContact O-N 3.1Å; C45-N48 PolarHBondContact O-N 2.88Å; C45-L49 PolarHBondContact O-N 2.89Å
46Q54.3Low58Low113 Ų113117.7 Ų117.753%0.52863%0.633SS.*Hα-helixtrans-68.7-34.8174.3-172167.5-19.300112C42 S50C42-Q46 PolarHBondContact O-N 3.38Å; Q46-S50 VanDerWaalsContact O-CB 3.3Å; Q46-S50 WeakPolarHBondContact O-CB 3.38Å; Q46-S50 PolarHBondContact O-N 2.96Å; Q46-S50 PolarHBondContact O-OG 3.33Å
47K56.7Low60.2Low149 Ų149118.9 Ų118.965%0.64862%0.619SS**Hα-helixtrans-64-43.2174-82.1-180178.4-178.10112S43 S50 L51S43-K47 WeakPolarHBondContact O-CG 3.2Å; S43-K47 PolarHBondContact O-N 3.45Å; K47-S50 WeakPolarHBondContact CA-OG 3.34Å; K47-S50 PolarHBondContact O-N 2.91Å; K47-S50 PolarHBondContact O-OG 2.88Å; K47-L51 VanDerWaalsContact O-CB 3.29Å; K47-L51 WeakPolarHBondContact O-CB 3.42Å; K47-L51 PolarHBondContact O-N 3.09Å
48N57.8Low62.7Low113 Ų113113.2 Ų113.260%0.60461%0.606SS**Hα-helixtrans-68.3-38.4-178-141.4-2.8000112.2R44 C45 H52R44-N48 PolarHBondContact O-N 3.46Å; C45-N48 PolarHBondContact O-N 2.88Å; N48-H52 WeakPolarHBondContact O-CB 3.39Å; N48-H52 PolarHBondContact O-N 3.29Å
49L60.5Low64.5Low131 Ų131114.5 Ų114.569%0.68660%0.595SS**Hα-helixtrans-67.6-42173.2-158.877.7000111.8C45 L51 H52 T53C45-L49 PolarHBondContact O-N 2.89Å; L49-L51 VanDerWaalsContact C-N 3.34Å; L49-L51 PolarHBondContact O-N 3.32Å; L49-H52 PolarHBondContact O-N 3.43Å; L49-T53 WeakPolarHBondContact O-CG2 3.18Å; L49-T53 PolarHBondContact O-N 3.46Å; L49-T53 PolarHBondContact O-OG1 3.18Å; L49-T53 VanDerWaalsContact O-OG1 3.06Å
50S64Low66.4Low59 Ų59117.2 Ų117.241%0.41360%0.595SS.*Hα-helixtrans-66-35.4177.576.90000112.8Q46 K47 T53 S54Q46-S50 VanDerWaalsContact O-CB 3.3Å; Q46-S50 WeakPolarHBondContact O-CB 3.38Å; Q46-S50 PolarHBondContact O-N 2.96Å; Q46-S50 PolarHBondContact O-OG 3.33Å; K47-S50 WeakPolarHBondContact CA-OG 3.34Å; K47-S50 PolarHBondContact O-N 2.91Å; K47-S50 PolarHBondContact O-OG 2.88Å; S50-T53 WeakPolarHBondContact CA-OG1 3.35Å; S50-T53 PolarHBondContact O-OG1 3.32Å; S50-S54 VanDerWaalsContact O-CB 3.24Å; S50-S54 WeakPolarHBondContact O-CB 3.44Å; S50-S54 PolarHBondContact O-N 3.43Å; S50-S54 PolarHBondContact O-OG 3.5Å
51L69.4Low68.4Low111 Ų111117 Ų11758%0.58158%0.58SS**Hα-helixtrans-69.1-44.8177.4-164.5103000109.7K47 L49 T53 S54 V55K47-L51 VanDerWaalsContact O-CB 3.29Å; K47-L51 WeakPolarHBondContact O-CB 3.42Å; K47-L51 PolarHBondContact O-N 3.09Å; L49-L51 VanDerWaalsContact C-N 3.34Å; L49-L51 PolarHBondContact O-N 3.32Å; L51-T53 VanDerWaalsContact C-N 3.34Å; L51-T53 PolarHBondContact O-N 2.71Å; L51-S54 PolarHBondContact O-N 3.2Å; L51-V55 WeakPolarHBondContact O-CB 3.42Å; L51-V55 WeakPolarHBondContact O-CG2 3.47Å; L51-V55 PolarHBondContact O-N 3.47Å
52H69.4Low70.4Confident100 Ų100111.7 Ų111.746%0.46357%0.567SS.*Hα-helixtrans-67.4-33.7179.4-151.3-60.2000112.7N48 L49 R56N48-H52 WeakPolarHBondContact O-CB 3.39Å; N48-H52 PolarHBondContact O-N 3.29Å; L49-H52 PolarHBondContact O-N 3.43Å; H52-R56 WeakPolarHBondContact O-CG 3.21Å; H52-R56 PolarHBondContact O-N 2.99Å; H52-R56 VanDerWaalsContact O-N 3.16Å
53T76.3Confident71.8Confident68 Ų68110.3 Ų110.342%0.41756%0.561SS.*Hα-helixtrans-71.4-41.5171.450.30000111.9L49 S50 L51 V55 R56 I57L49-T53 WeakPolarHBondContact O-CG2 3.18Å; L49-T53 PolarHBondContact O-N 3.46Å; L49-T53 PolarHBondContact O-OG1 3.18Å; L49-T53 VanDerWaalsContact O-OG1 3.06Å; S50-T53 WeakPolarHBondContact CA-OG1 3.35Å; S50-T53 PolarHBondContact O-OG1 3.32Å; L51-T53 VanDerWaalsContact C-N 3.34Å; L51-T53 PolarHBondContact O-N 2.71Å; T53-V55 PolarHBondContact O-N 2.94Å; T53-R56 PolarHBondContact O-N 3.26Å; T53-I57 WeakPolarHBondContact O-CB 3.29Å; T53-I57 VanDerWaalsContact O-CG1 3.22Å; T53-I57 WeakPolarHBondContact O-CG1 3.4Å; T53-I57 PolarHBondContact O-N 2.85Å
54S74.8Confident73.2Confident71 Ų71111.6 Ų111.650%0.49756%0.56SS.*Hα-helixtrans-65.4-39.1178-68.10000112S50 L51 I57 L58S50-S54 VanDerWaalsContact O-CB 3.24Å; S50-S54 WeakPolarHBondContact O-CB 3.44Å; S50-S54 PolarHBondContact O-N 3.43Å; S50-S54 PolarHBondContact O-OG 3.5Å; L51-S54 PolarHBondContact O-N 3.2Å; S54-I57 PolarHBondContact O-N 3.39Å; S54-L58 WeakPolarHBondContact O-CB 3.31Å; S54-L58 PolarHBondContact O-N 3Å
55V82.4Confident74.8Confident61 Ų61105.9 Ų105.937%0.3755%0.545SS..Hα-helixtrans-65.2-43.7174.8170.70000110.7L51 T53 I57 L58 Y59L51-V55 WeakPolarHBondContact O-CB 3.42Å; L51-V55 WeakPolarHBondContact O-CG2 3.47Å; L51-V55 PolarHBondContact O-N 3.47Å; T53-V55 PolarHBondContact O-N 2.94Å; V55-I57 PolarHBondContact O-N 3.32Å; V55-L58 WeakPolarHBondContact O-CB 3.3Å; V55-L58 PolarHBondContact O-N 3.08Å; V55-Y59 HydrophobicContact CG1-CD2 3.67Å; V55-Y59 HydrophobicContact CG1-CE2 3.5Å; V55-Y59 VanDerWaalsContact CG1-CE2 3.5Å; V55-Y59 WeakPolarHBondContact O-CD2 3.44Å; V55-Y59 PolarHBondContact O-N 2.82Å
56R81.8Confident76.3Confident167 Ų167107 Ų10763%0.6354%0.544SS*.Hα-helixtrans-63.4-39.5175-77.6-178.9177.4170.81.3112.8H52 T53 L58 Y59 L60H52-R56 WeakPolarHBondContact O-CG 3.21Å; H52-R56 PolarHBondContact O-N 2.99Å; H52-R56 VanDerWaalsContact O-N 3.16Å; T53-R56 PolarHBondContact O-N 3.26Å; R56-L58 VanDerWaalsContact C-N 3.34Å; R56-Y59 PolarHBondContact O-N 3.11Å; R56-L60 WeakPolarHBondContact O-CG 3.47Å; R56-L60 PolarHBondContact O-N 2.77Å
57I83.1Confident77.9Confident108 Ų108105.9 Ų105.955%0.55455%0.545SS*.Hα-helixtrans-65.7-40.3175-68.3164.8000110.2T53 S54 V55 L60 F61T53-I57 WeakPolarHBondContact O-CB 3.29Å; T53-I57 VanDerWaalsContact O-CG1 3.22Å; T53-I57 WeakPolarHBondContact O-CG1 3.4Å; T53-I57 PolarHBondContact O-N 2.85Å; S54-I57 PolarHBondContact O-N 3.39Å; V55-I57 PolarHBondContact O-N 3.32Å; I57-L60 PolarHBondContact O-N 3.32Å; I57-F61 WeakPolarHBondContact O-CB 3.43Å; I57-F61 PolarHBondContact O-N 3.49Å
58L85.2Confident79.2Confident122 Ų122100.9 Ų100.964%0.63953%0.531SS*.Hα-helixtrans-63.5-42176.1-168.673.9000111.6S54 V55 R56 F61 L62S54-L58 WeakPolarHBondContact O-CB 3.31Å; S54-L58 PolarHBondContact O-N 3Å; V55-L58 WeakPolarHBondContact O-CB 3.3Å; V55-L58 PolarHBondContact O-N 3.08Å; R56-L58 VanDerWaalsContact C-N 3.34Å; L58-F61 PolarHBondContact O-N 3.05Å; L58-L62 VanDerWaalsContact O-CB 3.3Å; L58-L62 WeakPolarHBondContact O-CB 3.35Å; L58-L62 PolarHBondContact O-N 2.85Å
59Y85.7Confident80.7Confident161 Ų16199.7 Ų99.763%0.63153%0.528SS*.Hα-helixtrans-64.8-39.9174.2-84.2-68.3000112.5V55 R56 F61 L62 A63V55-Y59 HydrophobicContact CG1-CD2 3.67Å; V55-Y59 HydrophobicContact CG1-CE2 3.5Å; V55-Y59 VanDerWaalsContact CG1-CE2 3.5Å; V55-Y59 WeakPolarHBondContact O-CD2 3.44Å; V55-Y59 PolarHBondContact O-N 2.82Å; R56-Y59 PolarHBondContact O-N 3.11Å; Y59-F61 VanDerWaalsContact C-N 3.34Å; Y59-L62 PolarHBondContact O-N 3.39Å; Y59-A63 VanDerWaalsContact O-CB 3.3Å; Y59-A63 WeakPolarHBondContact O-CB 3.26Å; Y59-A63 PolarHBondContact O-N 2.75Å
60L85.9Confident81.7Confident115 Ų11596.3 Ų96.360%0.60252%0.519SS*.Hα-helixtrans-64.1-40.3173.6-80.4167.2000111.8R56 I57 A63 L64R56-L60 WeakPolarHBondContact O-CG 3.47Å; R56-L60 PolarHBondContact O-N 2.77Å; I57-L60 PolarHBondContact O-N 3.32Å; L60-A63 PolarHBondContact O-N 2.68Å; L60-L64 WeakPolarHBondContact O-CB 3.45Å; L60-L64 WeakPolarHBondContact O-CG 3.4Å; L60-L64 PolarHBondContact O-N 3.17Å
61F87.4Confident82.8Confident135 Ų13597 Ų9759%0.59252%0.521SS*.Hα-helixtrans-69-39.3177.8-151.9-91.2000111.7I57 L58 Y59 L64 L65I57-F61 WeakPolarHBondContact O-CB 3.43Å; I57-F61 PolarHBondContact O-N 3.49Å; L58-F61 PolarHBondContact O-N 3.05Å; Y59-F61 VanDerWaalsContact C-N 3.34Å; F61-L64 PolarHBondContact O-N 2.73Å; F61-L65 HydrophobicContact CD1-CD1 3.8Å; F61-L65 HydrophobicContact CD1-CG 4.43Å; F61-L65 HydrophobicContact CE1-CD1 3.97Å; F61-L65 HydrophobicContact CE1-CG 4.46Å; F61-L65 WeakPolarHBondContact O-CB 3.43Å; F61-L65 PolarHBondContact O-N 3.5Å
62L85.6Confident83.3Confident95 Ų9596.9 Ų96.950%0.49752%0.52SS..Hα-helixtrans-64.5-42.5173.6-169.376.7000111.1L58 Y59 L65 L66L58-L62 VanDerWaalsContact O-CB 3.3Å; L58-L62 WeakPolarHBondContact O-CB 3.35Å; L58-L62 PolarHBondContact O-N 2.85Å; Y59-L62 PolarHBondContact O-N 3.39Å; L62-L65 PolarHBondContact O-N 3.3Å; L62-L66 HydrophobicContact CG-CD1 4.49Å; L62-L66 WeakPolarHBondContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.19Å; L62-L66 PolarHBondContact O-N 3.32Å
63A84.3Confident83.6Confident48 Ų4893.9 Ų93.940%0.39751%0.512SS..Hα-helixtrans-63.4-42.9175.300000111.5Y59 L60 L66 V67Y59-A63 VanDerWaalsContact O-CB 3.3Å; Y59-A63 WeakPolarHBondContact O-CB 3.26Å; Y59-A63 PolarHBondContact O-N 2.75Å; L60-A63 PolarHBondContact O-N 2.68Å; A63-L66 PolarHBondContact O-N 2.99Å; A63-V67 VanDerWaalsContact O-CG2 3.29Å; A63-V67 WeakPolarHBondContact O-CG2 3.35Å; A63-V67 PolarHBondContact O-N 2.69Å
64L85.9Confident83.8Confident117 Ų11793.7 Ų93.761%0.61351%0.514SS*.Hα-helixtrans-64.1-38.9174.2-78.2166.6000112.2L60 F61 V67 A68L60-L64 WeakPolarHBondContact O-CB 3.45Å; L60-L64 WeakPolarHBondContact O-CG 3.4Å; L60-L64 PolarHBondContact O-N 3.17Å; F61-L64 PolarHBondContact O-N 2.73Å; L64-V67 PolarHBondContact O-N 3.39Å; L64-A68 VanDerWaalsContact O-CB 3.26Å; L64-A68 WeakPolarHBondContact O-CB 3.28Å; L64-A68 PolarHBondContact O-N 3.38Å
65L86.8Confident84Confident89 Ų8995.2 Ų95.247%0.46652%0.516SS..Hα-helixtrans-63.6-44.4173.4-95.4162.6000111.7F61 L62 V67 A68 V69F61-L65 HydrophobicContact CD1-CD1 3.8Å; F61-L65 HydrophobicContact CD1-CG 4.43Å; F61-L65 HydrophobicContact CE1-CD1 3.97Å; F61-L65 HydrophobicContact CE1-CG 4.46Å; F61-L65 WeakPolarHBondContact O-CB 3.43Å; F61-L65 PolarHBondContact O-N 3.5Å; L62-L65 PolarHBondContact O-N 3.3Å; L65-V67 VanDerWaalsContact C-N 3.34Å; L65-V67 PolarHBondContact O-N 3.33Å; L65-A68 PolarHBondContact O-N 3.01Å; L65-V69 WeakPolarHBondContact O-CB 3.48Å; L65-V69 VanDerWaalsContact O-CG2 3.23Å; L65-V69 WeakPolarHBondContact O-CG2 3.46Å; L65-V69 PolarHBondContact O-N 3.33Å
66L85.8Confident83.9Confident114 Ų11496.3 Ų96.360%0.59752%0.523SS*.Hα-helixtrans-62.7-41.9176.6-75.1170.6000111.5L62 A63 V69 A70L62-L66 HydrophobicContact CG-CD1 4.49Å; L62-L66 WeakPolarHBondContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.19Å; L62-L66 PolarHBondContact O-N 3.32Å; A63-L66 PolarHBondContact O-N 2.99Å; L66-V69 PolarHBondContact O-N 3.49Å; L66-A70 VanDerWaalsContact O-CB 3.27Å; L66-A70 WeakPolarHBondContact O-CB 3.19Å; L66-A70 PolarHBondContact O-N 3.41Å
67V87.7Confident83.6Confident89 Ų8994.8 Ų94.854%0.53952%0.521SS..Hα-helixtrans-65.4-43.3174.3172.60000110.8A63 L64 L65 A70 V71A63-V67 VanDerWaalsContact O-CG2 3.29Å; A63-V67 WeakPolarHBondContact O-CG2 3.35Å; A63-V67 PolarHBondContact O-N 2.69Å; L64-V67 PolarHBondContact O-N 3.39Å; L65-V67 VanDerWaalsContact C-N 3.34Å; L65-V67 PolarHBondContact O-N 3.33Å; V67-A70 PolarHBondContact O-N 2.91Å; V67-V71 HydrophobicContact CG1-CG2 4.29Å; V67-V71 WeakPolarHBondContact O-CB 3.47Å; V67-V71 VanDerWaalsContact O-CG2 3.23Å; V67-V71 WeakPolarHBondContact O-CG2 3.48Å; V67-V71 PolarHBondContact O-N 3.36Å
68A84.1Confident83.2Confident45 Ų4599 Ų9937%0.37253%0.529SS..Hα-helixtrans-63.7-42.4177.700000111.8L64 L65 V71 L72L64-A68 VanDerWaalsContact O-CB 3.26Å; L64-A68 WeakPolarHBondContact O-CB 3.28Å; L64-A68 PolarHBondContact O-N 3.38Å; L65-A68 PolarHBondContact O-N 3.01Å; A68-V71 PolarHBondContact O-N 3.36Å; A68-L72 VanDerWaalsContact O-CB 3.29Å; A68-L72 WeakPolarHBondContact O-CB 3.38Å; A68-L72 VanDerWaalsContact O-CG 3.25Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 2.83Å
69V88.2Confident82.8Confident88 Ų88100.1 Ų100.153%0.53353%0.529SS..Hα-helixtrans-65.1-41.4174.9171.20000110.6L65 L66 L72 A73L65-V69 WeakPolarHBondContact O-CB 3.48Å; L65-V69 VanDerWaalsContact O-CG2 3.23Å; L65-V69 WeakPolarHBondContact O-CG2 3.46Å; L65-V69 PolarHBondContact O-N 3.33Å; L66-V69 PolarHBondContact O-N 3.49Å; V69-L72 PolarHBondContact O-N 3.22Å; V69-A73 WeakPolarHBondContact O-CB 3.42Å; V69-A73 PolarHBondContact O-N 3Å
70A82.4Confident82.2Confident60 Ų6096.1 Ų96.150%0.49652%0.522SS..Hα-helixtrans-64.9-40.9175.800000112.1L66 V67 S74L66-A70 VanDerWaalsContact O-CB 3.27Å; L66-A70 WeakPolarHBondContact O-CB 3.19Å; L66-A70 PolarHBondContact O-N 3.41Å; V67-A70 PolarHBondContact O-N 2.91Å; A70-S74 WeakPolarHBondContact O-CB 3.43Å; A70-S74 PolarHBondContact O-N 2.91Å; A70-S74 PolarHBondContact O-OG 2.92Å
71V87.7Confident81.3Confident74 Ų7495.5 Ų95.545%0.44852%0.519SS..Hα-helixtrans-67.2-45176.2171.10000110.7V67 A68 S74 L75V67-V71 HydrophobicContact CG1-CG2 4.29Å; V67-V71 WeakPolarHBondContact O-CB 3.47Å; V67-V71 VanDerWaalsContact O-CG2 3.23Å; V67-V71 WeakPolarHBondContact O-CG2 3.48Å; V67-V71 PolarHBondContact O-N 3.36Å; A68-V71 PolarHBondContact O-N 3.36Å; V71-S74 WeakPolarHBondContact CA-OG 3.36Å; V71-S74 PolarHBondContact O-N 2.78Å; V71-S74 PolarHBondContact O-OG 3.33Å; V71-L75 HydrophobicContact CG1-CD1 4.09Å; V71-L75 WeakPolarHBondContact O-CB 3.45Å; V71-L75 WeakPolarHBondContact O-CG 3.49Å; V71-L75 PolarHBondContact O-N 2.95Å
72L80.1Confident80.6Confident108 Ų10891.9 Ų91.957%0.56551%0.51SS*.Hα-helixtrans-62.3-44.8175.3-76168000111.4A68 V69 S74 L75 V76A68-L72 VanDerWaalsContact O-CB 3.29Å; A68-L72 WeakPolarHBondContact O-CB 3.38Å; A68-L72 VanDerWaalsContact O-CG 3.25Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 2.83Å; V69-L72 PolarHBondContact O-N 3.22Å; L72-S74 VanDerWaalsContact C-N 3.32Å; L72-S74 PolarHBondContact O-N 3.33Å; L72-L75 PolarHBondContact O-N 3.18Å; L72-V76 WeakPolarHBondContact O-CB 3.48Å; L72-V76 VanDerWaalsContact O-CG2 3.24Å; L72-V76 WeakPolarHBondContact O-CG2 3.47Å; L72-V76 PolarHBondContact O-N 3.24Å
73A75.6Confident79.8Confident37 Ų3791.7 Ų91.731%0.30651%0.509SS..Hα-helixtrans-58.8-45.6173.700000110.5V69 L75 V76 F77V69-A73 WeakPolarHBondContact O-CB 3.42Å; V69-A73 PolarHBondContact O-N 3Å; A73-L75 VanDerWaalsContact C-N 3.33Å; A73-L75 PolarHBondContact O-N 2.78Å; A73-V76 PolarHBondContact O-N 2.9Å; A73-F77 HydrophobicContact CB-CD2 4.34Å; A73-F77 HydrophobicContact CB-CE2 4.24Å; A73-F77 WeakPolarHBondContact O-CB 3.4Å; A73-F77 WeakPolarHBondContact O-CD2 3.24Å; A73-F77 PolarHBondContact O-N 3.44Å
74S78.8Confident79Confident64 Ų6492.7 Ų92.745%0.44851%0.514SS..Hα-helixtrans-63.4-36.7177.777.90000113.1A70 V71 L72 R78A70-S74 WeakPolarHBondContact O-CB 3.43Å; A70-S74 PolarHBondContact O-N 2.91Å; A70-S74 PolarHBondContact O-OG 2.92Å; V71-S74 WeakPolarHBondContact CA-OG 3.36Å; V71-S74 PolarHBondContact O-N 2.78Å; V71-S74 PolarHBondContact O-OG 3.33Å; L72-S74 VanDerWaalsContact C-N 3.32Å; L72-S74 PolarHBondContact O-N 3.33Å; S74-R78 WeakPolarHBondContact O-CB 3.32Å; S74-R78 PolarHBondContact O-N 2.8Å
75L79.4Confident78.2Confident102 Ų10293.8 Ų93.853%0.53452%0.516SS..Hα-helixtrans-69.8-39.6175.3-80.2167.5000111.4V71 L72 A73 K79V71-L75 HydrophobicContact CG1-CD1 4.09Å; V71-L75 WeakPolarHBondContact O-CB 3.45Å; V71-L75 WeakPolarHBondContact O-CG 3.49Å; V71-L75 PolarHBondContact O-N 2.95Å; L72-L75 PolarHBondContact O-N 3.18Å; A73-L75 VanDerWaalsContact C-N 3.33Å; A73-L75 PolarHBondContact O-N 2.78Å; L75-K79 VanDerWaalsContact O-CB 3.28Å; L75-K79 WeakPolarHBondContact O-CB 3.47Å; L75-K79 PolarHBondContact O-N 2.8Å
76V80.3Confident77.3Confident85 Ų8594.2 Ų94.252%0.51552%0.518SS..Hα-helixtrans-66-48175.4171.30000110L72 A73 R78 K79 V80L72-V76 WeakPolarHBondContact O-CB 3.48Å; L72-V76 VanDerWaalsContact O-CG2 3.24Å; L72-V76 WeakPolarHBondContact O-CG2 3.47Å; L72-V76 PolarHBondContact O-N 3.24Å; A73-V76 PolarHBondContact O-N 2.9Å; V76-R78 PolarHBondContact O-N 2.83Å; V76-K79 CarbonylContact O-C 3.56Å; V76-K79 PolarHBondContact O-N 3.27Å; V76-K79 VanDerWaalsContact O-N 3.11Å; V76-V80 HydrophobicContact CG1-CG2 4.2Å; V76-V80 WeakPolarHBondContact O-CB 3.12Å; V76-V80 VanDerWaalsContact O-CG2 3.27Å; V76-V80 WeakPolarHBondContact O-CG2 3.35Å; V76-V80 PolarHBondContact O-N 3.3Å
77F75.3Confident76.3Confident134 Ų13493.3 Ų93.359%0.58851%0.513SS*.Hα-helixtrans-60.3-44.5176-76.2-61.6000111.7A73 K79 V80 D81A73-F77 HydrophobicContact CB-CD2 4.34Å; A73-F77 HydrophobicContact CB-CE2 4.24Å; A73-F77 WeakPolarHBondContact O-CB 3.4Å; A73-F77 WeakPolarHBondContact O-CD2 3.24Å; A73-F77 PolarHBondContact O-N 3.44Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 2.86Å; F77-V80 PolarHBondContact O-N 3.49Å; F77-D81 WeakPolarHBondContact O-CB 3.47Å; F77-D81 VanDerWaalsContact O-CG 3.31Å; F77-D81 PolarHBondContact O-N 3.3Å
78R76.2Confident75.3Confident196 Ų19692.1 Ų92.174%0.7451%0.509SS*.Hα-helixtrans-58.8-38.8173.7-113.8179.9162.7163.2-3.4113.2S74 V76 S82S74-R78 WeakPolarHBondContact O-CB 3.32Å; S74-R78 PolarHBondContact O-N 2.8Å; V76-R78 PolarHBondContact O-N 2.83Å; R78-S82 WeakPolarHBondContact O-CB 3.44Å; R78-S82 PolarHBondContact O-N 2.9Å
79K75.5Confident74.7Confident146 Ų14695 Ų9564%0.63552%0.517SS*.Hα-helixtrans-73.8-36.9179.7-161.4173.7-176.5177.80111.1L75 V76 F77 L83L75-K79 VanDerWaalsContact O-CB 3.28Å; L75-K79 WeakPolarHBondContact O-CB 3.47Å; L75-K79 PolarHBondContact O-N 2.8Å; V76-K79 CarbonylContact O-C 3.56Å; V76-K79 PolarHBondContact O-N 3.27Å; V76-K79 VanDerWaalsContact O-N 3.11Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 2.86Å; K79-L83 HydrophobicContact CG-CD1 4.23Å; K79-L83 WeakPolarHBondContact O-CB 3.4Å; K79-L83 WeakPolarHBondContact O-CD1 3.33Å; K79-L83 PolarHBondContact O-N 2.99Å
80V74.1Confident73.6Confident78 Ų7893.8 Ų93.847%0.47351%0.51SS..Hα-helixtrans-67.3-41.5173.8170.50000110.9V76 F77 L83 S84V76-V80 HydrophobicContact CG1-CG2 4.2Å; V76-V80 WeakPolarHBondContact O-CB 3.12Å; V76-V80 VanDerWaalsContact O-CG2 3.27Å; V76-V80 WeakPolarHBondContact O-CG2 3.35Å; V76-V80 PolarHBondContact O-N 3.3Å; F77-V80 PolarHBondContact O-N 3.49Å; V80-L83 PolarHBondContact O-N 2.95Å; V80-S84 VanDerWaalsContact O-CB 3.25Å; V80-S84 WeakPolarHBondContact O-CB 3.36Å; V80-S84 PolarHBondContact O-N 2.9Å
81D65.8Low72.5Confident102 Ų10296.6 Ų96.655%0.54551%0.513SS..Hα-helixtrans-64.5-43.3175.4-72.1-25.3000111F77 L83 S84 E85F77-D81 WeakPolarHBondContact O-CB 3.47Å; F77-D81 VanDerWaalsContact O-CG 3.31Å; F77-D81 PolarHBondContact O-N 3.3Å; D81-L83 PolarHBondContact O-N 3.32Å; D81-S84 WeakPolarHBondContact O-CB 3.35Å; D81-S84 PolarHBondContact O-N 3.04Å; D81-E85 WeakPolarHBondContact O-CB 3.08Å; D81-E85 PolarHBondContact O-N 3.28Å
82S74.1Confident71.5Confident59 Ų5995.5 Ų95.541%0.41351%0.509SS..Hα-helixtrans-60.3-43.2172.6155.70000112.4R78 E85 D86R78-S82 WeakPolarHBondContact O-CB 3.44Å; R78-S82 PolarHBondContact O-N 2.9Å; S82-E85 PolarHBondContact O-N 3.12Å; S82-D86 WeakPolarHBondContact O-CB 3.3Å; S82-D86 PolarHBondContact O-N 3.45Å
83L68.6Low71.1Confident90 Ų9094.2 Ų94.247%0.47150%0.501SS..Hα-helixtrans-67.4-38175.8-98.3135000111.7K79 V80 D81 D86 I87K79-L83 HydrophobicContact CG-CD1 4.23Å; K79-L83 WeakPolarHBondContact O-CB 3.4Å; K79-L83 WeakPolarHBondContact O-CD1 3.33Å; K79-L83 PolarHBondContact O-N 2.99Å; V80-L83 PolarHBondContact O-N 2.95Å; D81-L83 PolarHBondContact O-N 3.32Å; L83-D86 PolarHBondContact O-N 3.34Å; L83-I87 VanDerWaalsContact O-CB 3.3Å; L83-I87 WeakPolarHBondContact O-CB 3.39Å; L83-I87 VanDerWaalsContact O-CD1 3.32Å; L83-I87 WeakPolarHBondContact O-CD1 3.41Å; L83-I87 WeakPolarHBondContact O-CG1 3.46Å; L83-I87 PolarHBondContact O-N 3.16Å
84S66.4Low70.4Confident70 Ų7097.8 Ų97.849%0.4951%0.508SS..Hα-helixtrans-64.7-42.3176.3-173.50000111.1V80 D81 I87 S88V80-S84 VanDerWaalsContact O-CB 3.25Å; V80-S84 WeakPolarHBondContact O-CB 3.36Å; V80-S84 PolarHBondContact O-N 2.9Å; D81-S84 WeakPolarHBondContact O-CB 3.35Å; D81-S84 PolarHBondContact O-N 3.04Å; S84-I87 PolarHBondContact O-N 3.24Å; S84-S88 WeakPolarHBondContact O-CB 3.42Å; S84-S88 PolarHBondContact O-N 2.77Å; S84-S88 PolarHBondContact O-OG 3.45Å
85E68.9Low69.6Low140 Ų14099.1 Ų99.165%0.65451%0.51SS*.Hα-helixtrans-66.3-44.6176.7-149.3170.6-16000110.8D81 S82 S88 L89D81-E85 WeakPolarHBondContact O-CB 3.08Å; D81-E85 PolarHBondContact O-N 3.28Å; S82-E85 PolarHBondContact O-N 3.12Å; E85-S88 PolarHBondContact O-N 2.85Å; E85-S88 PolarHBondContact O-OG 3.3Å; E85-L89 WeakPolarHBondContact O-CB 3.47Å; E85-L89 PolarHBondContact O-N 3.11Å
86D67.8Low69.3Low97 Ų97101.1 Ų101.152%0.51952%0.515SS..Hα-helixtrans-62.5-42173.9-82.3-22.7000112.2S82 L83 L89 T90S82-D86 WeakPolarHBondContact O-CB 3.3Å; S82-D86 PolarHBondContact O-N 3.45Å; L83-D86 PolarHBondContact O-N 3.34Å; D86-L89 PolarHBondContact O-N 2.84Å; D86-T90 VanDerWaalsContact O-CB 3.25Å; D86-T90 WeakPolarHBondContact O-CB 3.42Å; D86-T90 PolarHBondContact O-N 2.85Å; D86-T90 PolarHBondContact O-OG1 2.87Å
87I65.4Low68.7Low95 Ų95103 Ų10349%0.48752%0.515SS..Hα-helixtrans-64.5-43.9176.3-71.1162.6000110.2L83 S84 L89 T90 Q91L83-I87 VanDerWaalsContact O-CB 3.3Å; L83-I87 WeakPolarHBondContact O-CB 3.39Å; L83-I87 VanDerWaalsContact O-CD1 3.32Å; L83-I87 WeakPolarHBondContact O-CD1 3.41Å; L83-I87 WeakPolarHBondContact O-CG1 3.46Å; L83-I87 PolarHBondContact O-N 3.16Å; S84-I87 PolarHBondContact O-N 3.24Å; I87-L89 VanDerWaalsContact C-N 3.33Å; I87-L89 PolarHBondContact O-N 3.3Å; I87-T90 PolarHBondContact O-N 3.09Å; I87-Q91 VanDerWaalsContact O-CB 3.27Å; I87-Q91 WeakPolarHBondContact O-CB 3.23Å; I87-Q91 PolarHBondContact O-N 3.37Å
88S67.3Low68.3Low65 Ų65101.8 Ų101.846%0.45552%0.515SS..Hα-helixtrans-64.5-37.4178.577.50000112.6S84 E85 Q91 S92S84-S88 WeakPolarHBondContact O-CB 3.42Å; S84-S88 PolarHBondContact O-N 2.77Å; S84-S88 PolarHBondContact O-OG 3.45Å; E85-S88 PolarHBondContact O-N 2.85Å; E85-S88 PolarHBondContact O-OG 3.3Å; S88-Q91 PolarHBondContact O-N 2.95Å; S88-S92 WeakPolarHBondContact O-CB 3.42Å; S88-S92 PolarHBondContact O-N 3.09Å
89L71.4Confident68Low104 Ų10497.1 Ų97.155%0.54551%0.508SS..Hα-helixtrans-71.1-40177.3-165.5145.1000110.5E85 D86 I87 S92 I93E85-L89 WeakPolarHBondContact O-CB 3.47Å; E85-L89 PolarHBondContact O-N 3.11Å; D86-L89 PolarHBondContact O-N 2.84Å; I87-L89 VanDerWaalsContact C-N 3.33Å; I87-L89 PolarHBondContact O-N 3.3Å; L89-S92 PolarHBondContact O-N 3.31Å; L89-I93 HydrophobicContact CD2-CD1 3.61Å; L89-I93 HydrophobicContact CD2-CG1 4.47Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.27Å
90T65.3Low67.8Low64 Ų6495.2 Ų95.239%0.39350%0.504SS..Hα-helixtrans-64.8-42.5174.5-53.50000110.9D86 I87 I93 Y94D86-T90 VanDerWaalsContact O-CB 3.25Å; D86-T90 WeakPolarHBondContact O-CB 3.42Å; D86-T90 PolarHBondContact O-N 2.85Å; D86-T90 PolarHBondContact O-OG1 2.87Å; I87-T90 PolarHBondContact O-N 3.09Å; T90-I93 PolarHBondContact O-N 2.86Å; T90-I93 VanDerWaalsContact O-N 3.17Å; T90-Y94 HydrophobicContact CG2-CD2 3.68Å; T90-Y94 HydrophobicContact CG2-CE2 3.46Å; T90-Y94 VanDerWaalsContact CG2-CE2 3.46Å; T90-Y94 WeakPolarHBondContact O-CD2 3.45Å; T90-Y94 PolarHBondContact O-N 3.16Å
91Q59.4Low66.9Low119 Ų11997.3 Ų97.356%0.55651%0.51SS*.Hα-helixtrans-64.4-39.8176-166154.1-15.400111.8I87 S88 I93 Y94 D95I87-Q91 VanDerWaalsContact O-CB 3.27Å; I87-Q91 WeakPolarHBondContact O-CB 3.23Å; I87-Q91 PolarHBondContact O-N 3.37Å; S88-Q91 PolarHBondContact O-N 2.95Å; Q91-I93 VanDerWaalsContact C-N 3.33Å; Q91-I93 PolarHBondContact O-N 3.21Å; Q91-Y94 PolarHBondContact O-N 2.98Å; Q91-D95 WeakPolarHBondContact O-CB 3.27Å; Q91-D95 PolarHBondContact O-N 3.23Å
92S66.8Low66.3Low51 Ų5198.4 Ų98.436%0.35751%0.512SS..Hα-helixtrans-63-36.4171.9-175.10000113.1S88 L89 K96S88-S92 WeakPolarHBondContact O-CB 3.42Å; S88-S92 PolarHBondContact O-N 3.09Å; L89-S92 PolarHBondContact O-N 3.31Å; S92-K96 WeakPolarHBondContact O-CB 3.44Å; S92-K96 VanDerWaalsContact O-CG 3.27Å; S92-K96 WeakPolarHBondContact O-CG 3.38Å; S92-K96 PolarHBondContact O-N 3.49Å
93I71.2Confident65.8Low80 Ų80103 Ų10341%0.4153%0.525SS..Hα-helixtrans-70-42.7176.1-69.5167.8000110.6L89 T90 Q91 K96 K97L89-I93 HydrophobicContact CD2-CD1 3.61Å; L89-I93 HydrophobicContact CD2-CG1 4.47Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.27Å; T90-I93 PolarHBondContact O-N 2.86Å; T90-I93 VanDerWaalsContact O-N 3.17Å; Q91-I93 VanDerWaalsContact C-N 3.33Å; Q91-I93 PolarHBondContact O-N 3.21Å; I93-K96 PolarHBondContact O-N 3.45Å; I93-K97 WeakPolarHBondContact O-CB 3.45Å; I93-K97 WeakPolarHBondContact O-CG 3.43Å; I93-K97 PolarHBondContact O-N 2.84Å
94Y60.1Low65.3Low113 Ų113103.1 Ų103.144%0.44353%0.526SS..Hα-helixtrans-66.5-41.5176.9-82.1-68.7000112.1T90 Q91 K96 K97 L98T90-Y94 HydrophobicContact CG2-CD2 3.68Å; T90-Y94 HydrophobicContact CG2-CE2 3.46Å; T90-Y94 VanDerWaalsContact CG2-CE2 3.46Å; T90-Y94 WeakPolarHBondContact O-CD2 3.45Å; T90-Y94 PolarHBondContact O-N 3.16Å; Q91-Y94 PolarHBondContact O-N 2.98Å; Y94-K96 PolarHBondContact O-N 3.29Å; Y94-K97 CarbonylContact O-C 3.53Å; Y94-K97 PolarHBondContact O-N 2.9Å; Y94-L98 WeakPolarHBondContact O-CB 3.44Å; Y94-L98 PolarHBondContact O-N 2.68Å
95D63.4Low64.8Low92 Ų92105.7 Ų105.749%0.49253%0.533SS..Hα-helixtrans-62.2-43.1173.8-86-17.4000111.8Q91 K97 L98 V99Q91-D95 WeakPolarHBondContact O-CB 3.27Å; Q91-D95 PolarHBondContact O-N 3.23Å; D95-K97 VanDerWaalsContact C-N 3.32Å; D95-K97 PolarHBondContact O-N 3.18Å; D95-L98 PolarHBondContact O-N 3.14Å; D95-V99 WeakPolarHBondContact O-CB 3.32Å; D95-V99 VanDerWaalsContact O-CG2 3.3Å; D95-V99 WeakPolarHBondContact O-CG2 3.43Å; D95-V99 PolarHBondContact O-N 3.48Å
96K71.6Confident64Low144 Ų144106.5 Ų106.563%0.62654%0.537SS*.Hα-helixtrans-62.5-39.3174.2-78.4171.6-177.6163.80111.9S92 I93 Y94 L100S92-K96 WeakPolarHBondContact O-CB 3.44Å; S92-K96 VanDerWaalsContact O-CG 3.27Å; S92-K96 WeakPolarHBondContact O-CG 3.38Å; S92-K96 PolarHBondContact O-N 3.49Å; I93-K96 PolarHBondContact O-N 3.45Å; Y94-K96 PolarHBondContact O-N 3.29Å; K96-L100 WeakPolarHBondContact O-CB 3.42Å; K96-L100 PolarHBondContact O-N 3.32Å
97K69.3Low63.2Low123 Ų123104.9 Ų104.954%0.53554%0.543SS..Hα-helixtrans-68.4-39.2175-80.4-176.4178.7179.10111.9I93 Y94 D95 L100 M101I93-K97 WeakPolarHBondContact O-CB 3.45Å; I93-K97 WeakPolarHBondContact O-CG 3.43Å; I93-K97 PolarHBondContact O-N 2.84Å; Y94-K97 CarbonylContact O-C 3.53Å; Y94-K97 PolarHBondContact O-N 2.9Å; D95-K97 VanDerWaalsContact C-N 3.32Å; D95-K97 PolarHBondContact O-N 3.18Å; K97-L100 PolarHBondContact O-N 2.85Å; K97-M101 VanDerWaalsContact O-CB 3.32Å; K97-M101 WeakPolarHBondContact O-CB 3.45Å; K97-M101 WeakPolarHBondContact O-CG 3.37Å; K97-M101 PolarHBondContact O-N 2.89Å
98L65.6Low62.7Low109 Ų109107 Ų10757%0.57156%0.555SS**Hα-helixtrans-64.2-45.6175.8-96.9158.5000111.2Y94 D95 L100 M101 Q102Y94-L98 WeakPolarHBondContact O-CB 3.44Å; Y94-L98 PolarHBondContact O-N 2.68Å; D95-L98 PolarHBondContact O-N 3.14Å; L98-L100 VanDerWaalsContact C-N 3.3Å; L98-L100 PolarHBondContact O-N 3.36Å; L98-M101 PolarHBondContact O-N 2.94Å; L98-Q102 VanDerWaalsContact O-CB 3.22Å; L98-Q102 WeakPolarHBondContact O-CB 3.45Å; L98-Q102 PolarHBondContact O-N 2.99Å
99V69.9Low61.6Low99 Ų99110.6 Ų110.660%0.657%0.569SS**Hα-helixtrans-63.7-37.3174.6172.70000111.2D95 K103D95-V99 WeakPolarHBondContact O-CB 3.32Å; D95-V99 VanDerWaalsContact O-CG2 3.3Å; D95-V99 WeakPolarHBondContact O-CG2 3.43Å; D95-V99 PolarHBondContact O-N 3.48Å; V99-K103 VanDerWaalsContact O-CB 3.24Å; V99-K103 WeakPolarHBondContact O-CB 3.41Å; V99-K103 PolarHBondContact O-N 2.94Å
100L70.8Confident60.7Low105 Ų105110.8 Ų110.855%0.5558%0.577SS.*Hα-helixtrans-71.5-38.8177-164.8128.3000112.2K96 K97 L98 K103 N104K96-L100 WeakPolarHBondContact O-CB 3.42Å; K96-L100 PolarHBondContact O-N 3.32Å; K97-L100 PolarHBondContact O-N 2.85Å; L98-L100 VanDerWaalsContact C-N 3.3Å; L98-L100 PolarHBondContact O-N 3.36Å; L100-K103 PolarHBondContact O-N 2.67Å; L100-N104 WeakPolarHBondContact O-CB 3.45Å; L100-N104 PolarHBondContact O-N 3.47Å; L100-N104 PolarHBondContact O-ND2 2.88Å
101M55.1Low59.8Low122 Ų122117.8 Ų117.860%0.60160%0.602SS**Hα-helixtrans-66.3-40.7172.7-73.4-73-116.700111.3K97 L98 K103 N104 L105K97-M101 VanDerWaalsContact O-CB 3.32Å; K97-M101 WeakPolarHBondContact O-CB 3.45Å; K97-M101 WeakPolarHBondContact O-CG 3.37Å; K97-M101 PolarHBondContact O-N 2.89Å; L98-M101 PolarHBondContact O-N 2.94Å; M101-K103 VanDerWaalsContact C-N 3.35Å; M101-N104 PolarHBondContact O-N 3.4Å; M101-L105 WeakPolarHBondContact O-CB 3.27Å; M101-L105 WeakPolarHBondContact O-CG 3.4Å; M101-L105 PolarHBondContact O-N 2.93Å
102Q54.5Low59.3Low125 Ų125116.9 Ų116.958%0.58461%0.614SS**Hα-helixtrans-67.5-35.2175.8-171.9153.6-1600112L98 L105 Q106L98-Q102 VanDerWaalsContact O-CB 3.22Å; L98-Q102 WeakPolarHBondContact O-CB 3.45Å; L98-Q102 PolarHBondContact O-N 2.99Å; Q102-L105 PolarHBondContact O-N 2.8Å; Q102-Q106 WeakPolarHBondContact O-CB 3.46Å; Q102-Q106 PolarHBondContact O-N 3.42Å
103K63.1Low58.4Low156 Ų156121.4 Ų121.468%0.67863%0.634SS**Hα-helixtrans-71.4-36.1172.7-165.3173-173.5173.40112.5V99 L100 M101 Q106 G107V99-K103 VanDerWaalsContact O-CB 3.24Å; V99-K103 WeakPolarHBondContact O-CB 3.41Å; V99-K103 PolarHBondContact O-N 2.94Å; L100-K103 PolarHBondContact O-N 2.67Å; M101-K103 VanDerWaalsContact C-N 3.35Å; K103-Q106 PolarHBondContact O-N 3.2Å; K103-G107 PolarHBondContact O-N 3.16Å; K103-G107 VanDerWaalsContact O-N 3.14Å
104N58.9Low57.4Low92 Ų92125.1 Ų125.149%0.49265%0.654SS.*Hα-helixtrans-68.7-37.3172.9-71.3-18.5000111.5L100 M101 G107 L108L100-N104 WeakPolarHBondContact O-CB 3.45Å; L100-N104 PolarHBondContact O-N 3.47Å; L100-N104 PolarHBondContact O-ND2 2.88Å; M101-N104 PolarHBondContact O-N 3.4Å; N104-G107 PolarHBondContact O-N 3.05Å; N104-L108 WeakPolarHBondContact O-CD1 3.47Å
105L55.4Low56.9Low124 Ų124127.8 Ų127.865%0.64968%0.676SS**Hα-helixtrans-70-36.3173.7-78161.7000112.4M101 Q102 G107 L108M101-L105 WeakPolarHBondContact O-CB 3.27Å; M101-L105 WeakPolarHBondContact O-CG 3.4Å; M101-L105 PolarHBondContact O-N 2.93Å; Q102-L105 PolarHBondContact O-N 2.8Å; L105-G107 VanDerWaalsContact C-N 3.26Å; L105-G107 PolarHBondContact O-N 3.42Å; L105-L108 PolarHBondContact O-N 3.3Å; L105-L108 VanDerWaalsContact O-N 3.16Å
106Q52.5Low56Low157 Ų157127.6 Ų127.673%0.73468%0.681SS**Hα-helixtrans-70.4-17.9172.2-98.3177.9-15.400114Q102 K103 L108Q102-Q106 WeakPolarHBondContact O-CB 3.46Å; Q102-Q106 PolarHBondContact O-N 3.42Å; K103-Q106 PolarHBondContact O-N 3.2Å; Q106-L108 VanDerWaalsContact C-N 3.26Å
107G50.8Low54.9Low63 Ų63126.9 Ų126.965%0.64969%0.694SS**THydrogen-bonded Turntrans-78-8.8170.500000113.9K103 N104 L105K103-G107 PolarHBondContact O-N 3.16Å; K103-G107 VanDerWaalsContact O-N 3.14Å; N104-G107 PolarHBondContact O-N 3.05Å; L105-G107 VanDerWaalsContact C-N 3.26Å; L105-G107 PolarHBondContact O-N 3.42Å
108L53.6Low54Low139 Ų139129.6 Ų129.673%0.72871%0.707SS**  trans-101.165.4179-77.9147.3000110.3N104 L105 Q106N104-L108 WeakPolarHBondContact O-CD1 3.47Å; L105-L108 PolarHBondContact O-N 3.3Å; L105-L108 VanDerWaalsContact O-N 3.16Å; Q106-L108 VanDerWaalsContact C-N 3.26Å
109D44.2Very low53Low141 Ų141127.6 Ų127.675%0.75470%0.701SS**  trans-102152.9163.5-136.824.7000109.1K111D109-K111 PolarHBondContact O-N 3.14Å
110P53Low52Low109 Ų109131.7 Ų131.771%0.70871%0.713SS**SBendtrans-93.658.6-13138.8-39.3000112.7
111K47.7Very low51.3Low211 Ų211133.9 Ų133.992%0.91772%0.72SS**  trans-113.319.3179.6-82.9-177177.4175.50115.2D109D109-K111 PolarHBondContact O-N 3.14Å
112A48.5Very low51.1Low99 Ų99132.7 Ų132.782%0.81872%0.72SS**  trans-119.832.5171.800000113
113L47.8Very low51.2Low146 Ų146129.9 Ų129.976%0.76473%0.725SS**  trans-110.563.5173.1-150.393.9000110.6
114N49.7Very low50.9Low159 Ų159128.9 Ų128.985%0.8572%0.722SS**SBendtrans-156.564.4161.8-91.3-21.5000109.2
115N50.6Low50.7Low169 Ų169129.1 Ų129.190%0.90472%0.723SS**  trans162.384.9146-89.9-9000108.8
116C43.5Very low51.3Low87 Ų87124.7 Ų124.759%0.58871%0.708SS**  trans-143.4103.6159.9-164.20000107.6F118 C119C116-F118 PolarHBondContact O-N 3.05Å; C116-F118 VanDerWaalsContact O-N 3.14Å; C116-C119 VanDerWaalsContact CB-SG 3.58Å
117S48.9Very low52.2Low130 Ų130120.3 Ų120.391%0.90969%0.693SS**SBendtrans-8129.617657.60000112.2
118F48.9Very low53Low180 Ų180122.8 Ų122.879%0.78969%0.688SS**  trans-148.959.7173.6-144.5-90.9000110.4C116C116-F118 PolarHBondContact O-N 3.05Å; C116-F118 VanDerWaalsContact O-N 3.14Å
119C46Very low53.8Low66 Ų66120.5 Ų120.545%0.44668%0.675SS.*  trans-114.767.6176-74.20000110.8C116C116-C119 VanDerWaalsContact CB-SG 3.58Å
120H49.4Very low55Low185 Ų185121.6 Ų121.686%0.85667%0.669SS**SBendtrans-112.69167.3-130.554.1000114.6
121E54.2Low56.2Low151 Ų151122.5 Ų122.571%0.70666%0.661SS**SBendtrans-124.22.7175.7-90.9172.6158.200114.2
122V51.2Low57.4Low97 Ų97117.8 Ų117.859%0.58865%0.646SS**Hα-helixtrans-87.4-21177.8-173.30000111.9
123G57.3Low58.6Low67 Ų67119.1 Ų119.169%0.69164%0.635SS**Hα-helixtrans-73.4-21.5177.300000114.7P127G123-P127 WeakPolarHBondContact O-CD 3.47Å
124Q55.9Low60Low134 Ų134119.1 Ų119.163%0.62663%0.631SS**Hα-helixtrans-86.9-29.4176.5-101.7173.6-1800113P127 E128Q124-P127 VanDerWaalsContact O-CD 3.25Å; Q124-P127 WeakPolarHBondContact O-CD 3.5Å; Q124-P127 VanDerWaalsContact O-CG 3.28Å; Q124-P127 WeakPolarHBondContact O-CG 3.44Å; Q124-E128 PolarHBondContact O-N 3Å
125L56.3Low61.6Low97 Ų97116.5 Ų116.551%0.50861%0.614SS.*Hα-helixtrans-71.5-35.5-178-146.577.7000112.6E128 I129L125-E128 PolarHBondContact O-N 3.46Å; L125-I129 HydrophobicContact CD2-CD1 4.07Å; L125-I129 HydrophobicContact CG-CD1 3.98Å; L125-I129 HydrophobicContact CG-CG1 4.48Å; L125-I129 WeakPolarHBondContact O-CB 3.28Å; L125-I129 WeakPolarHBondContact O-CD1 3.46Å; L125-I129 WeakPolarHBondContact O-CG1 3.5Å; L125-I129 PolarHBondContact O-N 3.32Å
126G67.3Low62.6Low32 Ų32113.9 Ų113.933%0.3360%0.599SS.*Hα-helixtrans-59.5-49178.200000115.4R130G126-R130 WeakPolarHBondContact O-CG 3.41Å; G126-R130 PolarHBondContact O-N 2.89Å; G126-R130 VanDerWaalsContact O-N 3.16Å
127P70.5Confident64.3Low64 Ų64114.6 Ų114.642%0.41659%0.594SS.*Hα-helixtrans-67.4-3417423.4-31000113.3G123 Q124 R130 K131G123-P127 WeakPolarHBondContact O-CD 3.47Å; Q124-P127 VanDerWaalsContact O-CD 3.25Å; Q124-P127 WeakPolarHBondContact O-CD 3.5Å; Q124-P127 VanDerWaalsContact O-CG 3.28Å; Q124-P127 WeakPolarHBondContact O-CG 3.44Å; P127-R130 PolarHBondContact O-N 2.87Å; P127-K131 WeakPolarHBondContact O-CB 3.43Å; P127-K131 PolarHBondContact O-N 3.25Å
128E68Low65.9Low116 Ų116110.3 Ų110.354%0.54257%0.57SS.*Hα-helixtrans-67.2-40.7174.9-74.2-173.617000112.6Q124 L125 R130 K131 L132Q124-E128 PolarHBondContact O-N 3Å; L125-E128 PolarHBondContact O-N 3.46Å; E128-R130 VanDerWaalsContact C-N 3.34Å; E128-R130 PolarHBondContact O-N 3.36Å; E128-K131 PolarHBondContact O-N 2.87Å; E128-L132 WeakPolarHBondContact O-CB 3.42Å; E128-L132 PolarHBondContact O-N 3.29Å
129I70.5Confident67.2Low91 Ų91106.3 Ų106.347%0.46756%0.556SS.*Hα-helixtrans-62.8-41.5175.1-70.2164.1000110.8L125 L132 Q133L125-I129 HydrophobicContact CD2-CD1 4.07Å; L125-I129 HydrophobicContact CG-CD1 3.98Å; L125-I129 HydrophobicContact CG-CG1 4.48Å; L125-I129 WeakPolarHBondContact O-CB 3.28Å; L125-I129 WeakPolarHBondContact O-CD1 3.46Å; L125-I129 WeakPolarHBondContact O-CG1 3.5Å; L125-I129 PolarHBondContact O-N 3.32Å; I129-L132 PolarHBondContact O-N 3.4Å; I129-Q133 WeakPolarHBondContact O-CB 3.44Å; I129-Q133 PolarHBondContact O-N 3.41Å
130R69.6Low68.7Low164 Ų164108.7 Ų108.762%0.61956%0.561SS**Hα-helixtrans-65.8-39.6175.9-74.9-174-66.1-147.60.1112.5G126 P127 E128 Q133 E134G126-R130 WeakPolarHBondContact O-CG 3.41Å; G126-R130 PolarHBondContact O-N 2.89Å; G126-R130 VanDerWaalsContact O-N 3.16Å; P127-R130 PolarHBondContact O-N 2.87Å; E128-R130 VanDerWaalsContact C-N 3.34Å; E128-R130 PolarHBondContact O-N 3.36Å; R130-Q133 WeakPolarHBondContact O-CB 3.28Å; R130-Q133 PolarHBondContact O-N 3.1Å; R130-E134 PolarHBondContact O-N 2.88Å
131K78.7Confident70.2Confident127 Ų127106.1 Ų106.155%0.55255%0.547SS*.Hα-helixtrans-63.7-44.4175.3-172-176175.7-167.70111.5P127 E128 Q133 E134 E135P127-K131 WeakPolarHBondContact O-CB 3.43Å; P127-K131 PolarHBondContact O-N 3.25Å; E128-K131 PolarHBondContact O-N 2.87Å; K131-Q133 VanDerWaalsContact C-N 3.27Å; K131-Q133 PolarHBondContact O-N 2.98Å; K131-E134 PolarHBondContact O-N 3.3Å; K131-E135 WeakPolarHBondContact CE-OE1 3.19Å; K131-E135 WeakPolarHBondContact O-CG 3.4Å; K131-E135 PolarHBondContact O-N 3.03Å
132L72.7Confident71.6Confident113 Ų113104.3 Ų104.359%0.59254%0.542SS*.Hα-helixtrans-61.4-36.1173.2-85.8157.4000112E128 I129 E135 L136E128-L132 WeakPolarHBondContact O-CB 3.42Å; E128-L132 PolarHBondContact O-N 3.29Å; I129-L132 PolarHBondContact O-N 3.4Å; L132-E135 PolarHBondContact O-N 3.46Å; L132-L136 VanDerWaalsContact O-CB 3.26Å; L132-L136 WeakPolarHBondContact O-CB 3.39Å; L132-L136 PolarHBondContact O-N 3.38Å
133Q74.3Confident72.8Confident126 Ų126104.5 Ų104.559%0.58954%0.539SS*.Hα-helixtrans-69-39.4177.4-163.3172.2-2.300112.1I129 R130 K131 L136 E137I129-Q133 WeakPolarHBondContact O-CB 3.44Å; I129-Q133 PolarHBondContact O-N 3.41Å; R130-Q133 WeakPolarHBondContact O-CB 3.28Å; R130-Q133 PolarHBondContact O-N 3.1Å; K131-Q133 VanDerWaalsContact C-N 3.27Å; K131-Q133 PolarHBondContact O-N 2.98Å; Q133-L136 PolarHBondContact O-N 3.43Å; Q133-E137 PolarHBondContact O-N 3.32Å
134E77.3Confident74Confident147 Ų147106 Ų10669%0.68753%0.53SS*.Hα-helixtrans-66.4-42.4171.7-82.5-176.5158.800112.4R130 K131 L136 E137 G138R130-E134 PolarHBondContact O-N 2.88Å; K131-E134 PolarHBondContact O-N 3.3Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 2.84Å; E134-E137 PolarHBondContact O-N 2.91Å; E134-G138 PolarHBondContact O-N 2.66Å
135E81.4Confident75.3Confident104 Ų104102.4 Ų102.449%0.48652%0.524SS..Hα-helixtrans-63.7-39.4175.6-74.4-175.7-17200111.3K131 L132 G138 I139K131-E135 WeakPolarHBondContact CE-OE1 3.19Å; K131-E135 WeakPolarHBondContact O-CG 3.4Å; K131-E135 PolarHBondContact O-N 3.03Å; L132-E135 PolarHBondContact O-N 3.46Å; E135-G138 PolarHBondContact O-N 2.89Å; E135-I139 VanDerWaalsContact O-CG1 3.25Å; E135-I139 WeakPolarHBondContact O-CG1 3.38Å; E135-I139 PolarHBondContact O-N 3.5Å
136L73.1Confident76.6Confident114 Ų114103.3 Ų103.360%0.59753%0.526SS*.Hα-helixtrans-65.5-41.4175.9-166.374.7000111.8L132 Q133 E134 G138 I139 Q140L132-L136 VanDerWaalsContact O-CB 3.26Å; L132-L136 WeakPolarHBondContact O-CB 3.39Å; L132-L136 PolarHBondContact O-N 3.38Å; Q133-L136 PolarHBondContact O-N 3.43Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 2.84Å; L136-G138 VanDerWaalsContact C-N 3.32Å; L136-I139 PolarHBondContact O-N 3.34Å; L136-Q140 WeakPolarHBondContact O-CB 3.27Å; L136-Q140 PolarHBondContact O-N 2.82Å
137E79.1Confident77.3Confident101 Ų101108.1 Ų108.147%0.47254%0.539SS..Hα-helixtrans-66.6-35.9175.6-158.9-169.3142.300111.6Q133 E134 Q140 K141Q133-E137 PolarHBondContact O-N 3.32Å; E134-E137 PolarHBondContact O-N 2.91Å; E137-Q140 PolarHBondContact O-N 3.23Å; E137-K141 WeakPolarHBondContact O-CG 3.43Å; E137-K141 PolarHBondContact O-N 2.86Å; E137-K141 WeakPolarHBondContact OE1-CE 3.32Å; E137-K141 IonicContact OE1-NZ 3.97Å; E137-K141 PolarHBondContact OE1-NZ 3.38Å
138G83.2Confident78.1Confident41 Ų41109.1 Ų109.142%0.42354%0.544SS..Hα-helixtrans-62.9-45.5172.200000112.7E134 E135 L136 Q140 K141 L142E134-G138 PolarHBondContact O-N 2.66Å; E135-G138 PolarHBondContact O-N 2.89Å; L136-G138 VanDerWaalsContact C-N 3.32Å; G138-Q140 VanDerWaalsContact C-N 3.35Å; G138-K141 PolarHBondContact O-N 2.87Å; G138-L142 PolarHBondContact O-N 2.93Å
139I76.3Confident78.6Confident95 Ų95109.8 Ų109.849%0.48755%0.547SS..Hα-helixtrans-64.4-40.1175.8-68.7164.3000110.8E135 L136 K141 L142 L143E135-I139 VanDerWaalsContact O-CG1 3.25Å; E135-I139 WeakPolarHBondContact O-CG1 3.38Å; E135-I139 PolarHBondContact O-N 3.5Å; L136-I139 PolarHBondContact O-N 3.34Å; I139-K141 PolarHBondContact O-N 3.15Å; I139-L142 WeakPolarHBondContact O-CB 3.34Å; I139-L142 PolarHBondContact O-N 2.93Å; I139-L143 HydrophobicContact CG2-CD1 4.01Å; I139-L143 WeakPolarHBondContact O-CB 3.46Å; I139-L143 PolarHBondContact O-N 2.96Å
140Q75.8Confident79Confident117 Ų117110.5 Ų110.555%0.54755%0.552SS.*Hα-helixtrans-64.7-39178.3-166.5175.71.700112.1L136 E137 G138 L143 L144L136-Q140 WeakPolarHBondContact O-CB 3.27Å; L136-Q140 PolarHBondContact O-N 2.82Å; E137-Q140 PolarHBondContact O-N 3.23Å; G138-Q140 VanDerWaalsContact C-N 3.35Å; Q140-L143 PolarHBondContact O-N 2.87Å; Q140-L144 WeakPolarHBondContact O-CG 3.38Å; Q140-L144 PolarHBondContact O-N 3.29Å
141K81.1Confident79.5Confident130 Ų130107.2 Ų107.257%0.56555%0.546SS*.Hα-helixtrans-65.6-39.3172.7-75.7172.9-174155.10112.1E137 G138 I139 A145E137-K141 WeakPolarHBondContact O-CG 3.43Å; E137-K141 PolarHBondContact O-N 2.86Å; E137-K141 WeakPolarHBondContact OE1-CE 3.32Å; E137-K141 IonicContact OE1-NZ 3.97Å; E137-K141 PolarHBondContact OE1-NZ 3.38Å; G138-K141 PolarHBondContact O-N 2.87Å; I139-K141 PolarHBondContact O-N 3.15Å; K141-A145 WeakPolarHBondContact O-CB 3.46Å; K141-A145 PolarHBondContact O-N 3.49Å
142L83.1Confident79.7Confident113 Ų113107.2 Ų107.259%0.59255%0.548SS*.Hα-helixtrans-64.6-41.6175.9-163.789.1000111.6G138 I139 A145 Q146G138-L142 PolarHBondContact O-N 2.93Å; I139-L142 WeakPolarHBondContact O-CB 3.34Å; I139-L142 PolarHBondContact O-N 2.93Å; L142-A145 PolarHBondContact O-N 2.65Å; L142-Q146 PolarHBondContact O-N 2.97Å
143L76.9Confident79.8Confident102 Ų102105.4 Ų105.453%0.53454%0.542SS..Hα-helixtrans-62.9-46.1176.5-91.3160.3000112I139 Q140 A145 Q146 E147I139-L143 HydrophobicContact CG2-CD1 4.01Å; I139-L143 WeakPolarHBondContact O-CB 3.46Å; I139-L143 PolarHBondContact O-N 2.96Å; Q140-L143 PolarHBondContact O-N 2.87Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.5Å; L143-Q146 PolarHBondContact O-N 3.31Å; L143-E147 PolarHBondContact O-N 2.92Å
144L84.1Confident80.1Confident97 Ų97103.7 Ų103.751%0.50854%0.536SS..Hα-helixtrans-62-39.9175.6-76.1167.6000112Q140 E147 V148Q140-L144 WeakPolarHBondContact O-CG 3.38Å; Q140-L144 PolarHBondContact O-N 3.29Å; L144-E147 PolarHBondContact O-N 3.37Å; L144-V148 WeakPolarHBondContact O-CG2 3.38Å; L144-V148 PolarHBondContact O-N 2.66Å; L144-V148 VanDerWaalsContact O-N 3.17Å
145A82.7Confident80.4Confident59 Ų59102.3 Ų102.349%0.48853%0.53SS..Hα-helixtrans-65-39.3174.800000112K141 L142 L143 Q149K141-A145 WeakPolarHBondContact O-CB 3.46Å; K141-A145 PolarHBondContact O-N 3.49Å; L142-A145 PolarHBondContact O-N 2.65Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.5Å; A145-Q149 WeakPolarHBondContact O-CB 3.42Å; A145-Q149 PolarHBondContact O-N 3.48Å; A145-Q149 VanDerWaalsContact O-N 3.13Å
146Q82.4Confident80.1Confident117 Ų117100.2 Ų100.255%0.54753%0.53SS..Hα-helixtrans-66.3-37.3174.4-89-174.9-40.400112.8L142 L143 Q149 L150L142-Q146 PolarHBondContact O-N 2.97Å; L143-Q146 PolarHBondContact O-N 3.31Å; Q146-Q149 PolarHBondContact O-N 3.1Å; Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 PolarHBondContact O-N 3.16Å
147E83Confident80.3Confident132 Ų132101 Ų10162%0.61753%0.531SS*.Hα-helixtrans-64.3-45.3178.2-173.4171.2-167.700111.4L143 L144 Q149 L150 D151L143-E147 PolarHBondContact O-N 2.92Å; L144-E147 PolarHBondContact O-N 3.37Å; E147-Q149 VanDerWaalsContact C-N 3.31Å; E147-Q149 PolarHBondContact O-N 3.42Å; E147-L150 WeakPolarHBondContact O-CB 3.43Å; E147-L150 PolarHBondContact O-N 3.31Å; E147-D151 PolarHBondContact O-N 2.92Å
148V87Confident80.5Confident85 Ų85102.6 Ų102.652%0.51554%0.538SS..Hα-helixtrans-61.1-41.4174.2173.50000111.4L144 L150 D151 Q152L144-V148 WeakPolarHBondContact O-CG2 3.38Å; L144-V148 PolarHBondContact O-N 2.66Å; L144-V148 VanDerWaalsContact O-N 3.17Å; V148-L150 VanDerWaalsContact C-N 3.33Å; V148-D151 PolarHBondContact O-N 3.04Å; V148-Q152 WeakPolarHBondContact O-CG 3.47Å; V148-Q152 PolarHBondContact O-N 3.09Å
149Q79.1Confident80.6Confident130 Ų130105 Ų10561%0.60754%0.544SS*.Hα-helixtrans-68-36178.5-163.4177.8-48.900111.7A145 Q146 E147 T153A145-Q149 WeakPolarHBondContact O-CB 3.42Å; A145-Q149 PolarHBondContact O-N 3.48Å; A145-Q149 VanDerWaalsContact O-N 3.13Å; Q146-Q149 PolarHBondContact O-N 3.1Å; E147-Q149 VanDerWaalsContact C-N 3.31Å; E147-Q149 PolarHBondContact O-N 3.42Å; Q149-T153 PolarHBondContact O-N 3.12Å; Q149-T153 PolarHBondContact O-OG1 3.38Å; Q149-T153 VanDerWaalsContact O-OG1 3.1Å
150L79.4Confident80.7Confident107 Ų107104.1 Ų104.156%0.5654%0.541SS*.Hα-helixtrans-65.6-43.8175.6-171.565.6000110.9Q146 E147 V148 Q152 T153 L154Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 PolarHBondContact O-N 3.16Å; E147-L150 WeakPolarHBondContact O-CB 3.43Å; E147-L150 PolarHBondContact O-N 3.31Å; V148-L150 VanDerWaalsContact C-N 3.33Å; L150-Q152 PolarHBondContact O-N 3.23Å; L150-T153 VanDerWaalsContact CA-OG1 3.29Å; L150-T153 WeakPolarHBondContact CA-OG1 3.36Å; L150-T153 PolarHBondContact O-N 3.5Å; L150-T153 VanDerWaalsContact O-N 3.16Å; L150-T153 PolarHBondContact O-OG1 2.9Å; L150-L154 HydrophobicContact CG-CD1 4.3Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.34Å
151D79.8Confident80.9Confident95 Ų95101.4 Ų101.451%0.50854%0.535SS..Hα-helixtrans-64.5-41.2178.8-15835.7000111.8E147 V148 T153 L154 Q155E147-D151 PolarHBondContact O-N 2.92Å; V148-D151 PolarHBondContact O-N 3.04Å; D151-T153 VanDerWaalsContact C-N 3.35Å; D151-T153 PolarHBondContact O-N 3.35Å; D151-L154 PolarHBondContact O-N 3.23Å; D151-Q155 PolarHBondContact O-N 3.22Å
152Q81.4Confident81.1Confident126 Ų12698 Ų9859%0.58953%0.525SS*.Hα-helixtrans-61.5-40171.8-72.9175.94.800112.6V148 L150 A156V148-Q152 WeakPolarHBondContact O-CG 3.47Å; V148-Q152 PolarHBondContact O-N 3.09Å; L150-Q152 PolarHBondContact O-N 3.23Å; Q152-A156 WeakPolarHBondContact O-CB 3.41Å; Q152-A156 PolarHBondContact O-N 3.41Å
153T75.4Confident81Confident76 Ų7695.4 Ų95.447%0.46651%0.514SS..Hα-helixtrans-70-33.9176.147.10000113.2Q149 L150 D151 A156 Q157Q149-T153 PolarHBondContact O-N 3.12Å; Q149-T153 PolarHBondContact O-OG1 3.38Å; Q149-T153 VanDerWaalsContact O-OG1 3.1Å; L150-T153 VanDerWaalsContact CA-OG1 3.29Å; L150-T153 WeakPolarHBondContact CA-OG1 3.36Å; L150-T153 PolarHBondContact O-N 3.5Å; L150-T153 VanDerWaalsContact O-N 3.16Å; L150-T153 PolarHBondContact O-OG1 2.9Å; D151-T153 VanDerWaalsContact C-N 3.35Å; D151-T153 PolarHBondContact O-N 3.35Å; T153-A156 PolarHBondContact O-N 3.05Å; T153-Q157 WeakPolarHBondContact O-CB 3.42Å; T153-Q157 PolarHBondContact O-N 2.89Å
154L81.2Confident80.8Confident90 Ų9093.7 Ų93.747%0.47151%0.51SS..Hα-helixtrans-67.7-44.6175.6-76.3167.9000111.3L150 D151 A156 Q157 E158L150-L154 HydrophobicContact CG-CD1 4.3Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.34Å; D151-L154 PolarHBondContact O-N 3.23Å; L154-A156 VanDerWaalsContact C-N 3.34Å; L154-A156 PolarHBondContact O-N 2.93Å; L154-Q157 WeakPolarHBondContact O-CB 3.34Å; L154-Q157 PolarHBondContact O-N 3.33Å; L154-E158 PolarHBondContact O-N 2.9Å
155Q82.4Confident80.7Confident118 Ų11896.1 Ų96.155%0.55151%0.513SS*.Hα-helixtrans-60.6-43172.5-77.2-176.13.300111.9D151 Q157 E158 V159D151-Q155 PolarHBondContact O-N 3.22Å; Q155-Q157 VanDerWaalsContact C-N 3.29Å; Q155-Q157 PolarHBondContact O-N 3.03Å; Q155-E158 PolarHBondContact O-N 3.11Å; Q155-V159 WeakPolarHBondContact O-CG2 3.44Å; Q155-V159 PolarHBondContact O-N 2.94Å
156A76Confident80.9Confident60 Ų6099.2 Ų99.250%0.49652%0.517SS..Hα-helixtrans-62-37.4175.800000112.1Q152 T153 L154 L160Q152-A156 WeakPolarHBondContact O-CB 3.41Å; Q152-A156 PolarHBondContact O-N 3.41Å; T153-A156 PolarHBondContact O-N 3.05Å; L154-A156 VanDerWaalsContact C-N 3.34Å; L154-A156 PolarHBondContact O-N 2.93Å; A156-L160 VanDerWaalsContact O-CB 3.29Å; A156-L160 WeakPolarHBondContact O-CB 3.34Å; A156-L160 PolarHBondContact O-N 3.11Å
157Q77.8Confident80.6Confident129 Ų12998.2 Ų98.260%0.60351%0.514SS*.Hα-helixtrans-67.5-37.4176.1-174.6178-3.200112.3T153 L154 Q155 L160 S161T153-Q157 WeakPolarHBondContact O-CB 3.42Å; T153-Q157 PolarHBondContact O-N 2.89Å; L154-Q157 WeakPolarHBondContact O-CB 3.34Å; L154-Q157 PolarHBondContact O-N 3.33Å; Q155-Q157 VanDerWaalsContact C-N 3.29Å; Q155-Q157 PolarHBondContact O-N 3.03Å; Q157-L160 PolarHBondContact O-N 3.38Å; Q157-S161 VanDerWaalsContact O-CB 3.28Å; Q157-S161 WeakPolarHBondContact O-CB 3.46Å; Q157-S161 PolarHBondContact O-N 2.84Å
158E81.9Confident80.3Confident135 Ų13595.4 Ų95.463%0.63151%0.509SS*.Hα-helixtrans-67.4-43.9175.6-171.8171-16900111.8L154 Q155 L160 S161 T162L154-E158 PolarHBondContact O-N 2.9Å; Q155-E158 PolarHBondContact O-N 3.11Å; E158-L160 VanDerWaalsContact C-N 3.31Å; E158-L160 PolarHBondContact O-N 3.41Å; E158-S161 PolarHBondContact O-N 3.37Å; E158-T162 WeakPolarHBondContact O-CG2 3.4Å; E158-T162 PolarHBondContact O-N 3.39Å; E158-T162 PolarHBondContact O-OG1 3.13Å
159V85.9Confident80.2Confident91 Ų9198.1 Ų98.155%0.55252%0.516SS*.Hα-helixtrans-62.1-40173.2175.60000111Q155 T162 T163Q155-V159 WeakPolarHBondContact O-CG2 3.44Å; Q155-V159 PolarHBondContact O-N 2.94Å; V159-T162 WeakPolarHBondContact CA-OG1 3.5Å; V159-T162 PolarHBondContact O-OG1 2.92Å; V159-T163 HydrophobicContact CG1-CG2 4.45Å; V159-T163 WeakPolarHBondContact O-CB 3.37Å; V159-T163 WeakPolarHBondContact O-CG2 3.48Å; V159-T163 PolarHBondContact O-N 2.86Å; V159-T163 PolarHBondContact O-OG1 3.22Å
160L78.9Confident80.4Confident78 Ų7897.5 Ų97.541%0.40851%0.514SS..Hα-helixtrans-67.9-38.1176.9-166.169.8000112.2A156 Q157 E158 T163 S164A156-L160 VanDerWaalsContact O-CB 3.29Å; A156-L160 WeakPolarHBondContact O-CB 3.34Å; A156-L160 PolarHBondContact O-N 3.11Å; Q157-L160 PolarHBondContact O-N 3.38Å; E158-L160 VanDerWaalsContact C-N 3.31Å; E158-L160 PolarHBondContact O-N 3.41Å; L160-T163 WeakPolarHBondContact CA-OG1 3.38Å; L160-T163 PolarHBondContact O-OG1 3.31Å; L160-T163 VanDerWaalsContact O-OG1 3.06Å; L160-S164 WeakPolarHBondContact O-CB 3.3Å; L160-S164 PolarHBondContact O-N 3.46Å
161S79.2Confident80.2Confident60 Ų6097.3 Ų97.342%0.4251%0.511SS..Hα-helixtrans-65.5-45.8176.6171.20000111.9Q157 E158 S164 R165Q157-S161 VanDerWaalsContact O-CB 3.28Å; Q157-S161 WeakPolarHBondContact O-CB 3.46Å; Q157-S161 PolarHBondContact O-N 2.84Å; E158-S161 PolarHBondContact O-N 3.37Å; S161-S164 PolarHBondContact O-N 3.46Å; S161-R165 WeakPolarHBondContact O-CB 3.48Å; S161-R165 PolarHBondContact O-N 2.97Å; S161-R165 PolarHBondContact OG-NH2 3.03Å
162T85.3Confident80.2Confident59 Ų5994.8 Ų94.836%0.36251%0.507SS..Hα-helixtrans-65.2-46.5178.149.40000111.6E158 V159 R165 Q166E158-T162 WeakPolarHBondContact O-CG2 3.4Å; E158-T162 PolarHBondContact O-N 3.39Å; E158-T162 PolarHBondContact O-OG1 3.13Å; V159-T162 WeakPolarHBondContact CA-OG1 3.5Å; V159-T162 PolarHBondContact O-OG1 2.92Å; T162-R165 PolarHBondContact O-N 3.39Å; T162-Q166 PolarHBondContact O-N 2.97Å
163T80.3Confident80.4Confident58 Ų5892 Ų9236%0.35650%0.502SS..Hα-helixtrans-64.3-40175.549.90000112.6V159 L160 R165 Q166 I167V159-T163 HydrophobicContact CG1-CG2 4.45Å; V159-T163 WeakPolarHBondContact O-CB 3.37Å; V159-T163 WeakPolarHBondContact O-CG2 3.48Å; V159-T163 PolarHBondContact O-N 2.86Å; V159-T163 PolarHBondContact O-OG1 3.22Å; L160-T163 WeakPolarHBondContact CA-OG1 3.38Å; L160-T163 PolarHBondContact O-OG1 3.31Å; L160-T163 VanDerWaalsContact O-OG1 3.06Å; T163-R165 VanDerWaalsContact C-N 3.33Å; T163-R165 PolarHBondContact O-N 3.12Å; T163-Q166 PolarHBondContact O-N 3.32Å; T163-I167 VanDerWaalsContact O-CG1 3.3Å; T163-I167 WeakPolarHBondContact O-CG1 3.34Å; T163-I167 PolarHBondContact O-N 3.32Å
164S74.5Confident80.6Confident66 Ų6690.1 Ų90.146%0.46249%0.491SS..Hα-helixtrans-61.1-40.5174.9178.10000112.5L160 S161 S168L160-S164 WeakPolarHBondContact O-CB 3.3Å; L160-S164 PolarHBondContact O-N 3.46Å; S161-S164 PolarHBondContact O-N 3.46Å; S164-S168 WeakPolarHBondContact O-CB 3.49Å; S164-S168 PolarHBondContact O-N 3.39Å; S164-S168 PolarHBondContact O-OG 2.92Å
165R81.9Confident80.5Confident148 Ų14888.5 Ų88.556%0.55849%0.488SS*.Hα-helixtrans-64.2-43.3175.4-165.9-176.1-51118.410.3111.5S161 T162 T163 S168 Q169S161-R165 WeakPolarHBondContact O-CB 3.48Å; S161-R165 PolarHBondContact O-N 2.97Å; S161-R165 PolarHBondContact OG-NH2 3.03Å; T162-R165 PolarHBondContact O-N 3.39Å; T163-R165 VanDerWaalsContact C-N 3.33Å; T163-R165 PolarHBondContact O-N 3.12Å; R165-S168 PolarHBondContact O-N 3.4Å; R165-Q169 PolarHBondContact O-N 3.23Å
166Q86.4Confident80.6Confident124 Ų12489.6 Ų89.658%0.57949%0.491SS*.Hα-helixtrans-65.3-44.9178.5-168165.7-4.900111.7T162 T163 S168 Q169 E170T162-Q166 PolarHBondContact O-N 2.97Å; T163-Q166 PolarHBondContact O-N 3.32Å; Q166-S168 VanDerWaalsContact C-N 3.3Å; Q166-S168 PolarHBondContact O-N 2.9Å; Q166-Q169 PolarHBondContact O-N 3.41Å; Q166-E170 WeakPolarHBondContact O-CG 3.34Å; Q166-E170 PolarHBondContact O-N 3.28Å
167I76.8Confident80.9Confident95 Ų9589.3 Ų89.349%0.48749%0.485SS..Hα-helixtrans-59.7-42173.6-68.3166.3000110.9T163 Q169 E170 M171T163-I167 VanDerWaalsContact O-CG1 3.3Å; T163-I167 WeakPolarHBondContact O-CG1 3.34Å; T163-I167 PolarHBondContact O-N 3.32Å; I167-Q169 VanDerWaalsContact C-N 3.3Å; I167-Q169 PolarHBondContact O-N 3.3Å; I167-E170 PolarHBondContact O-N 3.24Å; I167-M171 WeakPolarHBondContact O-CB 3.48Å; I167-M171 PolarHBondContact O-N 2.91Å
168S76.8Confident80.9Confident73 Ų7387 Ų8751%0.5148%0.476SS..Hα-helixtrans-63.8-36.7178.4-59.40000112.1S164 R165 Q166 G172S164-S168 WeakPolarHBondContact O-CB 3.49Å; S164-S168 PolarHBondContact O-N 3.39Å; S164-S168 PolarHBondContact O-OG 2.92Å; R165-S168 PolarHBondContact O-N 3.4Å; Q166-S168 VanDerWaalsContact C-N 3.3Å; Q166-S168 PolarHBondContact O-N 2.9Å; S168-G172 PolarHBondContact O-N 3.31Å
169Q84.6Confident81Confident143 Ų14386.5 Ų86.567%0.66847%0.473SS*.Hα-helixtrans-69.9-45.6176.8-172.2174.8-8.400111.8R165 Q166 I167 M171 G172 S173R165-Q169 PolarHBondContact O-N 3.23Å; Q166-Q169 PolarHBondContact O-N 3.41Å; I167-Q169 VanDerWaalsContact C-N 3.3Å; I167-Q169 PolarHBondContact O-N 3.3Å; Q169-M171 VanDerWaalsContact C-N 3.33Å; Q169-M171 PolarHBondContact O-N 3.23Å; Q169-G172 PolarHBondContact O-N 2.97Å; Q169-S173 PolarHBondContact O-N 3.34Å
170E81.9Confident81Confident117 Ų11787.2 Ų87.255%0.54747%0.471SS..Hα-helixtrans-63.1-39.5174.8-68.6-59.4154.500111.7Q166 I167 G172 S173 C174Q166-E170 WeakPolarHBondContact O-CG 3.34Å; Q166-E170 PolarHBondContact O-N 3.28Å; I167-E170 PolarHBondContact O-N 3.24Å; E170-G172 VanDerWaalsContact C-N 3.33Å; E170-G172 PolarHBondContact O-N 3.07Å; E170-S173 WeakPolarHBondContact O-CB 3.2Å; E170-S173 PolarHBondContact O-N 2.95Å; E170-C174 WeakPolarHBondContact O-CB 3.32Å; E170-C174 PolarHBondContact O-N 3.31Å
171M76.6Confident81.2Confident103 Ų10387 Ų8751%0.50747%0.473SS..Hα-helixtrans-63.7-38.7174.9-170.966.5178.700111.7I167 Q169 C174 S175 M406I167-M171 WeakPolarHBondContact O-CB 3.48Å; I167-M171 PolarHBondContact O-N 2.91Å; Q169-M171 VanDerWaalsContact C-N 3.33Å; Q169-M171 PolarHBondContact O-N 3.23Å; M171-C174 PolarHBondContact O-N 2.67Å; M171-S175 WeakPolarHBondContact O-CB 3.39Å; M171-S175 PolarHBondContact O-N 2.76Å; M171-M406 HydrophobicContact SD-CE 4.36Å
172G80.1Confident81.4Confident42 Ų4289.2 Ų89.243%0.43348%0.48SS..Hα-helixtrans-62.8-44.3172.500000112.5S168 Q169 E170 S175 F176S168-G172 PolarHBondContact O-N 3.31Å; Q169-G172 PolarHBondContact O-N 2.97Å; E170-G172 VanDerWaalsContact C-N 3.33Å; E170-G172 PolarHBondContact O-N 3.07Å; G172-S175 PolarHBondContact O-N 2.74Å; G172-F176 PolarHBondContact O-N 3.42Å
173S83.6Confident81.7Confident67 Ų6792.9 Ų92.947%0.46949%0.493SS..Hα-helixtrans-62.5-43175.9-171.90000112.1Q169 E170 F176 S177Q169-S173 PolarHBondContact O-N 3.34Å; E170-S173 WeakPolarHBondContact O-CB 3.2Å; E170-S173 PolarHBondContact O-N 2.95Å; S173-F176 PolarHBondContact O-N 3.02Å; S173-S177 WeakPolarHBondContact O-CB 3.48Å; S173-S177 PolarHBondContact O-N 3Å; S173-S177 PolarHBondContact O-OG 3.46Å
174C79.7Confident82Confident37 Ų3792.6 Ų92.625%0.2549%0.493CS..Hα-helixtrans-63.4-45.4175.5-174.20000111.6E170 M171 F176 S177 I178E170-C174 WeakPolarHBondContact O-CB 3.32Å; E170-C174 PolarHBondContact O-N 3.31Å; M171-C174 PolarHBondContact O-N 2.67Å; C174-F176 VanDerWaalsContact C-N 3.32Å; C174-F176 PolarHBondContact O-N 3.07Å; C174-S177 WeakPolarHBondContact O-CB 3.43Å; C174-S177 PolarHBondContact O-N 3.43Å; C174-I178 VanDerWaalsContact O-CG1 3.29Å; C174-I178 WeakPolarHBondContact O-CG1 3.49Å; C174-I178 PolarHBondContact O-N 3.23Å
175S79.3Confident82.6Confident56 Ų5693.4 Ų93.439%0.39249%0.492SS..Hα-helixtrans-59.9-41.7176.2178.30000112.2M171 G172 I178 H179M171-S175 WeakPolarHBondContact O-CB 3.39Å; M171-S175 PolarHBondContact O-N 2.76Å; G172-S175 PolarHBondContact O-N 2.74Å; S175-I178 PolarHBondContact O-N 2.95Å; S175-H179 PolarHBondContact O-CD2 3.23Å; S175-H179 VanDerWaalsContact O-CD2 3.31Å; S175-H179 PolarHBondContact O-N 3.5Å
176F84.4Confident82.9Confident140 Ų14088.2 Ų88.261%0.61448%0.484SS*.Hα-helixtrans-62.2-45.2174.6-179.5-96000111.7G172 S173 C174 I178 H179 Q180G172-F176 PolarHBondContact O-N 3.42Å; S173-F176 PolarHBondContact O-N 3.02Å; C174-F176 VanDerWaalsContact C-N 3.32Å; C174-F176 PolarHBondContact O-N 3.07Å; F176-I178 PolarHBondContact O-N 3.46Å; F176-H179 WeakPolarHBondContact O-CB 3.45Å; F176-H179 PolarHBondContact O-N 3.23Å; F176-Q180 PolarHBondContact O-N 2.91Å
177S83.2Confident83.1Confident54 Ų5487.9 Ų87.938%0.37849%0.486SS..Hα-helixtrans-62.5-41.6178.1-56.50000111.7S173 C174 H179 Q180 V181S173-S177 WeakPolarHBondContact O-CB 3.48Å; S173-S177 PolarHBondContact O-N 3Å; S173-S177 PolarHBondContact O-OG 3.46Å; C174-S177 WeakPolarHBondContact O-CB 3.43Å; C174-S177 PolarHBondContact O-N 3.43Å; S177-H179 PolarHBondContact O-N 2.83Å; S177-Q180 PolarHBondContact O-N 3.45Å; S177-V181 WeakPolarHBondContact O-CG2 3.31Å; S177-V181 PolarHBondContact O-N 3.44Å
178I77.9Confident83.6Confident81 Ų8188.4 Ų88.442%0.41549%0.485SS..Hα-helixtrans-61.8-43.5174.5-70.4167.1000111C174 S175 F176 Q180 V181 N182C174-I178 VanDerWaalsContact O-CG1 3.29Å; C174-I178 WeakPolarHBondContact O-CG1 3.49Å; C174-I178 PolarHBondContact O-N 3.23Å; S175-I178 PolarHBondContact O-N 2.95Å; F176-I178 PolarHBondContact O-N 3.46Å; I178-Q180 VanDerWaalsContact C-N 3.32Å; I178-Q180 PolarHBondContact O-N 3.21Å; I178-V181 PolarHBondContact O-N 3.35Å; I178-N182 WeakPolarHBondContact O-CB 3.37Å; I178-N182 PolarHBondContact O-N 3Å
179H83.8Confident84.3Confident124 Ų12489.3 Ų89.357%0.57448%0.483SS*.Hα-helixtrans-61.5-41.5176-89.5-64.9000112.1S175 F176 S177 N182 Q183S175-H179 PolarHBondContact O-CD2 3.23Å; S175-H179 VanDerWaalsContact O-CD2 3.31Å; S175-H179 PolarHBondContact O-N 3.5Å; F176-H179 WeakPolarHBondContact O-CB 3.45Å; F176-H179 PolarHBondContact O-N 3.23Å; S177-H179 PolarHBondContact O-N 2.83Å; H179-N182 PolarHBondContact O-N 2.95Å; H179-Q183 PolarHBondContact O-N 3.08Å
180Q85.8Confident84.5Confident107 Ų10785.3 Ų85.350%0.548%0.475SS..Hα-helixtrans-65.8-43.6177.8-168.6174.44.800111.9F176 S177 I178 N182 Q183 S184F176-Q180 PolarHBondContact O-N 2.91Å; S177-Q180 PolarHBondContact O-N 3.45Å; I178-Q180 VanDerWaalsContact C-N 3.32Å; I178-Q180 PolarHBondContact O-N 3.21Å; Q180-N182 VanDerWaalsContact C-N 3.35Å; Q180-N182 PolarHBondContact O-N 3.24Å; Q180-Q183 PolarHBondContact O-N 2.94Å; Q180-S184 PolarHBondContact O-N 2.87Å; Q180-S184 PolarHBondContact O-OG 3.34Å
181V82.4Confident84.9Confident73 Ų7384.2 Ų84.244%0.44247%0.469SS..Hα-helixtrans-61-44.2174.4171.40000110.8S177 I178 Q183 S184 L185S177-V181 WeakPolarHBondContact O-CG2 3.31Å; S177-V181 PolarHBondContact O-N 3.44Å; I178-V181 PolarHBondContact O-N 3.35Å; V181-Q183 VanDerWaalsContact C-N 3.32Å; V181-Q183 PolarHBondContact O-N 3.13Å; V181-S184 PolarHBondContact O-N 2.81Å; V181-L185 WeakPolarHBondContact O-CB 3.44Å; V181-L185 PolarHBondContact O-N 3.02Å
182N85Confident85.4Confident106 Ų10682.2 Ų82.257%0.56746%0.463SS*.Hα-helixtrans-63.7-38.1179.2-16724.1000112.1I178 H179 Q180 L185 G186I178-N182 WeakPolarHBondContact O-CB 3.37Å; I178-N182 PolarHBondContact O-N 3Å; H179-N182 PolarHBondContact O-N 2.95Å; Q180-N182 VanDerWaalsContact C-N 3.35Å; Q180-N182 PolarHBondContact O-N 3.24Å; N182-L185 PolarHBondContact O-N 3.2Å; N182-G186 PolarHBondContact O-N 3.5Å
183Q90.1Very high86Confident137 Ų13788.5 Ų88.564%0.6447%0.474SS*.Hα-helixtrans-64.1-47.3174-174177.33.300111.6H179 Q180 V181 L185 G186 L187H179-Q183 PolarHBondContact O-N 3.08Å; Q180-Q183 PolarHBondContact O-N 2.94Å; V181-Q183 VanDerWaalsContact C-N 3.32Å; V181-Q183 PolarHBondContact O-N 3.13Å; Q183-L185 VanDerWaalsContact C-N 3.34Å; Q183-L185 PolarHBondContact O-N 2.96Å; Q183-G186 PolarHBondContact O-N 3.05Å; Q183-L187 PolarHBondContact O-N 3.4Å; Q183-L187 VanDerWaalsContact O-N 3.11Å
184S87.6Confident86.3Confident52 Ų5287.1 Ų87.136%0.36447%0.47SS..Hα-helixtrans-60.2-43.3176.1-62.60000111.8Q180 V181 G186 L187 F188Q180-S184 PolarHBondContact O-N 2.87Å; Q180-S184 PolarHBondContact O-OG 3.34Å; V181-S184 PolarHBondContact O-N 2.81Å; S184-G186 VanDerWaalsContact C-N 3.29Å; S184-G186 PolarHBondContact O-N 3.45Å; S184-L187 PolarHBondContact O-N 3.21Å; S184-F188 WeakPolarHBondContact O-CD2 3.42Å; S184-F188 PolarHBondContact O-N 3.04Å
185L86Confident86.7Confident83 Ų8391.2 Ų91.244%0.43548%0.48SS..Hα-helixtrans-61.5-39.1176.6-15291.1000111.5V181 N182 Q183 F188 L189V181-L185 WeakPolarHBondContact O-CB 3.44Å; V181-L185 PolarHBondContact O-N 3.02Å; N182-L185 PolarHBondContact O-N 3.2Å; Q183-L185 VanDerWaalsContact C-N 3.34Å; Q183-L185 PolarHBondContact O-N 2.96Å; L185-F188 PolarHBondContact O-N 3.12Å; L185-L189 WeakPolarHBondContact O-CB 3.12Å; L185-L189 WeakPolarHBondContact O-CG 3.42Å; L185-L189 PolarHBondContact O-N 2.93Å
186G88.9Confident87.1Confident38 Ų3895 Ų9539%0.39249%0.492SS..Hα-helixtrans-61-41174.500000113.2N182 Q183 S184 L189 A190N182-G186 PolarHBondContact O-N 3.5Å; Q183-G186 PolarHBondContact O-N 3.05Å; S184-G186 VanDerWaalsContact C-N 3.29Å; S184-G186 PolarHBondContact O-N 3.45Å; G186-L189 PolarHBondContact O-N 2.9Å; G186-A190 PolarHBondContact O-N 3.49Å; G186-A190 VanDerWaalsContact O-N 3.08Å
187L91.4Very high87.4Confident118 Ų11891.6 Ų91.662%0.61849%0.489SS*.Hα-helixtrans-66.7-44.8175.4-67.3173.3000111.7Q183 S184 L189 A190 Q191Q183-L187 PolarHBondContact O-N 3.4Å; Q183-L187 VanDerWaalsContact O-N 3.11Å; S184-L187 PolarHBondContact O-N 3.21Å; L187-L189 VanDerWaalsContact C-N 3.33Å; L187-L189 PolarHBondContact O-N 3.44Å; L187-A190 WeakPolarHBondContact O-CB 3.4Å; L187-A190 PolarHBondContact O-N 3.1Å; L187-A190 VanDerWaalsContact O-N 3.17Å; L187-Q191 PolarHBondContact O-N 3.05Å
188F86.8Confident87.8Confident106 Ų10693.3 Ų93.347%0.46550%0.498SS..Hα-helixtrans-60.3-42.4175.4-79.6-63.3000112.1S184 L185 A190 Q191 V192S184-F188 WeakPolarHBondContact O-CD2 3.42Å; S184-F188 PolarHBondContact O-N 3.04Å; L185-F188 PolarHBondContact O-N 3.12Å; F188-A190 VanDerWaalsContact C-N 3.31Å; F188-A190 PolarHBondContact O-N 3.41Å; F188-Q191 PolarHBondContact O-N 3.43Å; F188-V192 WeakPolarHBondContact O-CG2 3.42Å; F188-V192 PolarHBondContact O-N 3.33Å
189L90.8Very high88.3Confident91 Ų9193.8 Ų93.848%0.47650%0.504SS..Hα-helixtrans-61.6-39.1175.4-77.7170000112.3L185 G186 L187 R193L185-L189 WeakPolarHBondContact O-CB 3.12Å; L185-L189 WeakPolarHBondContact O-CG 3.42Å; L185-L189 PolarHBondContact O-N 2.93Å; G186-L189 PolarHBondContact O-N 2.9Å; L187-L189 VanDerWaalsContact C-N 3.33Å; L187-L189 PolarHBondContact O-N 3.44Å; L189-R193 VanDerWaalsContact O-CG 3.32Å; L189-R193 WeakPolarHBondContact O-CG 3.45Å; L189-R193 PolarHBondContact O-N 2.91Å; L189-R193 VanDerWaalsContact O-N 3.08Å
190A90.2Very high88.6Confident59 Ų5990.6 Ų90.649%0.48850%0.499SS..Hα-helixtrans-64.5-41.7174.700000111.5G186 L187 F188 R193 G194G186-A190 PolarHBondContact O-N 3.49Å; G186-A190 VanDerWaalsContact O-N 3.08Å; L187-A190 WeakPolarHBondContact O-CB 3.4Å; L187-A190 PolarHBondContact O-N 3.1Å; L187-A190 VanDerWaalsContact O-N 3.17Å; F188-A190 VanDerWaalsContact C-N 3.31Å; F188-A190 PolarHBondContact O-N 3.41Å; A190-R193 PolarHBondContact O-N 3.24Å; A190-G194 PolarHBondContact O-N 2.92Å
191Q89.6Confident88.9Confident94 Ų9487 Ų8744%0.43949%0.492SS..Hα-helixtrans-65.5-43.8178.1-169.4171.29.500112.3L187 F188 R193 G194 W195L187-Q191 PolarHBondContact O-N 3.05Å; F188-Q191 PolarHBondContact O-N 3.43Å; Q191-R193 VanDerWaalsContact C-N 3.31Å; Q191-R193 PolarHBondContact O-N 3.38Å; Q191-G194 WeakPolarHBondContact O-CA 3.33Å; Q191-G194 PolarHBondContact O-N 3.35Å; Q191-W195 HydrophobicContact CG-CD2 4.39Å; Q191-W195 HydrophobicContact CG-CH2 4.38Å; Q191-W195 HydrophobicContact CG-CZ2 3.91Å; Q191-W195 PolarHBondContact O-N 2.92Å
192V87.6Confident89.2Confident62 Ų6289.4 Ų89.438%0.37650%0.501SS..Hα-helixtrans-60.9-40.8175.4170.90000111.2F188 G194 W195 Q196F188-V192 WeakPolarHBondContact O-CG2 3.42Å; F188-V192 PolarHBondContact O-N 3.33Å; V192-G194 VanDerWaalsContact C-N 3.32Å; V192-G194 PolarHBondContact O-N 3.39Å; V192-W195 HydrophobicContact CG2-CE3 4.38Å; V192-W195 HydrophobicContact CG2-CZ3 4.5Å; V192-W195 PolarHBondContact O-N 3.29Å; V192-Q196 WeakPolarHBondContact O-CB 3.29Å; V192-Q196 PolarHBondContact O-N 3.18Å
193R91.1Very high89.3Confident174 Ų17488.1 Ų88.166%0.65749%0.494SS*.Hα-helixtrans-63.2-38.9173.3-73.9175.8-176.8163.72.6112.1L189 A190 Q191 Q196 A197L189-R193 VanDerWaalsContact O-CG 3.32Å; L189-R193 WeakPolarHBondContact O-CG 3.45Å; L189-R193 PolarHBondContact O-N 2.91Å; L189-R193 VanDerWaalsContact O-N 3.08Å; A190-R193 PolarHBondContact O-N 3.24Å; Q191-R193 VanDerWaalsContact C-N 3.31Å; Q191-R193 PolarHBondContact O-N 3.38Å; R193-Q196 PolarHBondContact O-N 2.99Å; R193-A197 PolarHBondContact O-N 3.41Å
194G91.4Very high89.5Confident37 Ų3786.7 Ų86.738%0.38149%0.49SS..Hα-helixtrans-58.7-49.6172.800000111.9A190 Q191 V192 Q196 A197 T198A190-G194 PolarHBondContact O-N 2.92Å; Q191-G194 WeakPolarHBondContact O-CA 3.33Å; Q191-G194 PolarHBondContact O-N 3.35Å; V192-G194 VanDerWaalsContact C-N 3.32Å; V192-G194 PolarHBondContact O-N 3.39Å; G194-Q196 VanDerWaalsContact C-N 3.33Å; G194-Q196 PolarHBondContact O-N 3.1Å; G194-A197 WeakPolarHBondContact O-CB 3.48Å; G194-A197 PolarHBondContact O-N 3.45Å; G194-T198 PolarHBondContact O-N 3.03Å; G194-T198 PolarHBondContact O-OG1 3.01Å
195W86.9Confident89.8Confident123 Ų12387.8 Ų87.847%0.46650%0.498SS..Hα-helixtrans-60.6-41.2175.9-66.6-24.2000112.6Q191 V192 A197 T198 T199Q191-W195 HydrophobicContact CG-CD2 4.39Å; Q191-W195 HydrophobicContact CG-CH2 4.38Å; Q191-W195 HydrophobicContact CG-CZ2 3.91Å; Q191-W195 PolarHBondContact O-N 2.92Å; V192-W195 HydrophobicContact CG2-CE3 4.38Å; V192-W195 HydrophobicContact CG2-CZ3 4.5Å; V192-W195 PolarHBondContact O-N 3.29Å; W195-A197 VanDerWaalsContact C-N 3.29Å; W195-A197 PolarHBondContact O-N 3.36Å; W195-T198 VanDerWaalsContact CA-OG1 3.29Å; W195-T198 WeakPolarHBondContact CA-OG1 3.24Å; W195-T198 PolarHBondContact O-N 3.19Å; W195-T198 PolarHBondContact O-OG1 3.43Å; W195-T199 PolarHBondContact O-N 3.31Å; W195-T199 PolarHBondContact O-OG1 2.97Å
196Q88.8Confident89.9Confident136 Ų13688.8 Ų88.864%0.63650%0.503SS*.Hα-helixtrans-59.8-40.6176.4-170.9178.5600112V192 R193 G194 T199 A200V192-Q196 WeakPolarHBondContact O-CB 3.29Å; V192-Q196 PolarHBondContact O-N 3.18Å; R193-Q196 PolarHBondContact O-N 2.99Å; G194-Q196 VanDerWaalsContact C-N 3.33Å; G194-Q196 PolarHBondContact O-N 3.1Å; Q196-T199 PolarHBondContact O-N 2.82Å; Q196-A200 PolarHBondContact O-N 3.38Å
197A90.8Very high90Very high68 Ų6892.3 Ų92.356%0.56251%0.508SS*.Hα-helixtrans-65.8-42.7175.600000111.9R193 G194 W195 A200 G201R193-A197 PolarHBondContact O-N 3.41Å; G194-A197 WeakPolarHBondContact O-CB 3.48Å; G194-A197 PolarHBondContact O-N 3.45Å; W195-A197 VanDerWaalsContact C-N 3.29Å; W195-A197 PolarHBondContact O-N 3.36Å; A197-A200 PolarHBondContact O-N 3.34Å; A197-G201 PolarHBondContact O-N 2.88Å
198T91.2Very high90.1Very high91 Ų9191.7 Ų91.756%0.55851%0.505SS*.Hα-helixtrans-65.2-39.1176.852.20000112.3G194 W195 A200 G201 L202G194-T198 PolarHBondContact O-N 3.03Å; G194-T198 PolarHBondContact O-OG1 3.01Å; W195-T198 VanDerWaalsContact CA-OG1 3.29Å; W195-T198 WeakPolarHBondContact CA-OG1 3.24Å; W195-T198 PolarHBondContact O-N 3.19Å; W195-T198 PolarHBondContact O-OG1 3.43Å; T198-A200 VanDerWaalsContact C-N 3.34Å; T198-A200 PolarHBondContact O-N 3.03Å; T198-G201 PolarHBondContact O-N 2.91Å; T198-L202 PolarHBondContact O-N 2.86Å
199T87.3Confident90.3Very high91 Ų9191.2 Ų91.256%0.55851%0.507SS*.Hα-helixtrans-65.7-38.5176.9-52.60000111.4W195 Q196 G201 L202 D203W195-T199 PolarHBondContact O-N 3.31Å; W195-T199 PolarHBondContact O-OG1 2.97Å; Q196-T199 PolarHBondContact O-N 2.82Å; T199-G201 VanDerWaalsContact C-N 3.34Å; T199-L202 PolarHBondContact O-N 3.05Å; T199-D203 PolarHBondContact O-N 2.89Å
200A90.1Very high90.3Very high56 Ų5690 Ų9046%0.46350%0.504SS..Hα-helixtrans-64.9-38.6173.700000112.2Q196 A197 T198 D203 L204Q196-A200 PolarHBondContact O-N 3.38Å; A197-A200 PolarHBondContact O-N 3.34Å; T198-A200 VanDerWaalsContact C-N 3.34Å; T198-A200 PolarHBondContact O-N 3.03Å; A200-D203 PolarHBondContact O-N 3.46Å; A200-L204 PolarHBondContact O-N 2.87Å
201G92.6Very high90.4Very high33 Ų3392.2 Ų92.234%0.3450%0.504SS..Hα-helixtrans-61.9-45.7172.700000112.4A197 T198 T199 D203 L204 S205A197-G201 PolarHBondContact O-N 2.88Å; T198-G201 PolarHBondContact O-N 2.91Å; T199-G201 VanDerWaalsContact C-N 3.34Å; G201-D203 VanDerWaalsContact C-N 3.34Å; G201-D203 PolarHBondContact O-N 3.17Å; G201-L204 WeakPolarHBondContact O-CB 3.49Å; G201-L204 PolarHBondContact O-N 3.28Å; G201-S205 PolarHBondContact O-N 2.95Å; G201-S205 PolarHBondContact O-OG 3.02Å
202L88.4Confident90.5Very high122 Ų12293.3 Ų93.364%0.63951%0.509SS*.Hα-helixtrans-60.7-41.2177.1-167.881000112.1T198 T199 L204 S205 L206T198-L202 PolarHBondContact O-N 2.86Å; T199-L202 PolarHBondContact O-N 3.05Å; L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 3.46Å; L202-S205 PolarHBondContact O-N 3.29Å; L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 PolarHBondContact O-N 3.13Å
203D88.2Confident90.6Very high80 Ų8094.1 Ų94.143%0.42852%0.516SS..Hα-helixtrans-61.1-38.2176.8-17860.1000112.1T199 A200 G201 K207T199-D203 PolarHBondContact O-N 2.89Å; A200-D203 PolarHBondContact O-N 3.46Å; G201-D203 VanDerWaalsContact C-N 3.34Å; G201-D203 PolarHBondContact O-N 3.17Å; D203-K207 WeakPolarHBondContact O-CG 3.44Å; D203-K207 PolarHBondContact O-N 3.37Å; D203-K207 IonicContact OD1-NZ 2.66Å; D203-K207 VanDerWaalsContact OD2-CE 3.31Å; D203-K207 WeakPolarHBondContact OD2-CE 3.38Å; D203-K207 IonicContact OD2-NZ 3.81Å; D203-K207 PolarHBondContact OD2-NZ 3.4Å
204L93.3Very high90.7Very high107 Ų10792.8 Ų92.856%0.5651%0.512SS*.Hα-helixtrans-66.4-48.7173.6-69.8168.8000111.5A200 G201 L202 L206 K207 D208A200-L204 PolarHBondContact O-N 2.87Å; G201-L204 WeakPolarHBondContact O-CB 3.49Å; G201-L204 PolarHBondContact O-N 3.28Å; L202-L204 VanDerWaalsContact C-N 3.3Å; L202-L204 PolarHBondContact O-N 3.46Å; L204-L206 VanDerWaalsContact C-N 3.26Å; L204-L206 PolarHBondContact O-N 3.02Å; L204-K207 WeakPolarHBondContact O-CB 3.29Å; L204-K207 PolarHBondContact O-N 3.18Å; L204-K207 VanDerWaalsContact O-N 3.09Å; L204-D208 PolarHBondContact O-N 3.02Å
205S94Very high90.8Very high75 Ų7595.3 Ų95.352%0.52452%0.517SS..Hα-helixtrans-60.6-35.6177.7-58.50000112.7G201 L202 K207 D208 L209G201-S205 PolarHBondContact O-N 2.95Å; G201-S205 PolarHBondContact O-OG 3.02Å; L202-S205 PolarHBondContact O-N 3.29Å; S205-K207 VanDerWaalsContact C-N 3.34Å; S205-D208 PolarHBondContact O-N 3.31Å; S205-L209 WeakPolarHBondContact O-CB 3.21Å; S205-L209 PolarHBondContact O-N 3.44Å
206L88.1Confident91Very high104 Ų10494.3 Ų94.355%0.54552%0.524SS..Hα-helixtrans-66.3-37.6176.5-159.897.9000111.6L202 L204 T210L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 PolarHBondContact O-N 3.13Å; L204-L206 VanDerWaalsContact C-N 3.26Å; L204-L206 PolarHBondContact O-N 3.02Å; L206-T210 WeakPolarHBondContact O-CB 3.48Å; L206-T210 PolarHBondContact O-N 3.48Å; L206-T210 PolarHBondContact O-OG1 3Å
207K92Very high91.1Very high112 Ų11294 Ų9449%0.48752%0.521SS..Hα-helixtrans-65.6-43.3174.4-72.9169.2-169.9160.60111.4D203 L204 S205 T210 Q211D203-K207 WeakPolarHBondContact O-CG 3.44Å; D203-K207 PolarHBondContact O-N 3.37Å; D203-K207 IonicContact OD1-NZ 2.66Å; D203-K207 VanDerWaalsContact OD2-CE 3.31Å; D203-K207 WeakPolarHBondContact OD2-CE 3.38Å; D203-K207 IonicContact OD2-NZ 3.81Å; D203-K207 PolarHBondContact OD2-NZ 3.4Å; L204-K207 WeakPolarHBondContact O-CB 3.29Å; L204-K207 PolarHBondContact O-N 3.18Å; L204-K207 VanDerWaalsContact O-N 3.09Å; S205-K207 VanDerWaalsContact C-N 3.34Å; K207-T210 WeakPolarHBondContact O-CB 3.49Å; K207-T210 PolarHBondContact O-N 3.46Å; K207-Q211 PolarHBondContact O-N 3.32Å
208D93.3Very high91.2Very high105 Ų10593.4 Ų93.456%0.56152%0.516SS*.Hα-helixtrans-61.5-46175.8-74-4.9000110.9L204 S205 T210 Q211 E212L204-D208 PolarHBondContact O-N 3.02Å; S205-D208 PolarHBondContact O-N 3.31Å; D208-T210 VanDerWaalsContact C-N 3.27Å; D208-T210 PolarHBondContact O-N 2.96Å; D208-Q211 WeakPolarHBondContact O-CA 3.22Å; D208-Q211 WeakPolarHBondContact O-CB 3.49Å; D208-Q211 PolarHBondContact O-N 3.32Å; D208-E212 PolarHBondContact O-N 3.21Å
209L90.5Very high91.2Very high96 Ų9691.4 Ų91.450%0.50351%0.509SS..Hα-helixtrans-61.8-35.7176.2-174.767.7000112.5S205 Q211 E212 C213S205-L209 WeakPolarHBondContact O-CB 3.21Å; S205-L209 PolarHBondContact O-N 3.44Å; L209-Q211 VanDerWaalsContact C-N 3.33Å; L209-E212 PolarHBondContact O-N 3.07Å; L209-C213 PolarHBondContact O-N 3.32Å; L209-C213 PolarHBondContact O-SG 3.29Å
210T90.3Very high91.3Very high66 Ų6693 Ų9341%0.40551%0.512SS..Hα-helixtrans-65.8-39.8175.2-55.40000110.6L206 K207 D208 C213 Y214L206-T210 WeakPolarHBondContact O-CB 3.48Å; L206-T210 PolarHBondContact O-N 3.48Å; L206-T210 PolarHBondContact O-OG1 3Å; K207-T210 WeakPolarHBondContact O-CB 3.49Å; K207-T210 PolarHBondContact O-N 3.46Å; D208-T210 VanDerWaalsContact C-N 3.27Å; D208-T210 PolarHBondContact O-N 2.96Å; T210-C213 WeakPolarHBondContact O-CB 3.39Å; T210-C213 PolarHBondContact O-N 3.45Å; T210-Y214 HydrophobicContact CG2-CD2 4.24Å; T210-Y214 HydrophobicContact CG2-CE2 3.75Å; T210-Y214 WeakPolarHBondContact O-CD2 3.34Å; T210-Y214 PolarHBondContact O-N 3.47Å
211Q93.9Very high91.4Very high105 Ų10595.9 Ų95.949%0.49152%0.515SS..Hα-helixtrans-64.3-46.3175.2-174.660.933.700111.3K207 D208 L209 C213 Y214 D215K207-Q211 PolarHBondContact O-N 3.32Å; D208-Q211 WeakPolarHBondContact O-CA 3.22Å; D208-Q211 WeakPolarHBondContact O-CB 3.49Å; D208-Q211 PolarHBondContact O-N 3.32Å; L209-Q211 VanDerWaalsContact C-N 3.33Å; Q211-C213 VanDerWaalsContact C-N 3.28Å; Q211-C213 PolarHBondContact O-N 3.42Å; Q211-Y214 WeakPolarHBondContact O-CA 3.3Å; Q211-Y214 WeakPolarHBondContact O-CB 3.46Å; Q211-Y214 PolarHBondContact O-N 2.85Å; Q211-D215 PolarHBondContact NE2-OD1 3.28Å; Q211-D215 PolarHBondContact O-N 3.34Å
212E91.8Very high91.5Very high116 Ų116101 Ų10154%0.54253%0.53SS..Hα-helixtrans-58.6-40.1175.1-70.7-177.7175.500111.9D208 L209 Y214 D215 V216D208-E212 PolarHBondContact O-N 3.21Å; L209-E212 PolarHBondContact O-N 3.07Å; E212-Y214 VanDerWaalsContact C-N 3.3Å; E212-Y214 PolarHBondContact O-N 3.19Å; E212-D215 PolarHBondContact O-N 3.49Å; E212-V216 WeakPolarHBondContact O-CG2 3.29Å; E212-V216 PolarHBondContact O-N 3.04Å
213C88.3Confident91.5Very high79 Ų79100 Ų10053%0.53452%0.524SS..Hα-helixtrans-58.7-40.1173.5-75.60000112.6L209 T210 Q211 K217L209-C213 PolarHBondContact O-N 3.32Å; L209-C213 PolarHBondContact O-SG 3.29Å; T210-C213 WeakPolarHBondContact O-CB 3.39Å; T210-C213 PolarHBondContact O-N 3.45Å; Q211-C213 VanDerWaalsContact C-N 3.28Å; Q211-C213 PolarHBondContact O-N 3.42Å; C213-K217 WeakPolarHBondContact O-CB 3.41Å; C213-K217 PolarHBondContact O-N 3.42Å
214Y93.3Very high91.7Very high146 Ų146101.4 Ų101.457%0.57353%0.532SS*.Hα-helixtrans-66.1-41175.5-76-62.7000111.9T210 Q211 E212 K217 A218T210-Y214 HydrophobicContact CG2-CD2 4.24Å; T210-Y214 HydrophobicContact CG2-CE2 3.75Å; T210-Y214 WeakPolarHBondContact O-CD2 3.34Å; T210-Y214 PolarHBondContact O-N 3.47Å; Q211-Y214 WeakPolarHBondContact O-CA 3.3Å; Q211-Y214 WeakPolarHBondContact O-CB 3.46Å; Q211-Y214 PolarHBondContact O-N 2.85Å; E212-Y214 VanDerWaalsContact C-N 3.3Å; E212-Y214 PolarHBondContact O-N 3.19Å; Y214-K217 PolarHBondContact O-N 3.21Å; Y214-A218 PolarHBondContact O-N 2.93Å
215D93.8Very high91.7Very high91 Ų91102.6 Ų102.649%0.48753%0.533SS..Hα-helixtrans-66.5-43.1179.4-65.5-21.4000111.4Q211 E212 K217 A218 A219Q211-D215 PolarHBondContact NE2-OD1 3.28Å; Q211-D215 PolarHBondContact O-N 3.34Å; E212-D215 PolarHBondContact O-N 3.49Å; D215-K217 VanDerWaalsContact C-N 3.32Å; D215-K217 PolarHBondContact O-N 2.85Å; D215-A218 WeakPolarHBondContact O-CB 3.32Å; D215-A218 PolarHBondContact O-N 3.38Å; D215-A219 PolarHBondContact O-N 3.34Å
216V90.7Very high91.7Very high102 Ų102102.3 Ų102.362%0.61853%0.528SS*.Hα-helixtrans-60.7-42.6173.5171.50000110.8E212 A218 A219 M220E212-V216 WeakPolarHBondContact O-CG2 3.29Å; E212-V216 PolarHBondContact O-N 3.04Å; V216-A218 VanDerWaalsContact C-N 3.33Å; V216-A218 PolarHBondContact O-N 3.09Å; V216-A219 PolarHBondContact O-N 3Å; V216-M220 WeakPolarHBondContact O-CB 3.41Å; V216-M220 PolarHBondContact O-N 3.3Å
217K91.6Very high91.8Very high128 Ų128101.1 Ų101.156%0.55753%0.525SS*.Hα-helixtrans-62.7-40.8176.8-173.2176.4-177.8177.60111.7C213 Y214 D215 M220 H221C213-K217 WeakPolarHBondContact O-CB 3.41Å; C213-K217 PolarHBondContact O-N 3.42Å; Y214-K217 PolarHBondContact O-N 3.21Å; D215-K217 VanDerWaalsContact C-N 3.32Å; D215-K217 PolarHBondContact O-N 2.85Å; K217-M220 PolarHBondContact O-N 3.18Å; K217-H221 PolarHBondContact O-CD2 3.25Å; K217-H221 PolarHBondContact O-N 3.22Å
218A93.3Very high91.8Very high56 Ų5697.5 Ų97.546%0.46352%0.519SS..Hα-helixtrans-63.1-45175.100000111.5Y214 D215 V216 M220 H221 Q222Y214-A218 PolarHBondContact O-N 2.93Å; D215-A218 WeakPolarHBondContact O-CB 3.32Å; D215-A218 PolarHBondContact O-N 3.38Å; V216-A218 VanDerWaalsContact C-N 3.33Å; V216-A218 PolarHBondContact O-N 3.09Å; A218-M220 VanDerWaalsContact C-N 3.33Å; A218-M220 PolarHBondContact O-N 2.71Å; A218-H221 PolarHBondContact O-N 2.96Å; A218-Q222 PolarHBondContact O-N 3.41Å; A218-Q222 VanDerWaalsContact O-N 3.1Å
219A91.4Very high91.7Very high50 Ų5097.4 Ų97.441%0.41352%0.515SS..Hα-helixtrans-60.1-42.1175.400000112D215 V216 H221 Q222 I223D215-A219 PolarHBondContact O-N 3.34Å; V216-A219 PolarHBondContact O-N 3Å; A219-H221 PolarHBondContact O-N 2.88Å; A219-Q222 WeakPolarHBondContact O-CB 3.47Å; A219-Q222 PolarHBondContact O-N 3.26Å; A219-Q222 VanDerWaalsContact O-N 3.12Å; A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 2.66Å
220M88.4Confident91.6Very high124 Ų12496.2 Ų96.261%0.61151%0.512SS*.Hα-helixtrans-61.5-42176.6-171.664.9176.200112V216 K217 A218 Q222 I223 N224V216-M220 WeakPolarHBondContact O-CB 3.41Å; V216-M220 PolarHBondContact O-N 3.3Å; K217-M220 PolarHBondContact O-N 3.18Å; A218-M220 VanDerWaalsContact C-N 3.33Å; A218-M220 PolarHBondContact O-N 2.71Å; M220-Q222 VanDerWaalsContact C-N 3.28Å; M220-Q222 PolarHBondContact O-N 2.88Å; M220-I223 PolarHBondContact O-N 3.06Å; M220-N224 WeakPolarHBondContact O-CB 3.37Å; M220-N224 PolarHBondContact O-N 2.98Å
221H92.5Very high91.7Very high116 Ų11695.6 Ų95.654%0.53751%0.51SS..Hα-helixtrans-60.8-38.9174.2-79.1-59000112.1K217 A218 A219 N224 F225K217-H221 PolarHBondContact O-CD2 3.25Å; K217-H221 PolarHBondContact O-N 3.22Å; A218-H221 PolarHBondContact O-N 2.96Å; A219-H221 PolarHBondContact O-N 2.88Å; H221-N224 PolarHBondContact O-N 3.44Å; H221-F225 PolarHBondContact O-N 3.48Å
222Q93.6Very high91.6Very high141 Ų14197.8 Ų97.866%0.65952%0.521SS*.Hα-helixtrans-70.2-38.6178.4-168150.2-1700112.7A218 A219 M220 F225 T226A218-Q222 PolarHBondContact O-N 3.41Å; A218-Q222 VanDerWaalsContact O-N 3.1Å; A219-Q222 WeakPolarHBondContact O-CB 3.47Å; A219-Q222 PolarHBondContact O-N 3.26Å; A219-Q222 VanDerWaalsContact O-N 3.12Å; M220-Q222 VanDerWaalsContact C-N 3.28Å; M220-Q222 PolarHBondContact O-N 2.88Å; Q222-F225 PolarHBondContact O-N 2.92Å; Q222-T226 PolarHBondContact O-N 2.9Å; Q222-T226 PolarHBondContact O-OG1 3.05Å
223I90.1Very high91.7Very high101 Ų101100.9 Ų100.952%0.51853%0.527SS..Hα-helixtrans-61.3-48.7171.6-68.6169.3000109.8A219 M220 F225 T226 V227A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 2.66Å; M220-I223 PolarHBondContact O-N 3.06Å; I223-F225 VanDerWaalsContact C-N 3.29Å; I223-F225 PolarHBondContact O-N 2.84Å; I223-T226 PolarHBondContact O-N 3.31Å; I223-V227 HydrophobicContact CG2-CG2 4.15Å; I223-V227 WeakPolarHBondContact O-CG2 3.3Å; I223-V227 PolarHBondContact O-N 2.85Å
224N91.6Very high91.6Very high109 Ų109101.6 Ų101.658%0.58353%0.525SS*.Hα-helixtrans-61.3-38.9-178.5-162.638000112.2M220 H221 G228M220-N224 WeakPolarHBondContact O-CB 3.37Å; M220-N224 PolarHBondContact O-N 2.98Å; H221-N224 PolarHBondContact O-N 3.44Å; N224-G228 PolarHBondContact O-N 2.83Å
225F93.9Very high91.6Very high132 Ų132100.1 Ų100.158%0.57952%0.523SS*.Hα-helixtrans-61.3-46.8172.5179.3-97.1000112H221 Q222 I223 V227 G228 Q229H221-F225 PolarHBondContact O-N 3.48Å; Q222-F225 PolarHBondContact O-N 2.92Å; I223-F225 VanDerWaalsContact C-N 3.29Å; I223-F225 PolarHBondContact O-N 2.84Å; F225-V227 PolarHBondContact O-N 3.35Å; F225-G228 PolarHBondContact O-N 2.95Å; F225-Q229 HydrophobicContact CD1-CG 4.46Å; F225-Q229 VanDerWaalsContact CE1-CD 3.42Å; F225-Q229 HydrophobicContact CE1-CG 4.07Å; F225-Q229 HydrophobicContact CZ-CG 4.23Å; F225-Q229 PolarHBondContact O-N 3.33Å
226T92.6Very high91.6Very high69 Ų6997.2 Ų97.242%0.42352%0.515SS..Hα-helixtrans-63.7-43.2179.7-49.30000111.1Q222 I223 G228 Q229 T230Q222-T226 PolarHBondContact O-N 2.9Å; Q222-T226 PolarHBondContact O-OG1 3.05Å; I223-T226 PolarHBondContact O-N 3.31Å; T226-G228 VanDerWaalsContact C-N 3.33Å; T226-G228 PolarHBondContact O-N 3.35Å; T226-Q229 PolarHBondContact O-N 2.91Å; T226-T230 WeakPolarHBondContact O-CG2 3.18Å; T226-T230 PolarHBondContact O-N 3.38Å; T226-T230 PolarHBondContact O-OG1 2.85Å
227V91.8Very high91.5Very high80 Ų8095.8 Ų95.849%0.48550%0.503SS..Hα-helixtrans-60-44.3174.7171.80000110.6I223 F225 Q229 T230 S231I223-V227 HydrophobicContact CG2-CG2 4.15Å; I223-V227 WeakPolarHBondContact O-CG2 3.3Å; I223-V227 PolarHBondContact O-N 2.85Å; F225-V227 PolarHBondContact O-N 3.35Å; V227-Q229 PolarHBondContact O-N 2.88Å; V227-T230 WeakPolarHBondContact CA-OG1 3.44Å; V227-T230 PolarHBondContact O-N 3.08Å; V227-T230 PolarHBondContact O-OG1 3.4Å; V227-S231 PolarHBondContact O-N 3.13Å
228G90.9Very high91.5Very high35 Ų3594.8 Ų94.836%0.36150%0.5SS..Hα-helixtrans-55.6-47.917400000112.7N224 F225 T226 T230 S231 E232N224-G228 PolarHBondContact O-N 2.83Å; F225-G228 PolarHBondContact O-N 2.95Å; T226-G228 VanDerWaalsContact C-N 3.33Å; T226-G228 PolarHBondContact O-N 3.35Å; G228-T230 PolarHBondContact O-N 2.87Å; G228-S231 WeakPolarHBondContact O-CB 3.46Å; G228-S231 PolarHBondContact O-N 3.47Å; G228-E232 PolarHBondContact O-N 3.06Å; G228-E232 VanDerWaalsContact O-N 3.08Å
229Q91.3Very high91.5Very high104 Ų10499.4 Ų99.449%0.48651%0.506SS..Hα-helixtrans-62.2-41.6176.6-70-168.2-2900112.7F225 T226 V227 S231 E232 W233F225-Q229 HydrophobicContact CD1-CG 4.46Å; F225-Q229 VanDerWaalsContact CE1-CD 3.42Å; F225-Q229 HydrophobicContact CE1-CG 4.07Å; F225-Q229 HydrophobicContact CZ-CG 4.23Å; F225-Q229 PolarHBondContact O-N 3.33Å; T226-Q229 PolarHBondContact O-N 2.91Å; V227-Q229 PolarHBondContact O-N 2.88Å; Q229-S231 VanDerWaalsContact C-N 3.31Å; Q229-S231 PolarHBondContact O-N 3.28Å; Q229-E232 PolarHBondContact O-N 3.48Å; Q229-W233 PolarHBondContact O-N 2.9Å; Q229-W233 VanDerWaalsContact O-N 3.11Å
230T88.1Confident91.6Very high70 Ų70102.9 Ų102.943%0.42951%0.512SS..Hα-helixtrans-65.6-35.617758.50000112.3T226 V227 G228 W233 I234T226-T230 WeakPolarHBondContact O-CG2 3.18Å; T226-T230 PolarHBondContact O-N 3.38Å; T226-T230 PolarHBondContact O-OG1 2.85Å; V227-T230 WeakPolarHBondContact CA-OG1 3.44Å; V227-T230 PolarHBondContact O-N 3.08Å; V227-T230 PolarHBondContact O-OG1 3.4Å; G228-T230 PolarHBondContact O-N 2.87Å; T230-W233 PolarHBondContact O-N 3.47Å; T230-I234 VanDerWaalsContact O-CG1 3.27Å; T230-I234 WeakPolarHBondContact O-CG1 3.48Å; T230-I234 PolarHBondContact O-N 3.25Å
231S92.6Very high91.7Very high53 Ų53100.1 Ų100.137%0.37150%0.502SS..Hα-helixtrans-64.1-43.9175.3176.20000111.7V227 G228 Q229 W233 I234 H235V227-S231 PolarHBondContact O-N 3.13Å; G228-S231 WeakPolarHBondContact O-CB 3.46Å; G228-S231 PolarHBondContact O-N 3.47Å; Q229-S231 VanDerWaalsContact C-N 3.31Å; Q229-S231 PolarHBondContact O-N 3.28Å; S231-W233 VanDerWaalsContact C-N 3.31Å; S231-W233 PolarHBondContact O-N 3.23Å; S231-I234 PolarHBondContact O-N 3Å; S231-H235 PolarHBondContact O-CD2 3Å; S231-H235 VanDerWaalsContact O-CD2 3.24Å; S231-H235 PolarHBondContact O-N 3.05Å
232E92.6Very high91.8Very high151 Ų15198.7 Ų98.771%0.70650%0.498SS*.Hα-helixtrans-60.4-41.1175.1-73.3-172.7166.200112.1G228 Q229 H235 G236G228-E232 PolarHBondContact O-N 3.06Å; G228-E232 VanDerWaalsContact O-N 3.08Å; Q229-E232 PolarHBondContact O-N 3.48Å; E232-H235 PolarHBondContact O-N 3.42Å; E232-G236 PolarHBondContact O-N 3.36Å
233W92.8Very high91.8Very high181 Ų18197.6 Ų97.669%0.68649%0.493SS*.Hα-helixtrans-65.2-44.2177.2-172.278.6000112.4Q229 T230 S231 H235 G236 I237Q229-W233 PolarHBondContact O-N 2.9Å; Q229-W233 VanDerWaalsContact O-N 3.11Å; T230-W233 PolarHBondContact O-N 3.47Å; S231-W233 VanDerWaalsContact C-N 3.31Å; S231-W233 PolarHBondContact O-N 3.23Å; W233-H235 VanDerWaalsContact C-N 3.34Å; W233-H235 PolarHBondContact O-N 3.49Å; W233-G236 WeakPolarHBondContact O-CA 3.34Å; W233-G236 PolarHBondContact O-N 3.43Å; W233-G236 VanDerWaalsContact O-N 3.13Å; W233-I237 HydrophobicContact CD2-CD1 3.75Å; W233-I237 HydrophobicContact CD2-CG1 4.46Å; W233-I237 HydrophobicContact CE3-CD1 3.59Å; W233-I237 HydrophobicContact CH2-CD1 3.23Å; W233-I237 HydrophobicContact CZ2-CD1 3.4Å; W233-I237 VanDerWaalsContact CZ2-CD1 3.4Å; W233-I237 HydrophobicContact CZ2-CG1 4.46Å; W233-I237 HydrophobicContact CZ3-CD1 3.32Å; W233-I237 PolarHBondContact O-N 2.9Å
234I88.1Confident91.8Very high94 Ų9497.9 Ų97.948%0.48249%0.492SS..Hα-helixtrans-59.2-45.8174.9-69.5165.5000110.3T230 S231 G236 I237 Q238T230-I234 VanDerWaalsContact O-CG1 3.27Å; T230-I234 WeakPolarHBondContact O-CG1 3.48Å; T230-I234 PolarHBondContact O-N 3.25Å; S231-I234 PolarHBondContact O-N 3Å; I234-G236 VanDerWaalsContact C-N 3.29Å; I234-G236 PolarHBondContact O-N 3.46Å; I234-I237 PolarHBondContact O-N 3.45Å; I234-Q238 WeakPolarHBondContact O-CB 3.32Å; I234-Q238 PolarHBondContact O-N 3.34Å
235H92.6Very high91.8Very high115 Ų11596 Ų9653%0.53249%0.485SS..Hα-helixtrans-61.9-36.5175.5-82.1-60000112.8S231 E232 W233 R239S231-H235 PolarHBondContact O-CD2 3Å; S231-H235 VanDerWaalsContact O-CD2 3.24Å; S231-H235 PolarHBondContact O-N 3.05Å; E232-H235 PolarHBondContact O-N 3.42Å; W233-H235 VanDerWaalsContact C-N 3.34Å; W233-H235 PolarHBondContact O-N 3.49Å; H235-R239 WeakPolarHBondContact O-CB 3.39Å; H235-R239 PolarHBondContact O-N 3.38Å
236G92.9Very high91.8Very high30 Ų3095.9 Ų95.931%0.30949%0.489SS..Hα-helixtrans-62-44.2173.600000112.7E232 W233 I234 K240E232-G236 PolarHBondContact O-N 3.36Å; W233-G236 WeakPolarHBondContact O-CA 3.34Å; W233-G236 PolarHBondContact O-N 3.43Å; W233-G236 VanDerWaalsContact O-N 3.13Å; I234-G236 VanDerWaalsContact C-N 3.29Å; I234-G236 PolarHBondContact O-N 3.46Å; G236-K240 PolarHBondContact O-N 3.31Å; G236-K240 VanDerWaalsContact O-N 3.12Å
237I89.3Confident91.8Very high72 Ų7296.5 Ų96.537%0.36949%0.493SS..Hα-helixtrans-65.8-47.7175.6-70.7175.7000111.1W233 I234 R239 K240 T241W233-I237 HydrophobicContact CD2-CD1 3.75Å; W233-I237 HydrophobicContact CD2-CG1 4.46Å; W233-I237 HydrophobicContact CE3-CD1 3.59Å; W233-I237 HydrophobicContact CH2-CD1 3.23Å; W233-I237 HydrophobicContact CZ2-CD1 3.4Å; W233-I237 VanDerWaalsContact CZ2-CD1 3.4Å; W233-I237 HydrophobicContact CZ2-CG1 4.46Å; W233-I237 HydrophobicContact CZ3-CD1 3.32Å; W233-I237 PolarHBondContact O-N 2.9Å; I234-I237 PolarHBondContact O-N 3.45Å; I237-R239 VanDerWaalsContact C-N 3.28Å; I237-R239 PolarHBondContact O-N 3.16Å; I237-K240 PolarHBondContact O-N 2.89Å; I237-K240 VanDerWaalsContact O-N 3.11Å; I237-T241 PolarHBondContact O-N 3.25Å; I237-T241 PolarHBondContact O-OG1 3.47Å
238Q90.8Very high91.7Very high108 Ų10897.7 Ų97.751%0.50550%0.496SS..Hα-helixtrans-54.1-48.9179.4-166.279.619.700110.4I234 K240 T241 D242I234-Q238 WeakPolarHBondContact O-CB 3.32Å; I234-Q238 PolarHBondContact O-N 3.34Å; Q238-K240 VanDerWaalsContact C-N 3.35Å; Q238-K240 PolarHBondContact O-N 3.5Å; Q238-T241 WeakPolarHBondContact O-CB 3.39Å; Q238-T241 PolarHBondContact O-N 3.17Å; Q238-D242 PolarHBondContact O-N 3.19Å
239R93.3Very high91.8Very high153 Ų153102.6 Ų102.658%0.57751%0.51SS*.Hα-helixtrans-60.6-42.9178.6-167.2-173.8-57.1117.22.3112.2H235 I237 D242 E243H235-R239 WeakPolarHBondContact O-CB 3.39Å; H235-R239 PolarHBondContact O-N 3.38Å; I237-R239 VanDerWaalsContact C-N 3.28Å; I237-R239 PolarHBondContact O-N 3.16Å; R239-D242 PolarHBondContact O-N 3.44Å; R239-E243 WeakPolarHBondContact O-CG 3.49Å; R239-E243 PolarHBondContact O-N 3.26Å
240K93.3Very high91.9Very high123 Ų123104.3 Ų104.354%0.53552%0.515SS..Hα-helixtrans-66-40.2178.2-172.7174.1178.1179.90111.9G236 I237 Q238 D242 E243 E244G236-K240 PolarHBondContact O-N 3.31Å; G236-K240 VanDerWaalsContact O-N 3.12Å; I237-K240 PolarHBondContact O-N 2.89Å; I237-K240 VanDerWaalsContact O-N 3.11Å; Q238-K240 VanDerWaalsContact C-N 3.35Å; Q238-K240 PolarHBondContact O-N 3.5Å; K240-D242 VanDerWaalsContact C-N 3.33Å; K240-E243 PolarHBondContact O-N 2.83Å; K240-E244 WeakPolarHBondContact CE-OE1 3.3Å; K240-E244 WeakPolarHBondContact O-CG 3.42Å; K240-E244 PolarHBondContact O-N 2.85Å
241T91.9Very high92.1Very high66 Ų66106 Ų10641%0.40552%0.521SS..Hα-helixtrans-63.2-40174.3-580000111.5I237 Q238 E244 T245I237-T241 PolarHBondContact O-N 3.25Å; I237-T241 PolarHBondContact O-OG1 3.47Å; Q238-T241 WeakPolarHBondContact O-CB 3.39Å; Q238-T241 PolarHBondContact O-N 3.17Å; T241-E244 PolarHBondContact O-N 2.7Å; T241-T245 WeakPolarHBondContact O-CB 3.48Å; T241-T245 WeakPolarHBondContact O-CG2 3.49Å; T241-T245 PolarHBondContact O-N 3.37Å; T241-T245 PolarHBondContact O-OG1 2.91Å
242D93.2Very high92.1Very high85 Ų85107.5 Ų107.546%0.45553%0.527SS..Hα-helixtrans-64.5-40.8175.4-66.4-22.4000111.3Q238 R239 K240 T245 L246Q238-D242 PolarHBondContact O-N 3.19Å; R239-D242 PolarHBondContact O-N 3.44Å; K240-D242 VanDerWaalsContact C-N 3.33Å; D242-T245 VanDerWaalsContact CA-OG1 3.28Å; D242-T245 WeakPolarHBondContact CA-OG1 3.33Å; D242-T245 PolarHBondContact O-OG1 2.97Å; D242-L246 WeakPolarHBondContact O-CB 3.36Å; D242-L246 PolarHBondContact O-N 3.07Å; D242-L246 VanDerWaalsContact O-N 3.09Å
243E93.5Very high92.2Very high119 Ų119103.3 Ų103.356%0.55651%0.512SS*.Hα-helixtrans-62-48.4173.3-73.9173-172.100111.5R239 K240 L246 T247R239-E243 WeakPolarHBondContact O-CG 3.49Å; R239-E243 PolarHBondContact O-N 3.26Å; K240-E243 PolarHBondContact O-N 2.83Å; E243-L246 WeakPolarHBondContact O-CB 3.37Å; E243-L246 PolarHBondContact O-N 3.49Å; E243-T247 WeakPolarHBondContact O-CG2 3.47Å; E243-T247 PolarHBondContact O-N 2.9Å
244E91.7Very high92.2Very high106 Ų10697.6 Ų97.650%0.49550%0.495SS..Hα-helixtrans-63.4-42.5179.7-74.8-178.3-174.700111.9K240 T241 L246 T247 L248K240-E244 WeakPolarHBondContact CE-OE1 3.3Å; K240-E244 WeakPolarHBondContact O-CG 3.42Å; K240-E244 PolarHBondContact O-N 2.85Å; T241-E244 PolarHBondContact O-N 2.7Å; E244-L246 VanDerWaalsContact C-N 3.29Å; E244-L246 PolarHBondContact O-N 2.95Å; E244-T247 PolarHBondContact O-N 3.41Å; E244-T247 VanDerWaalsContact O-N 3.15Å; E244-T247 PolarHBondContact O-OG1 3.34Å; E244-L248 PolarHBondContact O-N 3.49Å
245T91.1Very high92.3Very high70 Ų70101.6 Ų101.643%0.42950%0.504SS..Hα-helixtrans-62-37.1174.944.40000112.2T241 D242 T247 L248 Q249T241-T245 WeakPolarHBondContact O-CB 3.48Å; T241-T245 WeakPolarHBondContact O-CG2 3.49Å; T241-T245 PolarHBondContact O-N 3.37Å; T241-T245 PolarHBondContact O-OG1 2.91Å; D242-T245 VanDerWaalsContact CA-OG1 3.28Å; D242-T245 WeakPolarHBondContact CA-OG1 3.33Å; D242-T245 PolarHBondContact O-OG1 2.97Å; T245-T247 VanDerWaalsContact C-N 3.34Å; T245-T247 PolarHBondContact O-N 2.93Å; T245-L248 PolarHBondContact O-N 3.32Å; T245-Q249 WeakPolarHBondContact O-CB 3.38Å; T245-Q249 PolarHBondContact O-N 3.44Å
246L93.2Very high92.3Very high130 Ų130100.8 Ų100.868%0.68150%0.501SS*.Hα-helixtrans-66.1-37.1175.3-138144.6000111.9D242 E243 E244 Q249 K250D242-L246 WeakPolarHBondContact O-CB 3.36Å; D242-L246 PolarHBondContact O-N 3.07Å; D242-L246 VanDerWaalsContact O-N 3.09Å; E243-L246 WeakPolarHBondContact O-CB 3.37Å; E243-L246 PolarHBondContact O-N 3.49Å; E244-L246 VanDerWaalsContact C-N 3.29Å; E244-L246 PolarHBondContact O-N 2.95Å; L246-Q249 PolarHBondContact O-N 3.04Å; L246-K250 PolarHBondContact O-N 3.36Å; L246-K250 VanDerWaalsContact O-N 3.12Å
247T92.4Very high92.2Very high82 Ų82102.5 Ų102.550%0.50350%0.503SS..Hα-helixtrans-66.1-41.8172.867.20000112.3E243 E244 T245 K250 I251E243-T247 WeakPolarHBondContact O-CG2 3.47Å; E243-T247 PolarHBondContact O-N 2.9Å; E244-T247 PolarHBondContact O-N 3.41Å; E244-T247 VanDerWaalsContact O-N 3.15Å; E244-T247 PolarHBondContact O-OG1 3.34Å; T245-T247 VanDerWaalsContact C-N 3.34Å; T245-T247 PolarHBondContact O-N 2.93Å; T247-K250 WeakPolarHBondContact O-CB 3.39Å; T247-K250 PolarHBondContact O-N 2.76Å; T247-I251 WeakPolarHBondContact O-CG1 3.35Å; T247-I251 PolarHBondContact O-N 3.2Å
248L89.5Confident92.2Very high105 Ų105105.3 Ų105.355%0.5551%0.51SS..Hα-helixtrans-63-43.8175.8-73.1171.7000111.3E244 T245 K250 I251 V252E244-L248 PolarHBondContact O-N 3.49Å; T245-L248 PolarHBondContact O-N 3.32Å; L248-K250 VanDerWaalsContact C-N 3.26Å; L248-K250 PolarHBondContact O-N 3.19Å; L248-I251 PolarHBondContact O-N 2.87Å; L248-I251 VanDerWaalsContact O-N 3.16Å; L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 3.42Å
249Q92.8Very high92.1Very high138 Ų138103.4 Ų103.465%0.64551%0.506SS*.Hα-helixtrans-54.7-44.9174.9-16889.19.600110.8T245 L246 V252 T253T245-Q249 WeakPolarHBondContact O-CB 3.38Å; T245-Q249 PolarHBondContact O-N 3.44Å; L246-Q249 PolarHBondContact O-N 3.04Å; Q249-V252 PolarHBondContact O-N 3.49Å; Q249-T253 PolarHBondContact O-N 2.91Å; Q249-T253 PolarHBondContact O-OG1 3.07Å
250K94Very high91.9Very high139 Ų139103.4 Ų103.460%0.60451%0.506SS*.Hα-helixtrans-62.1-46.7177.9-173.7178178.4-178.70111.8L246 T247 L248 V252 T253 D254L246-K250 PolarHBondContact O-N 3.36Å; L246-K250 VanDerWaalsContact O-N 3.12Å; T247-K250 WeakPolarHBondContact O-CB 3.39Å; T247-K250 PolarHBondContact O-N 2.76Å; L248-K250 VanDerWaalsContact C-N 3.26Å; L248-K250 PolarHBondContact O-N 3.19Å; K250-V252 VanDerWaalsContact C-N 3.33Å; K250-V252 PolarHBondContact O-N 2.9Å; K250-T253 WeakPolarHBondContact O-CB 3.22Å; K250-T253 PolarHBondContact O-N 2.87Å; K250-T253 VanDerWaalsContact O-N 3.1Å; K250-D254 PolarHBondContact O-N 2.96Å
251I92Very high91.6Very high107 Ų107103.3 Ų103.355%0.54951%0.51SS..Hα-helixtrans-59.2-44.6177.4-67.1167.2000111T247 L248 T253 D254 W255T247-I251 WeakPolarHBondContact O-CG1 3.35Å; T247-I251 PolarHBondContact O-N 3.2Å; L248-I251 PolarHBondContact O-N 2.87Å; L248-I251 VanDerWaalsContact O-N 3.16Å; I251-T253 VanDerWaalsContact C-N 3.28Å; I251-T253 PolarHBondContact O-N 3.49Å; I251-D254 PolarHBondContact O-N 2.85Å; I251-W255 WeakPolarHBondContact O-CB 3.19Å; I251-W255 PolarHBondContact O-N 3.37Å
252V93.2Very high91.3Very high83 Ų83106.9 Ų106.950%0.50352%0.521SS..Hα-helixtrans-59.9-42.1176171.50000110.9L248 Q249 K250 W255 Q256L248-V252 WeakPolarHBondContact O-CG2 3.49Å; L248-V252 PolarHBondContact O-N 3.42Å; Q249-V252 PolarHBondContact O-N 3.49Å; K250-V252 VanDerWaalsContact C-N 3.33Å; K250-V252 PolarHBondContact O-N 2.9Å; V252-W255 PolarHBondContact O-N 3.41Å; V252-Q256 WeakPolarHBondContact O-CG 3.23Å; V252-Q256 PolarHBondContact O-N 2.91Å
253T94.6Very high90.8Very high63 Ų63105.9 Ų105.939%0.38752%0.521SS..Hα-helixtrans-65.8-43.2179.1-43.30000111.4Q249 K250 I251 Q256 N257Q249-T253 PolarHBondContact O-N 2.91Å; Q249-T253 PolarHBondContact O-OG1 3.07Å; K250-T253 WeakPolarHBondContact O-CB 3.22Å; K250-T253 PolarHBondContact O-N 2.87Å; K250-T253 VanDerWaalsContact O-N 3.1Å; I251-T253 VanDerWaalsContact C-N 3.28Å; I251-T253 PolarHBondContact O-N 3.49Å; T253-Q256 PolarHBondContact O-N 2.81Å; T253-N257 PolarHBondContact O-N 3.34Å; T253-N257 PolarHBondContact O-ND2 3.47Å
254D93.3Very high90.4Very high62 Ų62101.7 Ų101.733%0.33251%0.509SS..Hα-helixtrans-63.8-41.7176.5-71.1-21.1000111K250 I251 Q256 N257 Y258K250-D254 PolarHBondContact O-N 2.96Å; I251-D254 PolarHBondContact O-N 2.85Å; D254-Q256 PolarHBondContact O-N 3.24Å; D254-N257 WeakPolarHBondContact O-CB 3.29Å; D254-N257 PolarHBondContact O-N 3.47Å; D254-N257 VanDerWaalsContact O-N 3.14Å; D254-Y258 HydrophobicContact CB-CE2 4.17Å; D254-Y258 WeakPolarHBondContact O-CD2 3.26Å; D254-Y258 PolarHBondContact O-N 3.29Å
255W90.3Very high89.9Confident177 Ų177102.3 Ų102.367%0.6752%0.515SS*.Hα-helixtrans-60.3-43.4174.2-175.9-104.3000112.9I251 V252 N257 Y258 T259I251-W255 WeakPolarHBondContact O-CB 3.19Å; I251-W255 PolarHBondContact O-N 3.37Å; V252-W255 PolarHBondContact O-N 3.41Å; W255-N257 VanDerWaalsContact C-N 3.29Å; W255-N257 PolarHBondContact O-N 2.97Å; W255-Y258 PolarHBondContact O-N 3.3Å; W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 2.83Å; W255-T259 PolarHBondContact O-OG1 3.19Å
256Q91.4Very high89.6Confident98 Ų98108.2 Ų108.246%0.45853%0.53SS..Hα-helixtrans-61.3-39.3174.3-72.8177.7-0.700111.6V252 T253 D254 T259 R260V252-Q256 WeakPolarHBondContact O-CG 3.23Å; V252-Q256 PolarHBondContact O-N 2.91Å; T253-Q256 PolarHBondContact O-N 2.81Å; D254-Q256 PolarHBondContact O-N 3.24Å; Q256-T259 PolarHBondContact O-N 3.38Å; Q256-R260 WeakPolarHBondContact O-CG 3.23Å; Q256-R260 PolarHBondContact O-N 2.96Å
257N91.4Very high89.3Confident67 Ų67105.6 Ų105.636%0.35852%0.519SS..Hα-helixtrans-65.2-44.3175.2-73.7-26.9000112T253 D254 W255 T259 R260 L261T253-N257 PolarHBondContact O-N 3.34Å; T253-N257 PolarHBondContact O-ND2 3.47Å; D254-N257 WeakPolarHBondContact O-CB 3.29Å; D254-N257 PolarHBondContact O-N 3.47Å; D254-N257 VanDerWaalsContact O-N 3.14Å; W255-N257 VanDerWaalsContact C-N 3.29Å; W255-N257 PolarHBondContact O-N 2.97Å; N257-T259 VanDerWaalsContact C-N 3.33Å; N257-T259 PolarHBondContact O-N 3.08Å; N257-R260 PolarHBondContact O-N 3.35Å; N257-R260 PolarHBondContact OD1-NH1 3.17Å; N257-R260 VanDerWaalsContact OD1-NH1 3.16Å; N257-L261 WeakPolarHBondContact O-CG 3.42Å; N257-L261 PolarHBondContact O-N 3.38Å
258Y89.3Confident88.7Confident130 Ų130105.7 Ų105.751%0.5152%0.519SS..Hα-helixtrans-60.3-43.3174.1-66.8-51.6000111.7D254 W255 R260 L261 F262D254-Y258 HydrophobicContact CB-CE2 4.17Å; D254-Y258 WeakPolarHBondContact O-CD2 3.26Å; D254-Y258 PolarHBondContact O-N 3.29Å; W255-Y258 PolarHBondContact O-N 3.3Å; Y258-R260 VanDerWaalsContact C-N 3.3Å; Y258-R260 PolarHBondContact O-N 3.41Å; Y258-L261 HydrophobicContact CD1-CD1 4.37Å; Y258-L261 WeakPolarHBondContact O-CB 3.39Å; Y258-L261 PolarHBondContact O-N 3.23Å; Y258-L261 VanDerWaalsContact O-N 3.1Å; Y258-F262 WeakPolarHBondContact O-CD2 3.37Å; Y258-F262 PolarHBondContact O-N 2.92Å
259T88.9Confident88.2Confident69 Ų69104.4 Ų104.442%0.42352%0.519SS..Hα-helixtrans-59.3-41.7177.2-54.20000111.3W255 Q256 N257 F262 S263W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 2.83Å; W255-T259 PolarHBondContact O-OG1 3.19Å; Q256-T259 PolarHBondContact O-N 3.38Å; N257-T259 VanDerWaalsContact C-N 3.33Å; N257-T259 PolarHBondContact O-N 3.08Å; T259-F262 PolarHBondContact O-N 3.49Å; T259-S263 PolarHBondContact O-N 2.88Å
260R88.6Confident87.7Confident153 Ų153101.5 Ų101.558%0.57751%0.511SS*.Hα-helixtrans-63.6-43.7173.7-70.9179.3-162.8142.12.6111.9Q256 N257 Y258 F262 S263 G264Q256-R260 WeakPolarHBondContact O-CG 3.23Å; Q256-R260 PolarHBondContact O-N 2.96Å; N257-R260 PolarHBondContact O-N 3.35Å; N257-R260 PolarHBondContact OD1-NH1 3.17Å; N257-R260 VanDerWaalsContact OD1-NH1 3.16Å; Y258-R260 VanDerWaalsContact C-N 3.3Å; Y258-R260 PolarHBondContact O-N 3.41Å; R260-F262 PolarHBondContact O-N 3.41Å; R260-S263 PolarHBondContact O-N 3.48Å; R260-S263 PolarHBondContact O-OG 2.87Å; R260-G264 PolarHBondContact O-N 3.4Å
261L88.3Confident87.1Confident120 Ų120101.7 Ų101.763%0.62851%0.512SS*.Hα-helixtrans-60.1-44.7176.3-72171.6000111.7N257 Y258 S263 G264 L265N257-L261 WeakPolarHBondContact O-CG 3.42Å; N257-L261 PolarHBondContact O-N 3.38Å; Y258-L261 HydrophobicContact CD1-CD1 4.37Å; Y258-L261 WeakPolarHBondContact O-CB 3.39Å; Y258-L261 PolarHBondContact O-N 3.23Å; Y258-L261 VanDerWaalsContact O-N 3.1Å; L261-S263 VanDerWaalsContact C-N 3.34Å; L261-S263 PolarHBondContact O-N 3.49Å; L261-G264 PolarHBondContact O-N 3.08Å; L261-L265 PolarHBondContact O-N 3.43Å
262F84.3Confident86.3Confident141 Ų141100.4 Ų100.462%0.61851%0.509SS*.Hα-helixtrans-62.6-39.8174.9-77.4-63.2000112.1Y258 T259 R260 G264 L265 R266Y258-F262 WeakPolarHBondContact O-CD2 3.37Å; Y258-F262 PolarHBondContact O-N 2.92Å; T259-F262 PolarHBondContact O-N 3.49Å; R260-F262 PolarHBondContact O-N 3.41Å; F262-G264 VanDerWaalsContact C-N 3.35Å; F262-L265 PolarHBondContact O-N 3.41Å; F262-R266 WeakPolarHBondContact O-CB 3.49Å; F262-R266 PolarHBondContact O-N 2.86Å
263S82.1Confident85.7Confident65 Ų6598 Ų9846%0.45550%0.501SS..Hα-helixtrans-63.7-41174.4790000111.8T259 R260 L261 R266 T267T259-S263 PolarHBondContact O-N 2.88Å; R260-S263 PolarHBondContact O-N 3.48Å; R260-S263 PolarHBondContact O-OG 2.87Å; L261-S263 VanDerWaalsContact C-N 3.34Å; L261-S263 PolarHBondContact O-N 3.49Å; S263-R266 PolarHBondContact O-N 3.19Å; S263-T267 WeakPolarHBondContact O-CG2 3.34Å; S263-T267 PolarHBondContact O-N 3.49Å
264G86.6Confident85.1Confident30 Ų30100.8 Ų100.831%0.30951%0.509SS..Hα-helixtrans-57.7-52.4171.500000111.5R260 L261 F262 R266 T267 T268R260-G264 PolarHBondContact O-N 3.4Å; L261-G264 PolarHBondContact O-N 3.08Å; F262-G264 VanDerWaalsContact C-N 3.35Å; G264-R266 VanDerWaalsContact C-N 3.28Å; G264-R266 PolarHBondContact O-N 2.92Å; G264-T267 PolarHBondContact O-N 2.9Å; G264-T267 VanDerWaalsContact O-N 3.09Å; G264-T267 PolarHBondContact O-OG1 3.2Å; G264-T268 PolarHBondContact O-N 3.39Å; G264-T268 PolarHBondContact O-OG1 3.41Å
265L81.7Confident84.3Confident120 Ų120100.1 Ų100.163%0.62851%0.513SS*.Hα-helixtrans-57.5-41.2177.5-161.396.1000111.8L261 F262 T268 S269L261-L265 PolarHBondContact O-N 3.43Å; F262-L265 PolarHBondContact O-N 3.41Å; L265-T268 PolarHBondContact O-N 3.25Å; L265-S269 VanDerWaalsContact O-CB 3.32Å; L265-S269 WeakPolarHBondContact O-CB 3.05Å; L265-S269 PolarHBondContact O-N 2.87Å
266R84.5Confident83.5Confident194 Ų19495.3 Ų95.373%0.73250%0.503SS*.Hα-helixtrans-62.3-45.2175.9-172.4172.8-176.8145.8-0.1111.2F262 S263 G264 T268 S269 T270F262-R266 WeakPolarHBondContact O-CB 3.49Å; F262-R266 PolarHBondContact O-N 2.86Å; S263-R266 PolarHBondContact O-N 3.19Å; G264-R266 VanDerWaalsContact C-N 3.28Å; G264-R266 PolarHBondContact O-N 2.92Å; R266-T268 VanDerWaalsContact C-N 3.32Å; R266-T268 PolarHBondContact O-N 3.04Å; R266-S269 WeakPolarHBondContact O-CB 3.36Å; R266-S269 PolarHBondContact O-N 3.45Å; R266-T270 WeakPolarHBondContact O-CG2 3.41Å; R266-T270 PolarHBondContact O-N 2.95Å; R266-T270 PolarHBondContact O-OG1 3.03Å
267T85.8Confident82.7Confident75 Ų7597.6 Ų97.646%0.4651%0.511SS..Hα-helixtrans-65.3-34.5175.8630000112.9S263 G264 T270 K271S263-T267 WeakPolarHBondContact O-CG2 3.34Å; S263-T267 PolarHBondContact O-N 3.49Å; G264-T267 PolarHBondContact O-N 2.9Å; G264-T267 VanDerWaalsContact O-N 3.09Å; G264-T267 PolarHBondContact O-OG1 3.2Å; T267-T270 WeakPolarHBondContact CA-OG1 3.34Å; T267-T270 PolarHBondContact O-OG1 3.3Å; T267-K271 WeakPolarHBondContact O-CG 3.45Å; T267-K271 PolarHBondContact O-N 2.85Å; T267-K271 VanDerWaalsContact O-N 3.09Å
268T79.4Confident82Confident83 Ų8399.8 Ų99.851%0.50952%0.523SS..Hα-helixtrans-67.3-45.6172.8-43.40000110G264 L265 R266 T270 K271 T272G264-T268 PolarHBondContact O-N 3.39Å; G264-T268 PolarHBondContact O-OG1 3.41Å; L265-T268 PolarHBondContact O-N 3.25Å; R266-T268 VanDerWaalsContact C-N 3.32Å; R266-T268 PolarHBondContact O-N 3.04Å; T268-T270 VanDerWaalsContact C-N 3.32Å; T268-T270 PolarHBondContact O-N 2.84Å; T268-K271 CarbonylContact O-C 3.58Å; T268-K271 PolarHBondContact O-N 2.97Å; T268-K271 VanDerWaalsContact O-N 3.16Å; T268-T272 WeakPolarHBondContact O-CB 3.43Å; T268-T272 PolarHBondContact O-N 3.26Å; T268-T272 PolarHBondContact O-OG1 3.11Å
269S80Confident81Confident78 Ų7898.3 Ų98.355%0.54552%0.523SS..Hα-helixtrans-59.8-38.9176.5-175.40000112.4L265 R266 G273L265-S269 VanDerWaalsContact O-CB 3.32Å; L265-S269 WeakPolarHBondContact O-CB 3.05Å; L265-S269 PolarHBondContact O-N 2.87Å; R266-S269 WeakPolarHBondContact O-CB 3.36Å; R266-S269 PolarHBondContact O-N 3.45Å; S269-G273 PolarHBondContact O-N 3.19Å
270T82.4Confident79.7Confident77 Ų77101.1 Ų101.147%0.47253%0.531SS..Hα-helixtrans-68.3-41.5175.453.60000111.3R266 T267 T268 G273 E274R266-T270 WeakPolarHBondContact O-CG2 3.41Å; R266-T270 PolarHBondContact O-N 2.95Å; R266-T270 PolarHBondContact O-OG1 3.03Å; T267-T270 WeakPolarHBondContact CA-OG1 3.34Å; T267-T270 PolarHBondContact O-OG1 3.3Å; T268-T270 VanDerWaalsContact C-N 3.32Å; T268-T270 PolarHBondContact O-N 2.84Å; T270-G273 CarbonylContact O-C 3.6Å; T270-G273 WeakPolarHBondContact O-CA 3.46Å; T270-G273 PolarHBondContact O-N 3.46Å; T270-E274 PolarHBondContact O-N 2.97Å
271K81.3Confident78.5Confident143 Ų14396.9 Ų96.962%0.62253%0.529SS*.Hα-helixtrans-63.8-41.1173.9-74.8177.7179.9179.70112.3T267 T268 G273 E274 A275T267-K271 WeakPolarHBondContact O-CG 3.45Å; T267-K271 PolarHBondContact O-N 2.85Å; T267-K271 VanDerWaalsContact O-N 3.09Å; T268-K271 CarbonylContact O-C 3.58Å; T268-K271 PolarHBondContact O-N 2.97Å; T268-K271 VanDerWaalsContact O-N 3.16Å; K271-G273 VanDerWaalsContact C-N 3.32Å; K271-E274 PolarHBondContact O-N 3.47Å; K271-A275 PolarHBondContact O-N 3.39Å
272T75.6Confident77.2Confident80 Ų8096.1 Ų96.149%0.49153%0.529SS..Hα-helixtrans-63.3-40.9172.2-56.90000110.4T268 E274 A275 V276T268-T272 WeakPolarHBondContact O-CB 3.43Å; T268-T272 PolarHBondContact O-N 3.26Å; T268-T272 PolarHBondContact O-OG1 3.11Å; T272-E274 PolarHBondContact O-N 3.18Å; T272-A275 WeakPolarHBondContact O-CB 3.4Å; T272-A275 PolarHBondContact O-N 3.38Å; T272-V276 HydrophobicContact CG2-CG2 4.49Å; T272-V276 WeakPolarHBondContact O-CB 3.48Å; T272-V276 VanDerWaalsContact O-CG2 3.26Å; T272-V276 WeakPolarHBondContact O-CG2 3.34Å; T272-V276 PolarHBondContact O-N 2.83Å
273G80.5Confident75.7Confident32 Ų3294.3 Ų94.333%0.3353%0.526SS..Hα-helixtrans-61.4-39.4173.400000113.1S269 T270 K271 V276 K277S269-G273 PolarHBondContact O-N 3.19Å; T270-G273 CarbonylContact O-C 3.6Å; T270-G273 WeakPolarHBondContact O-CA 3.46Å; T270-G273 PolarHBondContact O-N 3.46Å; K271-G273 VanDerWaalsContact C-N 3.32Å; G273-V276 PolarHBondContact O-N 3.42Å; G273-K277 WeakPolarHBondContact O-CB 3.48Å; G273-K277 WeakPolarHBondContact O-CG 3.25Å; G273-K277 PolarHBondContact O-N 3.26Å
274E81.2Confident74.6Confident122 Ų12292.7 Ų92.757%0.5752%0.519SS*.Hα-helixtrans-66.6-41.1172.3-76.2176.8172.500112.1T270 K271 T272 V276 K277 N278T270-E274 PolarHBondContact O-N 2.97Å; K271-E274 PolarHBondContact O-N 3.47Å; T272-E274 PolarHBondContact O-N 3.18Å; E274-V276 VanDerWaalsContact C-N 3.35Å; E274-K277 PolarHBondContact O-N 2.87Å; E274-N278 PolarHBondContact O-N 3.24Å
275A77Confident72.9Confident49 Ų4994.9 Ų94.941%0.40553%0.534SS..Hα-helixtrans-62.7-42.4173.700000111.6K271 T272 N278 I279K271-A275 PolarHBondContact O-N 3.39Å; T272-A275 WeakPolarHBondContact O-CB 3.4Å; T272-A275 PolarHBondContact O-N 3.38Å; A275-N278 PolarHBondContact O-N 3.43Å; A275-I279 VanDerWaalsContact O-CG1 3.28Å; A275-I279 WeakPolarHBondContact O-CG1 3.17Å; A275-I279 PolarHBondContact O-N 3.26Å
276V73.3Confident71.2Confident75 Ų7591.9 Ų91.946%0.45552%0.523SS..Hα-helixtrans-63.2-40.8173.1170.40000110.7T272 G273 E274 N278 I279 Q280T272-V276 HydrophobicContact CG2-CG2 4.49Å; T272-V276 WeakPolarHBondContact O-CB 3.48Å; T272-V276 VanDerWaalsContact O-CG2 3.26Å; T272-V276 WeakPolarHBondContact O-CG2 3.34Å; T272-V276 PolarHBondContact O-N 2.83Å; G273-V276 PolarHBondContact O-N 3.42Å; E274-V276 VanDerWaalsContact C-N 3.35Å; V276-N278 PolarHBondContact O-N 3Å; V276-I279 CarbonylContact O-C 3.54Å; V276-I279 PolarHBondContact O-N 3.48Å; V276-Q280 WeakPolarHBondContact O-CB 3.49Å; V276-Q280 PolarHBondContact O-N 2.98Å
277K74.9Confident69.3Low147 Ų14786.1 Ų86.164%0.63951%0.512SS*.Hα-helixtrans-63.8-37.6173.9-80.4-180178.9-179.30112.7G273 E274 Q280 A281G273-K277 WeakPolarHBondContact O-CB 3.48Å; G273-K277 WeakPolarHBondContact O-CG 3.25Å; G273-K277 PolarHBondContact O-N 3.26Å; E274-K277 PolarHBondContact O-N 2.87Å; K277-Q280 CarbonylContact O-C 3.58Å; K277-Q280 PolarHBondContact O-N 2.91Å; K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.03Å
278N76.3Confident67.4Low112 Ų11291 Ų9160%0.59953%0.53SS*.Hα-helixtrans-67.6-41.5174.1-77.9-16.3000111.5E274 A275 V276 Q280 A281 T282E274-N278 PolarHBondContact O-N 3.24Å; A275-N278 PolarHBondContact O-N 3.43Å; V276-N278 PolarHBondContact O-N 3Å; N278-Q280 VanDerWaalsContact C-N 3.31Å; N278-Q280 PolarHBondContact O-N 3.48Å; N278-A281 PolarHBondContact O-N 3.33Å; N278-T282 PolarHBondContact O-N 2.81Å; N278-T282 PolarHBondContact O-OG1 3.21Å
279I67.5Low65.9Low99 Ų9997.5 Ų97.551%0.50855%0.545SS..Hα-helixtrans-61.9-42.6171.9-68.6164.8000110A275 V276 T282 L283A275-I279 VanDerWaalsContact O-CG1 3.28Å; A275-I279 WeakPolarHBondContact O-CG1 3.17Å; A275-I279 PolarHBondContact O-N 3.26Å; V276-I279 CarbonylContact O-C 3.54Å; V276-I279 PolarHBondContact O-N 3.48Å; I279-T282 CarbonylContact O-C 3.52Å; I279-T282 WeakPolarHBondContact O-CB 3.29Å; I279-T282 PolarHBondContact O-N 2.93Å; I279-T282 VanDerWaalsContact O-N 3.17Å; I279-L283 HydrophobicContact CG2-CD1 3.64Å; I279-L283 WeakPolarHBondContact O-CB 3.37Å; I279-L283 PolarHBondContact O-N 2.98Å
280Q62Low64.2Low129 Ų129100.2 Ų100.260%0.60355%0.552SS**Hα-helixtrans-67.8-31.8177.5-1711714.200112.6V276 K277 N278 L283 G284V276-Q280 WeakPolarHBondContact O-CB 3.49Å; V276-Q280 PolarHBondContact O-N 2.98Å; K277-Q280 CarbonylContact O-C 3.58Å; K277-Q280 PolarHBondContact O-N 2.91Å; N278-Q280 VanDerWaalsContact C-N 3.31Å; N278-Q280 PolarHBondContact O-N 3.48Å; Q280-L283 CarbonylContact O-C 3.52Å; Q280-L283 PolarHBondContact O-N 3.47Å; Q280-G284 WeakPolarHBondContact O-CA 3.5Å; Q280-G284 PolarHBondContact O-N 3.34Å
281A64.3Low62Low64 Ų64100.6 Ų100.653%0.52956%0.558SS.*Hα-helixtrans-69.6-36.6170.800000111.4K277 N278 G284 A285K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.03Å; N278-A281 PolarHBondContact O-N 3.33Å; A281-G284 PolarHBondContact O-N 3.3Å; A281-A285 PolarHBondContact O-N 3.36Å
282T59.8Low60.5Low103 Ų103101.8 Ų101.863%0.63257%0.566SS**Hα-helixtrans-70.8-35.9174.2-42.30000111.5N278 I279 S286N278-T282 PolarHBondContact O-N 2.81Å; N278-T282 PolarHBondContact O-OG1 3.21Å; I279-T282 CarbonylContact O-C 3.52Å; I279-T282 WeakPolarHBondContact O-CB 3.29Å; I279-T282 PolarHBondContact O-N 2.93Å; I279-T282 VanDerWaalsContact O-N 3.17Å; T282-S286 PolarHBondContact O-OG 3.35Å
283L54.6Low58.8Low104 Ų104105 Ų10555%0.54558%0.58SS.*Hα-helixtrans-72.9-30.6170-100.1128.3000112.3I279 Q280 S286 S287I279-L283 HydrophobicContact CG2-CD1 3.64Å; I279-L283 WeakPolarHBondContact O-CB 3.37Å; I279-L283 PolarHBondContact O-N 2.98Å; Q280-L283 CarbonylContact O-C 3.52Å; Q280-L283 PolarHBondContact O-N 3.47Å; L283-S286 VanDerWaalsContact CA-OG 3.29Å; L283-S286 WeakPolarHBondContact CA-OG 3.35Å; L283-S286 CarbonylContact O-C 3.51Å; L283-S286 PolarHBondContact O-N 3.35Å; L283-S286 PolarHBondContact O-OG 3.41Å; L283-S287 WeakPolarHBondContact O-CB 3.36Å; L283-S287 PolarHBondContact O-N 3.39Å
284G57.4Low57.2Low31 Ų31109.4 Ų109.432%0.3261%0.606SS.*Hα-helixtrans-67.9-39.3175.100000111.9Q280 A281 S286 S287 Q288Q280-G284 WeakPolarHBondContact O-CA 3.5Å; Q280-G284 PolarHBondContact O-N 3.34Å; A281-G284 PolarHBondContact O-N 3.3Å; G284-S286 PolarHBondContact O-N 3.45Å; G284-S287 PolarHBondContact O-N 3.47Å; G284-Q288 WeakPolarHBondContact O-CB 3.29Å; G284-Q288 PolarHBondContact O-N 3.49Å
285A51.3Low55.9Low75 Ų75111 Ų11162%0.6261%0.613SS**Hα-helixtrans-64.6-22.4171.500000113.4A281A281-A285 PolarHBondContact O-N 3.36Å
286S45.9Very low54.8Low57 Ų57113.1 Ų113.140%0.39963%0.625SS.*Hα-helixtrans-96.3-27173.547.10000113.7T282 L283 G284 R289T282-S286 PolarHBondContact O-OG 3.35Å; L283-S286 VanDerWaalsContact CA-OG 3.29Å; L283-S286 WeakPolarHBondContact CA-OG 3.35Å; L283-S286 CarbonylContact O-C 3.51Å; L283-S286 PolarHBondContact O-N 3.35Å; L283-S286 PolarHBondContact O-OG 3.41Å; G284-S286 PolarHBondContact O-N 3.45Å; S286-R289 PolarHBondContact O-N 3.38Å
287S45.4Very low53.8Low73 Ų73116.7 Ų116.751%0.5164%0.639SS.*Hα-helixtrans-78.2-23.4176.7-171.50000112.8L283 G284 R289 I290L283-S287 WeakPolarHBondContact O-CB 3.36Å; L283-S287 PolarHBondContact O-N 3.39Å; G284-S287 PolarHBondContact O-N 3.47Å; S287-R289 PolarHBondContact O-N 3.37Å; S287-R289 VanDerWaalsContact O-N 3.09Å; S287-I290 PolarHBondContact O-N 3.42Å
288Q45Very low52.9Low179 Ų179115.7 Ų115.784%0.83664%0.636SS**THydrogen-bonded Turntrans-70.81.7172.7-161.3148.6-8.800113.4G284G284-Q288 WeakPolarHBondContact O-CB 3.29Å; G284-Q288 PolarHBondContact O-N 3.49Å
289R47.3Very low52.1Low219 Ų219115.1 Ų115.183%0.82663%0.633SS**THydrogen-bonded Turntrans-105-2166-90.2-169.3-74.3156.6-5.1114.7S286 S287S286-R289 PolarHBondContact O-N 3.38Å; S287-R289 PolarHBondContact O-N 3.37Å; S287-R289 VanDerWaalsContact O-N 3.09Å
290I45.5Very low51.8Low134 Ų134115.5 Ų115.569%0.68764%0.635SS**SBendtrans-118.897.9177.1-60.9177000107.6S287S287-I290 PolarHBondContact O-N 3.42Å
291S36.8Very low51.9Low85 Ų85113.4 Ų113.459%0.59463%0.632SS**  trans-43.1137.9174.3-165.30000113.4
292Q49.7Very low52.1Low168 Ų168114.9 Ų114.979%0.78563%0.63SS**  trans53114.2140.7-69.3164.6-17.100118.4
293N39.7Very low52.9Low149 Ų149116 Ų11680%0.79763%0.628SS**  -163.9136.8129-105.8-9.5000111.9E295N293-E295 VanDerWaalsContact C-N 3.28Å; N293-E295 PolarHBondContact O-N 2.81Å
294S47.1Very low53.8Low124 Ų124115.1 Ų115.187%0.86763%0.627SS**THydrogen-bonded Turntrans-86.536.2-17169.50000114.1
295E53.5Low54.5Low155 Ų155119.1 Ų119.172%0.72464%0.639SS**THydrogen-bonded Turntrans-106.2-15.3-177.6-118.9174.1-179.500113.9N293 M297N293-E295 VanDerWaalsContact C-N 3.28Å; N293-E295 PolarHBondContact O-N 2.81Å; E295-M297 PolarHBondContact O-N 3.29Å
296S53.4Low55.8Low94 Ų94117.1 Ų117.166%0.65763%0.625SS**Hα-helixtrans-80.2-16.7-178800000115L300S296-L300 WeakPolarHBondContact O-CB 3.5Å; S296-L300 PolarHBondContact O-N 3.26Å; S296-L300 VanDerWaalsContact O-N 3.17Å
297M51.5Low57.3Low149 Ų149119.3 Ų119.373%0.73463%0.632SS**Hα-helixtrans-72.9-32.5175.8-103.7-155.9-132.700112.3E295 V301E295-M297 PolarHBondContact O-N 3.29Å; M297-V301 WeakPolarHBondContact O-CB 3.33Å; M297-V301 WeakPolarHBondContact O-CG2 3.44Å; M297-V301 PolarHBondContact O-N 2.83Å
298H56.3Low58.8Low126 Ų126120.5 Ų120.558%0.58363%0.629SS**Hα-helixtrans-71.6-42.3-179.6-166.565.4000111.2V301 L302H298-V301 PolarHBondContact O-N 3.43Å; H298-L302 WeakPolarHBondContact O-CG 3.39Å; H298-L302 PolarHBondContact O-N 2.92Å
299D59.7Low60.5Low101 Ų101117.5 Ų117.554%0.5462%0.619SS.*Hα-helixtrans-66.5-35.5173.9-86.4-6.7000112.7L302 Q303D299-L302 PolarHBondContact O-N 3.48Å; D299-Q303 WeakPolarHBondContact O-CB 3.49Å; D299-Q303 VanDerWaalsContact O-CG 3.31Å; D299-Q303 WeakPolarHBondContact O-CG 3.41Å; D299-Q303 PolarHBondContact O-N 3.33Å
300L61.2Low62.2Low106 Ų106112.9 Ų112.956%0.55561%0.606SS**Hα-helixtrans-68.2-39.2174.8-161.677.3000111.4S296 Q303 V304S296-L300 WeakPolarHBondContact O-CB 3.5Å; S296-L300 PolarHBondContact O-N 3.26Å; S296-L300 VanDerWaalsContact O-N 3.17Å; L300-Q303 PolarHBondContact O-N 2.8Å; L300-V304 WeakPolarHBondContact O-CB 3.4Å; L300-V304 WeakPolarHBondContact O-CG2 3.43Å; L300-V304 PolarHBondContact O-N 3.48Å
301V64.3Low64Low86 Ų86111.9 Ų111.952%0.52160%0.602SS.*Hα-helixtrans-66.5-39175.1169.20000111.2M297 H298 V304 M305M297-V301 WeakPolarHBondContact O-CB 3.33Å; M297-V301 WeakPolarHBondContact O-CG2 3.44Å; M297-V301 PolarHBondContact O-N 2.83Å; H298-V301 PolarHBondContact O-N 3.43Å; V301-V304 PolarHBondContact O-N 3.32Å; V301-M305 WeakPolarHBondContact O-CB 3.36Å; V301-M305 PolarHBondContact O-N 3.14Å
302L68.6Low66Low94 Ų94111.8 Ų111.849%0.49260%0.595SS.*Hα-helixtrans-67.3-39.4174.9-74.1169.3000112.4H298 D299 M305 G306H298-L302 WeakPolarHBondContact O-CG 3.39Å; H298-L302 PolarHBondContact O-N 2.92Å; D299-L302 PolarHBondContact O-N 3.48Å; L302-M305 PolarHBondContact O-N 3.26Å; L302-G306 PolarHBondContact O-N 3.37Å
303Q76.3Confident67.6Low127 Ų127109.2 Ų109.259%0.59359%0.586SS**Hα-helixtrans-69-37.7174.7-75178.95.200112.5D299 L300 G306 L307D299-Q303 WeakPolarHBondContact O-CB 3.49Å; D299-Q303 VanDerWaalsContact O-CG 3.31Å; D299-Q303 WeakPolarHBondContact O-CG 3.41Å; D299-Q303 PolarHBondContact O-N 3.33Å; L300-Q303 PolarHBondContact O-N 2.8Å; Q303-G306 PolarHBondContact O-N 2.98Å; Q303-L307 WeakPolarHBondContact O-CB 3.26Å; Q303-L307 WeakPolarHBondContact O-CG 3.28Å; Q303-L307 PolarHBondContact O-N 3.31Å
304V73.4Confident69.6Low85 Ų85106.9 Ų106.952%0.51557%0.573SS.*Hα-helixtrans-67.3-39.4174.2169.80000110.7L300 V301 L307 Q308L300-V304 WeakPolarHBondContact O-CB 3.4Å; L300-V304 WeakPolarHBondContact O-CG2 3.43Å; L300-V304 PolarHBondContact O-N 3.48Å; V301-V304 PolarHBondContact O-N 3.32Å; V304-L307 PolarHBondContact O-N 2.99Å; V304-Q308 VanDerWaalsContact O-CB 3.3Å; V304-Q308 WeakPolarHBondContact O-CB 3.38Å; V304-Q308 PolarHBondContact O-N 3.49Å
305M72.6Confident71.3Confident116 Ų116103.7 Ų103.757%0.57155%0.55SS**Hα-helixtrans-65.5-39.4173.8-163.591.283.900111.8V301 L302 Q308 L309V301-M305 WeakPolarHBondContact O-CB 3.36Å; V301-M305 PolarHBondContact O-N 3.14Å; L302-M305 PolarHBondContact O-N 3.26Å; M305-Q308 PolarHBondContact O-N 3.46Å; M305-L309 PolarHBondContact O-N 2.96Å
306G79Confident72.9Confident33 Ų3398.8 Ų98.834%0.3453%0.533SS..Hα-helixtrans-65.1-40.7174.700000112.9L302 Q303 Q310L302-G306 PolarHBondContact O-N 3.37Å; Q303-G306 PolarHBondContact O-N 2.98Å; G306-Q310 WeakPolarHBondContact O-CG 3.24Å; G306-Q310 PolarHBondContact O-N 3.4Å; G306-Q310 VanDerWaalsContact O-N 3.08Å
307L77.8Confident74.4Confident103 Ų103101.3 Ų101.354%0.53953%0.533SS..Hα-helixtrans-68.3-35.8173.1-77.7165.5000112Q303 V304 Q310 L311Q303-L307 WeakPolarHBondContact O-CB 3.26Å; Q303-L307 WeakPolarHBondContact O-CG 3.28Å; Q303-L307 PolarHBondContact O-N 3.31Å; V304-L307 PolarHBondContact O-N 2.99Å; L307-Q310 PolarHBondContact O-N 2.92Å; L307-L311 WeakPolarHBondContact O-CB 3.44Å; L307-L311 PolarHBondContact O-N 3.48Å
308Q77.2Confident75.8Confident97 Ų9799.2 Ų99.245%0.45352%0.524SS..Hα-helixtrans-63.8-46.3175.5-170.564.734.400111V304 M305 Q310 L311 D312V304-Q308 VanDerWaalsContact O-CB 3.3Å; V304-Q308 WeakPolarHBondContact O-CB 3.38Å; V304-Q308 PolarHBondContact O-N 3.49Å; M305-Q308 PolarHBondContact O-N 3.46Å; Q308-Q310 VanDerWaalsContact C-N 3.3Å; Q308-Q310 PolarHBondContact O-N 3.21Å; Q308-L311 WeakPolarHBondContact O-CB 3.48Å; Q308-L311 PolarHBondContact O-N 2.98Å; Q308-L311 VanDerWaalsContact O-N 3.11Å; Q308-D312 PolarHBondContact NE2-OD1 2.81Å; Q308-D312 VanDerWaalsContact O-CG 3.23Å; Q308-D312 PolarHBondContact O-N 2.92Å
309L79.9Confident77.3Confident117 Ų11797.5 Ų97.561%0.61352%0.519SS*.Hα-helixtrans-62.3-36.5174.7-80.3165.4000112.7M305 N313M305-L309 PolarHBondContact O-N 2.96Å; L309-N313 WeakPolarHBondContact O-CB 3.36Å; L309-N313 PolarHBondContact O-N 3.47Å
310Q83.6Confident78.5Confident122 Ų12297.2 Ų97.257%0.5752%0.517SS*.Hα-helixtrans-68.7-37.1173.4-74.9-166.1-29.100112.2G306 L307 Q308 N313 I314G306-Q310 WeakPolarHBondContact O-CG 3.24Å; G306-Q310 PolarHBondContact O-N 3.4Å; G306-Q310 VanDerWaalsContact O-N 3.08Å; L307-Q310 PolarHBondContact O-N 2.92Å; Q308-Q310 VanDerWaalsContact C-N 3.3Å; Q308-Q310 PolarHBondContact O-N 3.21Å; Q310-N313 PolarHBondContact O-N 3.33Å; Q310-I314 WeakPolarHBondContact O-CB 3.37Å; Q310-I314 WeakPolarHBondContact O-CD1 3.35Å; Q310-I314 WeakPolarHBondContact O-CG1 3.46Å; Q310-I314 PolarHBondContact O-N 3.26Å
311L81.9Confident79.7Confident112 Ų11297.4 Ų97.459%0.58652%0.515SS*.Hα-helixtrans-65.7-42.9175.1-128.8100000111.3L307 Q308 N313 I314 S315L307-L311 WeakPolarHBondContact O-CB 3.44Å; L307-L311 PolarHBondContact O-N 3.48Å; Q308-L311 WeakPolarHBondContact O-CB 3.48Å; Q308-L311 PolarHBondContact O-N 2.98Å; Q308-L311 VanDerWaalsContact O-N 3.11Å; L311-N313 VanDerWaalsContact C-N 3.33Å; L311-N313 PolarHBondContact O-N 3.48Å; L311-I314 PolarHBondContact O-N 2.86Å; L311-S315 WeakPolarHBondContact O-CB 3.4Å; L311-S315 PolarHBondContact O-N 3.37Å
312D79.5Confident80.9Confident84 Ų8498.7 Ų98.745%0.44952%0.516SS..Hα-helixtrans-65.2-39178.1-65.8-16.2000110.7Q308 S315 S316Q308-D312 PolarHBondContact NE2-OD1 2.81Å; Q308-D312 VanDerWaalsContact O-CG 3.23Å; Q308-D312 PolarHBondContact O-N 2.92Å; D312-S315 WeakPolarHBondContact O-CB 3.22Å; D312-S315 PolarHBondContact O-N 3.21Å; D312-S316 PolarHBondContact O-N 2.84Å
313N84.1Confident81.7Confident113 Ų113100.9 Ų100.960%0.60452%0.523SS*.Hα-helixtrans-67.4-41.9175.5-163.837.2000112L309 Q310 L311 S315 S316 F317L309-N313 WeakPolarHBondContact O-CB 3.36Å; L309-N313 PolarHBondContact O-N 3.47Å; Q310-N313 PolarHBondContact O-N 3.33Å; L311-N313 VanDerWaalsContact C-N 3.33Å; L311-N313 PolarHBondContact O-N 3.48Å; N313-S315 VanDerWaalsContact C-N 3.33Å; N313-S316 PolarHBondContact O-N 3.49Å; N313-S316 PolarHBondContact O-OG 2.93Å; N313-F317 WeakPolarHBondContact O-CB 3.48Å; N313-F317 PolarHBondContact O-N 3.5Å
314I81.9Confident82.3Confident100 Ų100100 Ų10051%0.51352%0.523SS..Hα-helixtrans-64.9-38.7174-69.1165000110.8Q310 L311 F317 L318Q310-I314 WeakPolarHBondContact O-CB 3.37Å; Q310-I314 WeakPolarHBondContact O-CD1 3.35Å; Q310-I314 WeakPolarHBondContact O-CG1 3.46Å; Q310-I314 PolarHBondContact O-N 3.26Å; L311-I314 PolarHBondContact O-N 2.86Å; I314-F317 PolarHBondContact O-N 3.35Å; I314-L318 HydrophobicContact CG2-CD1 3.98Å; I314-L318 HydrophobicContact CG2-CG 4.42Å; I314-L318 WeakPolarHBondContact O-CB 3.38Å; I314-L318 VanDerWaalsContact O-CG 3.29Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 3.48Å
315S81.8Confident82.8Confident57 Ų57100.3 Ų100.340%0.39952%0.52SS..Hα-helixtrans-61.6-49.1175-167.40000110.7L311 D312 N313 F317 L318 D319L311-S315 WeakPolarHBondContact O-CB 3.4Å; L311-S315 PolarHBondContact O-N 3.37Å; D312-S315 WeakPolarHBondContact O-CB 3.22Å; D312-S315 PolarHBondContact O-N 3.21Å; N313-S315 VanDerWaalsContact C-N 3.33Å; S315-F317 VanDerWaalsContact C-N 3.28Å; S315-F317 PolarHBondContact O-N 2.84Å; S315-L318 WeakPolarHBondContact O-CB 3.5Å; S315-L318 PolarHBondContact O-N 2.6Å; S315-L318 VanDerWaalsContact O-N 3.11Å; S315-D319 VanDerWaalsContact O-CG 3.3Å; S315-D319 PolarHBondContact O-N 3.4Å
316S86.1Confident83.6Confident53 Ų5399.8 Ų99.837%0.37152%0.515SS..Hα-helixtrans-62.7-36.3178.379.10000112.4D312 N313 L318 D319 D320D312-S316 PolarHBondContact O-N 2.84Å; N313-S316 PolarHBondContact O-N 3.49Å; N313-S316 PolarHBondContact O-OG 2.93Å; S316-L318 VanDerWaalsContact C-N 3.34Å; S316-D319 PolarHBondContact O-N 3.39Å; S316-D320 WeakPolarHBondContact O-CB 3.36Å; S316-D320 PolarHBondContact O-N 2.91Å
317F85.1Confident84.1Confident146 Ų146102.7 Ų102.764%0.6452%0.523SS*.Hα-helixtrans-70-32.9176.4-164.8-88.7000112.2N313 I314 S315 H321N313-F317 WeakPolarHBondContact O-CB 3.48Å; N313-F317 PolarHBondContact O-N 3.5Å; I314-F317 PolarHBondContact O-N 3.35Å; S315-F317 VanDerWaalsContact C-N 3.28Å; S315-F317 PolarHBondContact O-N 2.84Å; F317-H321 VanDerWaalsContact O-CB 3.24Å; F317-H321 WeakPolarHBondContact O-CB 3.15Å; F317-H321 PolarHBondContact O-N 3.28Å
318L82.5Confident84.6Confident105 Ų105103.1 Ų103.155%0.5553%0.525SS..Hα-helixtrans-69.4-40.8173.2-76.1168.8000111.2I314 S315 S316 H321 E322I314-L318 HydrophobicContact CG2-CD1 3.98Å; I314-L318 HydrophobicContact CG2-CG 4.42Å; I314-L318 WeakPolarHBondContact O-CB 3.38Å; I314-L318 VanDerWaalsContact O-CG 3.29Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 3.48Å; S315-L318 WeakPolarHBondContact O-CB 3.5Å; S315-L318 PolarHBondContact O-N 2.6Å; S315-L318 VanDerWaalsContact O-N 3.11Å; S316-L318 VanDerWaalsContact C-N 3.34Å; L318-H321 PolarHBondContact O-N 2.87Å; L318-E322 WeakPolarHBondContact O-CB 3.41Å; L318-E322 PolarHBondContact O-N 3.07Å
319D85.9Confident85.2Confident90 Ų90103.7 Ų103.748%0.48153%0.528SS..Hα-helixtrans-63.8-46.8175.9-65.2-24.5000110.9S315 S316 H321 E322 E323S315-D319 VanDerWaalsContact O-CG 3.3Å; S315-D319 PolarHBondContact O-N 3.4Å; S316-D319 PolarHBondContact O-N 3.39Å; D319-H321 VanDerWaalsContact C-N 3.26Å; D319-H321 PolarHBondContact O-N 2.7Å; D319-E322 PolarHBondContact O-N 3.4Å; D319-E322 VanDerWaalsContact O-N 3.16Å; D319-E323 PolarHBondContact O-N 3.17Å
320D86.1Confident85.7Confident95 Ų95105.4 Ų105.451%0.50853%0.528SS..Hα-helixtrans-61.1-34.3174.7-78.8-8000112.3S316 N324S316-D320 WeakPolarHBondContact O-CB 3.36Å; S316-D320 PolarHBondContact O-N 2.91Å; D320-N324 WeakPolarHBondContact O-CB 3.49Å; D320-N324 PolarHBondContact O-N 3.19Å; D320-N324 VanDerWaalsContact O-N 3.12Å; D320-N324 PolarHBondContact O-ND2 3.19Å
321H86.7Confident85.8Confident110 Ų110105 Ų10551%0.50953%0.525SS..Hα-helixtrans-75.1-35.1177.2-16469.6000111.9F317 L318 D319 N324 M325F317-H321 VanDerWaalsContact O-CB 3.24Å; F317-H321 WeakPolarHBondContact O-CB 3.15Å; F317-H321 PolarHBondContact O-N 3.28Å; L318-H321 PolarHBondContact O-N 2.87Å; D319-H321 VanDerWaalsContact C-N 3.26Å; D319-H321 PolarHBondContact O-N 2.7Å; H321-N324 PolarHBondContact O-N 2.84Å; H321-M325 WeakPolarHBondContact O-CB 3.37Å; H321-M325 PolarHBondContact O-N 2.86Å
322E88.1Confident85.9Confident113 Ų113102.8 Ų102.853%0.52852%0.517SS..Hα-helixtrans-67.5-41.9175.2-174.4166.9-176.500111.4L318 D319 M325 H326L318-E322 WeakPolarHBondContact O-CB 3.41Å; L318-E322 PolarHBondContact O-N 3.07Å; D319-E322 PolarHBondContact O-N 3.4Å; D319-E322 VanDerWaalsContact O-N 3.16Å; E322-M325 PolarHBondContact O-N 3.24Å; E322-H326 PolarHBondContact O-N 3.49Å; E322-H326 PolarHBondContact O-ND1 3.39Å; E322-H326 IonicContact OE1-CE1 3.84Å
323E87.1Confident86.3Confident141 Ų141104.3 Ų104.366%0.65952%0.521SS*.Hα-helixtrans-61.2-47.7171.5-87.8-167.9159.900111.5D319 M325 H326 D327D319-E323 PolarHBondContact O-N 3.17Å; E323-M325 VanDerWaalsContact C-N 3.29Å; E323-M325 PolarHBondContact O-N 3.49Å; E323-H326 PolarHBondContact O-N 3.45Å; E323-H326 VanDerWaalsContact O-N 3.14Å; E323-D327 PolarHBondContact O-N 3.45Å
324N88.8Confident86.4Confident109 Ų109104.8 Ų104.858%0.58352%0.515SS*.Hα-helixtrans-60.8-36.9177-99.2-48000113D320 H321 L328D320-N324 WeakPolarHBondContact O-CB 3.49Å; D320-N324 PolarHBondContact O-N 3.19Å; D320-N324 VanDerWaalsContact O-N 3.12Å; D320-N324 PolarHBondContact O-ND2 3.19Å; H321-N324 PolarHBondContact O-N 2.84Å; N324-L328 VanDerWaalsContact O-CB 3.3Å; N324-L328 WeakPolarHBondContact O-CB 3.02Å; N324-L328 PolarHBondContact O-N 2.78Å
325M83.7Confident86.5Confident90 Ų90102.6 Ų102.644%0.44351%0.512SS..Hα-helixtrans-66.9-39.8175.4-98-73.4-66.400112.1H321 E322 E323 Q329H321-M325 WeakPolarHBondContact O-CB 3.37Å; H321-M325 PolarHBondContact O-N 2.86Å; E322-M325 PolarHBondContact O-N 3.24Å; E323-M325 VanDerWaalsContact C-N 3.29Å; E323-M325 PolarHBondContact O-N 3.49Å; M325-Q329 WeakPolarHBondContact O-CB 3.39Å; M325-Q329 PolarHBondContact O-N 3.36Å
326H89.8Confident86.8Confident105 Ų105105 Ų10549%0.48652%0.517SS..Hα-helixtrans-66.4-43.4175.1-81.186.1000111.8E322 E323 Q329 Y330E322-H326 PolarHBondContact O-N 3.49Å; E322-H326 PolarHBondContact O-ND1 3.39Å; E322-H326 IonicContact OE1-CE1 3.84Å; E323-H326 PolarHBondContact O-N 3.45Å; E323-H326 VanDerWaalsContact O-N 3.14Å; H326-Q329 PolarHBondContact O-N 2.81Å; H326-Y330 WeakPolarHBondContact O-CB 3.27Å; H326-Y330 PolarHBondContact O-N 3.18Å
327D89Confident87Confident95 Ų95107 Ų10751%0.50852%0.524SS..Hα-helixtrans-62.8-42.7175.6-95.88.5000111.6E323 Y330 H331E323-D327 PolarHBondContact O-N 3.45Å; D327-Y330 PolarHBondContact O-N 3.45Å; D327-H331 WeakPolarHBondContact O-CB 3.44Å; D327-H331 PolarHBondContact O-CD2 3.16Å; D327-H331 PolarHBondContact O-N 3.42Å
328L87.2Confident87.2Confident111 Ų111105.6 Ų105.658%0.58151%0.514SS*.Hα-helixtrans-63.6-44.1175.8-174.365.4000111.5N324 H331 T332N324-L328 VanDerWaalsContact O-CB 3.3Å; N324-L328 WeakPolarHBondContact O-CB 3.02Å; N324-L328 PolarHBondContact O-N 2.78Å; L328-H331 PolarHBondContact O-N 2.85Å; L328-T332 WeakPolarHBondContact O-CB 3.47Å; L328-T332 PolarHBondContact O-N 2.9Å; L328-T332 PolarHBondContact O-OG1 3.46Å
329Q89.5Confident87.5Confident110 Ų110103.9 Ų103.951%0.51451%0.508SS..Hα-helixtrans-62.5-43.5174.9-88.3-174.5-21.500112M325 H326 T332 H333M325-Q329 WeakPolarHBondContact O-CB 3.39Å; M325-Q329 PolarHBondContact O-N 3.36Å; H326-Q329 PolarHBondContact O-N 2.81Å; Q329-T332 PolarHBondContact O-N 2.98Å; Q329-H333 WeakPolarHBondContact O-CB 3.43Å; Q329-H333 PolarHBondContact O-N 2.96Å
330Y90.4Very high87.8Confident152 Ų152103.2 Ų103.260%0.59651%0.507SS*.Hα-helixtrans-60.2-49.9177.5178.7-95.6000111.2H326 D327 T332 H333 Y334H326-Y330 WeakPolarHBondContact O-CB 3.27Å; H326-Y330 PolarHBondContact O-N 3.18Å; D327-Y330 PolarHBondContact O-N 3.45Å; Y330-T332 VanDerWaalsContact C-N 3.33Å; Y330-T332 PolarHBondContact O-N 3.19Å; Y330-H333 PolarHBondContact O-N 3.36Å; Y330-Y334 VanDerWaalsContact O-CB 3.23Å; Y330-Y334 WeakPolarHBondContact O-CB 3.45Å; Y330-Y334 PolarHBondContact O-N 3.4Å
331H87.1Confident88.1Confident113 Ų113104.5 Ų104.552%0.52351%0.51SS..Hα-helixtrans-64.9-36.2178.5-77.9-56000112.8D327 L328 A335D327-H331 WeakPolarHBondContact O-CB 3.44Å; D327-H331 PolarHBondContact O-CD2 3.16Å; D327-H331 PolarHBondContact O-N 3.42Å; L328-H331 PolarHBondContact O-N 2.85Å; H331-A335 VanDerWaalsContact O-CB 3.27Å; H331-A335 WeakPolarHBondContact O-CB 3.39Å; H331-A335 PolarHBondContact O-N 2.89Å
332T83.1Confident88.3Confident67 Ų67107 Ų10741%0.41152%0.515SS..Hα-helixtrans-66.8-46.4176.8-53.20000111.1L328 Q329 Y330 A335 Q336L328-T332 WeakPolarHBondContact O-CB 3.47Å; L328-T332 PolarHBondContact O-N 2.9Å; L328-T332 PolarHBondContact O-OG1 3.46Å; Q329-T332 PolarHBondContact O-N 2.98Å; Y330-T332 VanDerWaalsContact C-N 3.33Å; Y330-T332 PolarHBondContact O-N 3.19Å; T332-A335 PolarHBondContact O-N 2.98Å; T332-Q336 WeakPolarHBondContact O-CB 3.47Å; T332-Q336 WeakPolarHBondContact O-CG 3.4Å; T332-Q336 PolarHBondContact O-N 3.47Å
333H88.5Confident88.5Confident115 Ų115108.4 Ų108.453%0.53252%0.52SS..Hα-helixtrans-64.6-41.4175.8-101.3-65.5000112.4Q329 Y330 Q336 N337Q329-H333 WeakPolarHBondContact O-CB 3.43Å; Q329-H333 PolarHBondContact O-N 2.96Å; Y330-H333 PolarHBondContact O-N 3.36Å; H333-Q336 PolarHBondContact O-N 3.49Å; H333-N337 WeakPolarHBondContact O-CB 3.11Å; H333-N337 PolarHBondContact O-N 3.42Å
334Y87Confident88.8Confident124 Ų124107.8 Ų107.849%0.48652%0.517SS..Hα-helixtrans-62.8-43.6176.9-179.9-98000111.6Y330 R338Y330-Y334 VanDerWaalsContact O-CB 3.23Å; Y330-Y334 WeakPolarHBondContact O-CB 3.45Å; Y330-Y334 PolarHBondContact O-N 3.4Å; Y334-R338 VanDerWaalsContact O-CB 3.27Å; Y334-R338 WeakPolarHBondContact O-CB 3.3Å; Y334-R338 PolarHBondContact O-N 3.02Å
335A83.8Confident89Confident54 Ų54106.2 Ų106.245%0.44651%0.514SS..Hα-helixtrans-64.2-45.1175.900000111.7H331 T332 R338 T339H331-A335 VanDerWaalsContact O-CB 3.27Å; H331-A335 WeakPolarHBondContact O-CB 3.39Å; H331-A335 PolarHBondContact O-N 2.89Å; T332-A335 PolarHBondContact O-N 2.98Å; A335-R338 PolarHBondContact O-N 2.82Å; A335-T339 WeakPolarHBondContact O-CG2 3.3Å; A335-T339 PolarHBondContact O-N 3.47Å; A335-T339 PolarHBondContact O-OG1 3.26Å
336Q87.8Confident89.5Confident106 Ų106105.7 Ų105.750%0.49551%0.513SS..Hα-helixtrans-60.4-51.9176.9-81.1-178.3-17.200112.1T332 H333 R338 T339 V340T332-Q336 WeakPolarHBondContact O-CB 3.47Å; T332-Q336 WeakPolarHBondContact O-CG 3.4Å; T332-Q336 PolarHBondContact O-N 3.47Å; H333-Q336 PolarHBondContact O-N 3.49Å; Q336-R338 VanDerWaalsContact C-N 3.28Å; Q336-R338 PolarHBondContact O-N 3.37Å; Q336-T339 WeakPolarHBondContact CA-OG1 3.48Å; Q336-T339 PolarHBondContact O-N 2.88Å; Q336-T339 PolarHBondContact O-OG1 3.01Å; Q336-V340 WeakPolarHBondContact O-CG2 3.43Å; Q336-V340 PolarHBondContact O-N 3.41Å
337N89.3Confident89.7Confident96 Ų96107.3 Ų107.351%0.51352%0.52SS..Hα-helixtrans-58.2-43179.1-76.1-3.7000111.3H333 T339 V340 E341H333-N337 WeakPolarHBondContact O-CB 3.11Å; H333-N337 PolarHBondContact O-N 3.42Å; N337-T339 VanDerWaalsContact C-N 3.32Å; N337-T339 PolarHBondContact O-N 2.93Å; N337-V340 PolarHBondContact O-N 3.43Å; N337-E341 WeakPolarHBondContact O-CG 3.48Å; N337-E341 PolarHBondContact O-N 3.49Å
338R90Very high89.9Confident116 Ų116104.9 Ų104.944%0.43852%0.518SS..Hα-helixtrans-67.3-31.3178-169.5165.3177.784.1-5.6113.1Y334 A335 Q336 R342Y334-R338 VanDerWaalsContact O-CB 3.27Å; Y334-R338 WeakPolarHBondContact O-CB 3.3Å; Y334-R338 PolarHBondContact O-N 3.02Å; A335-R338 PolarHBondContact O-N 2.82Å; Q336-R338 VanDerWaalsContact C-N 3.28Å; Q336-R338 PolarHBondContact O-N 3.37Å; R338-R342 VanDerWaalsContact O-CG 3.28Å; R338-R342 WeakPolarHBondContact O-CG 3.48Å; R338-R342 PolarHBondContact O-N 3.44Å
339T88.5Confident90.3Very high70 Ų70106.6 Ų106.643%0.42952%0.517SS..Hα-helixtrans-70.5-42.2171.851.80000111.8A335 Q336 N337 R342 F343A335-T339 WeakPolarHBondContact O-CG2 3.3Å; A335-T339 PolarHBondContact O-N 3.47Å; A335-T339 PolarHBondContact O-OG1 3.26Å; Q336-T339 WeakPolarHBondContact CA-OG1 3.48Å; Q336-T339 PolarHBondContact O-N 2.88Å; Q336-T339 PolarHBondContact O-OG1 3.01Å; N337-T339 VanDerWaalsContact C-N 3.32Å; N337-T339 PolarHBondContact O-N 2.93Å; T339-R342 PolarHBondContact O-N 2.96Å; T339-F343 WeakPolarHBondContact O-CD2 3.47Å; T339-F343 PolarHBondContact O-N 3.15Å
340V92.6Very high90.4Very high75 Ų75107.4 Ų107.446%0.45552%0.522SS..Hα-helixtrans-61.3-49.6177.5172.30000110.7Q336 N337 R342 F343 E344Q336-V340 WeakPolarHBondContact O-CG2 3.43Å; Q336-V340 PolarHBondContact O-N 3.41Å; N337-V340 PolarHBondContact O-N 3.43Å; V340-R342 PolarHBondContact O-N 3.18Å; V340-F343 PolarHBondContact O-N 2.99Å; V340-E344 HydrophobicContact CG1-CG 4.43Å; V340-E344 PolarHBondContact O-N 2.9Å
341E92.2Very high90.6Very high123 Ų123102.2 Ų102.258%0.57551%0.511SS*.Hα-helixtrans-57.1-37.8176.9-74.8178172.900112.5N337 S345N337-E341 WeakPolarHBondContact O-CG 3.48Å; N337-E341 PolarHBondContact O-N 3.49Å; E341-S345 WeakPolarHBondContact O-CB 3.47Å; E341-S345 PolarHBondContact O-N 2.9Å
342R90.9Very high91Very high163 Ų16399.5 Ų99.562%0.61551%0.505SS*.Hα-helixtrans-69.1-38.8176.4-77176.7176.5-168.8-2.1112.3R338 T339 V340 L346R338-R342 VanDerWaalsContact O-CG 3.28Å; R338-R342 WeakPolarHBondContact O-CG 3.48Å; R338-R342 PolarHBondContact O-N 3.44Å; T339-R342 PolarHBondContact O-N 2.96Å; V340-R342 PolarHBondContact O-N 3.18Å; R342-L346 WeakPolarHBondContact O-CB 3.47Å; R342-L346 PolarHBondContact O-N 2.97Å
343F92.8Very high91.6Very high142 Ų142100.8 Ų100.862%0.62351%0.506SS*.Hα-helixtrans-68.4-44.2176.3-84.6-68000111.5T339 V340 S345 L346 E347T339-F343 WeakPolarHBondContact O-CD2 3.47Å; T339-F343 PolarHBondContact O-N 3.15Å; V340-F343 PolarHBondContact O-N 2.99Å; F343-S345 VanDerWaalsContact C-N 3.31Å; F343-S345 PolarHBondContact O-N 3.22Å; F343-L346 PolarHBondContact O-N 3.4Å; F343-L346 VanDerWaalsContact O-N 3.13Å; F343-E347 WeakPolarHBondContact O-CB 3.43Å; F343-E347 PolarHBondContact O-N 3.27Å
344E93.3Very high91.9Very high127 Ų127102.2 Ų102.259%0.59351%0.513SS*.Hα-helixtrans-60.3-41.6174.7-73.2-174.4162.600111.5V340 L346 E347 G348V340-E344 HydrophobicContact CG1-CG 4.43Å; V340-E344 PolarHBondContact O-N 2.9Å; E344-L346 PolarHBondContact O-N 3.23Å; E344-E347 PolarHBondContact O-N 2.93Å; E344-G348 PolarHBondContact O-N 3.37Å
345S93.5Very high92.3Very high76 Ų76102 Ų10253%0.53152%0.519SS..Hα-helixtrans-63.4-40.8174.5-179.50000112.4E341 F343 R349E341-S345 WeakPolarHBondContact O-CB 3.47Å; E341-S345 PolarHBondContact O-N 2.9Å; F343-S345 VanDerWaalsContact C-N 3.31Å; F343-S345 PolarHBondContact O-N 3.22Å; S345-R349 WeakPolarHBondContact O-CG 3.32Å; S345-R349 PolarHBondContact O-N 3.2Å
346L93Very high92.9Very high79 Ų79104.4 Ų104.441%0.41452%0.521SS..Hα-helixtrans-67.4-42.7177.3-174.669.4000111.5R342 F343 E344 R349 M350R342-L346 WeakPolarHBondContact O-CB 3.47Å; R342-L346 PolarHBondContact O-N 2.97Å; F343-L346 PolarHBondContact O-N 3.4Å; F343-L346 VanDerWaalsContact O-N 3.13Å; E344-L346 PolarHBondContact O-N 3.23Å; L346-R349 WeakPolarHBondContact O-CB 3.3Å; L346-R349 PolarHBondContact O-N 3.23Å; L346-M350 HydrophobicContact CG-SD 4.48Å; L346-M350 WeakPolarHBondContact O-CG 3.37Å; L346-M350 PolarHBondContact O-N 2.96Å
347E93.6Very high93.2Very high139 Ų139104.8 Ų104.865%0.6553%0.525SS*.Hα-helixtrans-62.6-44.3176.8-173.7171.3-166.100111F343 E344 R349 M350 A351F343-E347 WeakPolarHBondContact O-CB 3.43Å; F343-E347 PolarHBondContact O-N 3.27Å; E344-E347 PolarHBondContact O-N 2.93Å; E347-R349 VanDerWaalsContact C-N 3.29Å; E347-R349 PolarHBondContact O-N 2.84Å; E347-M350 PolarHBondContact O-N 3.24Å; E347-A351 WeakPolarHBondContact O-CB 3.09Å; E347-A351 PolarHBondContact O-N 3.45Å
348G93.1Very high93.6Very high45 Ų45101.9 Ų101.946%0.46452%0.518SS..Hα-helixtrans-59.1-39.6172.800000112.8E344 S352E344-G348 PolarHBondContact O-N 3.37Å; G348-S352 WeakPolarHBondContact O-CB 3.28Å; G348-S352 PolarHBondContact O-N 3.33Å
349R96.2Very high93.8Very high147 Ų14799.6 Ų99.656%0.55552%0.517SS*.Hα-helixtrans-67.9-41.7174.1-73.8175.961.6-155.8-4.7112.5S345 L346 E347 S352 H353S345-R349 WeakPolarHBondContact O-CG 3.32Å; S345-R349 PolarHBondContact O-N 3.2Å; L346-R349 WeakPolarHBondContact O-CB 3.3Å; L346-R349 PolarHBondContact O-N 3.23Å; E347-R349 VanDerWaalsContact C-N 3.29Å; E347-R349 PolarHBondContact O-N 2.84Å; R349-S352 WeakPolarHBondContact O-CB 3.4Å; R349-S352 PolarHBondContact O-N 2.79Å; R349-H353 PolarHBondContact O-N 3Å; R349-H353 PolarHBondContact O-ND1 2.77Å
350M91.4Very high94.1Very high126 Ų126100.9 Ų100.962%0.62152%0.52SS*.Hα-helixtrans-63.9-43.4177.4-75.2-176.173.700111.2L346 E347 S352 H353 E354L346-M350 HydrophobicContact CG-SD 4.48Å; L346-M350 WeakPolarHBondContact O-CG 3.37Å; L346-M350 PolarHBondContact O-N 2.96Å; E347-M350 PolarHBondContact O-N 3.24Å; M350-S352 VanDerWaalsContact C-N 3.33Å; M350-S352 PolarHBondContact O-N 3.46Å; M350-H353 PolarHBondContact O-N 2.86Å; M350-E354 WeakPolarHBondContact O-CB 3.37Å; M350-E354 PolarHBondContact O-N 3.47Å
351A94.1Very high94.3Very high44 Ų44104 Ų10436%0.36453%0.528SS..Hα-helixtrans-61.6-40.5174.100000111.9E347 E354 I355E347-A351 WeakPolarHBondContact O-CB 3.09Å; E347-A351 PolarHBondContact O-N 3.45Å; A351-E354 PolarHBondContact O-N 3.22Å; A351-I355 WeakPolarHBondContact O-CG1 3.25Å; A351-I355 PolarHBondContact O-N 2.83Å; A351-I355 VanDerWaalsContact O-N 3.07Å
352S96.6Very high94.5Very high55 Ų55102.2 Ų102.239%0.38553%0.525SS..Hα-helixtrans-60.7-45.4173.1-1720000111.9G348 R349 M350 E354 I355 E356G348-S352 WeakPolarHBondContact O-CB 3.28Å; G348-S352 PolarHBondContact O-N 3.33Å; R349-S352 WeakPolarHBondContact O-CB 3.4Å; R349-S352 PolarHBondContact O-N 2.79Å; M350-S352 VanDerWaalsContact C-N 3.33Å; M350-S352 PolarHBondContact O-N 3.46Å; S352-E354 VanDerWaalsContact C-N 3.33Å; S352-E354 PolarHBondContact O-N 3.49Å; S352-I355 PolarHBondContact O-N 2.84Å; S352-E356 WeakPolarHBondContact O-CG 3.47Å; S352-E356 PolarHBondContact O-N 3.44Å
353H95.2Very high94.7Very high95 Ų9599.1 Ų99.144%0.4452%0.521SS..Hα-helixtrans-65.8-36.3177.8-7435.7000111.6R349 M350 E356 I357R349-H353 PolarHBondContact O-N 3Å; R349-H353 PolarHBondContact O-ND1 2.77Å; M350-H353 PolarHBondContact O-N 2.86Å; H353-E356 PolarHBondContact O-N 2.84Å; H353-I357 WeakPolarHBondContact O-CB 3.29Å; H353-I357 WeakPolarHBondContact O-CD1 3.38Å; H353-I357 WeakPolarHBondContact O-CG1 3.33Å; H353-I357 PolarHBondContact O-N 2.68Å
354E94.9Very high94.8Very high145 Ų14597 Ų9768%0.67852%0.515SS*.Hα-helixtrans-61.8-43.3175.5-173.6176.2-176.100111.6M350 A351 S352 I357 G358M350-E354 WeakPolarHBondContact O-CB 3.37Å; M350-E354 PolarHBondContact O-N 3.47Å; A351-E354 PolarHBondContact O-N 3.22Å; S352-E354 VanDerWaalsContact C-N 3.33Å; S352-E354 PolarHBondContact O-N 3.49Å; E354-I357 PolarHBondContact O-N 2.95Å; E354-G358 PolarHBondContact O-N 3.22Å
355I95.6Very high94.8Very high120 Ų12095.2 Ų95.262%0.61551%0.51SS*.Hα-helixtrans-64.7-43.3175.4-65.4165.4000111.1A351 S352 G358 T359A351-I355 WeakPolarHBondContact O-CG1 3.25Å; A351-I355 PolarHBondContact O-N 2.83Å; A351-I355 VanDerWaalsContact O-N 3.07Å; S352-I355 PolarHBondContact O-N 2.84Å; I355-G358 PolarHBondContact O-N 2.68Å; I355-T359 PolarHBondContact O-N 3.27Å; I355-T359 PolarHBondContact O-OG1 3.48Å
356E96.8Very high94.8Very high104 Ų10494.5 Ų94.549%0.48651%0.508SS..Hα-helixtrans-61.7-47.4176.6-77175.4-161.200111.5S352 H353 G358 T359 I360S352-E356 WeakPolarHBondContact O-CG 3.47Å; S352-E356 PolarHBondContact O-N 3.44Å; H353-E356 PolarHBondContact O-N 2.84Å; E356-G358 VanDerWaalsContact C-N 3.32Å; E356-G358 PolarHBondContact O-N 3.44Å; E356-T359 WeakPolarHBondContact O-CB 3.43Å; E356-T359 PolarHBondContact O-N 2.88Å; E356-T359 VanDerWaalsContact O-N 3.13Å; E356-I360 VanDerWaalsContact O-CG1 3.32Å; E356-I360 WeakPolarHBondContact O-CG1 3.41Å; E356-I360 PolarHBondContact O-N 3.46Å
357I94Very high94.9Very high113 Ų11394.8 Ų94.858%0.57951%0.513SS*.Hα-helixtrans-60.3-43.2176.5-69.5165.4000110.6H353 E354 T359 I360 F361H353-I357 WeakPolarHBondContact O-CB 3.29Å; H353-I357 WeakPolarHBondContact O-CD1 3.38Å; H353-I357 WeakPolarHBondContact O-CG1 3.33Å; H353-I357 PolarHBondContact O-N 2.68Å; E354-I357 PolarHBondContact O-N 2.95Å; I357-T359 VanDerWaalsContact C-N 3.29Å; I357-T359 PolarHBondContact O-N 3.45Å; I357-I360 PolarHBondContact O-N 3.26Å; I357-F361 PolarHBondContact O-N 3.32Å
358G96.4Very high94.9Very high36 Ų3692 Ų9237%0.37150%0.503SS..Hα-helixtrans-58.7-41.717500000112.4E354 I355 E356 F361 T362E354-G358 PolarHBondContact O-N 3.22Å; I355-G358 PolarHBondContact O-N 2.68Å; E356-G358 VanDerWaalsContact C-N 3.32Å; E356-G358 PolarHBondContact O-N 3.44Å; G358-F361 PolarHBondContact O-N 2.94Å; G358-T362 WeakPolarHBondContact O-CG2 3.44Å; G358-T362 PolarHBondContact O-N 3.23Å; G358-T362 PolarHBondContact O-OG1 3.12Å
359T95.7Very high95Very high68 Ų6893.1 Ų93.142%0.41750%0.504SS..Hα-helixtrans-69.3-37.9177.4-51.70000112.2I355 E356 I357 F361 T362 N363I355-T359 PolarHBondContact O-N 3.27Å; I355-T359 PolarHBondContact O-OG1 3.48Å; E356-T359 WeakPolarHBondContact O-CB 3.43Å; E356-T359 PolarHBondContact O-N 2.88Å; E356-T359 VanDerWaalsContact O-N 3.13Å; I357-T359 VanDerWaalsContact C-N 3.29Å; I357-T359 PolarHBondContact O-N 3.45Å; T359-F361 VanDerWaalsContact C-N 3.31Å; T359-T362 WeakPolarHBondContact CA-OG1 3.4Å; T359-T362 PolarHBondContact O-N 3.43Å; T359-T362 PolarHBondContact O-OG1 2.95Å; T359-N363 WeakPolarHBondContact O-CB 3.25Å; T359-N363 VanDerWaalsContact O-CG 3.28Å; T359-N363 PolarHBondContact O-N 2.96Å; T359-N363 VanDerWaalsContact O-N 3.08Å; T359-N363 PolarHBondContact O-ND2 2.87Å
360I94.6Very high94.9Very high96 Ų9692 Ų9249%0.49250%0.504SS..Hα-helixtrans-62.4-43.6173.4-68.8164.8000109.7E356 I357 T362 N363 I364E356-I360 VanDerWaalsContact O-CG1 3.32Å; E356-I360 WeakPolarHBondContact O-CG1 3.41Å; E356-I360 PolarHBondContact O-N 3.46Å; I357-I360 PolarHBondContact O-N 3.26Å; I360-T362 PolarHBondContact O-N 3.06Å; I360-N363 PolarHBondContact O-N 3.27Å; I360-I364 HydrophobicContact CG2-CD1 3.71Å; I360-I364 HydrophobicContact CG2-CG1 4.31Å; I360-I364 VanDerWaalsContact O-CG1 3.29Å; I360-I364 WeakPolarHBondContact O-CG1 3.36Å; I360-I364 PolarHBondContact O-N 3.47Å
361F96.5Very high95Very high142 Ų14289.4 Ų89.462%0.62350%0.496SS*.Hα-helixtrans-63.1-42.6179.6-168.3-92.1000112.5I357 G358 T359 N363 I364 N365I357-F361 PolarHBondContact O-N 3.32Å; G358-F361 PolarHBondContact O-N 2.94Å; T359-F361 VanDerWaalsContact C-N 3.31Å; F361-N363 VanDerWaalsContact C-N 3.34Å; F361-N363 PolarHBondContact O-N 2.96Å; F361-I364 PolarHBondContact O-N 3.35Å; F361-N365 WeakPolarHBondContact O-CB 3.5Å; F361-N365 PolarHBondContact O-N 3.49Å
362T95.9Very high95Very high84 Ų8493 Ų9352%0.51551%0.505SS..Hα-helixtrans-64.4-39.8176.2550000111.9G358 T359 I360 N365 A366G358-T362 WeakPolarHBondContact O-CG2 3.44Å; G358-T362 PolarHBondContact O-N 3.23Å; G358-T362 PolarHBondContact O-OG1 3.12Å; T359-T362 WeakPolarHBondContact CA-OG1 3.4Å; T359-T362 PolarHBondContact O-N 3.43Å; T359-T362 PolarHBondContact O-OG1 2.95Å; I360-T362 PolarHBondContact O-N 3.06Å; T362-N365 PolarHBondContact O-N 2.84Å; T362-A366 WeakPolarHBondContact O-CB 3.34Å; T362-A366 PolarHBondContact O-N 3.37Å
363N96.3Very high94.9Very high98 Ų9894.2 Ų94.252%0.52451%0.513SS..Hα-helixtrans-63.5-44.9174.5-72.6-20.4000111.9T359 I360 F361 N365 A366 T367T359-N363 WeakPolarHBondContact O-CB 3.25Å; T359-N363 VanDerWaalsContact O-CG 3.28Å; T359-N363 PolarHBondContact O-N 2.96Å; T359-N363 VanDerWaalsContact O-N 3.08Å; T359-N363 PolarHBondContact O-ND2 2.87Å; I360-N363 PolarHBondContact O-N 3.27Å; F361-N363 VanDerWaalsContact C-N 3.34Å; F361-N363 PolarHBondContact O-N 2.96Å; N363-N365 VanDerWaalsContact C-N 3.32Å; N363-N365 PolarHBondContact O-N 3.11Å; N363-A366 PolarHBondContact O-N 2.95Å; N363-T367 PolarHBondContact O-N 3.03Å; N363-T367 PolarHBondContact O-OG1 3.37Å
364I93.6Very high94.7Very high97 Ų9794.3 Ų94.350%0.49752%0.515SS..Hα-helixtrans-58.7-46.3175.7-70.4169.1000110.2I360 F361 A366 T367 D368I360-I364 HydrophobicContact CG2-CD1 3.71Å; I360-I364 HydrophobicContact CG2-CG1 4.31Å; I360-I364 VanDerWaalsContact O-CG1 3.29Å; I360-I364 WeakPolarHBondContact O-CG1 3.36Å; I360-I364 PolarHBondContact O-N 3.47Å; F361-I364 PolarHBondContact O-N 3.35Å; I364-A366 VanDerWaalsContact C-N 3.32Å; I364-A366 PolarHBondContact O-N 3.03Å; I364-T367 VanDerWaalsContact CA-OG1 3.3Å; I364-T367 WeakPolarHBondContact CA-OG1 3.5Å; I364-T367 PolarHBondContact O-N 3Å; I364-T367 PolarHBondContact O-OG1 3.14Å; I364-D368 PolarHBondContact O-N 3.3Å
365N93.3Very high94.5Very high91 Ų9192 Ų9249%0.48751%0.507SS..Hα-helixtrans-65.8-35.1-179.6-16449.4000112.6F361 T362 N363 S369F361-N365 WeakPolarHBondContact O-CB 3.5Å; F361-N365 PolarHBondContact O-N 3.49Å; T362-N365 PolarHBondContact O-N 2.84Å; N363-N365 VanDerWaalsContact C-N 3.32Å; N363-N365 PolarHBondContact O-N 3.11Å; N365-S369 WeakPolarHBondContact O-CB 3.35Å; N365-S369 PolarHBondContact O-N 3.11Å; N365-S369 PolarHBondContact O-OG 3.45Å
366A94.2Very high94.4Very high60 Ų6093.1 Ų93.150%0.49651%0.507SS..Hα-helixtrans-66.7-42.7172.700000111.6T362 N363 I364 S369 H370T362-A366 WeakPolarHBondContact O-CB 3.34Å; T362-A366 PolarHBondContact O-N 3.37Å; N363-A366 PolarHBondContact O-N 2.95Å; I364-A366 VanDerWaalsContact C-N 3.32Å; I364-A366 PolarHBondContact O-N 3.03Å; A366-S369 PolarHBondContact O-N 3.41Å; A366-H370 PolarHBondContact O-N 2.78Å
367T94.8Very high94.3Very high85 Ų8595.6 Ų95.652%0.52151%0.513SS..Hα-helixtrans-64.6-39.717549.40000112.2N363 I364 S369 H370 V371N363-T367 PolarHBondContact O-N 3.03Å; N363-T367 PolarHBondContact O-OG1 3.37Å; I364-T367 VanDerWaalsContact CA-OG1 3.3Å; I364-T367 WeakPolarHBondContact CA-OG1 3.5Å; I364-T367 PolarHBondContact O-N 3Å; I364-T367 PolarHBondContact O-OG1 3.14Å; T367-S369 PolarHBondContact O-N 3.13Å; T367-H370 PolarHBondContact O-N 3.2Å; T367-V371 VanDerWaalsContact O-CG2 3.32Å; T367-V371 WeakPolarHBondContact O-CG2 3.47Å; T367-V371 PolarHBondContact O-N 3.23Å
368D94.6Very high94.1Very high81 Ų8195.1 Ų95.143%0.43351%0.511SS..Hα-helixtrans-61.1-45.6175.2179.264.9000111.4I364 H370 V371 H372I364-D368 PolarHBondContact O-N 3.3Å; D368-H370 VanDerWaalsContact C-N 3.31Å; D368-H370 PolarHBondContact O-N 2.78Å; D368-V371 PolarHBondContact O-N 3.3Å; D368-H372 WeakPolarHBondContact O-CB 3.31Å; D368-H372 PolarHBondContact O-N 2.99Å; D368-H372 IonicContact OD1-ND1 2.76Å; D368-H372 IonicContact OD2-ND1 3.92Å
369S93.8Very high93.9Very high69 Ų6997.4 Ų97.448%0.48352%0.515SS..Hα-helixtrans-59.9-41.4175.4-62.50000112N365 A366 T367 H372 S373N365-S369 WeakPolarHBondContact O-CB 3.35Å; N365-S369 PolarHBondContact O-N 3.11Å; N365-S369 PolarHBondContact O-OG 3.45Å; A366-S369 PolarHBondContact O-N 3.41Å; T367-S369 PolarHBondContact O-N 3.13Å; S369-H372 PolarHBondContact O-N 3.42Å; S369-S373 PolarHBondContact O-N 3.03Å
370H94.1Very high93.7Very high122 Ų12298.8 Ų98.857%0.56552%0.52SS*.Hα-helixtrans-65.5-45.2176.8-174.2-86.9000111.8A366 T367 D368 H372 S373 M374A366-H370 PolarHBondContact O-N 2.78Å; T367-H370 PolarHBondContact O-N 3.2Å; D368-H370 VanDerWaalsContact C-N 3.31Å; D368-H370 PolarHBondContact O-N 2.78Å; H370-H372 VanDerWaalsContact C-N 3.35Å; H370-H372 PolarHBondContact O-N 3.39Å; H370-S373 WeakPolarHBondContact O-CB 3.37Å; H370-S373 PolarHBondContact O-N 2.91Å; H370-M374 PolarHBondContact CE1-SD 3.4Å; H370-M374 PolarHBondContact ND1-SD 3.29Å; H370-M374 WeakPolarHBondContact O-CG 3.42Å; H370-M374 PolarHBondContact O-N 3.01Å
371V94.1Very high93.5Very high73 Ų7396.6 Ų96.644%0.44251%0.511SS..Hα-helixtrans-61.4-43.5176.61710000110.8T367 D368 S373 M374 L375T367-V371 VanDerWaalsContact O-CG2 3.32Å; T367-V371 WeakPolarHBondContact O-CG2 3.47Å; T367-V371 PolarHBondContact O-N 3.23Å; D368-V371 PolarHBondContact O-N 3.3Å; V371-S373 VanDerWaalsContact C-N 3.32Å; V371-S373 PolarHBondContact O-N 3.43Å; V371-M374 PolarHBondContact O-N 3.18Å; V371-L375 HydrophobicContact CG1-CD1 4.11Å; V371-L375 HydrophobicContact CG1-CG 4.41Å; V371-L375 WeakPolarHBondContact O-CG 3.49Å; V371-L375 PolarHBondContact O-N 2.92Å
372H93.9Very high93.2Very high119 Ų11996.5 Ų96.555%0.55151%0.506SS*.Hα-helixtrans-58.7-42.3174.2-101.688.6000112.5D368 S369 H370 L375 K376D368-H372 WeakPolarHBondContact O-CB 3.31Å; D368-H372 PolarHBondContact O-N 2.99Å; D368-H372 IonicContact OD1-ND1 2.76Å; D368-H372 IonicContact OD2-ND1 3.92Å; S369-H372 PolarHBondContact O-N 3.42Å; H370-H372 VanDerWaalsContact C-N 3.35Å; H370-H372 PolarHBondContact O-N 3.39Å; H372-L375 PolarHBondContact O-N 2.88Å; H372-K376 PolarHBondContact O-N 2.94Å
373S94.8Very high93Very high80 Ų8097.7 Ų97.756%0.55951%0.509SS*.Hα-helixtrans-64.4-42.2175.8-175.10000112.1S369 H370 V371 K376 Y377S369-S373 PolarHBondContact O-N 3.03Å; H370-S373 WeakPolarHBondContact O-CB 3.37Å; H370-S373 PolarHBondContact O-N 2.91Å; V371-S373 VanDerWaalsContact C-N 3.32Å; V371-S373 PolarHBondContact O-N 3.43Å; S373-K376 PolarHBondContact O-N 3.04Å; S373-Y377 PolarHBondContact O-N 3.48Å
374M90.8Very high92.6Very high98 Ų9897 Ų9748%0.48351%0.512SS..Hα-helixtrans-62.6-42.9175.1-72.2-177.869.900112.2H370 V371 K376 Y377 L378H370-M374 PolarHBondContact CE1-SD 3.4Å; H370-M374 PolarHBondContact ND1-SD 3.29Å; H370-M374 WeakPolarHBondContact O-CG 3.42Å; H370-M374 PolarHBondContact O-N 3.01Å; V371-M374 PolarHBondContact O-N 3.18Å; M374-K376 VanDerWaalsContact C-N 3.33Å; M374-K376 PolarHBondContact O-N 3.24Å; M374-Y377 PolarHBondContact O-N 3.02Å; M374-L378 WeakPolarHBondContact O-CG 3.42Å; M374-L378 PolarHBondContact O-N 3.4Å
375L91.4Very high92Very high95 Ų9594.5 Ų94.550%0.49750%0.503SS..Hα-helixtrans-61-43.4176.7-74.9171.6000111.2V371 H372 Y377 L378 D379V371-L375 HydrophobicContact CG1-CD1 4.11Å; V371-L375 HydrophobicContact CG1-CG 4.41Å; V371-L375 WeakPolarHBondContact O-CG 3.49Å; V371-L375 PolarHBondContact O-N 2.92Å; H372-L375 PolarHBondContact O-N 2.88Å; L375-Y377 PolarHBondContact O-N 3.23Å; L375-L378 PolarHBondContact O-N 3.36Å; L375-D379 PolarHBondContact O-N 3.24Å
376K93.3Very high91.7Very high145 Ų14593.9 Ų93.963%0.6350%0.502SS*.Hα-helixtrans-60.8-44.9175-173.4178.5178.2-179.80112H372 S373 M374 L378 D379 D380H372-K376 PolarHBondContact O-N 2.94Å; S373-K376 PolarHBondContact O-N 3.04Å; M374-K376 VanDerWaalsContact C-N 3.33Å; M374-K376 PolarHBondContact O-N 3.24Å; K376-L378 VanDerWaalsContact C-N 3.34Å; K376-L378 PolarHBondContact O-N 3.09Å; K376-D379 PolarHBondContact O-N 3.15Å; K376-D380 PolarHBondContact O-N 3.48Å
377Y94Very high91.5Very high156 Ų15697 Ų9761%0.61251%0.51SS*.Hα-helixtrans-61.2-42.6175.7175.2-99.8000112S373 M374 L375 D379 D380 V381S373-Y377 PolarHBondContact O-N 3.48Å; M374-Y377 PolarHBondContact O-N 3.02Å; L375-Y377 PolarHBondContact O-N 3.23Å; Y377-D379 VanDerWaalsContact C-N 3.29Å; Y377-D379 PolarHBondContact O-N 3.39Å; Y377-D380 PolarHBondContact O-N 3.48Å; Y377-V381 HydrophobicContact CD1-CG2 4.14Å; Y377-V381 HydrophobicContact CD2-CG2 4.44Å; Y377-V381 HydrophobicContact CE1-CG2 3.64Å; Y377-V381 HydrophobicContact CE2-CG2 3.98Å; Y377-V381 WeakPolarHBondContact O-CG2 3.47Å; Y377-V381 PolarHBondContact O-N 2.88Å
378L90.3Very high91Very high103 Ų10394 Ų9454%0.53950%0.496SS..Hα-helixtrans-62.2-37.7175.6-75173.3000111.9M374 L375 K376 V381 R382M374-L378 WeakPolarHBondContact O-CG 3.42Å; M374-L378 PolarHBondContact O-N 3.4Å; L375-L378 PolarHBondContact O-N 3.36Å; K376-L378 VanDerWaalsContact C-N 3.34Å; K376-L378 PolarHBondContact O-N 3.09Å; L378-V381 PolarHBondContact O-N 2.66Å; L378-R382 WeakPolarHBondContact O-CB 3.4Å; L378-R382 PolarHBondContact O-N 3.22Å
379D91.3Very high90.5Very high84 Ų8495 Ų9545%0.44950%0.496SS..Hα-helixtrans-66.2-40.9174.3-102.6-32000112.5L375 K376 Y377 R382 L383L375-D379 PolarHBondContact O-N 3.24Å; K376-D379 PolarHBondContact O-N 3.15Å; Y377-D379 VanDerWaalsContact C-N 3.29Å; Y377-D379 PolarHBondContact O-N 3.39Å; D379-R382 WeakPolarHBondContact O-CB 3.32Å; D379-R382 PolarHBondContact O-N 2.96Å; D379-R382 IonicContact OD1-CZ 3.71Å; D379-R382 IonicContact OD1-NE 3.56Å; D379-R382 PolarHBondContact OD1-NE 3.42Å; D379-R382 IonicContact OD1-NH2 3.85Å; D379-R382 PolarHBondContact OD1-NH2 2.88Å; D379-L383 WeakPolarHBondContact O-CB 3.4Å; D379-L383 PolarHBondContact O-N 3.34Å
380D92.1Very high90Very high97 Ų9798 Ų9852%0.51950%0.503SS..Hα-helixtrans-63-44.6174.9-72.4-22.6000111.2K376 Y377 L383 S384K376-D380 PolarHBondContact O-N 3.48Å; Y377-D380 PolarHBondContact O-N 3.48Å; D380-L383 PolarHBondContact O-N 3.03Å; D380-S384 WeakPolarHBondContact O-CB 3.28Å; D380-S384 PolarHBondContact O-N 3.23Å
381V91.4Very high89.6Confident50 Ų5095.1 Ų95.130%0.30349%0.493SS..Hα-helixtrans-62.9-43.9175.1171.90000110.8Y377 L378 L383 S384 C385Y377-V381 HydrophobicContact CD1-CG2 4.14Å; Y377-V381 HydrophobicContact CD2-CG2 4.44Å; Y377-V381 HydrophobicContact CE1-CG2 3.64Å; Y377-V381 HydrophobicContact CE2-CG2 3.98Å; Y377-V381 WeakPolarHBondContact O-CG2 3.47Å; Y377-V381 PolarHBondContact O-N 2.88Å; L378-V381 PolarHBondContact O-N 2.66Å; V381-L383 PolarHBondContact O-N 3.43Å; V381-S384 PolarHBondContact O-N 2.91Å; V381-C385 WeakPolarHBondContact O-CB 3.48Å; V381-C385 PolarHBondContact O-N 3.33Å; V381-C385 PolarHBondContact O-SG 3.38Å
382R90.3Very high89Confident139 Ų13996.7 Ų96.753%0.52550%0.496SS..Hα-helixtrans-58.5-49.5176-178-173.46980.5-0.6110.1L378 D379 S384 C385 T386L378-R382 WeakPolarHBondContact O-CB 3.4Å; L378-R382 PolarHBondContact O-N 3.22Å; D379-R382 WeakPolarHBondContact O-CB 3.32Å; D379-R382 PolarHBondContact O-N 2.96Å; D379-R382 IonicContact OD1-CZ 3.71Å; D379-R382 IonicContact OD1-NE 3.56Å; D379-R382 PolarHBondContact OD1-NE 3.42Å; D379-R382 IonicContact OD1-NH2 3.85Å; D379-R382 PolarHBondContact OD1-NH2 2.88Å; R382-S384 PolarHBondContact O-N 3.45Å; R382-C385 PolarHBondContact O-N 2.98Å; R382-T386 WeakPolarHBondContact O-CB 3.38Å; R382-T386 PolarHBondContact O-N 3.18Å; R382-T386 PolarHBondContact O-OG1 3.41Å
383L90.3Very high88.4Confident110 Ų11093.8 Ų93.858%0.57649%0.492SS*.Hα-helixtrans-61.2-46.4-179.4-15293000111D379 D380 V381 T386 L387D379-L383 WeakPolarHBondContact O-CB 3.4Å; D379-L383 PolarHBondContact O-N 3.34Å; D380-L383 PolarHBondContact O-N 3.03Å; V381-L383 PolarHBondContact O-N 3.43Å; L383-T386 PolarHBondContact O-N 3.48Å; L383-L387 WeakPolarHBondContact O-CB 3.41Å; L383-L387 PolarHBondContact O-N 2.94Å
384S88.6Confident88Confident84 Ų8494.4 Ų94.459%0.58749%0.486SS*.Hα-helixtrans-61-45.9177.6-174.10000112D380 V381 R382 T386 L387 G388D380-S384 WeakPolarHBondContact O-CB 3.28Å; D380-S384 PolarHBondContact O-N 3.23Å; V381-S384 PolarHBondContact O-N 2.91Å; R382-S384 PolarHBondContact O-N 3.45Å; S384-T386 PolarHBondContact O-N 3.22Å; S384-L387 PolarHBondContact O-N 3.48Å; S384-G388 PolarHBondContact O-N 3.49Å
385C80.3Confident87.8Confident44 Ų4495.4 Ų95.430%0.29749%0.49SS..Hα-helixtrans-62.7-42.6175.4-71.10000111.6V381 R382 L387 G388 F389V381-C385 WeakPolarHBondContact O-CB 3.48Å; V381-C385 PolarHBondContact O-N 3.33Å; V381-C385 PolarHBondContact O-SG 3.38Å; R382-C385 PolarHBondContact O-N 2.98Å; C385-L387 VanDerWaalsContact C-N 3.34Å; C385-L387 PolarHBondContact O-N 3.4Å; C385-G388 PolarHBondContact O-N 2.99Å; C385-F389 HydrophobicContact CB-CD2 4.36Å; C385-F389 HydrophobicContact CB-CE2 4.14Å; C385-F389 WeakPolarHBondContact O-CB 3.18Å; C385-F389 WeakPolarHBondContact O-CD2 3.43Å; C385-F389 WeakPolarHBondContact O-CG 3.27Å; C385-F389 PolarHBondContact O-N 3.35Å
386T87.8Confident87.2Confident77 Ų7794.7 Ų94.747%0.47249%0.486SS..Hα-helixtrans-64.2-42.7-179.3-43.50000110.8R382 L383 S384 H390R382-T386 WeakPolarHBondContact O-CB 3.38Å; R382-T386 PolarHBondContact O-N 3.18Å; R382-T386 PolarHBondContact O-OG1 3.41Å; L383-T386 PolarHBondContact O-N 3.48Å; S384-T386 PolarHBondContact O-N 3.22Å; T386-H390 PolarHBondContact O-N 2.95Å
387L89.2Confident86.8Confident126 Ų12694.8 Ų94.866%0.6648%0.483SS*.Hα-helixtrans-63.9-47.2175.6-158.892.2000111L383 S384 C385 F389 H390 T391L383-L387 WeakPolarHBondContact O-CB 3.41Å; L383-L387 PolarHBondContact O-N 2.94Å; S384-L387 PolarHBondContact O-N 3.48Å; C385-L387 VanDerWaalsContact C-N 3.34Å; C385-L387 PolarHBondContact O-N 3.4Å; L387-F389 PolarHBondContact O-N 2.92Å; L387-H390 WeakPolarHBondContact O-CB 3.35Å; L387-H390 PolarHBondContact O-N 3.25Å; L387-H390 VanDerWaalsContact O-N 3.15Å; L387-T391 PolarHBondContact O-N 2.84Å; L387-T391 PolarHBondContact O-OG1 2.87Å
388G85.2Confident86.3Confident22 Ų2293.5 Ų93.523%0.22748%0.478CS..Hα-helixtrans-62.1-40.1178.200000113.3S384 C385 H390 T391 H392S384-G388 PolarHBondContact O-N 3.49Å; C385-G388 PolarHBondContact O-N 2.99Å; G388-H390 VanDerWaalsContact C-N 3.33Å; G388-H390 PolarHBondContact O-N 2.83Å; G388-T391 WeakPolarHBondContact CA-OG1 3.27Å; G388-T391 PolarHBondContact O-N 3.29Å; G388-T391 PolarHBondContact O-OG1 2.75Å; G388-H392 WeakPolarHBondContact O-CB 3.49Å; G388-H392 PolarHBondContact O-CD2 2.95Å; G388-H392 PolarHBondContact O-N 3.06Å
389F82.9Confident85.9Confident102 Ų10292.4 Ų92.445%0.44747%0.473SS..Hα-helixtrans-65.6-37.2174-74.7-49000112C385 L387 A393C385-F389 HydrophobicContact CB-CD2 4.36Å; C385-F389 HydrophobicContact CB-CE2 4.14Å; C385-F389 WeakPolarHBondContact O-CB 3.18Å; C385-F389 WeakPolarHBondContact O-CD2 3.43Å; C385-F389 WeakPolarHBondContact O-CG 3.27Å; C385-F389 PolarHBondContact O-N 3.35Å; L387-F389 PolarHBondContact O-N 2.92Å; F389-A393 VanDerWaalsContact O-CB 3.26Å; F389-A393 WeakPolarHBondContact O-CB 3.29Å; F389-A393 PolarHBondContact O-N 3.11Å
390H84.2Confident85.4Confident132 Ų13293.2 Ų93.261%0.61148%0.477SS*.Hα-helixtrans-64-46.6176.1-167.669.8000111.5T386 L387 G388 H392 A393 E394T386-H390 PolarHBondContact O-N 2.95Å; L387-H390 WeakPolarHBondContact O-CB 3.35Å; L387-H390 PolarHBondContact O-N 3.25Å; L387-H390 VanDerWaalsContact O-N 3.15Å; G388-H390 VanDerWaalsContact C-N 3.33Å; G388-H390 PolarHBondContact O-N 2.83Å; H390-H392 PolarHBondContact O-N 2.69Å; H390-A393 PolarHBondContact O-N 3.36Å; H390-E394 PolarHBondContact O-N 2.96Å
391T84.9Confident85.1Confident61 Ų6193.9 Ų93.937%0.37448%0.476SS..Hα-helixtrans-62.2-43.8177.551.80000111.7L387 G388 A393 E394 E395L387-T391 PolarHBondContact O-N 2.84Å; L387-T391 PolarHBondContact O-OG1 2.87Å; G388-T391 WeakPolarHBondContact CA-OG1 3.27Å; G388-T391 PolarHBondContact O-N 3.29Å; G388-T391 PolarHBondContact O-OG1 2.75Å; T391-A393 PolarHBondContact O-N 3.46Å; T391-E394 WeakPolarHBondContact O-CB 3.42Å; T391-E394 PolarHBondContact O-N 3.4Å; T391-E395 WeakPolarHBondContact O-CG 3.47Å; T391-E395 PolarHBondContact O-N 2.86Å
392H82.7Confident84.6Confident107 Ų10794.7 Ų94.750%0.49548%0.483SS..Hα-helixtrans-67.8-34.6177.3-70.4-40.4000113.1G388 H390 E394 E395 L396G388-H392 WeakPolarHBondContact O-CB 3.49Å; G388-H392 PolarHBondContact O-CD2 2.95Å; G388-H392 PolarHBondContact O-N 3.06Å; H390-H392 PolarHBondContact O-N 2.69Å; H392-E394 VanDerWaalsContact C-N 3.31Å; H392-E395 IonicContact CE1-OE2 3.21Å; H392-E395 IonicContact ND1-OE2 2.98Å; H392-E395 PolarHBondContact ND1-OE2 3.21Å; H392-E395 PolarHBondContact O-N 2.98Å; H392-L396 WeakPolarHBondContact O-CB 3.35Å; H392-L396 PolarHBondContact O-N 3.49Å
393A81.2Confident84.1Confident57 Ų5790.2 Ų90.247%0.47147%0.471SS..Hα-helixtrans-64.3-39.3173.900000111.5F389 H390 T391 L396 Y397F389-A393 VanDerWaalsContact O-CB 3.26Å; F389-A393 WeakPolarHBondContact O-CB 3.29Å; F389-A393 PolarHBondContact O-N 3.11Å; H390-A393 PolarHBondContact O-N 3.36Å; T391-A393 PolarHBondContact O-N 3.46Å; A393-L396 PolarHBondContact O-N 2.91Å; A393-Y397 WeakPolarHBondContact O-CB 3.37Å; A393-Y397 PolarHBondContact O-N 3.3Å
394E86.8Confident83.7Confident93 Ų9388 Ų8844%0.43547%0.465SS..Hα-helixtrans-65.3-45.4174.6-174.6172.3-158.500111.6H390 T391 H392 L396 Y397 Y398H390-E394 PolarHBondContact O-N 2.96Å; T391-E394 WeakPolarHBondContact O-CB 3.42Å; T391-E394 PolarHBondContact O-N 3.4Å; H392-E394 VanDerWaalsContact C-N 3.31Å; E394-L396 PolarHBondContact O-N 3.33Å; E394-Y397 WeakPolarHBondContact O-CB 3.33Å; E394-Y397 PolarHBondContact O-N 3.04Å; E394-Y398 HydrophobicContact CG-CD2 3.89Å; E394-Y398 HydrophobicContact CG-CE2 3.53Å; E394-Y398 WeakPolarHBondContact O-CD2 3.3Å; E394-Y398 PolarHBondContact O-N 3.49Å
395E85.3Confident83.5Confident119 Ų11989 Ų8956%0.55646%0.462SS*.Hα-helixtrans-59.3-44.8174-72178.1153.500112.3T391 H392 Y397 Y398 L399T391-E395 WeakPolarHBondContact O-CG 3.47Å; T391-E395 PolarHBondContact O-N 2.86Å; H392-E395 IonicContact CE1-OE2 3.21Å; H392-E395 IonicContact ND1-OE2 2.98Å; H392-E395 PolarHBondContact ND1-OE2 3.21Å; H392-E395 PolarHBondContact O-N 2.98Å; E395-Y397 VanDerWaalsContact C-N 3.31Å; E395-Y397 PolarHBondContact O-N 3.35Å; E395-Y398 PolarHBondContact O-N 3.24Å; E395-L399 WeakPolarHBondContact O-CB 3.39Å; E395-L399 PolarHBondContact O-N 2.97Å
396L79.7Confident83.2Confident81 Ų8191.2 Ų91.242%0.42447%0.47SS..Hα-helixtrans-61.3-39.1175.3-89.9156.8000112H392 A393 E394 L399 N400H392-L396 WeakPolarHBondContact O-CB 3.35Å; H392-L396 PolarHBondContact O-N 3.49Å; A393-L396 PolarHBondContact O-N 2.91Å; E394-L396 PolarHBondContact O-N 3.33Å; L396-L399 PolarHBondContact O-N 3.39Å; L396-N400 WeakPolarHBondContact O-CB 3.37Å; L396-N400 PolarHBondContact O-N 2.91Å
397Y84.9Confident82.8Confident146 Ų14692 Ų9257%0.57347%0.471SS*.Hα-helixtrans-62.4-46.7175.1172.9-99.2000111.5A393 E394 E395 N400 K401A393-Y397 WeakPolarHBondContact O-CB 3.37Å; A393-Y397 PolarHBondContact O-N 3.3Å; E394-Y397 WeakPolarHBondContact O-CB 3.33Å; E394-Y397 PolarHBondContact O-N 3.04Å; E395-Y397 VanDerWaalsContact C-N 3.31Å; E395-Y397 PolarHBondContact O-N 3.35Å; Y397-N400 PolarHBondContact O-N 3.11Å; Y397-K401 PolarHBondContact O-N 2.98Å
398Y82.9Confident82.4Confident129 Ų12988.1 Ų88.151%0.50646%0.461SS..Hα-helixtrans-65.8-38.4176.4-76.7-65.5000112.9E394 E395 K401 S402E394-Y398 HydrophobicContact CG-CD2 3.89Å; E394-Y398 HydrophobicContact CG-CE2 3.53Å; E394-Y398 WeakPolarHBondContact O-CD2 3.3Å; E394-Y398 PolarHBondContact O-N 3.49Å; E395-Y398 PolarHBondContact O-N 3.24Å; Y398-K401 PolarHBondContact O-N 2.95Å; Y398-S402 PolarHBondContact O-N 3.02Å; Y398-S402 PolarHBondContact O-OG 2.88Å
399L81.7Confident82.2Confident80 Ų8090.5 Ų90.542%0.41947%0.471SS..Hα-helixtrans-62.9-47.3175.1-175.866.9000110.9E395 L396 K401 S402 V403E395-L399 WeakPolarHBondContact O-CB 3.39Å; E395-L399 PolarHBondContact O-N 2.97Å; L396-L399 PolarHBondContact O-N 3.39Å; L399-K401 VanDerWaalsContact C-N 3.27Å; L399-K401 PolarHBondContact O-N 3.27Å; L399-S402 WeakPolarHBondContact O-CB 3.27Å; L399-S402 PolarHBondContact O-N 3.33Å; L399-S402 VanDerWaalsContact O-N 3.11Å; L399-V403 HydrophobicContact CG-CG2 4.48Å; L399-V403 WeakPolarHBondContact O-CG2 3.43Å; L399-V403 PolarHBondContact O-N 3.41Å
400N81.3Confident81.9Confident102 Ų10288.4 Ų88.455%0.54547%0.467SS..Hα-helixtrans-60.3-39.1177.9-17435.5000111.9L396 Y397 V403 S404L396-N400 WeakPolarHBondContact O-CB 3.37Å; L396-N400 PolarHBondContact O-N 2.91Å; Y397-N400 PolarHBondContact O-N 3.11Å; N400-V403 PolarHBondContact O-N 3.22Å; N400-S404 WeakPolarHBondContact O-CB 3.46Å; N400-S404 PolarHBondContact O-N 2.99Å; N400-S404 PolarHBondContact O-OG 3.33Å
401K84.6Confident81.8Confident111 Ų11185.9 Ų85.948%0.48346%0.458SS..Hα-helixtrans-62.5-45.3173.7-171.3175.2-178.3178.30111.7Y397 Y398 L399 S404 I405Y397-K401 PolarHBondContact O-N 2.98Å; Y398-K401 PolarHBondContact O-N 2.95Å; L399-K401 VanDerWaalsContact C-N 3.27Å; L399-K401 PolarHBondContact O-N 3.27Å; K401-S404 WeakPolarHBondContact O-CB 3.48Å; K401-S404 PolarHBondContact O-N 3.49Å; K401-I405 HydrophobicContact CG-CD1 4.41Å; K401-I405 WeakPolarHBondContact O-CG1 3.42Å; K401-I405 PolarHBondContact O-N 3.08Å
402S81.6Confident81.7Confident66 Ų6687.4 Ų87.446%0.46246%0.463SS..Hα-helixtrans-64.2-42.9177.6-62.40000112.4Y398 L399 S404 I405 M406Y398-S402 PolarHBondContact O-N 3.02Å; Y398-S402 PolarHBondContact O-OG 2.88Å; L399-S402 WeakPolarHBondContact O-CB 3.27Å; L399-S402 PolarHBondContact O-N 3.33Å; L399-S402 VanDerWaalsContact O-N 3.11Å; S402-S404 VanDerWaalsContact C-N 3.33Å; S402-S404 PolarHBondContact O-N 3.49Å; S402-I405 PolarHBondContact O-N 2.76Å; S402-M406 PolarHBondContact O-N 2.93Å
403V79.7Confident81.5Confident45 Ų4586.8 Ų86.827%0.27346%0.463SS..Hα-helixtrans-62.1-40.9174.8171.40000111L399 N400 I405 M406 L407L399-V403 HydrophobicContact CG-CG2 4.48Å; L399-V403 WeakPolarHBondContact O-CG2 3.43Å; L399-V403 PolarHBondContact O-N 3.41Å; N400-V403 PolarHBondContact O-N 3.22Å; V403-I405 VanDerWaalsContact C-N 3.34Å; V403-I405 PolarHBondContact O-N 3.46Å; V403-M406 WeakPolarHBondContact O-CB 3.49Å; V403-M406 PolarHBondContact O-N 3.1Å; V403-L407 HydrophobicContact CG1-CD1 4.13Å; V403-L407 HydrophobicContact CG1-CG 4.48Å; V403-L407 WeakPolarHBondContact O-CG 3.45Å; V403-L407 PolarHBondContact O-N 2.61Å
404S82Confident81.4Confident64 Ų6491.2 Ų91.245%0.44847%0.467SS..Hα-helixtrans-62.5-40.6176.3-62.90000112.3N400 K401 S402 L407 G408N400-S404 WeakPolarHBondContact O-CB 3.46Å; N400-S404 PolarHBondContact O-N 2.99Å; N400-S404 PolarHBondContact O-OG 3.33Å; K401-S404 WeakPolarHBondContact O-CB 3.48Å; K401-S404 PolarHBondContact O-N 3.49Å; S402-S404 VanDerWaalsContact C-N 3.33Å; S402-S404 PolarHBondContact O-N 3.49Å; S404-L407 PolarHBondContact O-N 2.86Å; S404-G408 PolarHBondContact O-N 2.91Å; S404-G408 VanDerWaalsContact O-N 3.12Å
405I84.3Confident81.2Confident104 Ų10492.3 Ų92.353%0.53347%0.473SS..Hα-helixtrans-64.5-45.1175.3-66.8164.9000110.4K401 S402 V403 L407 G408 T409K401-I405 HydrophobicContact CG-CD1 4.41Å; K401-I405 WeakPolarHBondContact O-CG1 3.42Å; K401-I405 PolarHBondContact O-N 3.08Å; S402-I405 PolarHBondContact O-N 2.76Å; V403-I405 VanDerWaalsContact C-N 3.34Å; V403-I405 PolarHBondContact O-N 3.46Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.41Å; I405-G408 PolarHBondContact O-N 3.45Å; I405-T409 PolarHBondContact O-N 3.28Å; I405-T409 PolarHBondContact O-OG1 3.1Å
406M73.8Confident81Confident91 Ų9195.3 Ų95.345%0.44848%0.479SS..Hα-helixtrans-60-40.3176.2-81.1-108.9-66.700113M171 S402 V403 T409 T410M171-M406 HydrophobicContact SD-CE 4.36Å; S402-M406 PolarHBondContact O-N 2.93Å; V403-M406 WeakPolarHBondContact O-CB 3.49Å; V403-M406 PolarHBondContact O-N 3.1Å; M406-T409 WeakPolarHBondContact CA-OG1 3.34Å; M406-T409 PolarHBondContact O-N 3.47Å; M406-T409 PolarHBondContact O-OG1 2.94Å; M406-T410 WeakPolarHBondContact O-CB 3.46Å; M406-T410 PolarHBondContact O-N 3.31Å; M406-T410 PolarHBondContact O-OG1 3.46Å
407L79.3Confident81Confident94 Ų9497.5 Ų97.549%0.49249%0.485SS..Hα-helixtrans-62.4-45.9175.3-75.6168.3000110.8V403 S404 I405 T409 T410 D411V403-L407 HydrophobicContact CG1-CD1 4.13Å; V403-L407 HydrophobicContact CG1-CG 4.48Å; V403-L407 WeakPolarHBondContact O-CG 3.45Å; V403-L407 PolarHBondContact O-N 2.61Å; S404-L407 PolarHBondContact O-N 2.86Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.41Å; L407-T409 PolarHBondContact O-N 2.88Å; L407-T410 PolarHBondContact O-N 2.93Å; L407-D411 PolarHBondContact O-N 3.28Å
408G81.9Confident81Confident44 Ų4493.8 Ų93.845%0.45448%0.481SS..Hα-helixtrans-61.2-41.3177.400000113.7S404 I405 L412S404-G408 PolarHBondContact O-N 2.91Å; S404-G408 VanDerWaalsContact O-N 3.12Å; I405-G408 PolarHBondContact O-N 3.45Å; G408-L412 PolarHBondContact O-N 2.99Å
409T79.7Confident81.1Confident72 Ų7292.9 Ų92.944%0.44248%0.484SS..Hα-helixtrans-69.5-36175.955.90000112.2I405 M406 L407 L412 L413I405-T409 PolarHBondContact O-N 3.28Å; I405-T409 PolarHBondContact O-OG1 3.1Å; M406-T409 WeakPolarHBondContact CA-OG1 3.34Å; M406-T409 PolarHBondContact O-N 3.47Å; M406-T409 PolarHBondContact O-OG1 2.94Å; L407-T409 PolarHBondContact O-N 2.88Å; T409-L412 PolarHBondContact O-N 3.47Å; T409-L413 WeakPolarHBondContact O-CB 3.22Å; T409-L413 PolarHBondContact O-N 2.69Å
410T76.9Confident81.1Confident58 Ų5894.2 Ų94.236%0.35649%0.491SS..Hα-helixtrans-64.7-41.1176.3-55.50000111.5M406 L407 L413 R414M406-T410 WeakPolarHBondContact O-CB 3.46Å; M406-T410 PolarHBondContact O-N 3.31Å; M406-T410 PolarHBondContact O-OG1 3.46Å; L407-T410 PolarHBondContact O-N 2.93Å; T410-L413 PolarHBondContact O-N 3.35Å; T410-R414 WeakPolarHBondContact O-CB 3.17Å; T410-R414 PolarHBondContact O-N 2.85Å
411D82.6Confident81.2Confident80 Ų8091.8 Ų91.843%0.42848%0.482SS..Hα-helixtrans-64.6-42.4176.7-71.9-21.7000111.6L407 L413 R414 E415L407-D411 PolarHBondContact O-N 3.28Å; D411-L413 VanDerWaalsContact C-N 3.34Å; D411-L413 PolarHBondContact O-N 3.25Å; D411-R414 WeakPolarHBondContact O-CB 3.32Å; D411-R414 PolarHBondContact O-N 3.37Å; D411-R414 IonicContact OD1-CZ 3.84Å; D411-R414 IonicContact OD1-NH1 3.51Å; D411-R414 PolarHBondContact OD1-NH1 3.47Å; D411-R414 IonicContact OD1-NH2 3.02Å; D411-E415 PolarHBondContact O-N 2.95Å
412L83.1Confident81.2Confident92 Ų9289.3 Ų89.348%0.48248%0.482SS..Hα-helixtrans-61.9-40.8174.4-175.469.9000112.3G408 T409 E415 R416G408-L412 PolarHBondContact O-N 2.99Å; T409-L412 PolarHBondContact O-N 3.47Å; L412-E415 PolarHBondContact O-N 3.29Å; L412-R416 WeakPolarHBondContact O-CG 3.48Å; L412-R416 PolarHBondContact O-N 3.32Å
413L79.2Confident81.2Confident95 Ų9594.1 Ų94.150%0.49749%0.49SS..Hα-helixtrans-64-41.9175.2-110.4142000111.5T409 T410 D411 E415 R416 F417T409-L413 WeakPolarHBondContact O-CB 3.22Å; T409-L413 PolarHBondContact O-N 2.69Å; T410-L413 PolarHBondContact O-N 3.35Å; D411-L413 VanDerWaalsContact C-N 3.34Å; D411-L413 PolarHBondContact O-N 3.25Å; L413-E415 VanDerWaalsContact C-N 3.35Å; L413-R416 PolarHBondContact O-N 3.46Å; L413-F417 WeakPolarHBondContact O-CB 3.47Å; L413-F417 PolarHBondContact O-N 2.92Å
414R77.9Confident81.2Confident149 Ų14997.1 Ų97.156%0.56250%0.504SS*.Hα-helixtrans-62.3-42.6176.4-166.7-178.3-57.8121.38.5111.5T410 D411 F417 S418T410-R414 WeakPolarHBondContact O-CB 3.17Å; T410-R414 PolarHBondContact O-N 2.85Å; D411-R414 WeakPolarHBondContact O-CB 3.32Å; D411-R414 PolarHBondContact O-N 3.37Å; D411-R414 IonicContact OD1-CZ 3.84Å; D411-R414 IonicContact OD1-NH1 3.51Å; D411-R414 PolarHBondContact OD1-NH1 3.47Å; D411-R414 IonicContact OD1-NH2 3.02Å; R414-F417 PolarHBondContact O-N 3.36Å; R414-S418 WeakPolarHBondContact O-CB 3.39Å; R414-S418 PolarHBondContact O-N 3.44Å
415E83.8Confident81.3Confident117 Ų11798 Ų9855%0.54750%0.504SS..Hα-helixtrans-60.4-49.5175.2-170.8-177.4-178.600111D411 L412 L413 F417 S418 L419D411-E415 PolarHBondContact O-N 2.95Å; L412-E415 PolarHBondContact O-N 3.29Å; L413-E415 VanDerWaalsContact C-N 3.35Å; E415-F417 PolarHBondContact O-N 2.96Å; E415-S418 PolarHBondContact O-N 3.42Å; E415-S418 PolarHBondContact O-OG 2.93Å; E415-L419 PolarHBondContact O-N 3.24Å; E415-L419 VanDerWaalsContact O-N 3.09Å
416R79.9Confident81.5Confident181 Ų18197.6 Ų97.668%0.68350%0.502SS*.Hα-helixtrans-61.4-41.5177.5-73.6-173176.7-116.10.4113.1L412 L413 L419 L420L412-R416 WeakPolarHBondContact O-CG 3.48Å; L412-R416 PolarHBondContact O-N 3.32Å; L413-R416 PolarHBondContact O-N 3.46Å; R416-L419 WeakPolarHBondContact O-CB 3.3Å; R416-L419 PolarHBondContact O-N 2.98Å; R416-L420 PolarHBondContact O-N 3.18Å
417F80.1Confident81.8Confident128 Ų12897.4 Ų97.456%0.56150%0.503SS*.Hα-helixtrans-63-42.5176.5-178.3-95.9000111.6L413 R414 E415 L419 L420 S421L413-F417 WeakPolarHBondContact O-CB 3.47Å; L413-F417 PolarHBondContact O-N 2.92Å; R414-F417 PolarHBondContact O-N 3.36Å; E415-F417 PolarHBondContact O-N 2.96Å; F417-L419 VanDerWaalsContact C-N 3.31Å; F417-L419 PolarHBondContact O-N 3.39Å; F417-L420 PolarHBondContact O-N 3.33Å; F417-S421 WeakPolarHBondContact O-CB 3.47Å; F417-S421 PolarHBondContact O-N 2.91Å
418S84.5Confident82Confident68 Ų6897 Ų9748%0.47651%0.505SS..Hα-helixtrans-61.3-40177.374.90000112.4R414 E415 S421 A422R414-S418 WeakPolarHBondContact O-CB 3.39Å; R414-S418 PolarHBondContact O-N 3.44Å; E415-S418 PolarHBondContact O-N 3.42Å; E415-S418 PolarHBondContact O-OG 2.93Å; S418-S421 PolarHBondContact O-N 2.99Å; S418-A422 WeakPolarHBondContact O-CB 3.25Å; S418-A422 PolarHBondContact O-N 3.01Å
419L85.9Confident82.2Confident110 Ų110103 Ų10358%0.57651%0.514SS*.Hα-helixtrans-64.5-43.7174.9-107.4160.4000112.4E415 R416 F417 A422 R423E415-L419 PolarHBondContact O-N 3.24Å; E415-L419 VanDerWaalsContact O-N 3.09Å; R416-L419 WeakPolarHBondContact O-CB 3.3Å; R416-L419 PolarHBondContact O-N 2.98Å; F417-L419 VanDerWaalsContact C-N 3.31Å; F417-L419 PolarHBondContact O-N 3.39Å; L419-A422 PolarHBondContact O-N 2.97Å; L419-R423 PolarHBondContact O-N 2.86Å; L419-R423 VanDerWaalsContact O-N 3.1Å
420L81.6Confident82.6Confident108 Ų108103.1 Ų103.157%0.56551%0.511SS*.Hα-helixtrans-65.3-43.7177.8-168.175000111.2R416 F417 A422 R423 L424R416-L420 PolarHBondContact O-N 3.18Å; F417-L420 PolarHBondContact O-N 3.33Å; L420-A422 PolarHBondContact O-N 3.14Å; L420-R423 PolarHBondContact O-N 3.38Å; L420-L424 PolarHBondContact O-N 3.2Å
421S82.3Confident82.8Confident50 Ų50105.6 Ų105.635%0.3552%0.522SS..Hα-helixtrans-60.1-45176.7-167.60000111.5F417 S418 R423 L424 D425F417-S421 WeakPolarHBondContact O-CB 3.47Å; F417-S421 PolarHBondContact O-N 2.91Å; S418-S421 PolarHBondContact O-N 2.99Å; S421-R423 VanDerWaalsContact C-N 3.3Å; S421-R423 PolarHBondContact O-N 3.46Å; S421-L424 PolarHBondContact O-N 3.3Å; S421-D425 PolarHBondContact O-N 3.37Å
422A84.1Confident82.9Confident60 Ų60105.1 Ų105.150%0.49653%0.525SS..Hα-helixtrans-62.4-37.3177.100000112.5S418 L419 L420 L426S418-A422 WeakPolarHBondContact O-CB 3.25Å; S418-A422 PolarHBondContact O-N 3.01Å; L419-A422 PolarHBondContact O-N 2.97Å; L420-A422 PolarHBondContact O-N 3.14Å; A422-L426 PolarHBondContact O-N 3.4Å; A422-L426 VanDerWaalsContact O-N 3.15Å
423R83.3Confident83Confident166 Ų166106.4 Ų106.463%0.62653%0.53SS*.Hα-helixtrans-67.4-41.4175.1-175.8178.9-67-164.8-1.8111.9L419 L420 S421 L426 N427L419-R423 PolarHBondContact O-N 2.86Å; L419-R423 VanDerWaalsContact O-N 3.1Å; L420-R423 PolarHBondContact O-N 3.38Å; S421-R423 VanDerWaalsContact C-N 3.3Å; S421-R423 PolarHBondContact O-N 3.46Å; R423-L426 PolarHBondContact O-N 3.02Å; R423-N427 PolarHBondContact O-N 3.38Å; R423-N427 PolarHBondContact O-ND2 2.92Å
424L79.8Confident83.4Confident108 Ų108107 Ų10757%0.56553%0.532SS*.Hα-helixtrans-62-46.6176.9-176.164.2000110.9L420 S421 L426 N427 V428L420-L424 PolarHBondContact O-N 3.2Å; S421-L424 PolarHBondContact O-N 3.3Å; L424-L426 VanDerWaalsContact C-N 3.28Å; L424-L426 PolarHBondContact O-N 3.04Å; L424-N427 PolarHBondContact O-N 3.28Å; L424-N427 VanDerWaalsContact O-N 3.11Å; L424-V428 HydrophobicContact CD1-CG2 4.47Å; L424-V428 HydrophobicContact CG-CG2 4.45Å; L424-V428 WeakPolarHBondContact O-CG2 3.26Å; L424-V428 PolarHBondContact O-N 3.42Å
425D83.4Confident83.5Confident83 Ų83103.8 Ų103.844%0.44453%0.529SS..Hα-helixtrans-57.7-40.8176.3-81.7-10.8000112.3S421 R429S421-D425 PolarHBondContact O-N 3.37Å; D425-R429 VanDerWaalsContact O-CG 3.3Å; D425-R429 WeakPolarHBondContact O-CG 3.45Å; D425-R429 PolarHBondContact O-N 2.94Å
426L87.6Confident83.6Confident95 Ų95103.1 Ų103.150%0.49753%0.526SS..Hα-helixtrans-63-45.6175.6-17570.3000111.6A422 R423 L424 R429 N430A422-L426 PolarHBondContact O-N 3.4Å; A422-L426 VanDerWaalsContact O-N 3.15Å; R423-L426 PolarHBondContact O-N 3.02Å; L424-L426 VanDerWaalsContact C-N 3.28Å; L424-L426 PolarHBondContact O-N 3.04Å; L426-R429 PolarHBondContact O-N 3.47Å; L426-N430 PolarHBondContact O-N 3.29Å
427N80.8Confident83.9Confident87 Ų87100.4 Ų100.447%0.46552%0.521SS..Hα-helixtrans-65.1-40.4179.3-71.8-24000112.1R423 L424 R429 N430 L431R423-N427 PolarHBondContact O-N 3.38Å; R423-N427 PolarHBondContact O-ND2 2.92Å; L424-N427 PolarHBondContact O-N 3.28Å; L424-N427 VanDerWaalsContact O-N 3.11Å; N427-R429 VanDerWaalsContact C-N 3.33Å; N427-R429 PolarHBondContact O-N 2.9Å; N427-N430 PolarHBondContact O-N 3.43Å; N427-L431 PolarHBondContact O-N 2.79Å
428V83.4Confident83.7Confident87 Ų87101 Ų10153%0.52753%0.527SS..Hα-helixtrans-62.2-42175.3171.70000110.7L424 L431 S432L424-V428 HydrophobicContact CD1-CG2 4.47Å; L424-V428 HydrophobicContact CG-CG2 4.45Å; L424-V428 WeakPolarHBondContact O-CG2 3.26Å; L424-V428 PolarHBondContact O-N 3.42Å; V428-L431 PolarHBondContact O-N 3.25Å; V428-S432 WeakPolarHBondContact O-CB 3.42Å; V428-S432 PolarHBondContact O-N 3.06Å
429R85.6Confident83.6Confident170 Ų170103.6 Ų103.664%0.64253%0.53SS*.Hα-helixtrans-62.6-43.7174.4-73.1174.2-172.7163.86.1112.3D425 L426 N427 S432 M433D425-R429 VanDerWaalsContact O-CG 3.3Å; D425-R429 WeakPolarHBondContact O-CG 3.45Å; D425-R429 PolarHBondContact O-N 2.94Å; L426-R429 PolarHBondContact O-N 3.47Å; N427-R429 VanDerWaalsContact C-N 3.33Å; N427-R429 PolarHBondContact O-N 2.9Å; R429-S432 PolarHBondContact O-N 2.84Å; R429-M433 PolarHBondContact O-N 3.44Å
430N88Confident83.5Confident74 Ų74100.7 Ų100.740%0.39652%0.522SS..Hα-helixtrans-62.1-43.4176.9-73.1-11.4000111.6L426 N427 M433 I434L426-N430 PolarHBondContact O-N 3.29Å; N427-N430 PolarHBondContact O-N 3.43Å; N430-M433 WeakPolarHBondContact O-CB 3.48Å; N430-M433 PolarHBondContact O-N 3.41Å; N430-I434 WeakPolarHBondContact O-CG1 3.24Å; N430-I434 PolarHBondContact O-N 3.22Å
431L81.2Confident83.6Confident110 Ų11098.7 Ų98.758%0.57651%0.514SS*.Hα-helixtrans-64.7-42.5177.1-16967.9000111.3N427 V428 M433 I434 V435N427-L431 PolarHBondContact O-N 2.79Å; V428-L431 PolarHBondContact O-N 3.25Å; L431-M433 VanDerWaalsContact C-N 3.26Å; L431-M433 PolarHBondContact O-N 3.24Å; L431-I434 PolarHBondContact O-N 3.18Å; L431-V435 VanDerWaalsContact O-CG2 3.31Å; L431-V435 WeakPolarHBondContact O-CG2 3.22Å; L431-V435 PolarHBondContact O-N 2.91Å
432S85.3Confident83.5Confident69 Ų69100.7 Ų100.748%0.48352%0.521SS..Hα-helixtrans-59.3-37.6174.7-171.70000112.1V428 R429 V435 E436V428-S432 WeakPolarHBondContact O-CB 3.42Å; V428-S432 PolarHBondContact O-N 3.06Å; R429-S432 PolarHBondContact O-N 2.84Å; S432-V435 PolarHBondContact O-N 3.32Å; S432-E436 PolarHBondContact O-N 3.04Å; S432-E436 VanDerWaalsContact O-N 3.11Å
433M86.3Confident83.3Confident120 Ų120101.9 Ų101.959%0.59152%0.522SS*.Hα-helixtrans-64.5-47.9175.2-173.1-174.8-60.400111R429 N430 L431 V435 E436 E437R429-M433 PolarHBondContact O-N 3.44Å; N430-M433 WeakPolarHBondContact O-CB 3.48Å; N430-M433 PolarHBondContact O-N 3.41Å; L431-M433 VanDerWaalsContact C-N 3.26Å; L431-M433 PolarHBondContact O-N 3.24Å; M433-V435 VanDerWaalsContact C-N 3.29Å; M433-V435 PolarHBondContact O-N 3.08Å; M433-E436 PolarHBondContact O-N 3.33Å; M433-E437 WeakPolarHBondContact O-CG 3.36Å; M433-E437 PolarHBondContact O-N 3.43Å
434I86.3Confident83Confident106 Ų10699.6 Ų99.654%0.54452%0.518SS..Hα-helixtrans-59.7-40.5177.5-66.4167.1000111.3N430 L431 E437 M438N430-I434 WeakPolarHBondContact O-CG1 3.24Å; N430-I434 PolarHBondContact O-N 3.22Å; L431-I434 PolarHBondContact O-N 3.18Å; I434-E437 PolarHBondContact O-N 2.94Å; I434-M438 WeakPolarHBondContact O-CB 3.35Å; I434-M438 PolarHBondContact O-N 2.93Å
435V80.7Confident82.9Confident83 Ų8399.4 Ų99.450%0.50351%0.514SS..Hα-helixtrans-64.4-42178.2171.10000111.5L431 S432 M433 M438 K439L431-V435 VanDerWaalsContact O-CG2 3.31Å; L431-V435 WeakPolarHBondContact O-CG2 3.22Å; L431-V435 PolarHBondContact O-N 2.91Å; S432-V435 PolarHBondContact O-N 3.32Å; M433-V435 VanDerWaalsContact C-N 3.29Å; M433-V435 PolarHBondContact O-N 3.08Å; V435-M438 PolarHBondContact O-N 3.42Å; V435-K439 WeakPolarHBondContact O-CB 3.41Å; V435-K439 PolarHBondContact O-N 2.84Å
436E86.5Confident82.4Confident102 Ų10297 Ų9748%0.47751%0.509SS..Hα-helixtrans-67.6-38.7176-71.6-59.8139.700112.1S432 M433 K439 A440S432-E436 PolarHBondContact O-N 3.04Å; S432-E436 VanDerWaalsContact O-N 3.11Å; M433-E436 PolarHBondContact O-N 3.33Å; E436-K439 WeakPolarHBondContact O-CB 3.17Å; E436-K439 PolarHBondContact O-N 3.26Å; E436-K439 IonicContact OE1-NZ 3.63Å; E436-K439 IonicContact OE2-NZ 2.68Å; E436-A440 PolarHBondContact O-N 3.46Å
437E86.3Confident81.8Confident124 Ų12498.8 Ų98.858%0.57952%0.515SS*.Hα-helixtrans-61.9-45.1172.3-69-62139.600111.5M433 I434 K439 A440 V441M433-E437 WeakPolarHBondContact O-CG 3.36Å; M433-E437 PolarHBondContact O-N 3.43Å; I434-E437 PolarHBondContact O-N 2.94Å; E437-K439 VanDerWaalsContact C-N 3.27Å; E437-K439 PolarHBondContact O-N 2.89Å; E437-A440 WeakPolarHBondContact O-CB 3.41Å; E437-A440 PolarHBondContact O-N 2.71Å; E437-A440 VanDerWaalsContact O-N 3.14Å; E437-V441 WeakPolarHBondContact O-CG2 3.33Å; E437-V441 PolarHBondContact O-N 3.1Å
438M74.4Confident81.2Confident142 Ų14298.8 Ų98.870%0.751%0.514SS*.Hα-helixtrans-63.9-35.3178.4-166.8149.7105.900111.9I434 V435 V441 D442I434-M438 WeakPolarHBondContact O-CB 3.35Å; I434-M438 PolarHBondContact O-N 2.93Å; V435-M438 PolarHBondContact O-N 3.42Å; M438-V441 PolarHBondContact O-N 3.21Å; M438-D442 WeakPolarHBondContact O-CB 3.34Å; M438-D442 PolarHBondContact O-N 3.43Å
439K83.9Confident80.2Confident122 Ų122100.5 Ų100.553%0.5352%0.52SS..Hα-helixtrans-66.9-40.4173.1-173.9-178176.8-170.80112V435 E436 E437 V441 D442 T443V435-K439 WeakPolarHBondContact O-CB 3.41Å; V435-K439 PolarHBondContact O-N 2.84Å; E436-K439 WeakPolarHBondContact O-CB 3.17Å; E436-K439 PolarHBondContact O-N 3.26Å; E436-K439 IonicContact OE1-NZ 3.63Å; E436-K439 IonicContact OE2-NZ 2.68Å; E437-K439 VanDerWaalsContact C-N 3.27Å; E437-K439 PolarHBondContact O-N 2.89Å; K439-V441 VanDerWaalsContact C-N 3.35Å; K439-D442 PolarHBondContact O-N 3.16Å; K439-T443 WeakPolarHBondContact O-CG2 3.46Å; K439-T443 PolarHBondContact O-N 3Å; K439-T443 PolarHBondContact O-OG1 3.18Å
440A82.3Confident79.1Confident49 Ų49101.9 Ų101.941%0.40553%0.525SS..Hα-helixtrans-61.2-45.3174.100000111.1E436 E437 D442 T443 Q444E436-A440 PolarHBondContact O-N 3.46Å; E437-A440 WeakPolarHBondContact O-CB 3.41Å; E437-A440 PolarHBondContact O-N 2.71Å; E437-A440 VanDerWaalsContact O-N 3.14Å; A440-D442 PolarHBondContact O-N 3.03Å; A440-T443 WeakPolarHBondContact CA-OG1 3.46Å; A440-T443 PolarHBondContact O-N 3.04Å; A440-T443 PolarHBondContact O-OG1 3.17Å; A440-Q444 PolarHBondContact O-N 3.43Å
441V83.3Confident77.6Confident65 Ų65104.8 Ų104.839%0.39454%0.541SS..Hα-helixtrans-61.2-42.4175.2172.70000111.8E437 M438 K439 Q444 H445E437-V441 WeakPolarHBondContact O-CG2 3.33Å; E437-V441 PolarHBondContact O-N 3.1Å; M438-V441 PolarHBondContact O-N 3.21Å; K439-V441 VanDerWaalsContact C-N 3.35Å; V441-Q444 PolarHBondContact O-N 3.03Å; V441-H445 WeakPolarHBondContact CG1-CE1 3.48Å; V441-H445 WeakPolarHBondContact CG1-ND1 3.46Å; V441-H445 PolarHBondContact O-N 3.14Å; V441-H445 PolarHBondContact O-ND1 3.49Å
442D80.4Confident76.4Confident92 Ų92105 Ų10549%0.49255%0.546SS..Hα-helixtrans-64.7-40.4177.3-166.446.5000112.1M438 K439 A440 Q444 H445 G446M438-D442 WeakPolarHBondContact O-CB 3.34Å; M438-D442 PolarHBondContact O-N 3.43Å; K439-D442 PolarHBondContact O-N 3.16Å; A440-D442 PolarHBondContact O-N 3.03Å; D442-Q444 PolarHBondContact O-N 3.5Å; D442-H445 PolarHBondContact O-N 3.04Å; D442-G446 PolarHBondContact O-N 2.96Å
443T81.4Confident74.7Confident85 Ų85106.5 Ų106.552%0.52155%0.553SS.*Hα-helixtrans-62.5-41.6173.856.50000112.3K439 A440 G446 E447K439-T443 WeakPolarHBondContact O-CG2 3.46Å; K439-T443 PolarHBondContact O-N 3Å; K439-T443 PolarHBondContact O-OG1 3.18Å; A440-T443 WeakPolarHBondContact CA-OG1 3.46Å; A440-T443 PolarHBondContact O-N 3.04Å; A440-T443 PolarHBondContact O-OG1 3.17Å; T443-G446 PolarHBondContact O-N 3.3Å; T443-E447 PolarHBondContact O-N 2.85Å
444Q77.1Confident72.9Confident119 Ų119108.1 Ų108.156%0.55656%0.562SS**Hα-helixtrans-64.2-44.7176.8-173.4-178.9-4.100111.6A440 V441 D442 G446 E447 I448A440-Q444 PolarHBondContact O-N 3.43Å; V441-Q444 PolarHBondContact O-N 3.03Å; D442-Q444 PolarHBondContact O-N 3.5Å; Q444-G446 VanDerWaalsContact C-N 3.32Å; Q444-G446 PolarHBondContact O-N 3.44Å; Q444-E447 PolarHBondContact O-N 2.77Å; Q444-I448 HydrophobicContact CG-CD1 4.24Å; Q444-I448 WeakPolarHBondContact O-CG1 3.42Å; Q444-I448 PolarHBondContact O-N 3.44Å
445H75.8Confident71Confident103 Ų103111.3 Ų111.348%0.47758%0.579SS.*Hα-helixtrans-62.4-39.2173.9-72.3126.3000112.1V441 D442 E447 I448 L449V441-H445 WeakPolarHBondContact CG1-CE1 3.48Å; V441-H445 WeakPolarHBondContact CG1-ND1 3.46Å; V441-H445 PolarHBondContact O-N 3.14Å; V441-H445 PolarHBondContact O-ND1 3.49Å; D442-H445 PolarHBondContact O-N 3.04Å; H445-E447 VanDerWaalsContact C-N 3.34Å; H445-E447 PolarHBondContact O-N 3.17Å; H445-I448 PolarHBondContact O-N 3.18Å; H445-L449 WeakPolarHBondContact O-CB 3.5Å; H445-L449 VanDerWaalsContact O-CG 3.27Å; H445-L449 WeakPolarHBondContact O-CG 3.5Å; H445-L449 PolarHBondContact O-N 2.87Å
446G73.8Confident69.3Low33 Ų33118.3 Ų118.334%0.3460%0.596SS.*Hα-helixtrans-60.7-39174.600000113.4D442 T443 Q444 R450D442-G446 PolarHBondContact O-N 2.96Å; T443-G446 PolarHBondContact O-N 3.3Å; Q444-G446 VanDerWaalsContact C-N 3.32Å; Q444-G446 PolarHBondContact O-N 3.44Å; G446-R450 PolarHBondContact O-N 3.41Å; G446-R450 VanDerWaalsContact O-N 3.08Å
447E74.6Confident67.7Low133 Ų133116.5 Ų116.562%0.62161%0.606SS**Hα-helixtrans-69.2-41.7174.7-71.5-167.2162.600112.6T443 Q444 H445 L449 R450 N451T443-E447 PolarHBondContact O-N 2.85Å; Q444-E447 PolarHBondContact O-N 2.77Å; H445-E447 VanDerWaalsContact C-N 3.34Å; H445-E447 PolarHBondContact O-N 3.17Å; E447-L449 VanDerWaalsContact C-N 3.34Å; E447-L449 PolarHBondContact O-N 3.31Å; E447-R450 WeakPolarHBondContact O-CB 3.25Å; E447-R450 PolarHBondContact O-N 3.37Å; E447-N451 PolarHBondContact O-N 2.93Å; E447-N451 VanDerWaalsContact O-N 3.1Å
448I69.6Low65.8Low87 Ų87115.1 Ų115.145%0.44662%0.615SS.*Hα-helixtrans-61.4-44.1175-66.5165.9000110.4Q444 H445 R450 N451 V452Q444-I448 HydrophobicContact CG-CD1 4.24Å; Q444-I448 WeakPolarHBondContact O-CG1 3.42Å; Q444-I448 PolarHBondContact O-N 3.44Å; H445-I448 PolarHBondContact O-N 3.18Å; I448-R450 VanDerWaalsContact C-N 3.32Å; I448-R450 PolarHBondContact O-N 2.9Å; I448-N451 PolarHBondContact O-N 2.88Å; I448-V452 WeakPolarHBondContact O-CG2 3.45Å; I448-V452 PolarHBondContact O-N 3.34Å
449L61.9Low65Low123 Ų123113.9 Ų113.964%0.64462%0.618SS**Hα-helixtrans-65.2-32.9177.7-72.7168.8000112.8H445 E447 V452 T453H445-L449 WeakPolarHBondContact O-CB 3.5Å; H445-L449 VanDerWaalsContact O-CG 3.27Å; H445-L449 WeakPolarHBondContact O-CG 3.5Å; H445-L449 PolarHBondContact O-N 2.87Å; E447-L449 VanDerWaalsContact C-N 3.34Å; E447-L449 PolarHBondContact O-N 3.31Å; L449-V452 PolarHBondContact O-N 3.17Å; L449-T453 PolarHBondContact O-OG1 3.31Å
450R61.3Low63.7Low199 Ų199111.1 Ų111.175%0.75162%0.624SS**Hα-helixtrans-66.4-37.5172-89.6-177.8172.3153.1-0112.8G446 E447 I448 V452 T453G446-R450 PolarHBondContact O-N 3.41Å; G446-R450 VanDerWaalsContact O-N 3.08Å; E447-R450 WeakPolarHBondContact O-CB 3.25Å; E447-R450 PolarHBondContact O-N 3.37Å; I448-R450 VanDerWaalsContact C-N 3.32Å; I448-R450 PolarHBondContact O-N 2.9Å; R450-V452 VanDerWaalsContact C-N 3.28Å; R450-V452 PolarHBondContact O-N 3.43Å; R450-T453 WeakPolarHBondContact CA-OG1 3.15Å; R450-T453 PolarHBondContact O-N 3.13Å; R450-T453 PolarHBondContact O-OG1 2.96Å; R450-T453 VanDerWaalsContact O-OG1 3.06Å
451N57.1Low62.6Low135 Ų135114.7 Ų114.772%0.72264%0.643SS**Hα-helixtrans-71-23.8177.4-81.7-14.7000113.2E447 I448 T453E447-N451 PolarHBondContact O-N 2.93Å; E447-N451 VanDerWaalsContact O-N 3.1Å; I448-N451 PolarHBondContact O-N 2.88Å; N451-T453 VanDerWaalsContact C-N 3.35Å
452V56.5Low61.6Low115 Ų115117.8 Ų117.870%0.69766%0.664SS**THydrogen-bonded Turntrans-84-7.5176.61780000112.6I448 L449 R450 I454I448-V452 WeakPolarHBondContact O-CG2 3.45Å; I448-V452 PolarHBondContact O-N 3.34Å; L449-V452 PolarHBondContact O-N 3.17Å; R450-V452 VanDerWaalsContact C-N 3.28Å; R450-V452 PolarHBondContact O-N 3.43Å; V452-I454 PolarHBondContact O-N 3.42Å
453T49Very low60.5Low100 Ų100116.3 Ų116.361%0.61367%0.671SS**  trans-89.933.6-176.77.60000115.6L449 R450 N451 L455L449-T453 PolarHBondContact O-OG1 3.31Å; R450-T453 WeakPolarHBondContact CA-OG1 3.15Å; R450-T453 PolarHBondContact O-N 3.13Å; R450-T453 PolarHBondContact O-OG1 2.96Å; R450-T453 VanDerWaalsContact O-OG1 3.06Å; N451-T453 VanDerWaalsContact C-N 3.35Å; T453-L455 PolarHBondContact O-N 2.77Å; T453-L455 VanDerWaalsContact O-N 3.14Å
454I48.9Very low59.3Low154 Ų154118.7 Ų118.779%0.7969%0.688SS**  trans-85.167.2164.4-50176.3000109.3V452V452-I454 PolarHBondContact O-N 3.42Å
455L46.5Very low58.2Low172 Ų172124.9 Ų124.990%0.90171%0.706SS**  trans-16370.2156.6-94.4177.4000106.9T453 G457T453-L455 PolarHBondContact O-N 2.77Å; T453-L455 VanDerWaalsContact O-N 3.14Å; L455-G457 PolarHBondContact O-N 2.87Å
456R44.4Very low57Low230 Ų230123.1 Ų123.187%0.86872%0.716SS**  trans-73.4102.5178.4-167.8179.6-174.4-179.12.3109.2
457G52.2Low56Low65 Ų65130 Ų13067%0.6774%0.744SS**PPolyproline II helixtrans-60.2142.8165.800000111.1L455L455-G457 PolarHBondContact O-N 2.87Å
458A47.7Very low55.1Low95 Ų95133.3 Ų133.379%0.78576%0.757SS**PPolyproline II helixtrans-54.9144.3-17400000113G460A458-G460 PolarHBondContact O-N 3.27Å
459P57.1Low54.2Low116 Ų116132.4 Ų132.475%0.75377%0.769SS**PPolyproline II helixtrans-58.7128.8178.4-21.131.9000112
460G57Low53.8Low64 Ų64134.4 Ų134.466%0.6678%0.78SS**PPolyproline II helixtrans-62.7149.8172.100000111.8A458A458-G460 PolarHBondContact O-N 3.27Å
461P58.4Low53.2Low123 Ų123133.5 Ų133.580%0.79979%0.786SS**PPolyproline II helixtrans-60.3148-176.623.9-32.7000111.9G463P461-G463 PolarHBondContact O-N 3.43Å
462P63Low52.8Low130 Ų130130.4 Ų130.484%0.84479%0.786SS**PPolyproline II helixtrans-56.8126.1179.4-21.631.6000111.4
463G57.1Low52.8Low62 Ų62131.7 Ų131.764%0.63980%0.795SS**PPolyproline II helixtrans-61.1149.5173.200000111.5P461 R465P461-G463 PolarHBondContact O-N 3.43Å; G463-R465 PolarHBondContact O-N 3.04Å
464P56.6Low53.1Low134 Ų134136.3 Ų136.387%0.8781%0.806SS**PPolyproline II helixtrans-58.5139.9-179.523.5-32.3000111.2G466P464-G466 PolarHBondContact O-N 3.35Å; P464-G466 VanDerWaalsContact O-N 3.08Å
465R54.8Low53.4Low249 Ų249131.6 Ų131.694%0.9480%0.795SS**  trans-57.4110.9178.6-169.1178.2-174.4179.12.4109.5G463 L467G463-R465 PolarHBondContact O-N 3.04Å; R465-L467 PolarHBondContact O-N 2.89Å
466G50.3Low53.8Low67 Ų67129.6 Ų129.669%0.69179%0.793SS**PPolyproline II helixtrans-55.8136.3174.200000111.1P464P464-G466 PolarHBondContact O-N 3.35Å; P464-G466 VanDerWaalsContact O-N 3.08Å
467L52.4Low54.3Low176 Ų176125.2 Ų125.292%0.92179%0.791SS**PPolyproline II helixtrans-56.5137.5178.8-69.6163000110.4R465 G469R465-L467 PolarHBondContact O-N 2.89Å; L467-G469 PolarHBondContact O-N 3.48Å
468K55.3Low54.2Low203 Ų203125.4 Ų125.488%0.88379%0.793SS**PPolyproline II helixtrans-58.8118.8175.3-173.1178.9-177-176.60108.2D470K468-D470 PolarHBondContact O-N 3.49Å
469G51.5Low54.3Low68 Ų68124.3 Ų124.370%0.70179%0.792SS**PPolyproline II helixtrans-55.5136.2-178.700000111.9L467L467-G469 PolarHBondContact O-N 3.48Å
470D52.8Low54.1Low165 Ų165130.6 Ų130.688%0.88280%0.8SS**PPolyproline II helixtrans-58.9137.5174.2-71.1-41.7000110.4K468 G472K468-D470 PolarHBondContact O-N 3.49Å; D470-G472 PolarHBondContact O-N 3.3Å; D470-G472 VanDerWaalsContact O-N 3.13Å
471M48.9Very low53.8Low180 Ų180130.1 Ų130.189%0.88780%0.795SS**  trans-63.9111.8178.8-166.3175.869.100108.8V473M471-V473 PolarHBondContact O-N 2.88Å
472G49.3Very low53.3Low70 Ų70130.5 Ų130.572%0.72280%0.798SS**PPolyproline II helixtrans-52.4125.1176.700000111.1D470 K474D470-G472 PolarHBondContact O-N 3.3Å; D470-G472 VanDerWaalsContact O-N 3.13Å; G472-K474 PolarHBondContact O-N 3.47Å
473V55.1Low52.6Low143 Ų143133.9 Ų133.987%0.86780%0.799SS**PPolyproline II helixtrans-61.1127.6-178.5-155.80000109M471 G475M471-V473 PolarHBondContact O-N 2.88Å; V473-G475 PolarHBondContact O-N 2.89Å; V473-G475 VanDerWaalsContact O-N 3.14Å
474K56.2Low52.2Low196 Ų196134 Ų13485%0.85280%0.801SS**PPolyproline II helixtrans-56.4116.9174-171.7177.5-175.81790108.7G472G472-K474 PolarHBondContact O-N 3.47Å
475G54.6Low51.7Low55 Ų55134.9 Ų134.957%0.56780%0.798SS**PPolyproline II helixtrans-55.8145.8177.900000111.5V473V473-G475 PolarHBondContact O-N 2.89Å; V473-G475 VanDerWaalsContact O-N 3.14Å
476P54.8Low51.4Low130 Ų130128.9 Ų128.984%0.84479%0.792SS**PPolyproline II helixtrans-60.1141.6179.124.7-32.1000110.5G478P476-G478 PolarHBondContact O-N 3.04Å
477V55.9Low51.2Low138 Ų138129.3 Ų129.384%0.83680%0.796SS**PPolyproline II helixtrans-55.3121.1172.7172.70000108.2G479V477-G479 PolarHBondContact O-N 3.38Å
478G49.4Very low50.8Low69 Ų69126.5 Ų126.571%0.71179%0.791SS**PPolyproline II helixtrans-54.4123.9175.800000110.3P476P476-G478 PolarHBondContact O-N 3.04Å
479G49.4Very low50.2Low73 Ų73124.9 Ų124.975%0.75379%0.791SS**PPolyproline II helixtrans-56.9141.1175.200000110.9V477 G481V477-G479 PolarHBondContact O-N 3.38Å; G479-G481 PolarHBondContact O-N 3.43Å; G479-G481 VanDerWaalsContact O-N 3.17Å
480R53.3Low50.1Low247 Ų247124.3 Ų124.393%0.93279%0.785SS**PPolyproline II helixtrans-54.3118.3169.6-177.8-179.1-70.8-105.21108.1
481G51.3Low49.7Very low54 Ų54122.2 Ų122.256%0.55778%0.781SS**PPolyproline II helixtrans-55.7146175.300000110.8G479 K483G479-G481 PolarHBondContact O-N 3.43Å; G479-G481 VanDerWaalsContact O-N 3.17Å; G481-K483 PolarHBondContact O-N 3.04Å
482P47.3Very low49.8Very low131 Ų131119.5 Ų119.585%0.85178%0.777SS**PPolyproline II helixtrans-56.6137.4177.424.1-32.1000109.8G484P482-G484 PolarHBondContact O-N 3.21Å
483K48.6Very low49.7Very low201 Ų201119.8 Ų119.887%0.87478%0.779SS**PPolyproline II helixtrans-55.8119.1171.7-175.5-180179.7-175.10107.2G481 D485G481-K483 PolarHBondContact O-N 3.04Å; K483-D485 PolarHBondContact O-N 3.03Å
484G49.4Very low49Very low66 Ų66118.6 Ų118.668%0.6878%0.777SS**PPolyproline II helixtrans-55.4133.7176.900000110.3P482P482-G484 PolarHBondContact O-N 3.21Å
485D45.8Very low48.4Very low152 Ų152118.4 Ų118.481%0.81378%0.779SS**PPolyproline II helixtrans-56.3138.6173.9-66.7-48.6000109.7K483 G487K483-D485 PolarHBondContact O-N 3.03Å; D485-G487 PolarHBondContact O-N 2.87Å
486P47.7Very low48.1Very low123 Ų123118.5 Ų118.580%0.79978%0.78SS**PPolyproline II helixtrans-56.2124.5170.4-19.630.9000109S488P486-S488 PolarHBondContact O-N 3.29Å
487G46.5Very low47.4Very low76 Ų76118.6 Ų118.678%0.78478%0.781SS**PPolyproline II helixtrans-53.4129.8174.700000110.1D485 L489D485-G487 PolarHBondContact O-N 2.87Å; G487-L489 PolarHBondContact O-N 3.3Å
488S43.4Very low46.7Very low117 Ų117121 Ų12182%0.81878%0.783SS**PPolyproline II helixtrans-54.1129.417551.20000110.1P486 G490P486-S488 PolarHBondContact O-N 3.29Å; S488-G490 PolarHBondContact O-N 3.42Å
489L43.3Very low46.4Very low168 Ų168121 Ų12188%0.8878%0.782SS**PPolyproline II helixtrans-52.8126.3168.2-146.382.1000108.5G487G487-L489 PolarHBondContact O-N 3.3Å
490G48.8Very low45.9Very low56 Ų56126.3 Ų126.358%0.57779%0.788SS**PPolyproline II helixtrans-57.7142.5174.200000110.3S488S488-G490 PolarHBondContact O-N 3.42Å
491P44.8Very low45.3Very low122 Ų122120.7 Ų120.779%0.79278%0.783SS**PPolyproline II helixtrans-60.7138.5179.125.2-32.2000109.7G493P491-G493 PolarHBondContact O-N 3.32Å
492P50.5Low44.9Very low123 Ų123121.7 Ų121.780%0.79979%0.794SS**PPolyproline II helixtrans-54.4135.8169-21.731.8000109.9S494P492-S494 PolarHBondContact O-N 2.9Å
493G47.1Very low44.6Very low75 Ų75124.8 Ų124.877%0.77380%0.797SS**PPolyproline II helixtrans-54.8137.4174.900000110.9P491 Q495P491-G493 PolarHBondContact O-N 3.32Å; G493-Q495 PolarHBondContact O-N 2.79Å
494S41.3Very low44.1Very low119 Ų119120.1 Ų120.183%0.83280%0.796SS**PPolyproline II helixtrans-56.1127.718050.70000111.6P492 G496P492-S494 PolarHBondContact O-N 2.9Å; S494-G496 PolarHBondContact O-N 2.82Å
495Q44.3Very low43.9Very low191 Ų191120.1 Ų120.189%0.89380%0.796SS**PPolyproline II helixtrans-57.1127.5166.7-173.5176.2-100109.2G493G493-Q495 PolarHBondContact O-N 2.79Å
496G48.1Very low43.5Very low57 Ų57119.1 Ų119.159%0.58880%0.798SS**PPolyproline II helixtrans-59146.5175.900000111.2S494 Q498S494-G496 PolarHBondContact O-N 2.82Å; G496-Q498 PolarHBondContact O-N 2.91Å
497P39.3Very low43.2Very low133 Ų133120.1 Ų120.186%0.86480%0.801SS**PPolyproline II helixtrans-62.9132.5-17625.8-32.7000110.9G499P497-G499 PolarHBondContact O-N 3.22Å
498Q41.3Very low42.9Very low189 Ų189119.8 Ų119.888%0.88380%0.797SS**PPolyproline II helixtrans-61.5123.9170.3-174.7175.72.600109.1G496 Q500G496-Q498 PolarHBondContact O-N 2.91Å; Q498-Q500 PolarHBondContact O-N 3.41Å
499G42.6Very low42.5Very low67 Ų67123.6 Ų123.669%0.69180%0.802SS**PPolyproline II helixtrans-59.1134.7175.900000111.2P497P497-G499 PolarHBondContact O-N 3.22Å
500Q39.4Very low42.4Very low186 Ų186127 Ų12787%0.86980%0.803SS**PPolyproline II helixtrans-63.7141178.7-70.5-177.3-3.300111.1Q498 G502Q498-Q500 PolarHBondContact O-N 3.41Å; Q500-G502 PolarHBondContact O-N 3.48Å
501P41.1Very low42.3Very low128 Ų128127 Ų12783%0.83180%0.803SS**PPolyproline II helixtrans-61.1129.5169.4-18.931.1000110.5
502G41.4Very low41.9Very low76 Ų76127.5 Ų127.578%0.78481%0.807SS**PPolyproline II helixtrans-64.1142.9175.600000112.2Q500Q500-G502 PolarHBondContact O-N 3.48Å
503E41.2Very low41.5Very low196 Ų196128.5 Ų128.592%0.91681%0.81SS**PPolyproline II helixtrans-61.1147.2-179.7-71.9-163.5146.700113.2G505E503-G505 PolarHBondContact O-N 3.42Å
504A38.4Very low41.5Very low102 Ų102127.7 Ų127.784%0.84380%0.803SS**PPolyproline II helixtrans-68.3127.5176.500000111.2
505G45.2Very low41.3Very low66 Ų66128.5 Ų128.568%0.6881%0.805SS**PPolyproline II helixtrans-64.6152.2175.600000113.1E503E503-G505 PolarHBondContact O-N 3.42Å
506P37.5Very low41.2Very low132 Ų132130.3 Ų130.386%0.85780%0.804SS**PPolyproline II helixtrans-67.5147.1-173.627.4-34000112.8G508P506-G508 PolarHBondContact O-N 2.99Å
507V41.6Very low40.8Very low143 Ų143130.6 Ų130.687%0.86781%0.806SS**PPolyproline II helixtrans-64.1120.6176.9173.10000110
508G39.7Very low40.8Very low69 Ų69134.2 Ų134.271%0.71181%0.809SS**PPolyproline II helixtrans-66.7135174.500000112.5P506P506-G508 PolarHBondContact O-N 2.99Å
509E36.4Very low40.7Very low197 Ų197130.7 Ų130.792%0.92180%0.802SS**PPolyproline II helixtrans-63.7145.9178.7-70.2-171.8146.800113G511E509-G511 PolarHBondContact O-N 3.35Å
510R40.9Very low40.4Very low239 Ų239131.2 Ų131.290%0.90281%0.808SS**PPolyproline II helixtrans-74.3120-179.7-179.6-175.8-67.5-129.1-1.3110.5
511G46.3Very low40Very low56 Ų56130.4 Ų130.458%0.57781%0.808SS**PPolyproline II helixtrans-62.615017200000113.2E509E509-G511 PolarHBondContact O-N 3.35Å
512P37.3Very low39.7Very low134 Ų134134 Ų13487%0.8781%0.811SS**PPolyproline II helixtrans-69.8149.3-17528.7-33.7000112.7
513V41.6Very low39.5Very low143 Ų143133.5 Ų133.587%0.86781%0.805SS**PPolyproline II helixtrans-71.5125.1-176.8176.30000110.8
514G46.4Very low39Very low59 Ų59129.8 Ų129.861%0.60880%0.801SS**PPolyproline II helixtrans-69.7145.6171.200000112.5
515P36.5Very low38.7Very low136 Ų136134.8 Ų134.888%0.88380%0.804SS**PPolyproline II helixtrans-70.9139.5-174.929.5-33.1000111.7
516R42.3Very low38.5Very low229 Ų229135.2 Ų135.286%0.86481%0.808SS**PPolyproline II helixtrans-81.3123.5-178.3-169.2177.7-177.2-176.11.8110.6
517G40.6Very low38.3Very low62 Ų62134.9 Ų134.964%0.63981%0.809SS**PPolyproline II helixtrans-69.7139.9166.600000111.7P519G517-P519 WeakPolarHBondContact O-CD 3.28Å
518F39Very low37.9Very low210 Ų210138.4 Ų138.492%0.92181%0.813SS**PPolyproline II helixtrans-73.2133.6-176.2-70.5-92.4000113.2
519P39.2Very low37.7Very low115 Ų115138.3 Ų138.375%0.74781%0.812SS**  trans-109.5145.7152.6-1.623.3000112.1G517G517-P519 WeakPolarHBondContact O-CD 3.28Å
520G36.9Very low37.5Very low78 Ų78136.3 Ų136.380%0.80481%0.813SS**  trans-74.4154-162.400000118.8
521L30.8Very low37.2Very low169 Ų169128.5 Ų128.589%0.88581%0.808SS**  trans6.7107.4157.1-68.2158.9000121.6
522K34.7Very low36.8Very low204 Ų204129.9 Ų129.989%0.88782%0.822SS**  56.9128111.8-158.1176.2-172.1178.50121.6
523G36.7Very low36.8Very low64 Ų64129.3 Ų129.366%0.6682%0.818SS**  trans-17365.815300000119
524S30.8Very low36.5Very low118 Ų118133.9 Ų133.983%0.82582%0.82SS**  trans62.3151.3147.777.40000119.5
525K32.6Very low36.2Very low208 Ų208135 Ų13590%0.90483%0.831SS**  cis-166118.44.5-159.7176-178.2-179.80103.4
526G39.8Very low36.3Very low75 Ų75137.1 Ų137.177%0.77383%0.829SS**  90.2100.684.600000114.1
527S34.4Very low36.1Very low125 Ų125132.3 Ų132.387%0.87483%0.827SS**  trans-163.4151.7137.656.40000111.1
528F32.4Very low36.4Very low216 Ų216132.6 Ų132.695%0.94783%0.83SS**  trans-80.9159-153.4-93.2-111000116.7
529G36.4Very low36.5Very low67 Ų67128.9 Ų128.969%0.69183%0.827SS**  trans-71-176.9176.800000114.9
530T31.1Very low36.5Very low155 Ų155132.9 Ų132.995%0.95183%0.833SS**  cis-164.9164.845.135.20000111.4
531G34.7Very low36.9Very low76 Ų76132.4 Ų132.478%0.78483%0.828SS**  trans13784.4160.200000114
532G38.6Very low37.3Very low85 Ų85132.1 Ų132.188%0.87683%0.827SS**  trans-86.7141.5-175.300000114.8
533P37.8Very low37.6Very low122 Ų122130.2 Ų130.279%0.79283%0.825SS**  trans-117.9135.7157.733.7-21000112.9
534R34.7Very low38.3Very low239 Ų239129.8 Ų129.890%0.90282%0.821SS**  trans34.2111147.8-156.6172.8-176176.20.4118.5
535G40.7Very low38.8Very low81 Ų81129.9 Ų129.984%0.83582%0.818SS**PPolyproline II helixtrans-61.4133.9172.900000113.8
536Q37.7Very low39.5Very low182 Ų182126 Ų12685%0.8581%0.814SS**PPolyproline II helixtrans-83.6160.4173.1-73.9179.916.200111.8
537P39Very low40.2Very low127 Ų127125.4 Ų125.483%0.82581%0.808SS**PPolyproline II helixtrans-57.3146179.3-22.933.9000113.7
538G46.2Very low40.5Very low68 Ų68125.7 Ų125.770%0.70181%0.807SS**PPolyproline II helixtrans-63.7150.6-179.500000113.6
539P41.1Very low41.2Very low133 Ų133124.7 Ų124.786%0.86481%0.806SS**PPolyproline II helixtrans-67145.9-176.427.4-33.8000112.6
540K39.2Very low42Very low198 Ų198124.1 Ų124.186%0.86180%0.8SS**PPolyproline II helixtrans-58.5129171.3-169.2177.9-177.9-177.30109.2
541G45.1Very low42.5Very low68 Ų68122.6 Ų122.670%0.70179%0.793SS**PPolyproline II helixtrans-59.5139.8176.400000111.7
542D40.3Very low43.4Very low163 Ų163125.1 Ų125.187%0.87280%0.795SS**PPolyproline II helixtrans-61.9143.2-179.3-66.8-47.4000111.9G544D542-G544 PolarHBondContact O-N 3.31Å
543I41Very low44.1Very low165 Ų165124.5 Ų124.585%0.84679%0.789SS**PPolyproline II helixtrans-66.6127.5174.1-65.3169.5000107.9
544G50.2Low44.2Very low54 Ų54123.9 Ų123.956%0.55779%0.787SS**PPolyproline II helixtrans-57.8149175.500000111.7D542D542-G544 PolarHBondContact O-N 3.31Å
545P40.9Very low45Very low120 Ų120118.6 Ų118.678%0.77978%0.784SS**PPolyproline II helixtrans-60146.2-177.725.4-33.2000111
546P49.1Very low45.7Very low126 Ų126117.7 Ų117.782%0.81877%0.774SS**PPolyproline II helixtrans-54.9140.4171.8-20.230.7000110.6
547G54Low46Very low63 Ų63115.2 Ų115.265%0.64977%0.774SS**PPolyproline II helixtrans-58153.5173.200000111.6
548P40.8Very low46.3Very low131 Ų131115 Ų11585%0.85178%0.776SS**PPolyproline II helixtrans-59.4141.4-178.424.6-33000111.3G550P548-G550 PolarHBondContact O-N 2.95Å
549E46.7Very low46.7Very low195 Ų195114.8 Ų114.891%0.91177%0.774SS**PPolyproline II helixtrans-57.3129.8174.6-164.2171.4-169.400109.7
550G52.3Low46.6Very low56 Ų56114.7 Ų114.758%0.57777%0.773SS**PPolyproline II helixtrans-61.6149177.500000111.1P548P548-G550 PolarHBondContact O-N 2.95Å
551P43.3Very low46.7Very low123 Ų123114.4 Ų114.480%0.79978%0.775SS**PPolyproline II helixtrans-58.9142.5-179.324.4-33000110.9G553P551-G553 PolarHBondContact O-N 2.76Å
552P53.6Low46.7Very low129 Ų129114.4 Ų114.484%0.83878%0.775SS**PPolyproline II helixtrans-55.2132.9175.8-22.431.3000110.7
553G51.6Low46.6Very low71 Ų71116.2 Ų116.273%0.73278%0.775SS**PPolyproline II helixtrans-54.8141.5173.400000111P551P551-G553 PolarHBondContact O-N 2.76Å
554S39.8Very low46.8Very low110 Ų110115 Ų11577%0.76978%0.778SS**PPolyproline II helixtrans-54.4138.9178.541.80000111.2G556S554-G556 PolarHBondContact O-N 2.9Å
555P52.9Low46.3Very low127 Ų127115.6 Ų115.683%0.82579%0.785SS**PPolyproline II helixtrans-57.2129.1175.9-22.632.2000110.6
556G54.5Low45.9Very low62 Ų62118.2 Ų118.264%0.63979%0.79SS**PPolyproline II helixtrans-60.1148.6172.500000111.1S554 S558S554-G556 PolarHBondContact O-N 2.9Å; G556-S558 PolarHBondContact O-N 2.89Å
557P43.9Very low45.8Very low131 Ų131117.2 Ų117.285%0.85179%0.793SS**PPolyproline II helixtrans-59137.5-17924-32.9000111.3G559P557-G559 PolarHBondContact O-N 3.28Å
558S46.7Very low45.1Very low122 Ų122117.7 Ų117.785%0.85380%0.798SS**PPolyproline II helixtrans-54.4125179.2-59.20000111.6G556G556-S558 PolarHBondContact O-N 2.89Å
559G53Low44.8Very low64 Ų64121.3 Ų121.366%0.6680%0.8SS**PPolyproline II helixtrans-64148.2172.800000111.8P557P557-G559 PolarHBondContact O-N 3.28Å
560P39.3Very low44.9Very low131 Ų131119.4 Ų119.485%0.85180%0.802SS**PPolyproline II helixtrans-63.2142.2-17824.8-32.6000112.2G562P560-G562 PolarHBondContact O-N 3.48Å
561Q42.6Very low44.6Very low191 Ų191119.8 Ų119.889%0.89381%0.806SS**  trans-57.7112.7-175.6-172177.112.700112.4
562G43.6Very low44.5Very low69 Ų69119.2 Ų119.271%0.71180%0.804SS**PPolyproline II helixtrans-73.2135168.600000111.6P560P560-G562 PolarHBondContact O-N 3.48Å
563K38.9Very low44.2Very low201 Ų201119.2 Ų119.287%0.87480%0.804SS**PPolyproline II helixtrans-64.2153.1178.6-68.6-178.6178.6-179.70112
564P45.9Very low44Very low138 Ų138119.4 Ų119.490%0.89681%0.806SS**PPolyproline II helixtrans-69.9133.5-171.4-12.427.3000112.3
565G38.4Very low44.2Very low68 Ų68123.5 Ų123.570%0.70181%0.814SS**  trans-152.196.7175.800000113.9
566I33Very low43.9Very low175 Ų175129.1 Ų129.190%0.89782%0.818SS**  trans58.1125145.4-45.5173000118.7
567A46Very low43.6Very low105 Ų105129.3 Ų129.387%0.86882%0.82SS**  trans-78.4145.1177.700000114.1
568G40Very low43.7Very low73 Ų73128 Ų12875%0.75382%0.82SS**  trans137.5136.5164.700000111.2
569K34.5Very low43.7Very low206 Ų206131.1 Ų131.190%0.89682%0.824SS**  cis-147.1153.77.5-74.1174.5172.7175.60107.1G571K569-G571 PolarHBondContact O-N 2.92Å
570T49.9Very low43.6Very low156 Ų156130.7 Ų130.796%0.95782%0.82SS**  trans-58.8122.9169.8-51.10000110.6
571G45.7Very low43.8Very low64 Ų64130.7 Ų130.766%0.6682%0.82SS**  trans-132.6117.7176.500000111.9K569K569-G571 PolarHBondContact O-N 2.92Å
572S40.4Very low44.2Very low110 Ų110131.3 Ų131.377%0.76982%0.82SS**  trans26.5135.7163.653.60000121.8G574S572-G574 PolarHBondContact O-N 2.98Å
573P47.5Very low44.4Very low129 Ų129131.2 Ų131.284%0.83882%0.818SS**PPolyproline II helixtrans-55.4130.7168.6-19.430.4000112.1
574G46.8Very low44.6Very low75 Ų75130.4 Ų130.477%0.77382%0.818SS**PPolyproline II helixtrans-67.2142.1176.800000112.6S572S572-G574 PolarHBondContact O-N 2.98Å
575Q45.3Very low45Very low197 Ų197130 Ų13092%0.92182%0.815SS**PPolyproline II helixtrans-59.5140.6169.2-85.3-178-6.600110.7G577Q575-G577 PolarHBondContact O-N 3.14Å
576R47.1Very low45.5Very low244 Ų244130.3 Ų130.392%0.92182%0.818SS**PPolyproline II helixtrans-55.8119.6172.2-176.5-177-66.4-153.8-0.8109.1
577G48.3Very low46Very low66 Ų66130.2 Ų130.268%0.6882%0.817SS**PPolyproline II helixtrans-57.9145.4174.500000111.7Q575Q575-G577 PolarHBondContact O-N 3.14Å
578A44.1Very low46.2Very low104 Ų104134.2 Ų134.286%0.8682%0.818SS**PPolyproline II helixtrans-58.8142.1176.300000110.9G580A578-G580 PolarHBondContact O-N 3.4Å
579M47.8Very low46.8Very low187 Ų187133.4 Ų133.492%0.92181%0.81SS**PPolyproline II helixtrans-56.8124.8174.1-166.3107.967.100109
580G51.5Low47.3Very low56 Ų56129.3 Ų129.358%0.57781%0.805SS**PPolyproline II helixtrans-58.8149.9175.600000111.4A578 K582A578-G580 PolarHBondContact O-N 3.4Å; G580-K582 PolarHBondContact O-N 3.34Å
581P43.1Very low47.8Very low131 Ų131128 Ų12885%0.85180%0.799SS**PPolyproline II helixtrans-58.9140.9178.725.2-32.6000110.4G583P581-G583 PolarHBondContact O-N 3.5Å
582K50.5Low48Very low204 Ų204128.5 Ų128.589%0.88780%0.804SS**PPolyproline II helixtrans-59.3123.7174.4-175.3179.5178.8-176.20108.2G580G580-K582 PolarHBondContact O-N 3.34Å
583G48.7Very low48.3Very low66 Ų66129.7 Ų129.768%0.6881%0.806SS**PPolyproline II helixtrans-54.8140.5178.200000111.6P581P581-G583 PolarHBondContact O-N 3.5Å
584E41.5Very low48.9Very low185 Ų185129.5 Ų129.586%0.86481%0.805SS**PPolyproline II helixtrans-62.2146.9180-66.2-173.2158.400111.3G586E584-G586 PolarHBondContact O-N 2.88Å
585P55.4Low49.2Very low128 Ų128129 Ų12983%0.83180%0.8SS**PPolyproline II helixtrans-56.6130.8173.4-20.832.1000110.6I587P585-I587 PolarHBondContact O-N 3.48Å
586G48.8Very low49.4Very low75 Ų75125.5 Ų125.577%0.77379%0.794SS**PPolyproline II helixtrans-56.1134.3175.900000111.3E584 Q588E584-G586 PolarHBondContact O-N 2.88Å; G586-Q588 PolarHBondContact O-N 3.16Å
587I42.3Very low50.2Low173 Ų173120.1 Ų120.189%0.88779%0.791SS**PPolyproline II helixtrans-55.5130.1178.6-12.5175.6000109.6P585 G589P585-I587 PolarHBondContact O-N 3.48Å; I587-G589 PolarHBondContact O-N 2.88Å
588Q51.8Low50.4Low189 Ų189120 Ų12088%0.88379%0.79SS**PPolyproline II helixtrans-63125.1177.1-171.6169.742.600109.3G586G586-Q588 PolarHBondContact O-N 3.16Å
589G51.4Low50.5Low57 Ų57120.9 Ų120.959%0.58879%0.787SS**PPolyproline II helixtrans-58.9146.9178.700000111.7I587I587-G589 PolarHBondContact O-N 2.88Å
590P46.1Very low51.1Low120 Ų120118.1 Ų118.178%0.77978%0.783SS**PPolyproline II helixtrans-59.9147.5-178.624.5-33000111.1G592P590-G592 PolarHBondContact O-N 3.36Å
591P59.6Low50.9Low128 Ų128119 Ų11983%0.83179%0.791SS**PPolyproline II helixtrans-54.5134.9175.4-23.632.7000111.3V593P591-V593 PolarHBondContact O-N 3.43Å
592G50Low51Low74 Ų74118.2 Ų118.276%0.76379%0.79SS**PPolyproline II helixtrans-59.3135.3176.400000111.3P590P590-G592 PolarHBondContact O-N 3.36Å
593V46.1Very low51Low135 Ų135116.3 Ų116.382%0.81878%0.784SS**PPolyproline II helixtrans-59.5137.3176.9-84.20000111P591 G595P591-V593 PolarHBondContact O-N 3.43Å; V593-G595 PolarHBondContact O-N 3.16Å
594P60.3Low50.7Low126 Ų126118.5 Ų118.582%0.81879%0.789SS**PPolyproline II helixtrans-55.2136.9176.2-25.333.9000112
595G53Low51Low64 Ų64118.4 Ų118.466%0.6679%0.786SS**PPolyproline II helixtrans-64.1150.717600000112.1V593V593-G595 PolarHBondContact O-N 3.16Å
596P50.1Low50.5Low123 Ų123126.5 Ų126.580%0.79980%0.802SS**PPolyproline II helixtrans-63.8151.3-178.925.9-33.5000111.9
597P63.1Low50.5Low131 Ų131129.1 Ų129.185%0.85180%0.803SS**PPolyproline II helixtrans-56.1138175.9-22.732.4000112.1
598G52.6Low51Low65 Ų65126.7 Ų126.767%0.6780%0.799SS**PPolyproline II helixtrans-64.8151.4175.600000112.4
599P47.7Very low50.9Low122 Ų122123.3 Ų123.379%0.79279%0.794SS**PPolyproline II helixtrans-65.1148-178.125.7-33000112.2G601P599-G601 PolarHBondContact O-N 3.48Å
600P58.6Low50.9Low128 Ų128127.2 Ų127.283%0.83181%0.806SS**PPolyproline II helixtrans-60132.8176.4-20.431.1000112S602P600-S602 PolarHBondContact O-N 3.14Å
601G47.8Very low51.2Low74 Ų74127.6 Ų127.676%0.76381%0.808SS**PPolyproline II helixtrans-64.5124.7175.400000111.7P599 Q603P599-G601 PolarHBondContact O-N 3.48Å; G601-Q603 PolarHBondContact O-N 2.91Å
602S44.7Very low50.7Low116 Ų116127.6 Ų127.681%0.81181%0.806SS**  trans-69115.4174.251.90000110.6P600P600-S602 PolarHBondContact O-N 3.14Å
603Q51.7Low50.7Low163 Ų163131.4 Ų131.476%0.76281%0.809SS**  trans-75.1121.3168.6-73.1179.3-1500109.8G601 F605G601-Q603 PolarHBondContact O-N 2.91Å; Q603-F605 HydrophobicContact CB-CD2 4.47Å; Q603-F605 HydrophobicContact CB-CE2 4.12Å
604S43Very low51.1Low113 Ų113131.2 Ų131.279%0.7981%0.809SS**  trans-73.7124.4165.2-57.70000109.4
605F48.1Very low50.3Low182 Ų182131.6 Ų131.680%0.79881%0.808SS**  trans-106.8122.8165.2-80.6-85.6000109Q603Q603-F605 HydrophobicContact CB-CD2 4.47Å; Q603-F605 HydrophobicContact CB-CE2 4.12Å
606Y43.2Very low50Low298 Ų298137.7 Ų137.7100%1.16982%0.821SS**  trans-860155.7-91.9-81000109.4

Retrieved 606 of 606 residues in 1810.8 ms (Link to these results)