A0A077YYM6_TRITR Loading...

Ion trans 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YYM6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 303 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
1M44.2Very low43.7Very low229 Ų229148.3 Ų148.3100%1.12872%0.721SS**  0-39.20-123.1118.6148.700113.9R3M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.02Å
2G41.9Very low43.3Very low61 Ų61150.8 Ų150.863%0.62973%0.726SS**THydrogen-bonded Turntrans-766.2-177.600000118.5
3R37.3Very low43.1Very low221 Ų221151.9 Ų151.983%0.83473%0.73SS**THydrogen-bonded Turntrans-94.2-19.8176.7-151.4173.9-161.4162.74.6113.1M1M1-R3 VanDerWaalsContact C-N 3.32Å; M1-R3 PolarHBondContact O-N 3.02Å
4M39.1Very low42.9Very low157 Ų157151.5 Ų151.577%0.77373%0.731SS**SBendtrans-80-26.6180-71.5-71.9-165.600112.9R6 L7M4-R6 PolarHBondContact O-N 3.09Å; M4-L7 PolarHBondContact O-N 3.44Å
5E48.8Very low42.5Very low163 Ų163147.6 Ų147.676%0.76273%0.726SS**Hα-helixtrans-73.9-21.8179.7-77.5-174146.400114.2
6R46.7Very low41.9Very low199 Ų199152.3 Ų152.375%0.75173%0.733SS**Hα-helixtrans-77-22.7175.4-93.1-167.8-76.8-159.7-3.6113.8M4M4-R6 PolarHBondContact O-N 3.09Å
7L43.9Very low41.5Very low119 Ų119150.8 Ų150.862%0.62374%0.742SS**Hα-helixtrans-83.6-27.6175.5-69.7169.6000112.3M4 R9 T10M4-L7 PolarHBondContact O-N 3.44Å; L7-R9 VanDerWaalsContact C-N 3.31Å; L7-R9 PolarHBondContact O-N 3.39Å; L7-T10 PolarHBondContact O-OG1 3.04Å; L7-T10 VanDerWaalsContact O-OG1 3.1Å
8G42.4Very low41Very low45 Ų45155.6 Ų155.646%0.46475%0.75SS.*Hα-helixtrans-72.2-18.5177.700000115
9R45.7Very low41.3Very low207 Ų207152.6 Ų152.678%0.78174%0.744SS**Hα-helixtrans-88.1-28.1177.4-159.4174.8-71.8-178.8-1.7112.8L7L7-R9 VanDerWaalsContact C-N 3.31Å; L7-R9 PolarHBondContact O-N 3.39Å
10T44.9Very low40.6Very low79 Ų79156.8 Ų156.849%0.48575%0.752SS.*Hα-helixtrans-77.9-27.9178.549.40000113.2L7L7-T10 PolarHBondContact O-OG1 3.04Å; L7-T10 VanDerWaalsContact O-OG1 3.1Å
11E45.3Very low40.2Very low151 Ų151158.6 Ų158.671%0.70676%0.757SS**Hα-helixtrans-78-28.6-178-151.6173.6-171.700112.8E13E11-E13 VanDerWaalsContact C-N 3.3Å; E11-E13 PolarHBondContact O-N 3.34Å
12K39.5Very low39.8Very low178 Ų178155.9 Ų155.977%0.77474%0.738SS**Hα-helixtrans-72.7-19.9176.6-91.9-174.2176.8179.80114.1S15K12-S15 PolarHBondContact O-OG 2.86Å
13E40.2Very low39.6Very low166 Ų166158.3 Ų158.378%0.77674%0.741SS**Hα-helixtrans-92.8-17179.1-139.7158.9-158.600113.1E11 S15E11-E13 VanDerWaalsContact C-N 3.3Å; E11-E13 PolarHBondContact O-N 3.34Å; E13-S15 VanDerWaalsContact C-N 3.34Å
14I41.2Very low40.1Very low146 Ų146152.4 Ų152.475%0.74973%0.734SS**THydrogen-bonded Turntrans-83.9-8.8176.1-65.3171.9000112.4
15S36.7Very low40.2Very low93 Ų93155.5 Ų155.565%0.6574%0.737SS**THydrogen-bonded Turntrans-96.46.9-175.268.20000116.4K12 E13K12-S15 PolarHBondContact O-OG 2.86Å; E13-S15 VanDerWaalsContact C-N 3.34Å
16R33.2Very low39.9Very low223 Ų223152.4 Ų152.484%0.84273%0.729SS**SBendtrans-116.9115.7171.1-83.7-177.2173.8178.1-2.3111.6
17S33.7Very low39.5Very low126 Ų126151.1 Ų151.188%0.88173%0.729SS**  trans88.266.7169.868.10000118.9
18R33Very low39.5Very low237 Ų237153.1 Ų153.189%0.89474%0.735SS**  trans-88.8163.1136-64.8-162.9-161.6-127.28.3108.5
19P46.4Very low39.7Very low99 Ų99155.5 Ų155.564%0.64374%0.741SS**  cis-134.6134.9-12.929.8-9000113.5K21P19-K21 PolarHBondContact O-N 3.37Å; P19-K21 VanDerWaalsContact O-N 3.13Å
20W28.5Very low39.8Very low236 Ų236150.2 Ų150.289%0.89473%0.731SS**  trans-74.197.9156.8-8065.1000109K22W20-K22 VanDerWaalsContact C-N 3.31Å; W20-K22 PolarHBondContact O-N 2.92Å; W20-K22 VanDerWaalsContact O-N 3.11Å
21K32.2Very low39.8Very low196 Ų196154.6 Ų154.685%0.85274%0.744SS**  trans-77.881.8165.3-87.9-170.5175.3-177.30108.8P19 T23P19-K21 PolarHBondContact O-N 3.37Å; P19-K21 VanDerWaalsContact O-N 3.13Å; K21-T23 PolarHBondContact O-N 3.44Å
22K35.7Very low40Very low171 Ų171152.3 Ų152.374%0.74374%0.74SS**  trans-90.399.8171.8-140.9172.4-173.8177.80109.4W20W20-K22 VanDerWaalsContact C-N 3.31Å; W20-K22 PolarHBondContact O-N 2.92Å; W20-K22 VanDerWaalsContact O-N 3.11Å
23T38.1Very low40.1Very low112 Ų112147.8 Ų147.869%0.68772%0.723SS**  trans32.6134.9143.4-65.30000121.2K21 R25K21-T23 PolarHBondContact O-N 3.44Å; T23-R25 VanDerWaalsContact C-N 3.27Å; T23-R25 PolarHBondContact O-N 3.35Å
24S46.4Very low40.4Very low98 Ų98150.7 Ų150.769%0.68573%0.727SS**SBendtrans-53.811.8-172.1550000120.4T26S24-T26 PolarHBondContact O-N 3.12Å
25R42.7Very low41Very low222 Ų222149.5 Ų149.584%0.83873%0.727SS**THydrogen-bonded Turntrans-72.3-5.7176.8-88.4-171.2-175.1178.12.7114.4T23T23-R25 VanDerWaalsContact C-N 3.27Å; T23-R25 PolarHBondContact O-N 3.35Å
26T40.9Very low41.5Very low97 Ų97150.8 Ų150.860%0.59573%0.726SS**Hα-helixtrans-77.9-17.9178.250.20000114.4S24 V30S24-T26 PolarHBondContact O-N 3.12Å; T26-V30 WeakPolarHBondContact O-CG2 3.45Å; T26-V30 PolarHBondContact O-N 3.47Å
27K38.1Very low42.4Very low172 Ų172145.3 Ų145.375%0.74872%0.72SS**Hα-helixtrans-75.1-31.8-177.3-73.6-168.7176.7-176.10113.8F31K27-F31 PolarHBondContact O-N 2.88Å
28E44.9Very low43.5Very low162 Ų162146.9 Ų146.976%0.75772%0.717SS**Hα-helixtrans-79-37.7179.8-67.1-160.6157.500112.7V30 F31 V32E28-V30 VanDerWaalsContact C-N 3.31Å; E28-V30 PolarHBondContact O-N 2.91Å; E28-F31 PolarHBondContact O-N 3.43Å; E28-F31 VanDerWaalsContact O-N 3.16Å; E28-V32 PolarHBondContact O-N 2.97Å
29V47.5Very low44.4Very low95 Ų95144.6 Ų144.658%0.57671%0.714SS**Hα-helixtrans-66.6-35.1177.9-173.50000111.4F31 L33V29-F31 VanDerWaalsContact C-N 3.29Å; V29-F31 PolarHBondContact O-N 3.18Å; V29-L33 HydrophobicContact CG1-CD1 4.36Å; V29-L33 WeakPolarHBondContact O-CD1 3.23Å; V29-L33 WeakPolarHBondContact O-CG 3.32Å; V29-L33 PolarHBondContact O-N 3.16Å
30V46.4Very low44.7Very low95 Ų95142.2 Ų142.258%0.57671%0.707SS**Hα-helixtrans-69.6-27.1176.7174.40000112.1T26 E28T26-V30 WeakPolarHBondContact O-CG2 3.45Å; T26-V30 PolarHBondContact O-N 3.47Å; E28-V30 VanDerWaalsContact C-N 3.31Å; E28-V30 PolarHBondContact O-N 2.91Å
31F45.6Very low46.2Very low172 Ų172136 Ų13675%0.75469%0.686SS**Hα-helixtrans-74.8-39179.4-167.9-101.7000112.5K27 E28 V29 L33 R34K27-F31 PolarHBondContact O-N 2.88Å; E28-F31 PolarHBondContact O-N 3.43Å; E28-F31 VanDerWaalsContact O-N 3.16Å; V29-F31 VanDerWaalsContact C-N 3.29Å; V29-F31 PolarHBondContact O-N 3.18Å; F31-L33 PolarHBondContact O-N 3.21Å; F31-R34 PolarHBondContact O-N 3.3Å
32V49.4Very low47.1Very low102 Ų102130.8 Ų130.862%0.61867%0.674SS**Hα-helixtrans-67.2-25.8177.6178.60000112.1E28 R34E28-V32 PolarHBondContact O-N 2.97Å; V32-R34 VanDerWaalsContact C-N 3.33Å; V32-R34 PolarHBondContact O-N 3.32Å
33L41.4Very low48.4Very low83 Ų83128.6 Ų128.644%0.43567%0.669SS.*G310 helixtrans-76.2-11.8-177.2-78.4169.2000115.2V29 F31 F41V29-L33 HydrophobicContact CG1-CD1 4.36Å; V29-L33 WeakPolarHBondContact O-CD1 3.23Å; V29-L33 WeakPolarHBondContact O-CG 3.32Å; V29-L33 PolarHBondContact O-N 3.16Å; F31-L33 PolarHBondContact O-N 3.21Å; L33-F41 HydrophobicContact CD2-CD2 4.2Å; L33-F41 HydrophobicContact CD2-CE2 3.24Å; L33-F41 HydrophobicContact CD2-CZ 3.68Å
34R46Very low49.6Very low227 Ų227128 Ų12886%0.85766%0.661SS**G310 helixtrans-86.2-4.5-172.6-116.4-177.6-171.5-166.82.2115.7F31 V32F31-R34 PolarHBondContact O-N 3.3Å; V32-R34 VanDerWaalsContact C-N 3.33Å; V32-R34 PolarHBondContact O-N 3.32Å
35T53.3Low50.5Low121 Ų121126.1 Ų126.174%0.74265%0.648SS**G310 helixtrans-113.110.3-172.449.30000115.1
36L47.8Very low52Low120 Ų120122 Ų12263%0.62864%0.639SS**SBendtrans-113.3135.8-176.2-78.1156.9000113.3
37P51.5Low53.4Low109 Ų109122.7 Ų122.771%0.70864%0.635SS**  trans-70.9136.3-169.127.5-33.2000113.1K39P37-K39 VanDerWaalsContact C-N 3.33Å; P37-K39 PolarHBondContact O-N 3.36Å
38L57.4Low55Low158 Ų158119.5 Ų119.583%0.82763%0.625SS**Hα-helixtrans-63.3-9.8-153.6-68.2161.6000118.4
39K51.6Low56.5Low190 Ų190114.2 Ų114.283%0.82661%0.609SS**Hα-helixtrans-89.8-32.8-176-81.6-177175.9-178.10114.3P37 F41P37-K39 VanDerWaalsContact C-N 3.33Å; P37-K39 PolarHBondContact O-N 3.36Å; K39-F41 VanDerWaalsContact C-N 3.35Å
40G52.9Low58Low48 Ų48116.6 Ų116.650%0.49561%0.614SS.*Hα-helixtrans-72.4-31.3175.300000112.5C42 L43 L44G40-C42 VanDerWaalsContact C-N 3.34Å; G40-C42 PolarHBondContact O-N 2.84Å; G40-L43 PolarHBondContact O-N 3.09Å; G40-L44 PolarHBondContact O-N 3.46Å; G40-L44 VanDerWaalsContact O-N 3.09Å
41F59.6Low59.4Low105 Ų105118.9 Ų118.946%0.46162%0.616SS.*Hα-helixtrans-66.8-32.3-175.5-166.3-107.3000113.5L33 K39 S45L33-F41 HydrophobicContact CD2-CD2 4.2Å; L33-F41 HydrophobicContact CD2-CE2 3.24Å; L33-F41 HydrophobicContact CD2-CZ 3.68Å; K39-F41 VanDerWaalsContact C-N 3.35Å; F41-S45 WeakPolarHBondContact O-CB 3.49Å; F41-S45 PolarHBondContact O-N 2.85Å
42C53Low60.9Low87 Ų87114.1 Ų114.159%0.58860%0.604SS**Hα-helixtrans-70.7-41.3180-147.20000112G40 S45 E46G40-C42 VanDerWaalsContact C-N 3.34Å; G40-C42 PolarHBondContact O-N 2.84Å; C42-S45 PolarHBondContact O-N 3.43Å; C42-E46 PolarHBondContact O-N 3.5Å
43L61.5Low62.4Low125 Ų125115.4 Ų115.465%0.65460%0.603SS**Hα-helixtrans-69-40.9176.2-68.3174.7000111.6G40 S45 E46 E47G40-L43 PolarHBondContact O-N 3.09Å; L43-S45 VanDerWaalsContact C-N 3.28Å; L43-S45 PolarHBondContact O-N 2.93Å; L43-E46 PolarHBondContact O-N 3.05Å; L43-E47 PolarHBondContact O-N 3.36Å; L43-E47 VanDerWaalsContact O-N 3.16Å
44L63.5Low64.3Low100 Ų100113.8 Ų113.852%0.52460%0.602SS.*Hα-helixtrans-65.2-34.3174.9-136.192000111.6G40 I48G40-L44 PolarHBondContact O-N 3.46Å; G40-L44 VanDerWaalsContact O-N 3.09Å; L44-I48 HydrophobicContact CD2-CD1 4.02Å; L44-I48 HydrophobicContact CG-CD1 4.34Å; L44-I48 WeakPolarHBondContact O-CB 3.41Å; L44-I48 WeakPolarHBondContact O-CD1 3.46Å; L44-I48 WeakPolarHBondContact O-CG1 3.34Å; L44-I48 PolarHBondContact O-N 3.17Å
45S66Low65.9Low59 Ų59108.1 Ų108.141%0.41359%0.588SS.*Hα-helixtrans-67.4-42.1179-179.80000112.4F41 C42 L43 A49F41-S45 WeakPolarHBondContact O-CB 3.49Å; F41-S45 PolarHBondContact O-N 2.85Å; C42-S45 PolarHBondContact O-N 3.43Å; L43-S45 VanDerWaalsContact C-N 3.28Å; L43-S45 PolarHBondContact O-N 2.93Å; S45-A49 VanDerWaalsContact O-CB 3.28Å; S45-A49 WeakPolarHBondContact O-CB 3.48Å; S45-A49 PolarHBondContact O-N 3.03Å
46E73.7Confident67.4Low135 Ų135107.3 Ų107.363%0.63158%0.576SS**Hα-helixtrans-66.1-43.2175.4-86179.315600111.1C42 L43 I48 A49 E50C42-E46 PolarHBondContact O-N 3.5Å; L43-E46 PolarHBondContact O-N 3.05Å; E46-I48 PolarHBondContact O-N 3.15Å; E46-A49 PolarHBondContact O-N 3.48Å; E46-E50 PolarHBondContact O-N 2.8Å
47E70.2Confident69.1Low111 Ų111105.2 Ų105.252%0.51957%0.565SS.*Hα-helixtrans-65.2-38178.9-167.9174.7174.700112.3L43 K51L43-E47 PolarHBondContact O-N 3.36Å; L43-E47 VanDerWaalsContact O-N 3.16Å; E47-K51 WeakPolarHBondContact O-CB 3.39Å; E47-K51 WeakPolarHBondContact O-CG 3.3Å; E47-K51 PolarHBondContact O-N 2.62Å; E47-K51 VanDerWaalsContact O-N 3.12Å
48I71.7Confident70.5Confident105 Ų105104.8 Ų104.854%0.53856%0.556SS.*Hα-helixtrans-67.5-40.2173.3-69.5167000110.8L44 E46 S52L44-I48 HydrophobicContact CD2-CD1 4.02Å; L44-I48 HydrophobicContact CG-CD1 4.34Å; L44-I48 WeakPolarHBondContact O-CB 3.41Å; L44-I48 WeakPolarHBondContact O-CD1 3.46Å; L44-I48 WeakPolarHBondContact O-CG1 3.34Å; L44-I48 PolarHBondContact O-N 3.17Å; E46-I48 PolarHBondContact O-N 3.15Å; I48-S52 VanDerWaalsContact O-CB 3.29Å; I48-S52 WeakPolarHBondContact O-CB 3.13Å; I48-S52 PolarHBondContact O-N 3.42Å
49A75.6Confident71.7Confident51 Ų51103.3 Ų103.342%0.42155%0.545SS..Hα-helixtrans-66.1-43.5179.100000111.9S45 E46 S52 Q53S45-A49 VanDerWaalsContact O-CB 3.28Å; S45-A49 WeakPolarHBondContact O-CB 3.48Å; S45-A49 PolarHBondContact O-N 3.03Å; E46-A49 PolarHBondContact O-N 3.48Å; A49-S52 WeakPolarHBondContact O-CB 3.43Å; A49-S52 PolarHBondContact O-N 3.34Å; A49-Q53 WeakPolarHBondContact O-CB 3.21Å; A49-Q53 PolarHBondContact O-N 3.47Å
50E80.4Confident73Confident145 Ų14599.4 Ų99.468%0.67853%0.525SS*.Hα-helixtrans-65.2-44.5178.6-169.2177.717800111.5E46 S52 Q53 A54E46-E50 PolarHBondContact O-N 2.8Å; E50-S52 VanDerWaalsContact C-N 3.33Å; E50-S52 PolarHBondContact O-N 3.48Å; E50-Q53 PolarHBondContact O-N 2.94Å; E50-A54 WeakPolarHBondContact O-CB 3.46Å; E50-A54 PolarHBondContact O-N 3.13Å
51K75.7Confident74.4Confident143 Ų143101.2 Ų101.262%0.62253%0.527SS*.Hα-helixtrans-62.9-38.5173.8-76-176-176.1-125.90112.3E47 L55E47-K51 WeakPolarHBondContact O-CB 3.39Å; E47-K51 WeakPolarHBondContact O-CG 3.3Å; E47-K51 PolarHBondContact O-N 2.62Å; E47-K51 VanDerWaalsContact O-N 3.12Å; K51-L55 VanDerWaalsContact O-CB 3.26Å; K51-L55 WeakPolarHBondContact O-CB 3.26Å; K51-L55 PolarHBondContact O-N 2.86Å
52S76.5Confident75.3Confident72 Ų72101.9 Ų101.950%0.50353%0.531SS..Hα-helixtrans-62.6-44.1176.3-1740000111.3I48 A49 E50 L55 E56I48-S52 VanDerWaalsContact O-CB 3.29Å; I48-S52 WeakPolarHBondContact O-CB 3.13Å; I48-S52 PolarHBondContact O-N 3.42Å; A49-S52 WeakPolarHBondContact O-CB 3.43Å; A49-S52 PolarHBondContact O-N 3.34Å; E50-S52 VanDerWaalsContact C-N 3.33Å; E50-S52 PolarHBondContact O-N 3.48Å; S52-L55 PolarHBondContact O-N 3.36Å; S52-E56 WeakPolarHBondContact O-CB 3.41Å; S52-E56 PolarHBondContact O-N 3.43Å
53Q81.5Confident76.5Confident129 Ų129103 Ų10360%0.60353%0.528SS*.Hα-helixtrans-74-36.5-177.1-156168.3-3.400111.9A49 E50 E56 N57A49-Q53 WeakPolarHBondContact O-CB 3.21Å; A49-Q53 PolarHBondContact O-N 3.47Å; E50-Q53 PolarHBondContact O-N 2.94Å; Q53-E56 PolarHBondContact O-N 3.5Å; Q53-N57 VanDerWaalsContact O-CG 3.3Å; Q53-N57 PolarHBondContact O-N 3.43Å; Q53-N57 PolarHBondContact O-ND2 2.93Å
54A81.1Confident77.1Confident49 Ų49101.7 Ų101.741%0.40552%0.521SS..Hα-helixtrans-63-44170.900000111.7E50 E56 N57 I58E50-A54 WeakPolarHBondContact O-CB 3.46Å; E50-A54 PolarHBondContact O-N 3.13Å; A54-E56 VanDerWaalsContact C-N 3.35Å; A54-E56 PolarHBondContact O-N 2.85Å; A54-N57 PolarHBondContact O-N 2.77Å; A54-I58 WeakPolarHBondContact O-CG1 3.31Å; A54-I58 PolarHBondContact O-N 2.63Å
55L80Confident77.5Confident109 Ų109101 Ų10157%0.57152%0.521SS*.Hα-helixtrans-62.9-42.2176-16478.9000111.1K51 S52 N57 I58 Q59K51-L55 VanDerWaalsContact O-CB 3.26Å; K51-L55 WeakPolarHBondContact O-CB 3.26Å; K51-L55 PolarHBondContact O-N 2.86Å; S52-L55 PolarHBondContact O-N 3.36Å; L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 3.16Å; L55-I58 PolarHBondContact O-N 3.4Å; L55-Q59 VanDerWaalsContact O-CB 3.32Å; L55-Q59 WeakPolarHBondContact O-CB 3.34Å; L55-Q59 PolarHBondContact O-N 3.34Å
56E84Confident77.6Confident103 Ų103102.8 Ų102.848%0.48153%0.525SS..Hα-helixtrans-64.1-39.2178.3-157.7-171.7151.700111.9S52 Q53 A54 Q59 R60S52-E56 WeakPolarHBondContact O-CB 3.41Å; S52-E56 PolarHBondContact O-N 3.43Å; Q53-E56 PolarHBondContact O-N 3.5Å; A54-E56 VanDerWaalsContact C-N 3.35Å; A54-E56 PolarHBondContact O-N 2.85Å; E56-Q59 PolarHBondContact O-N 3.03Å; E56-R60 VanDerWaalsContact CD-NH2 3.31Å; E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.2Å; E56-R60 PolarHBondContact O-N 2.93Å; E56-R60 IonicContact OE1-CZ 3.96Å; E56-R60 IonicContact OE1-NH2 2.81Å; E56-R60 PolarHBondContact OE1-NH2 3.17Å
57N84.3Confident77.3Confident76 Ų76101.8 Ų101.841%0.40652%0.52SS..Hα-helixtrans-66.5-39.7175.2-71.3-23.3000112.2Q53 A54 L55 R60 T61Q53-N57 VanDerWaalsContact O-CG 3.3Å; Q53-N57 PolarHBondContact O-N 3.43Å; Q53-N57 PolarHBondContact O-ND2 2.93Å; A54-N57 PolarHBondContact O-N 2.77Å; L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 3.16Å; N57-R60 PolarHBondContact OD1-NH1 3.5Å; N57-T61 WeakPolarHBondContact O-CB 3.27Å; N57-T61 PolarHBondContact O-N 2.93Å; N57-T61 PolarHBondContact O-OG1 3.28Å
58I80.2Confident77.1Confident101 Ų10198.9 Ų98.952%0.51852%0.52SS..Hα-helixtrans-64.9-44174.2-68.1168.3000110.2A54 L55 T61 H62A54-I58 WeakPolarHBondContact O-CG1 3.31Å; A54-I58 PolarHBondContact O-N 2.63Å; L55-I58 PolarHBondContact O-N 3.4Å; I58-T61 PolarHBondContact O-N 3.29Å; I58-H62 PolarHBondContact O-CD2 2.9Å; I58-H62 PolarHBondContact O-N 2.9Å
59Q82.4Confident76.6Confident127 Ų127102.2 Ų102.259%0.59353%0.531SS*.Hα-helixtrans-64.6-42.6-179.5-155.6172.2-55.100111.2L55 E56 T61 H62 E63L55-Q59 VanDerWaalsContact O-CB 3.32Å; L55-Q59 WeakPolarHBondContact O-CB 3.34Å; L55-Q59 PolarHBondContact O-N 3.34Å; E56-Q59 PolarHBondContact O-N 3.03Å; Q59-T61 VanDerWaalsContact C-N 3.35Å; Q59-T61 PolarHBondContact O-N 3.47Å; Q59-H62 PolarHBondContact O-N 3.28Å; Q59-E63 WeakPolarHBondContact O-CB 3.48Å; Q59-E63 PolarHBondContact O-N 3.32Å
60R80.1Confident75.9Confident108 Ų108103.1 Ų103.141%0.40853%0.528SS..Hα-helixtrans-66.3-35.5175-154-176.9-58.7124.5-0.6112.3E56 N57 E63 N64E56-R60 VanDerWaalsContact CD-NH2 3.31Å; E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.2Å; E56-R60 PolarHBondContact O-N 2.93Å; E56-R60 IonicContact OE1-CZ 3.96Å; E56-R60 IonicContact OE1-NH2 2.81Å; E56-R60 PolarHBondContact OE1-NH2 3.17Å; N57-R60 PolarHBondContact OD1-NH1 3.5Å; R60-E63 PolarHBondContact O-N 3.45Å; R60-N64 WeakPolarHBondContact O-CB 3.49Å; R60-N64 PolarHBondContact O-N 3.49Å; R60-N64 PolarHBondContact O-ND2 2.96Å
61T81.3Confident74.9Confident85 Ų85100.4 Ų100.452%0.52153%0.525SS..Hα-helixtrans-68.4-42.5174.3-53.10000110.9N57 I58 Q59 N64 V65N57-T61 WeakPolarHBondContact O-CB 3.27Å; N57-T61 PolarHBondContact O-N 2.93Å; N57-T61 PolarHBondContact O-OG1 3.28Å; I58-T61 PolarHBondContact O-N 3.29Å; Q59-T61 VanDerWaalsContact C-N 3.35Å; Q59-T61 PolarHBondContact O-N 3.47Å; T61-N64 PolarHBondContact O-N 2.95Å; T61-V65 HydrophobicContact CG2-CG2 4.42Å; T61-V65 WeakPolarHBondContact O-CB 3.36Å; T61-V65 WeakPolarHBondContact O-CG2 3.29Å; T61-V65 PolarHBondContact O-N 3.44Å
62H79.1Confident74.4Confident119 Ų119102.3 Ų102.355%0.55154%0.536SS*.Hα-helixtrans-61.1-43.8172.7-96.2-93.6000111.7I58 Q59 V65 I66I58-H62 PolarHBondContact O-CD2 2.9Å; I58-H62 PolarHBondContact O-N 2.9Å; Q59-H62 PolarHBondContact O-N 3.28Å; H62-V65 PolarHBondContact O-N 3.06Å; H62-I66 VanDerWaalsContact O-CB 3.28Å; H62-I66 WeakPolarHBondContact O-CB 3.46Å; H62-I66 WeakPolarHBondContact O-CD1 3.41Å; H62-I66 WeakPolarHBondContact O-CG1 3.28Å; H62-I66 PolarHBondContact O-N 3.34Å
63E77Confident74.1Confident111 Ų111100.5 Ų100.552%0.51952%0.524SS..Hα-helixtrans-63.3-46.6178.1-166.6164.4-160.500111.3Q59 R60 V65 I66 E67Q59-E63 WeakPolarHBondContact O-CB 3.48Å; Q59-E63 PolarHBondContact O-N 3.32Å; R60-E63 PolarHBondContact O-N 3.45Å; E63-V65 PolarHBondContact O-N 3.32Å; E63-I66 CarbonylContact O-C 3.6Å; E63-I66 PolarHBondContact O-N 3.03Å; E63-E67 WeakPolarHBondContact O-CB 3.42Å; E63-E67 WeakPolarHBondContact O-CG 3.26Å; E63-E67 PolarHBondContact O-N 2.83Å
64N74.5Confident74Confident97 Ų9799.7 Ų99.752%0.51953%0.529SS..Hα-helixtrans-64.6-39.2176.3-69.5-20.8000113R60 T61 G68R60-N64 WeakPolarHBondContact O-CB 3.49Å; R60-N64 PolarHBondContact O-N 3.49Å; R60-N64 PolarHBondContact O-ND2 2.96Å; T61-N64 PolarHBondContact O-N 2.95Å; N64-G68 PolarHBondContact O-N 3.32Å
65V72.9Confident74.1Confident86 Ų86103 Ų10352%0.52154%0.539SS..Hα-helixtrans-67.9-41.3176.4169.90000110.5T61 H62 E63 K69T61-V65 HydrophobicContact CG2-CG2 4.42Å; T61-V65 WeakPolarHBondContact O-CB 3.36Å; T61-V65 WeakPolarHBondContact O-CG2 3.29Å; T61-V65 PolarHBondContact O-N 3.44Å; H62-V65 PolarHBondContact O-N 3.06Å; E63-V65 PolarHBondContact O-N 3.32Å; V65-K69 VanDerWaalsContact O-CB 3.32Å; V65-K69 WeakPolarHBondContact O-CB 3.49Å; V65-K69 WeakPolarHBondContact O-CG 3.5Å; V65-K69 PolarHBondContact O-N 3.15Å
66I67.7Low74.2Confident96 Ų96101 Ų10149%0.49253%0.526SS..Hα-helixtrans-63.6-51.3174-69.5165.5000108.9H62 E63 G68 K69 L70H62-I66 VanDerWaalsContact O-CB 3.28Å; H62-I66 WeakPolarHBondContact O-CB 3.46Å; H62-I66 WeakPolarHBondContact O-CD1 3.41Å; H62-I66 WeakPolarHBondContact O-CG1 3.28Å; H62-I66 PolarHBondContact O-N 3.34Å; E63-I66 CarbonylContact O-C 3.6Å; E63-I66 PolarHBondContact O-N 3.03Å; I66-G68 VanDerWaalsContact C-N 3.35Å; I66-G68 PolarHBondContact O-N 3.5Å; I66-K69 PolarHBondContact O-N 3.2Å; I66-L70 HydrophobicContact CG2-CD2 4.28Å; I66-L70 WeakPolarHBondContact O-CA 3.36Å; I66-L70 WeakPolarHBondContact O-CB 3.46Å; I66-L70 PolarHBondContact O-N 3.45Å
67E67.3Low74.4Confident114 Ų114103 Ų10353%0.53353%0.533SS..Hα-helixtrans-57.6-45.5178.9-76.9-168.4158.800112.5E63 L70 S71E63-E67 WeakPolarHBondContact O-CB 3.42Å; E63-E67 WeakPolarHBondContact O-CG 3.26Å; E63-E67 PolarHBondContact O-N 2.83Å; E67-L70 PolarHBondContact O-N 3.48Å; E67-S71 WeakPolarHBondContact O-CB 3.37Å; E67-S71 PolarHBondContact O-N 3.19Å
68G65.1Low74.6Confident50 Ų50106.4 Ų106.452%0.51555%0.545SS..Hα-helixtrans-64.3-44.5179.300000113.3N64 I66N64-G68 PolarHBondContact O-N 3.32Å; I66-G68 VanDerWaalsContact C-N 3.35Å; I66-G68 PolarHBondContact O-N 3.5Å
69K61.1Low74.9Confident175 Ų175105.1 Ų105.176%0.76154%0.544SS*.Hα-helixtrans-74-35.2176.3-78-93.3-178.6170.90112.6V65 I66 S71V65-K69 VanDerWaalsContact O-CB 3.32Å; V65-K69 WeakPolarHBondContact O-CB 3.49Å; V65-K69 WeakPolarHBondContact O-CG 3.5Å; V65-K69 PolarHBondContact O-N 3.15Å; I66-K69 PolarHBondContact O-N 3.2Å; K69-S71 VanDerWaalsContact C-N 3.32Å
70L61.7Low75.3Confident71 Ų71104.4 Ų104.437%0.37254%0.543SS..Hα-helixtrans-73.5-30.3-175.9-159.373.6000109.5I66 E67 E72 S73 K76I66-L70 HydrophobicContact CG2-CD2 4.28Å; I66-L70 WeakPolarHBondContact O-CA 3.36Å; I66-L70 WeakPolarHBondContact O-CB 3.46Å; I66-L70 PolarHBondContact O-N 3.45Å; E67-L70 PolarHBondContact O-N 3.48Å; L70-E72 PolarHBondContact O-N 2.9Å; L70-S73 PolarHBondContact O-N 3.43Å; L70-S73 VanDerWaalsContact O-N 3.15Å; L70-S73 PolarHBondContact O-OG 3.37Å; L70-K76 HydrophobicContact CD2-CD 4.46Å; L70-K76 HydrophobicContact CD2-CG 4.31Å; L70-K76 HydrophobicContact CG-CD 4.06Å; L70-K76 HydrophobicContact CG-CG 3.79Å; L70-K76 WeakPolarHBondContact O-CD 3.42Å; L70-K76 WeakPolarHBondContact O-CE 3.44Å; L70-K76 WeakPolarHBondContact O-CG 3.24Å
71S60.1Low75.8Confident88 Ų88103 Ų10362%0.61554%0.543SS*.THydrogen-bonded Turntrans-60.5-26.1-178-161.30000115E67 K69 K76E67-S71 WeakPolarHBondContact O-CB 3.37Å; E67-S71 PolarHBondContact O-N 3.19Å; K69-S71 VanDerWaalsContact C-N 3.32Å; S71-K76 VanDerWaalsContact CA-NZ 3.29Å
72E64.3Low76.2Confident183 Ų183106.1 Ų106.186%0.85555%0.546SS*.THydrogen-bonded Turntrans-96.8-1.4179.2-64.1-167.715800113.5L70L70-E72 PolarHBondContact O-N 2.9Å
73S69.4Low76.9Confident34 Ų34102.3 Ų102.324%0.23854%0.535CS..  trans-94.9129.9-169.367.50000113.7L70 I75 K76L70-S73 PolarHBondContact O-N 3.43Å; L70-S73 VanDerWaalsContact O-N 3.15Å; L70-S73 PolarHBondContact O-OG 3.37Å; S73-I75 PolarHBondContact O-N 3.47Å; S73-K76 PolarHBondContact O-N 3.38Å; S73-K76 VanDerWaalsContact O-N 3.14Å
74P80.8Confident77.5Confident111 Ų111100.3 Ų100.372%0.72153%0.534SS*.Hα-helixtrans-59.5-17.1176.723.5-33.9000113.8K76 F77 F78P74-K76 VanDerWaalsContact C-N 3.29Å; P74-K76 PolarHBondContact O-N 3.07Å; P74-F77 PolarHBondContact O-N 2.67Å; P74-F78 PolarHBondContact O-N 2.94Å; P74-F78 VanDerWaalsContact O-N 3.16Å
75I83.6Confident78.4Confident118 Ų118100.2 Ų100.261%0.60554%0.536SS*.Hα-helixtrans-56.8-37.4173.7-85.5165000112.6S73 F77 F78 C79S73-I75 PolarHBondContact O-N 3.47Å; I75-F77 PolarHBondContact O-N 2.87Å; I75-F78 PolarHBondContact O-N 3.45Å; I75-C79 WeakPolarHBondContact O-CB 3.3Å; I75-C79 PolarHBondContact O-N 2.94Å
76K81.1Confident79.3Confident69 Ų6996.9 Ų96.930%0.352%0.519SS..Hα-helixtrans-60.7-47.6177.9-76.3-170.5171.2177.20111.2L70 S71 S73 P74 F78 C79 I80L70-K76 HydrophobicContact CD2-CD 4.46Å; L70-K76 HydrophobicContact CD2-CG 4.31Å; L70-K76 HydrophobicContact CG-CD 4.06Å; L70-K76 HydrophobicContact CG-CG 3.79Å; L70-K76 WeakPolarHBondContact O-CD 3.42Å; L70-K76 WeakPolarHBondContact O-CE 3.44Å; L70-K76 WeakPolarHBondContact O-CG 3.24Å; S71-K76 VanDerWaalsContact CA-NZ 3.29Å; S73-K76 PolarHBondContact O-N 3.38Å; S73-K76 VanDerWaalsContact O-N 3.14Å; P74-K76 VanDerWaalsContact C-N 3.29Å; P74-K76 PolarHBondContact O-N 3.07Å; K76-F78 VanDerWaalsContact C-N 3.34Å; K76-F78 PolarHBondContact O-N 2.73Å; K76-C79 PolarHBondContact O-N 3.44Å; K76-I80 VanDerWaalsContact O-CG1 3.3Å; K76-I80 WeakPolarHBondContact O-CG1 3.2Å; K76-I80 PolarHBondContact O-N 3.3Å
77F87.6Confident80.4Confident143 Ų14396.6 Ų96.663%0.62752%0.518SS*.Hα-helixtrans-63.7-42.6-179.3-175.4-103.6000111.3P74 I75 C79 I80 L81P74-F77 PolarHBondContact O-N 2.67Å; I75-F77 PolarHBondContact O-N 2.87Å; F77-C79 PolarHBondContact O-N 3.3Å; F77-I80 PolarHBondContact O-N 2.84Å; F77-L81 HydrophobicContact CD1-CD1 3.79Å; F77-L81 HydrophobicContact CD1-CG 4.37Å; F77-L81 HydrophobicContact CE1-CD1 3.28Å; F77-L81 HydrophobicContact CE1-CG 4.01Å; F77-L81 HydrophobicContact CZ-CD1 3.78Å; F77-L81 HydrophobicContact CZ-CD2 4.4Å; F77-L81 HydrophobicContact CZ-CG 4.12Å; F77-L81 WeakPolarHBondContact O-CG 3.29Å; F77-L81 PolarHBondContact O-N 3.49Å
78F88.3Confident81.6Confident149 Ų14994.3 Ų94.365%0.65451%0.513SS*.Hα-helixtrans-61.2-42.6174.2-174.5-96.9000112.4P74 I75 K76 L81 Y82P74-F78 PolarHBondContact O-N 2.94Å; P74-F78 VanDerWaalsContact O-N 3.16Å; I75-F78 PolarHBondContact O-N 3.45Å; K76-F78 VanDerWaalsContact C-N 3.34Å; K76-F78 PolarHBondContact O-N 2.73Å; F78-L81 PolarHBondContact O-N 3Å; F78-Y82 VanDerWaalsContact O-CB 3.32Å; F78-Y82 WeakPolarHBondContact O-CB 3.2Å; F78-Y82 PolarHBondContact O-N 3.49Å
79C88Confident82.8Confident74 Ų7497 Ų9750%0.552%0.515SS..Hα-helixtrans-63.6-41.7176.7-173.40000112.1I75 K76 F77 Y82 A83I75-C79 WeakPolarHBondContact O-CB 3.3Å; I75-C79 PolarHBondContact O-N 2.94Å; K76-C79 PolarHBondContact O-N 3.44Å; F77-C79 PolarHBondContact O-N 3.3Å; C79-Y82 PolarHBondContact O-N 3.26Å; C79-A83 VanDerWaalsContact O-CB 3.25Å; C79-A83 WeakPolarHBondContact O-CB 3.41Å; C79-A83 PolarHBondContact O-N 3.48Å
80I90.5Very high84Confident111 Ų11190.9 Ų90.957%0.56950%0.497SS*.Hα-helixtrans-64.9-42.8176.8-66.9164.6000111K76 F77 A83 S84K76-I80 VanDerWaalsContact O-CG1 3.3Å; K76-I80 WeakPolarHBondContact O-CG1 3.2Å; K76-I80 PolarHBondContact O-N 3.3Å; F77-I80 PolarHBondContact O-N 2.84Å; I80-A83 PolarHBondContact O-N 3.47Å; I80-S84 WeakPolarHBondContact O-CB 3.42Å; I80-S84 PolarHBondContact O-N 3.47Å; I80-S84 PolarHBondContact O-OG 2.83Å
81L89.8Confident85.1Confident79 Ų7993.3 Ų93.341%0.41451%0.51SS..Hα-helixtrans-64.7-42.2175.4-76.3179.7000112.4F77 F78 A83 S84 V85F77-L81 HydrophobicContact CD1-CD1 3.79Å; F77-L81 HydrophobicContact CD1-CG 4.37Å; F77-L81 HydrophobicContact CE1-CD1 3.28Å; F77-L81 HydrophobicContact CE1-CG 4.01Å; F77-L81 HydrophobicContact CZ-CD1 3.78Å; F77-L81 HydrophobicContact CZ-CD2 4.4Å; F77-L81 HydrophobicContact CZ-CG 4.12Å; F77-L81 WeakPolarHBondContact O-CG 3.29Å; F77-L81 PolarHBondContact O-N 3.49Å; F78-L81 PolarHBondContact O-N 3Å; L81-A83 VanDerWaalsContact C-N 3.34Å; L81-S84 PolarHBondContact O-N 3.38Å; L81-S84 PolarHBondContact O-OG 2.92Å; L81-V85 PolarHBondContact O-N 3.38Å
82Y91.1Very high86.5Confident150 Ų15093 Ų9359%0.58850%0.504SS*.Iπ-helixtrans-63.9-40.5174.6176.8-98.4000111.4F78 C79 G86 I87F78-Y82 VanDerWaalsContact O-CB 3.32Å; F78-Y82 WeakPolarHBondContact O-CB 3.2Å; F78-Y82 PolarHBondContact O-N 3.49Å; C79-Y82 PolarHBondContact O-N 3.26Å; Y82-G86 WeakPolarHBondContact O-CA 3.42Å; Y82-G86 PolarHBondContact O-N 2.87Å; Y82-I87 PolarHBondContact O-N 2.92Å
83A93.3Very high87.6Confident39 Ų3988 Ų8832%0.32249%0.486SS..Iπ-helixtrans-66.8-41.6177.200000111.7C79 I80 L81 I87C79-A83 VanDerWaalsContact O-CB 3.25Å; C79-A83 WeakPolarHBondContact O-CB 3.41Å; C79-A83 PolarHBondContact O-N 3.48Å; I80-A83 PolarHBondContact O-N 3.47Å; L81-A83 VanDerWaalsContact C-N 3.34Å; A83-I87 HydrophobicContact CB-CD1 3.84Å; A83-I87 WeakPolarHBondContact O-CB 3.15Å; A83-I87 WeakPolarHBondContact O-CD1 3.36Å; A83-I87 WeakPolarHBondContact O-CG1 3.47Å
84S89.8Confident88.3Confident69 Ų6988.4 Ų88.448%0.48349%0.487SS..Iπ-helixtrans-75.1-38.2-176.366.10000113.6I80 L81 P88I80-S84 WeakPolarHBondContact O-CB 3.42Å; I80-S84 PolarHBondContact O-N 3.47Å; I80-S84 PolarHBondContact O-OG 2.83Å; L81-S84 PolarHBondContact O-N 3.38Å; L81-S84 PolarHBondContact O-OG 2.92Å; S84-P88 VanDerWaalsContact O-CD 3.26Å; S84-P88 WeakPolarHBondContact O-CD 3.33Å; S84-P88 VanDerWaalsContact O-CG 3.27Å; S84-P88 WeakPolarHBondContact O-CG 3.34Å
85V92.7Very high88.5Confident95 Ų9584.4 Ų84.458%0.57647%0.466SS*.Iπ-helixtrans-99.3-41.9-178.9-178.20000111.7L81 L89L81-V85 PolarHBondContact O-N 3.38Å; V85-L89 VanDerWaalsContact O-CB 3.23Å; V85-L89 WeakPolarHBondContact O-CB 3.03Å; V85-L89 PolarHBondContact O-N 2.83Å
86G91Very high88.6Confident16 Ų1683.5 Ų83.517%0.16546%0.462CS..Iπ-helixtrans-72.3-40.5-174.100000113.5Y82 L89 A90Y82-G86 WeakPolarHBondContact O-CA 3.42Å; Y82-G86 PolarHBondContact O-N 2.87Å; G86-L89 PolarHBondContact O-N 3.41Å; G86-A90 WeakPolarHBondContact O-CB 3.38Å; G86-A90 PolarHBondContact O-N 2.7Å
87I91Very high88.8Confident91 Ų9185.3 Ų85.347%0.46747%0.47SS..Hα-helixtrans-65.1-49.3179.8-59168.9000111.2Y82 A83 L89 A90 L91Y82-I87 PolarHBondContact O-N 2.92Å; A83-I87 HydrophobicContact CB-CD1 3.84Å; A83-I87 WeakPolarHBondContact O-CB 3.15Å; A83-I87 WeakPolarHBondContact O-CD1 3.36Å; A83-I87 WeakPolarHBondContact O-CG1 3.47Å; I87-L89 VanDerWaalsContact C-N 3.34Å; I87-L89 PolarHBondContact O-N 3.45Å; I87-A90 PolarHBondContact O-N 3.24Å; I87-L91 HydrophobicContact CG2-CD1 4.12Å; I87-L91 HydrophobicContact CG2-CG 4.47Å; I87-L91 WeakPolarHBondContact O-CG 3.2Å; I87-L91 PolarHBondContact O-N 2.96Å
88P92.6Very high88.4Confident66 Ų6678.6 Ų78.643%0.42944%0.441SS..Hα-helixtrans-60.9-41.4175-2536.3000112.8S84 L91 V92S84-P88 VanDerWaalsContact O-CD 3.26Å; S84-P88 WeakPolarHBondContact O-CD 3.33Å; S84-P88 VanDerWaalsContact O-CG 3.27Å; S84-P88 WeakPolarHBondContact O-CG 3.34Å; P88-L91 PolarHBondContact O-N 3.01Å; P88-V92 WeakPolarHBondContact O-CG2 3.37Å; P88-V92 PolarHBondContact O-N 3.37Å
89L90Very high88.2Confident106 Ų10677.6 Ų77.656%0.55544%0.437SS*.Hα-helixtrans-65.8-39.6178.9-17165.7000111.8V85 G86 I87 V92 T93V85-L89 VanDerWaalsContact O-CB 3.23Å; V85-L89 WeakPolarHBondContact O-CB 3.03Å; V85-L89 PolarHBondContact O-N 2.83Å; G86-L89 PolarHBondContact O-N 3.41Å; I87-L89 VanDerWaalsContact C-N 3.34Å; I87-L89 PolarHBondContact O-N 3.45Å; L89-V92 PolarHBondContact O-N 3.26Å; L89-T93 WeakPolarHBondContact O-CB 3.2Å; L89-T93 VanDerWaalsContact O-CG2 3.25Å; L89-T93 WeakPolarHBondContact O-CG2 3.32Å; L89-T93 PolarHBondContact O-N 3.02Å; L89-T93 PolarHBondContact O-OG1 3.33Å
90A86.2Confident88Confident46 Ų4680.7 Ų80.738%0.3844%0.442SS..Hα-helixtrans-63-43.6173.700000111.3G86 I87 T93 V94G86-A90 WeakPolarHBondContact O-CB 3.38Å; G86-A90 PolarHBondContact O-N 2.7Å; I87-A90 PolarHBondContact O-N 3.24Å; A90-T93 WeakPolarHBondContact CA-OG1 3.29Å; A90-T93 PolarHBondContact O-N 2.84Å; A90-T93 PolarHBondContact O-OG1 2.87Å; A90-V94 WeakPolarHBondContact O-CB 3.41Å; A90-V94 WeakPolarHBondContact O-CG2 3.42Å; A90-V94 PolarHBondContact O-N 3.42Å
91L86.7Confident87.6Confident123 Ų12376.2 Ų76.264%0.64442%0.419SS*.Hα-helixtrans-64.2-43.3176.8-72.2172.7000112.3I87 P88 G95I87-L91 HydrophobicContact CG2-CD1 4.12Å; I87-L91 HydrophobicContact CG2-CG 4.47Å; I87-L91 WeakPolarHBondContact O-CG 3.2Å; I87-L91 PolarHBondContact O-N 2.96Å; P88-L91 PolarHBondContact O-N 3.01Å; L91-G95 PolarHBondContact O-N 2.83Å
92V89.4Confident87Confident82 Ų8274 Ų7450%0.49741%0.412SS..Hα-helixtrans-66.2-42.5177.6170.60000111.3P88 L89 G95 N96P88-V92 WeakPolarHBondContact O-CG2 3.37Å; P88-V92 PolarHBondContact O-N 3.37Å; L89-V92 PolarHBondContact O-N 3.26Å; V92-G95 PolarHBondContact O-N 3.48Å; V92-N96 WeakPolarHBondContact O-CB 3.21Å; V92-N96 VanDerWaalsContact O-CG 3.28Å; V92-N96 PolarHBondContact O-N 2.83Å; V92-N96 PolarHBondContact O-ND2 2.88Å
93T87.2Confident86.5Confident77 Ų7772.2 Ų72.247%0.47241%0.413SS..Hα-helixtrans-66.3-43.9178.349.30000111.5L89 A90 N96 F97L89-T93 WeakPolarHBondContact O-CB 3.2Å; L89-T93 VanDerWaalsContact O-CG2 3.25Å; L89-T93 WeakPolarHBondContact O-CG2 3.32Å; L89-T93 PolarHBondContact O-N 3.02Å; L89-T93 PolarHBondContact O-OG1 3.33Å; A90-T93 WeakPolarHBondContact CA-OG1 3.29Å; A90-T93 PolarHBondContact O-N 2.84Å; A90-T93 PolarHBondContact O-OG1 2.87Å; T93-N96 PolarHBondContact O-N 3.23Å; T93-F97 WeakPolarHBondContact O-CB 3.34Å; T93-F97 PolarHBondContact O-N 3.35Å
94V84.6Confident85.8Confident43 Ų4377.4 Ų77.426%0.26143%0.425SS..Hα-helixtrans-59.9-47.4173.7171.10000110.6A90 N96 F97 S98 L205 T209A90-V94 WeakPolarHBondContact O-CB 3.41Å; A90-V94 WeakPolarHBondContact O-CG2 3.42Å; A90-V94 PolarHBondContact O-N 3.42Å; V94-N96 PolarHBondContact O-N 3.42Å; V94-F97 PolarHBondContact O-N 3.49Å; V94-S98 WeakPolarHBondContact O-CB 3.39Å; V94-S98 PolarHBondContact O-N 2.85Å; V94-S98 PolarHBondContact O-OG 3.44Å; V94-L205 HydrophobicContact CG2-CD2 4.38Å; V94-T209 HydrophobicContact CG1-CG2 4.14Å
95G83.5Confident85.4Confident27 Ų2775.4 Ų75.428%0.27841%0.408SS..Hα-helixtrans-65.2-32.5179.600000114.7L91 V92 S98 K99L91-G95 PolarHBondContact O-N 2.83Å; V92-G95 PolarHBondContact O-N 3.48Å; G95-S98 WeakPolarHBondContact CA-OG 3.25Å; G95-S98 PolarHBondContact O-OG 3.36Å; G95-K99 WeakPolarHBondContact O-CG 3.37Å; G95-K99 PolarHBondContact O-N 3.39Å
96N86.9Confident84.6Confident98 Ų9871.7 Ų71.752%0.52439%0.386SS..Hα-helixtrans-78.5-40.8175.6-73.3-15.4000111.8V92 T93 V94 S98 K99 F100V92-N96 WeakPolarHBondContact O-CB 3.21Å; V92-N96 VanDerWaalsContact O-CG 3.28Å; V92-N96 PolarHBondContact O-N 2.83Å; V92-N96 PolarHBondContact O-ND2 2.88Å; T93-N96 PolarHBondContact O-N 3.23Å; V94-N96 PolarHBondContact O-N 3.42Å; N96-S98 VanDerWaalsContact C-N 3.26Å; N96-S98 PolarHBondContact O-N 3.32Å; N96-K99 PolarHBondContact O-N 2.74Å; N96-F100 WeakPolarHBondContact O-CB 3.23Å; N96-F100 PolarHBondContact O-N 3.39Å
97F83.7Confident84Confident107 Ų10774.7 Ų74.747%0.46941%0.405SS..Hα-helixtrans-65.6-37.1178.7-161-79.3000111T93 V94 T101 I206T93-F97 WeakPolarHBondContact O-CB 3.34Å; T93-F97 PolarHBondContact O-N 3.35Å; V94-F97 PolarHBondContact O-N 3.49Å; F97-T101 WeakPolarHBondContact CE1-OG1 3.29Å; F97-T101 WeakPolarHBondContact O-CB 3.19Å; F97-T101 PolarHBondContact O-N 2.97Å; F97-T101 PolarHBondContact O-OG1 3.47Å; F97-I206 HydrophobicContact CD1-CB 4.12Å; F97-I206 HydrophobicContact CD1-CD1 3.31Å; F97-I206 HydrophobicContact CD1-CG1 3.51Å; F97-I206 HydrophobicContact CD1-CG2 3.49Å; F97-I206 VanDerWaalsContact CD1-CG2 3.49Å; F97-I206 HydrophobicContact CE1-CB 4.39Å; F97-I206 HydrophobicContact CE1-CD1 3.21Å; F97-I206 HydrophobicContact CE1-CG1 3.91Å; F97-I206 HydrophobicContact CE1-CG2 3.76Å; F97-I206 HydrophobicContact CG-CD1 4.18Å; F97-I206 HydrophobicContact CG-CG1 4.38Å; F97-I206 HydrophobicContact CZ-CD1 4.01Å
98S80.6Confident83.6Confident2 Ų273 Ų731%0.01440%0.396CS..Hα-helixtrans-61.2-56.4175.375.30000109.2V94 G95 N96 F100 T101 A102 M210V94-S98 WeakPolarHBondContact O-CB 3.39Å; V94-S98 PolarHBondContact O-N 2.85Å; V94-S98 PolarHBondContact O-OG 3.44Å; G95-S98 WeakPolarHBondContact CA-OG 3.25Å; G95-S98 PolarHBondContact O-OG 3.36Å; N96-S98 VanDerWaalsContact C-N 3.26Å; N96-S98 PolarHBondContact O-N 3.32Å; S98-F100 VanDerWaalsContact C-N 3.35Å; S98-F100 PolarHBondContact O-N 2.88Å; S98-T101 CarbonylContact O-C 3.53Å; S98-T101 WeakPolarHBondContact O-CA 3.43Å; S98-T101 WeakPolarHBondContact O-CB 3.46Å; S98-T101 PolarHBondContact O-N 3.25Å; S98-A102 PolarHBondContact O-N 3.13Å; S98-M210 VanDerWaalsContact C-CE 3.41Å; S98-M210 VanDerWaalsContact O-CG 3.32Å; S98-M210 WeakPolarHBondContact O-CG 3.37Å; S98-M210 WeakPolarHBondContact OG-CE 3.35Å
99K83.3Confident82.9Confident129 Ų12972.3 Ų72.356%0.56139%0.385SS*.Hα-helixtrans-51.3-47.9175.4-72.3179.8179.7-166.50113.9G95 N96 T101 A102 D103G95-K99 WeakPolarHBondContact O-CG 3.37Å; G95-K99 PolarHBondContact O-N 3.39Å; N96-K99 PolarHBondContact O-N 2.74Å; K99-T101 PolarHBondContact O-N 3.43Å; K99-A102 WeakPolarHBondContact O-CB 3.44Å; K99-A102 PolarHBondContact O-N 3.03Å; K99-A102 VanDerWaalsContact O-N 3.09Å; K99-D103 PolarHBondContact O-N 3.33Å
100F85.3Confident82.2Confident138 Ų13874.5 Ų74.561%0.60539%0.386SS*.Hα-helixtrans-57.8-39.4176.1177.4-97.2000112.3N96 S98 D103 Y104N96-F100 WeakPolarHBondContact O-CB 3.23Å; N96-F100 PolarHBondContact O-N 3.39Å; S98-F100 VanDerWaalsContact C-N 3.35Å; S98-F100 PolarHBondContact O-N 2.88Å; F100-D103 PolarHBondContact O-N 3.49Å; F100-Y104 PolarHBondContact O-N 3.46Å; F100-Y104 VanDerWaalsContact O-N 3.1Å
101T81Confident82Confident17 Ų1779.1 Ų79.110%0.10440%0.395CS..Hα-helixtrans-70.4-36.1177-55.50000111.7F97 S98 K99 Y104 F105 I206F97-T101 WeakPolarHBondContact CE1-OG1 3.29Å; F97-T101 WeakPolarHBondContact O-CB 3.19Å; F97-T101 PolarHBondContact O-N 2.97Å; F97-T101 PolarHBondContact O-OG1 3.47Å; S98-T101 CarbonylContact O-C 3.53Å; S98-T101 WeakPolarHBondContact O-CA 3.43Å; S98-T101 WeakPolarHBondContact O-CB 3.46Å; S98-T101 PolarHBondContact O-N 3.25Å; K99-T101 PolarHBondContact O-N 3.43Å; T101-Y104 WeakPolarHBondContact O-CB 3.23Å; T101-Y104 PolarHBondContact O-N 2.89Å; T101-F105 HydrophobicContact CG2-CD2 3.66Å; T101-F105 HydrophobicContact CG2-CE2 3.34Å; T101-F105 HydrophobicContact CG2-CZ 4.32Å; T101-F105 WeakPolarHBondContact O-CD2 3.48Å; T101-F105 PolarHBondContact O-N 3.42Å; T101-I206 HydrophobicContact CG2-CG2 4.02Å; T101-I206 WeakPolarHBondContact OG1-CG2 3.46Å
102A77.4Confident81.7Confident32 Ų3276.8 Ų76.826%0.26438%0.383SS..Hα-helixtrans-62.5-41.8171.600000112.3S98 K99 Y104 F105 S106 M210S98-A102 PolarHBondContact O-N 3.13Å; K99-A102 WeakPolarHBondContact O-CB 3.44Å; K99-A102 PolarHBondContact O-N 3.03Å; K99-A102 VanDerWaalsContact O-N 3.09Å; A102-Y104 VanDerWaalsContact C-N 3.3Å; A102-Y104 PolarHBondContact O-N 3.34Å; A102-F105 PolarHBondContact O-N 3Å; A102-S106 WeakPolarHBondContact O-CB 3.23Å; A102-S106 PolarHBondContact O-N 3.46Å; A102-M210 HydrophobicContact CB-SD 3.39Å; A102-M210 WeakPolarHBondContact CB-SD 3.2Å
103D80.2Confident81.2Confident113 Ų11377.2 Ų77.260%0.60438%0.378SS*.Hα-helixtrans-61.4-41.9175.6-66.3-22.4000111K99 F100 S106 S107K99-D103 PolarHBondContact O-N 3.33Å; F100-D103 PolarHBondContact O-N 3.49Å; D103-S106 PolarHBondContact O-N 2.87Å; D103-S107 VanDerWaalsContact O-CB 3.29Å; D103-S107 WeakPolarHBondContact O-CB 3.41Å; D103-S107 PolarHBondContact O-N 3.38Å
104Y79.8Confident80.6Confident148 Ų14882.8 Ų82.858%0.5839%0.39SS*.Hα-helixtrans-60.7-45173.7-179.3-96.9000112.1F100 T101 A102 S107 L108F100-Y104 PolarHBondContact O-N 3.46Å; F100-Y104 VanDerWaalsContact O-N 3.1Å; T101-Y104 WeakPolarHBondContact O-CB 3.23Å; T101-Y104 PolarHBondContact O-N 2.89Å; A102-Y104 VanDerWaalsContact C-N 3.3Å; A102-Y104 PolarHBondContact O-N 3.34Å; Y104-S107 WeakPolarHBondContact O-CB 3.11Å; Y104-S107 PolarHBondContact O-N 3.06Å; Y104-L108 WeakPolarHBondContact O-CB 2.92Å; Y104-L108 PolarHBondContact O-N 3.49Å
105F80.1Confident80.1Confident28 Ų2884.1 Ų84.112%0.12340%0.399CS..Hα-helixtrans-71.5-32.7178.5-75.9-56.6000113.6T101 A102 L108 Y109 I146 I207T101-F105 HydrophobicContact CG2-CD2 3.66Å; T101-F105 HydrophobicContact CG2-CE2 3.34Å; T101-F105 HydrophobicContact CG2-CZ 4.32Å; T101-F105 WeakPolarHBondContact O-CD2 3.48Å; T101-F105 PolarHBondContact O-N 3.42Å; A102-F105 PolarHBondContact O-N 3Å; F105-L108 HydrophobicContact CD1-CD2 4.01Å; F105-L108 HydrophobicContact CE1-CD2 4.39Å; F105-L108 PolarHBondContact O-N 3.36Å; F105-Y109 WeakPolarHBondContact O-CB 3.44Å; F105-Y109 PolarHBondContact O-N 2.75Å; F105-I146 HydrophobicContact CB-CD1 4.29Å; F105-I146 HydrophobicContact CD1-CD1 3.62Å; F105-I146 HydrophobicContact CD1-CG1 4.47Å; F105-I146 HydrophobicContact CD1-CG2 4.25Å; F105-I146 HydrophobicContact CE1-CD1 4.1Å; F105-I146 HydrophobicContact CE1-CG2 3.66Å; F105-I146 HydrophobicContact CE2-CG2 4.22Å; F105-I146 HydrophobicContact CG-CD1 4.01Å; F105-I146 HydrophobicContact CZ-CG2 3.65Å; F105-I207 HydrophobicContact CE2-CG1 4.41Å
106S76.6Confident79.2Confident17 Ų1787 Ų8712%0.11942%0.415CS..Hα-helixtrans-67.1-42.9173-174.40000110.4A102 D103 L108 Y109 W110 Y136A102-S106 WeakPolarHBondContact O-CB 3.23Å; A102-S106 PolarHBondContact O-N 3.46Å; D103-S106 PolarHBondContact O-N 2.87Å; S106-L108 PolarHBondContact O-N 2.88Å; S106-Y109 WeakPolarHBondContact O-CB 3.28Å; S106-Y109 PolarHBondContact O-N 3.36Å; S106-W110 VanDerWaalsContact O-CD1 3.32Å; S106-W110 PolarHBondContact O-N 3.2Å; S106-Y136 PolarHBondContact OG-O 3.08Å
107S78.2Confident77.8Confident78 Ų7886.1 Ų86.155%0.54541%0.413SS..Hα-helixtrans-59.6-44.5170.7-175.60000111.7D103 Y104 Y109 W110 Y111D103-S107 VanDerWaalsContact O-CB 3.29Å; D103-S107 WeakPolarHBondContact O-CB 3.41Å; D103-S107 PolarHBondContact O-N 3.38Å; Y104-S107 WeakPolarHBondContact O-CB 3.11Å; Y104-S107 PolarHBondContact O-N 3.06Å; S107-Y109 PolarHBondContact O-N 2.97Å; S107-W110 PolarHBondContact O-N 2.87Å; S107-Y111 WeakPolarHBondContact O-CB 3.46Å; S107-Y111 PolarHBondContact O-N 3.46Å
108L81.8Confident76.1Confident56 Ų5686.4 Ų86.429%0.29343%0.426SS..Hα-helixtrans-61.6-41.1175.1-178.365000112Y104 F105 S106 Y111 L112Y104-L108 WeakPolarHBondContact O-CB 2.92Å; Y104-L108 PolarHBondContact O-N 3.49Å; F105-L108 HydrophobicContact CD1-CD2 4.01Å; F105-L108 HydrophobicContact CE1-CD2 4.39Å; F105-L108 PolarHBondContact O-N 3.36Å; S106-L108 PolarHBondContact O-N 2.88Å; L108-Y111 PolarHBondContact O-N 2.83Å; L108-L112 HydrophobicContact CD1-CD1 4.19Å; L108-L112 HydrophobicContact CD2-CD1 4.45Å; L108-L112 HydrophobicContact CG-CD1 3.86Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 2.74Å
109Y77.8Confident74.5Confident51 Ų5191.4 Ų91.420%0.246%0.461CS..Hα-helixtrans-61.4-48.3175.4170.4-101.8000111.3F105 S106 S107 Y111 L112 K113 A138 P139 F142F105-Y109 WeakPolarHBondContact O-CB 3.44Å; F105-Y109 PolarHBondContact O-N 2.75Å; S106-Y109 WeakPolarHBondContact O-CB 3.28Å; S106-Y109 PolarHBondContact O-N 3.36Å; S107-Y109 PolarHBondContact O-N 2.97Å; Y109-Y111 VanDerWaalsContact C-N 3.29Å; Y109-Y111 PolarHBondContact O-N 3.41Å; Y109-L112 PolarHBondContact O-N 3.3Å; Y109-K113 HydrophobicContact CE1-CD 4.28Å; Y109-K113 VanDerWaalsContact O-CB 3.26Å; Y109-K113 WeakPolarHBondContact O-CB 3.39Å; Y109-K113 PolarHBondContact O-N 2.88Å; Y109-A138 HydrophobicContact CG-CB 4.37Å; Y109-P139 HydrophobicContact CE2-CG 4.02Å; Y109-F142 HydrophobicContact CD2-CD1 4.11Å; Y109-F142 HydrophobicContact CD2-CD2 4.01Å; Y109-F142 HydrophobicContact CD2-CE1 4.13Å; Y109-F142 HydrophobicContact CD2-CE2 4.05Å; Y109-F142 HydrophobicContact CD2-CG 4.04Å; Y109-F142 HydrophobicContact CD2-CZ 4.1Å; Y109-F142 HydrophobicContact CG-CE1 4.32Å
110W75.4Confident72.5Confident152 Ų15293.2 Ų93.258%0.57648%0.475SS*.Hα-helixtrans-62.2-38.2176.8-83.8111000112.1S106 S107 K113 W114S106-W110 VanDerWaalsContact O-CD1 3.32Å; S106-W110 PolarHBondContact O-N 3.2Å; S107-W110 PolarHBondContact O-N 2.87Å; W110-K113 PolarHBondContact O-N 2.92Å; W110-W114 VanDerWaalsContact O-CB 3.28Å; W110-W114 WeakPolarHBondContact O-CB 3.4Å; W110-W114 PolarHBondContact O-N 2.81Å
111Y82Confident70.4Confident144 Ų14491.1 Ų91.157%0.56548%0.477SS*.Hα-helixtrans-65.9-47.4174.6-178.2-98.3000112.7S107 L108 Y109 K113 W114 T115S107-Y111 WeakPolarHBondContact O-CB 3.46Å; S107-Y111 PolarHBondContact O-N 3.46Å; L108-Y111 PolarHBondContact O-N 2.83Å; Y109-Y111 VanDerWaalsContact C-N 3.29Å; Y109-Y111 PolarHBondContact O-N 3.41Å; Y111-K113 VanDerWaalsContact C-N 3.29Å; Y111-K113 PolarHBondContact O-N 3.29Å; Y111-W114 PolarHBondContact O-N 3.3Å; Y111-T115 HydrophobicContact CD1-CG2 4.49Å; Y111-T115 HydrophobicContact CE1-CG2 4.06Å; Y111-T115 HydrophobicContact CE2-CG2 4.39Å; Y111-T115 WeakPolarHBondContact O-CG2 3.42Å; Y111-T115 PolarHBondContact O-N 2.95Å; Y111-T115 PolarHBondContact O-OG1 3.49Å; Y111-T115 VanDerWaalsContact O-OG1 3.09Å
112L81.1Confident68.2Low73 Ų7397.2 Ų97.238%0.38251%0.508SS..Hα-helixtrans-59.6-41173.8-85156.9000111.4L108 Y109 T115 S116 F142L108-L112 HydrophobicContact CD1-CD1 4.19Å; L108-L112 HydrophobicContact CD2-CD1 4.45Å; L108-L112 HydrophobicContact CG-CD1 3.86Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 2.74Å; Y109-L112 PolarHBondContact O-N 3.3Å; L112-T115 WeakPolarHBondContact CA-OG1 3.47Å; L112-T115 PolarHBondContact O-N 3.46Å; L112-T115 PolarHBondContact O-OG1 3.34Å; L112-S116 VanDerWaalsContact O-CB 3.22Å; L112-S116 WeakPolarHBondContact O-CB 3.13Å; L112-S116 PolarHBondContact O-N 2.99Å; L112-S116 PolarHBondContact O-OG 2.96Å; L112-F142 HydrophobicContact CD1-CE2 4.15Å; L112-F142 HydrophobicContact CD1-CZ 4Å
113K78.9Confident66.2Low92 Ų92102.5 Ų102.540%0.453%0.53SS..Hα-helixtrans-65.3-46.7176.6-176.1141.8-179.1175.60111.3Y109 W110 Y111 T115 S116 T117Y109-K113 HydrophobicContact CE1-CD 4.28Å; Y109-K113 VanDerWaalsContact O-CB 3.26Å; Y109-K113 WeakPolarHBondContact O-CB 3.39Å; Y109-K113 PolarHBondContact O-N 2.88Å; W110-K113 PolarHBondContact O-N 2.92Å; Y111-K113 VanDerWaalsContact C-N 3.29Å; Y111-K113 PolarHBondContact O-N 3.29Å; K113-T115 VanDerWaalsContact C-N 3.3Å; K113-T115 PolarHBondContact O-N 3.46Å; K113-S116 PolarHBondContact O-N 3.27Å; K113-S116 VanDerWaalsContact O-N 3.13Å; K113-T117 HydrophobicContact CG-CG2 4.31Å; K113-T117 PolarHBondContact O-N 3.41Å; K113-T117 PolarHBondContact O-OG1 3.23Å
114W75.1Confident64.1Low193 Ų193104 Ų10473%0.73154%0.538SS*.Hα-helixtrans-59.4-40.1177.2-179.178.7000112.4W110 Y111W110-W114 VanDerWaalsContact O-CB 3.28Å; W110-W114 WeakPolarHBondContact O-CB 3.4Å; W110-W114 PolarHBondContact O-N 2.81Å; Y111-W114 PolarHBondContact O-N 3.3Å
115T73.3Confident62.1Low71 Ų71106.2 Ų106.244%0.43655%0.554SS.*Hα-helixtrans-73.9-28.2176.3540000113.5Y111 L112 K113Y111-T115 HydrophobicContact CD1-CG2 4.49Å; Y111-T115 HydrophobicContact CE1-CG2 4.06Å; Y111-T115 HydrophobicContact CE2-CG2 4.39Å; Y111-T115 WeakPolarHBondContact O-CG2 3.42Å; Y111-T115 PolarHBondContact O-N 2.95Å; Y111-T115 PolarHBondContact O-OG1 3.49Å; Y111-T115 VanDerWaalsContact O-OG1 3.09Å; L112-T115 WeakPolarHBondContact CA-OG1 3.47Å; L112-T115 PolarHBondContact O-N 3.46Å; L112-T115 PolarHBondContact O-OG1 3.34Å; K113-T115 VanDerWaalsContact C-N 3.3Å; K113-T115 PolarHBondContact O-N 3.46Å
116S65.5Low59.8Low88 Ų88109.4 Ų109.462%0.61558%0.579SS**Hα-helixtrans-90.4-18.6-176.5-58.20000114.1L112 K113 P118L112-S116 VanDerWaalsContact O-CB 3.22Å; L112-S116 WeakPolarHBondContact O-CB 3.13Å; L112-S116 PolarHBondContact O-N 2.99Å; L112-S116 PolarHBondContact O-OG 2.96Å; K113-S116 PolarHBondContact O-N 3.27Å; K113-S116 VanDerWaalsContact O-N 3.13Å; S116-P118 WeakPolarHBondContact O-CD 3.31Å
117T56.5Low57.9Low80 Ų80116.8 Ų116.849%0.49162%0.617SS.*  trans-10494.5177.659.80000111.5K113 S119K113-T117 HydrophobicContact CG-CG2 4.31Å; K113-T117 PolarHBondContact O-N 3.41Å; K113-T117 PolarHBondContact O-OG1 3.23Å; T117-S119 PolarHBondContact O-N 3.49Å
118P48Very low55.7Low112 Ų112122.2 Ų122.273%0.72763%0.634SS**  trans-68.4103161.327.9-29000108.6S116 I120S116-P118 WeakPolarHBondContact O-CD 3.31Å; P118-I120 PolarHBondContact O-N 2.96Å
119S47.2Very low53.2Low108 Ų108127.7 Ų127.776%0.75566%0.66SS**SBendtrans36.979.5156.152.80000117.4T117T117-S119 PolarHBondContact O-N 3.49Å
120I40.8Very low51Low167 Ų167131.8 Ų131.886%0.85669%0.686SS**  trans-128.776.9143.9-57.8178000106.2P118P118-I120 PolarHBondContact O-N 2.96Å
121S41Very low49.1Very low94 Ų94131.9 Ų131.966%0.65770%0.695SS**  trans-67.1168.7154.148.10000108.3
122I35.7Very low47Very low144 Ų144129.1 Ų129.174%0.73869%0.689SS**  trans104.697.2176.4-47.3-64.8000112.9
123I34.4Very low45.5Very low143 Ų143133.8 Ų133.873%0.73371%0.709SS**SBendtrans96.585.9154.4-51.9152.6000117.2
124N37.4Very low44.2Very low145 Ų145132.5 Ų132.578%0.77571%0.705SS**  -176.780.2109.1-100.8-2000108.5
125E38.5Very low42.8Very low195 Ų195128 Ų12891%0.91170%0.703SS**  trans-100.687.6166.2-178.773.7-154.300105.9
126S31.3Very low41.6Very low94 Ų94131.9 Ų131.966%0.65771%0.71SS**  trans-172.972.816361.20000108.9
127D36.7Very low41.2Very low172 Ų172131.8 Ų131.892%0.9270%0.699SS**  trans-130.1109.4155-82.5-39.9000106.9M129D127-M129 PolarHBondContact O-N 2.99Å
128E31.9Very low41.7Very low192 Ų192128.6 Ų128.690%0.89768%0.681SS**  trans-63.6121.2-176.9-71.7171.9137.600110.9D130E128-D130 PolarHBondContact O-N 3.24Å; E128-D130 VanDerWaalsContact O-N 3.12Å
129M29.4Very low43.1Very low171 Ų171126 Ų12684%0.84266%0.664SS**  37.564.1128.6-151.9-179.4-54.200117.5D127D127-M129 PolarHBondContact O-N 2.99Å
130D31.7Very low44.7Very low137 Ų137122.8 Ų122.873%0.73364%0.638SS**  trans-115.9113135.1-80.3-42.1000106E128 D132E128-D130 PolarHBondContact O-N 3.24Å; E128-D130 VanDerWaalsContact O-N 3.12Å; D130-D132 PolarHBondContact O-N 3.5Å
131M34.5Very low46.9Very low155 Ų155124.3 Ų124.376%0.76464%0.635SS**  trans-80.362.9174.2-76.4-84-69.100107.8E133M131-E133 PolarHBondContact O-N 3.18Å
132D38.1Very low49Very low85 Ų85122 Ų12246%0.45561%0.612SS.*  trans-68.3128.1161.744.3-62.2000107.8D130 E134 S135D130-D132 PolarHBondContact O-N 3.5Å; D132-E134 HydrophobicContact CB-CB 4.13Å; D132-E134 PolarHBondContact O-N 3.39Å; D132-E134 WeakPolarHBondContact OD2-CB 3.33Å; D132-S135 PolarHBondContact O-N 2.9Å
133E50.1Low51.4Low172 Ų172116 Ų11680%0.80458%0.582SS**THydrogen-bonded Turntrans-52.1-5.8172.2-72.1-175.715100113.1M131M131-E133 PolarHBondContact O-N 3.18Å
134E50.6Low54Low64 Ų64111.5 Ų111.530%0.29956%0.559SS.*THydrogen-bonded Turntrans-68.1-37.1177.2-134.269.4-132.600114.1D132 Y136 K137 I217D132-E134 HydrophobicContact CB-CB 4.13Å; D132-E134 PolarHBondContact O-N 3.39Å; D132-E134 WeakPolarHBondContact OD2-CB 3.33Å; E134-Y136 VanDerWaalsContact C-N 3.29Å; E134-Y136 PolarHBondContact O-N 2.86Å; E134-K137 HydrophobicContact CG-CD 4.45Å; E134-K137 WeakPolarHBondContact O-CB 3.41Å; E134-K137 WeakPolarHBondContact O-CG 3.34Å; E134-K137 PolarHBondContact O-N 3.06Å; E134-K137 IonicContact OE1-NZ 3.07Å; E134-K137 PolarHBondContact OE1-NZ 3.02Å; E134-K137 IonicContact OE2-NZ 3.79Å; E134-K137 PolarHBondContact OE2-NZ 2.87Å; E134-K137 VanDerWaalsContact OE2-NZ 3.07Å; E134-I217 WeakPolarHBondContact OE1-CG2 3.44Å
135S46.7Very low56.5Low99 Ų99106.6 Ų106.669%0.69254%0.538SS*.THydrogen-bonded Turntrans-71.8-16.9-163.3-165.70000115.1D132D132-S135 PolarHBondContact O-N 2.9Å
136Y48.6Very low58.9Low152 Ų15298.4 Ų98.460%0.59650%0.5SS*.THydrogen-bonded Turntrans-89.22.9177.2-64.9-87.6000114.1S106 E134 A138S106-Y136 PolarHBondContact OG-O 3.08Å; E134-Y136 VanDerWaalsContact C-N 3.29Å; E134-Y136 PolarHBondContact O-N 2.86Å; Y136-A138 PolarHBondContact O-N 3.15Å
137K57.3Low61.8Low87 Ų8794.3 Ų94.338%0.37847%0.471SS..PPolyproline II helixtrans-77.5119.1-175.5-68.3171.2-179.5153.40110.5E134E134-K137 HydrophobicContact CG-CD 4.45Å; E134-K137 WeakPolarHBondContact O-CB 3.41Å; E134-K137 WeakPolarHBondContact O-CG 3.34Å; E134-K137 PolarHBondContact O-N 3.06Å; E134-K137 IonicContact OE1-NZ 3.07Å; E134-K137 PolarHBondContact OE1-NZ 3.02Å; E134-K137 IonicContact OE2-NZ 3.79Å; E134-K137 PolarHBondContact OE2-NZ 2.87Å; E134-K137 VanDerWaalsContact OE2-NZ 3.07Å
138A66.1Low64.5Low13 Ų1390.3 Ų90.311%0.10745%0.449CS..PPolyproline II helixtrans-52.9146.3172.500000110.4Y109 Y136 L140 F142 L143Y109-A138 HydrophobicContact CG-CB 4.37Å; Y136-A138 PolarHBondContact O-N 3.15Å; A138-L140 PolarHBondContact O-N 3.24Å; A138-F142 HydrophobicContact CB-CD1 3.78Å; A138-F142 HydrophobicContact CB-CE1 4.45Å; A138-L143 HydrophobicContact CB-CG 4.5Å
139P77.2Confident67.5Low58 Ų5887 Ų8738%0.37744%0.437SS..PPolyproline II helixtrans-55.9136.6-178.619.8-30000110.3Y109 Y141 F142 L143Y109-P139 HydrophobicContact CE2-CG 4.02Å; P139-Y141 PolarHBondContact O-N 3.46Å; P139-F142 HydrophobicContact CG-CB 3.99Å; P139-F142 WeakPolarHBondContact O-CA 3.09Å; P139-F142 VanDerWaalsContact O-CB 3.23Å; P139-F142 WeakPolarHBondContact O-CB 2.94Å; P139-F142 PolarHBondContact O-N 3.11Å; P139-L143 PolarHBondContact O-N 2.96Å
140L81.8Confident70.6Confident39 Ų3980.3 Ų80.320%0.20440%0.403CS..Hα-helixtrans-49.9-39.1-172.5-176.366.5000113.5A138 F142 L143 M144 M215 H218A138-L140 PolarHBondContact O-N 3.24Å; L140-F142 VanDerWaalsContact C-N 3.27Å; L140-F142 PolarHBondContact O-N 2.77Å; L140-L143 PolarHBondContact O-N 2.99Å; L140-M144 HydrophobicContact CD1-CE 4.04Å; L140-M144 HydrophobicContact CG-CE 4.5Å; L140-M144 WeakPolarHBondContact O-CG 3.37Å; L140-M144 PolarHBondContact O-N 3.47Å; L140-M215 HydrophobicContact CD1-CB 4.45Å; L140-M215 HydrophobicContact CD1-CG 3.7Å; L140-H218 HydrophobicContact CD2-CB 4.45Å
141Y85.2Confident73.6Confident200 Ų20073.8 Ų73.878%0.78437%0.368SS*.Hα-helixtrans-61.5-32.5177.4-61.2-70.4000113.5P139 A145P139-Y141 PolarHBondContact O-N 3.46Å; Y141-A145 WeakPolarHBondContact O-CB 3.41Å; Y141-A145 PolarHBondContact O-N 3.13Å
142F85.7Confident76.5Confident44 Ų4467.6 Ų67.619%0.19334%0.342CS..Hα-helixtrans-67.9-41.8175.6-178.8-101.6000111.3Y109 L112 A138 P139 L140 A145 I146Y109-F142 HydrophobicContact CD2-CD1 4.11Å; Y109-F142 HydrophobicContact CD2-CD2 4.01Å; Y109-F142 HydrophobicContact CD2-CE1 4.13Å; Y109-F142 HydrophobicContact CD2-CE2 4.05Å; Y109-F142 HydrophobicContact CD2-CG 4.04Å; Y109-F142 HydrophobicContact CD2-CZ 4.1Å; Y109-F142 HydrophobicContact CG-CE1 4.32Å; L112-F142 HydrophobicContact CD1-CE2 4.15Å; L112-F142 HydrophobicContact CD1-CZ 4Å; A138-F142 HydrophobicContact CB-CD1 3.78Å; A138-F142 HydrophobicContact CB-CE1 4.45Å; P139-F142 HydrophobicContact CG-CB 3.99Å; P139-F142 WeakPolarHBondContact O-CA 3.09Å; P139-F142 VanDerWaalsContact O-CB 3.23Å; P139-F142 WeakPolarHBondContact O-CB 2.94Å; P139-F142 PolarHBondContact O-N 3.11Å; L140-F142 VanDerWaalsContact C-N 3.27Å; L140-F142 PolarHBondContact O-N 2.77Å; F142-A145 WeakPolarHBondContact O-CB 3.12Å; F142-A145 PolarHBondContact O-N 2.94Å; F142-I146 HydrophobicContact CD1-CD1 3.62Å; F142-I146 HydrophobicContact CE1-CD1 3.26Å; F142-I146 HydrophobicContact CE1-CG1 4.26Å; F142-I146 HydrophobicContact CG-CD1 4.45Å; F142-I146 HydrophobicContact CZ-CD1 3.82Å; F142-I146 HydrophobicContact CZ-CG1 4.45Å; F142-I146 WeakPolarHBondContact O-CG1 3.41Å; F142-I146 PolarHBondContact O-N 3.48Å
143L86.5Confident79.2Confident20 Ų2069.7 Ų69.711%0.10535%0.347CS..Hα-helixtrans-65.6-41.7174.9-66.4173.6000111.9A138 P139 L140 A145 I146 L147 S214A138-L143 HydrophobicContact CB-CG 4.5Å; P139-L143 PolarHBondContact O-N 2.96Å; L140-L143 PolarHBondContact O-N 2.99Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.09Å; L143-I146 PolarHBondContact O-N 3.35Å; L143-L147 PolarHBondContact O-N 2.78Å; L143-S214 VanDerWaalsContact CD1-CB 3.43Å; L143-S214 VanDerWaalsContact CD1-OG 3.29Å; L143-S214 WeakPolarHBondContact CD1-OG 3.18Å
144M87.8Confident81.3Confident48 Ų4862 Ų6224%0.23631%0.312CS..Hα-helixtrans-58.1-43.2172-68.5-56.9110.400111.5L140 L147 L148 C211 M215L140-M144 HydrophobicContact CD1-CE 4.04Å; L140-M144 HydrophobicContact CG-CE 4.5Å; L140-M144 WeakPolarHBondContact O-CG 3.37Å; L140-M144 PolarHBondContact O-N 3.47Å; M144-L147 PolarHBondContact O-N 3.01Å; M144-L148 VanDerWaalsContact O-CG 3.31Å; M144-L148 WeakPolarHBondContact O-CG 3.22Å; M144-L148 PolarHBondContact O-N 3.21Å; M144-C211 WeakPolarHBondContact CE-SG 3.44Å; M144-M215 HydrophobicContact CE-CE 3.89Å; M144-M215 HydrophobicContact CE-CG 3.48Å; M144-M215 VanDerWaalsContact CE-CG 3.48Å; M144-M215 HydrophobicContact CE-SD 3.47Å; M144-M215 WeakPolarHBondContact CE-SD 3.05Å; M144-M215 HydrophobicContact SD-SD 3.92Å
145A90.6Very high83.4Confident42 Ų4259 Ų5935%0.34730%0.298SS..Hα-helixtrans-63.5-42.7178.400000111.6Y141 F142 L143 L147 L148 L149Y141-A145 WeakPolarHBondContact O-CB 3.41Å; Y141-A145 PolarHBondContact O-N 3.13Å; F142-A145 WeakPolarHBondContact O-CB 3.12Å; F142-A145 PolarHBondContact O-N 2.94Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.09Å; A145-L147 PolarHBondContact O-N 3Å; A145-L148 PolarHBondContact O-N 3.49Å; A145-L149 WeakPolarHBondContact O-CB 3.45Å; A145-L149 WeakPolarHBondContact O-CG 3.36Å; A145-L149 PolarHBondContact O-N 3.47Å
146I89.5Confident85.7Confident22 Ų2258.3 Ų58.311%0.11329%0.287CS..Hα-helixtrans-59.9-46.3175-70.4163.2000111.1F105 F142 L143 L148 L149 F150 I207F105-I146 HydrophobicContact CB-CD1 4.29Å; F105-I146 HydrophobicContact CD1-CD1 3.62Å; F105-I146 HydrophobicContact CD1-CG1 4.47Å; F105-I146 HydrophobicContact CD1-CG2 4.25Å; F105-I146 HydrophobicContact CE1-CD1 4.1Å; F105-I146 HydrophobicContact CE1-CG2 3.66Å; F105-I146 HydrophobicContact CE2-CG2 4.22Å; F105-I146 HydrophobicContact CG-CD1 4.01Å; F105-I146 HydrophobicContact CZ-CG2 3.65Å; F142-I146 HydrophobicContact CD1-CD1 3.62Å; F142-I146 HydrophobicContact CE1-CD1 3.26Å; F142-I146 HydrophobicContact CE1-CG1 4.26Å; F142-I146 HydrophobicContact CG-CD1 4.45Å; F142-I146 HydrophobicContact CZ-CD1 3.82Å; F142-I146 HydrophobicContact CZ-CG1 4.45Å; F142-I146 WeakPolarHBondContact O-CG1 3.41Å; F142-I146 PolarHBondContact O-N 3.48Å; L143-I146 PolarHBondContact O-N 3.35Å; I146-L148 PolarHBondContact O-N 3Å; I146-L149 PolarHBondContact O-N 3.13Å; I146-F150 WeakPolarHBondContact O-CB 3.49Å; I146-F150 PolarHBondContact O-N 2.83Å; I146-I207 HydrophobicContact CG2-CG2 4.42Å
147L91.3Very high87.7Confident9 Ų953.9 Ų53.95%0.04727%0.272CS..Hα-helixtrans-57.8-49.4176.6-176.982.3000110.6L143 M144 A145 L149 F150 V151 M178 I207 A208 C211L143-L147 PolarHBondContact O-N 2.78Å; M144-L147 PolarHBondContact O-N 3.01Å; A145-L147 PolarHBondContact O-N 3Å; L147-L149 PolarHBondContact O-N 2.91Å; L147-F150 PolarHBondContact O-N 3.25Å; L147-V151 HydrophobicContact CG-CG2 4.47Å; L147-V151 WeakPolarHBondContact O-CB 3.37Å; L147-V151 VanDerWaalsContact O-CG2 3.25Å; L147-V151 WeakPolarHBondContact O-CG2 3.23Å; L147-V151 PolarHBondContact O-N 3.25Å; L147-M178 HydrophobicContact CD2-SD 3.92Å; L147-I207 HydrophobicContact CD1-CG2 3.99Å; L147-A208 HydrophobicContact CD1-CB 4.15Å; L147-C211 HydrophobicContact CD1-CB 4.38Å
148L94.5Very high89.3Confident88 Ų8850 Ų5046%0.46126%0.256SS..Hα-helixtrans-65-38.8-178.9-69.5174.9000112.4M144 A145 I146 A152 F170M144-L148 VanDerWaalsContact O-CG 3.31Å; M144-L148 WeakPolarHBondContact O-CG 3.22Å; M144-L148 PolarHBondContact O-N 3.21Å; A145-L148 PolarHBondContact O-N 3.49Å; I146-L148 PolarHBondContact O-N 3Å; L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 3.43Å; L148-F170 HydrophobicContact CD2-CZ 4.07Å
149L94.5Very high90.5Very high123 Ų12353 Ų5364%0.64427%0.267SS*.Hα-helixtrans-66.8-41.7175.8-73.1172.9000111.6A145 I146 L147 A152 F153A145-L149 WeakPolarHBondContact O-CB 3.45Å; A145-L149 WeakPolarHBondContact O-CG 3.36Å; A145-L149 PolarHBondContact O-N 3.47Å; I146-L149 PolarHBondContact O-N 3.13Å; L147-L149 PolarHBondContact O-N 2.91Å; L149-A152 PolarHBondContact O-N 3.48Å; L149-F153 VanDerWaalsContact O-CB 3.29Å; L149-F153 WeakPolarHBondContact O-CB 3.17Å; L149-F153 PolarHBondContact O-N 2.69Å
150F93.3Very high91Very high29 Ų2958.1 Ų58.113%0.12729%0.286CS..Hα-helixtrans-62-49.2174.5172.7-98.7000111.2I146 L147 A152 F153 C154 F200 L203 I207I146-F150 WeakPolarHBondContact O-CB 3.49Å; I146-F150 PolarHBondContact O-N 2.83Å; L147-F150 PolarHBondContact O-N 3.25Å; F150-A152 VanDerWaalsContact C-N 3.33Å; F150-A152 PolarHBondContact O-N 3.38Å; F150-F153 PolarHBondContact O-N 2.86Å; F150-C154 VanDerWaalsContact CZ-SG 3.59Å; F150-C154 PolarHBondContact O-N 2.79Å; F150-C154 PolarHBondContact O-SG 2.97Å; F150-C154 VanDerWaalsContact O-SG 3.35Å; F150-F200 HydrophobicContact CE1-CD2 4.16Å; F150-F200 AromaticContact CE1-CE2 3.86Å; F150-F200 HydrophobicContact CE1-CE2 3.86Å; F150-F200 HydrophobicContact CZ-CD2 4.07Å; F150-F200 HydrophobicContact CZ-CE2 4.25Å; F150-L203 HydrophobicContact CE2-CB 4.03Å; F150-L203 HydrophobicContact CE2-CD2 4.38Å; F150-L203 HydrophobicContact CZ-CB 3.81Å; F150-I207 HydrophobicContact CB-CD1 4.15Å; F150-I207 HydrophobicContact CD1-CD1 3.95Å; F150-I207 HydrophobicContact CD2-CD1 3.4Å; F150-I207 VanDerWaalsContact CD2-CD1 3.4Å; F150-I207 HydrophobicContact CE1-CD1 4.22Å; F150-I207 HydrophobicContact CE2-CD1 3.69Å; F150-I207 HydrophobicContact CG-CD1 3.54Å; F150-I207 HydrophobicContact CZ-CD1 4.09Å
151V95.4Very high91.2Very high0 Ų058.7 Ų58.70%029%0.291CS..Hα-helixtrans-60.5-42.8176.8171.60000110.8L147 C154 A155 F170 C173 L174 A177L147-V151 HydrophobicContact CG-CG2 4.47Å; L147-V151 WeakPolarHBondContact O-CB 3.37Å; L147-V151 VanDerWaalsContact O-CG2 3.25Å; L147-V151 WeakPolarHBondContact O-CG2 3.23Å; L147-V151 PolarHBondContact O-N 3.25Å; V151-C154 PolarHBondContact O-N 3.39Å; V151-A155 VanDerWaalsContact O-CB 3.24Å; V151-A155 WeakPolarHBondContact O-CB 3.5Å; V151-A155 PolarHBondContact O-N 2.89Å; V151-F170 HydrophobicContact CB-CE2 4.16Å; V151-F170 HydrophobicContact CG1-CD2 3.68Å; V151-F170 HydrophobicContact CG1-CE1 4.48Å; V151-F170 HydrophobicContact CG1-CE2 3.49Å; V151-F170 VanDerWaalsContact CG1-CE2 3.49Å; V151-F170 HydrophobicContact CG1-CG 4.25Å; V151-F170 HydrophobicContact CG1-CZ 3.93Å; V151-C173 HydrophobicContact CG1-CB 3.75Å; V151-L174 HydrophobicContact CG1-CB 3.96Å; V151-L174 HydrophobicContact CG1-CD1 4.49Å; V151-L174 HydrophobicContact CG2-CD1 4.28Å; V151-A177 HydrophobicContact CG2-CB 4.37Å
152A95.9Very high91.2Very high26 Ų2649.2 Ų49.222%0.21526%0.255CS..Hα-helixtrans-64.3-41.9176.600000112.2L148 L149 F150 A155 L156 F166 F170L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 3.43Å; L149-A152 PolarHBondContact O-N 3.48Å; F150-A152 VanDerWaalsContact C-N 3.33Å; F150-A152 PolarHBondContact O-N 3.38Å; A152-A155 WeakPolarHBondContact O-CB 3.44Å; A152-A155 PolarHBondContact O-N 3.48Å; A152-L156 WeakPolarHBondContact O-CG 3.24Å; A152-L156 PolarHBondContact O-N 3.37Å; A152-F166 HydrophobicContact CB-CZ 4.49Å; A152-F170 HydrophobicContact CB-CD2 4.49Å; A152-F170 HydrophobicContact CB-CE2 4.3Å
153F94.9Very high91.1Very high128 Ų12852.7 Ų52.756%0.56128%0.28SS*.Hα-helixtrans-62.7-46.3176.3178.8-103.6000111.6L149 F150 A155 L156 I157L149-F153 VanDerWaalsContact O-CB 3.29Å; L149-F153 WeakPolarHBondContact O-CB 3.17Å; L149-F153 PolarHBondContact O-N 2.69Å; F150-F153 PolarHBondContact O-N 2.86Å; F153-A155 VanDerWaalsContact C-N 3.34Å; F153-A155 PolarHBondContact O-N 3.33Å; F153-L156 WeakPolarHBondContact O-CB 3.49Å; F153-L156 PolarHBondContact O-N 2.86Å; F153-I157 HydrophobicContact CD1-CD1 4.08Å; F153-I157 HydrophobicContact CE1-CD1 3.61Å; F153-I157 HydrophobicContact CZ-CD1 4.01Å; F153-I157 PolarHBondContact O-N 2.93Å
154C93.2Very high91.1Very high11 Ų1154 Ų547%0.07428%0.283CS..Hα-helixtrans-64.3-39.1175.2-66.70000111.9F150 V151 L156 I157 F158 F200F150-C154 VanDerWaalsContact CZ-SG 3.59Å; F150-C154 PolarHBondContact O-N 2.79Å; F150-C154 PolarHBondContact O-SG 2.97Å; F150-C154 VanDerWaalsContact O-SG 3.35Å; V151-C154 PolarHBondContact O-N 3.39Å; C154-L156 VanDerWaalsContact C-N 3.28Å; C154-L156 PolarHBondContact O-N 3.39Å; C154-I157 WeakPolarHBondContact O-CB 3.44Å; C154-I157 PolarHBondContact O-N 3.49Å; C154-F158 VanDerWaalsContact O-CD2 3.3Å; C154-F158 WeakPolarHBondContact O-CD2 3.4Å; C154-F158 PolarHBondContact O-N 3.27Å; C154-F200 HydrophobicContact CB-CD2 3.78Å; C154-F200 HydrophobicContact CB-CE2 3.81Å; C154-F200 VanDerWaalsContact SG-CD2 3.56Å
155A94.6Very high91.4Very high0 Ų055.4 Ų55.40%030%0.296CS..Hα-helixtrans-60-37.1176.200000112.4V151 A152 F153 I157 F158 Q159 F166 S169 F170V151-A155 VanDerWaalsContact O-CB 3.24Å; V151-A155 WeakPolarHBondContact O-CB 3.5Å; V151-A155 PolarHBondContact O-N 2.89Å; A152-A155 WeakPolarHBondContact O-CB 3.44Å; A152-A155 PolarHBondContact O-N 3.48Å; F153-A155 VanDerWaalsContact C-N 3.34Å; F153-A155 PolarHBondContact O-N 3.33Å; A155-I157 VanDerWaalsContact C-N 3.33Å; A155-I157 PolarHBondContact O-N 3.16Å; A155-F158 PolarHBondContact O-N 3.48Å; A155-Q159 VanDerWaalsContact O-CB 3.26Å; A155-Q159 WeakPolarHBondContact O-CB 3.05Å; A155-Q159 PolarHBondContact O-N 3.25Å; A155-F166 HydrophobicContact CB-CD2 4.22Å; A155-F166 HydrophobicContact CB-CE2 3.78Å; A155-F166 HydrophobicContact CB-CZ 4.4Å; A155-S169 WeakPolarHBondContact O-CB 3.25Å; A155-F170 HydrophobicContact CB-CB 3.99Å; A155-F170 HydrophobicContact CB-CD2 4.33Å
156L94.7Very high91.6Very high86 Ų8657.3 Ų57.345%0.4530%0.296SS..Hα-helixtrans-63.9-37.3173.2-68172.4000112.2A152 F153 C154 Q160 F166A152-L156 WeakPolarHBondContact O-CG 3.24Å; A152-L156 PolarHBondContact O-N 3.37Å; F153-L156 WeakPolarHBondContact O-CB 3.49Å; F153-L156 PolarHBondContact O-N 2.86Å; C154-L156 VanDerWaalsContact C-N 3.28Å; C154-L156 PolarHBondContact O-N 3.39Å; L156-Q160 WeakPolarHBondContact O-CG 3.47Å; L156-Q160 PolarHBondContact O-N 3.36Å; L156-F166 HydrophobicContact CD2-CD2 3.95Å; L156-F166 HydrophobicContact CD2-CE2 3.84Å; L156-F166 HydrophobicContact CG-CE2 4.07Å
157I92.1Very high91.9Very high58 Ų5859.5 Ų59.530%0.29732%0.318SS..Hα-helixtrans-68.2-45.2176.7-62.9171000110.7F153 C154 A155 Q160 T161 L196F153-I157 HydrophobicContact CD1-CD1 4.08Å; F153-I157 HydrophobicContact CE1-CD1 3.61Å; F153-I157 HydrophobicContact CZ-CD1 4.01Å; F153-I157 PolarHBondContact O-N 2.93Å; C154-I157 WeakPolarHBondContact O-CB 3.44Å; C154-I157 PolarHBondContact O-N 3.49Å; A155-I157 VanDerWaalsContact C-N 3.33Å; A155-I157 PolarHBondContact O-N 3.16Å; I157-Q160 PolarHBondContact O-N 3.14Å; I157-T161 PolarHBondContact O-N 3.46Å; I157-T161 PolarHBondContact O-OG1 3.49Å; I157-L196 HydrophobicContact CG2-CD1 4.24Å
158F90.4Very high92.1Very high6 Ų662.6 Ų62.63%0.02633%0.334CS..Hα-helixtrans-68.4-34.1178.3-81.7-71.8000112.5C154 A155 Q160 T161 D162 Y172 C173 P187 F200C154-F158 VanDerWaalsContact O-CD2 3.3Å; C154-F158 WeakPolarHBondContact O-CD2 3.4Å; C154-F158 PolarHBondContact O-N 3.27Å; A155-F158 PolarHBondContact O-N 3.48Å; F158-Q160 PolarHBondContact O-N 3.13Å; F158-T161 PolarHBondContact O-N 3.05Å; F158-D162 VanDerWaalsContact CD1-OD2 3.3Å; F158-D162 WeakPolarHBondContact CD1-OD2 3.4Å; F158-D162 PolarHBondContact O-N 3.01Å; F158-Y172 HydrophobicContact CD1-CE1 4.28Å; F158-Y172 HydrophobicContact CD2-CD1 4.44Å; F158-Y172 HydrophobicContact CD2-CE1 4.38Å; F158-Y172 AromaticContact CE1-CE1 3.93Å; F158-Y172 HydrophobicContact CE1-CE1 3.93Å; F158-Y172 HydrophobicContact CE2-CD1 4.49Å; F158-Y172 HydrophobicContact CE2-CE1 4.02Å; F158-Y172 HydrophobicContact CG-CD1 4.49Å; F158-Y172 AromaticContact CZ-CE1 3.79Å; F158-Y172 HydrophobicContact CZ-CE1 3.79Å; F158-C173 WeakPolarHBondContact CD2-SG 3.29Å; F158-P187 HydrophobicContact CE1-CB 4.2Å; F158-F200 HydrophobicContact CE2-CB 4.18Å; F158-F200 AromaticContact CE2-CD1 3.83Å; F158-F200 HydrophobicContact CE2-CD1 3.83Å; F158-F200 HydrophobicContact CE2-CD2 4.34Å; F158-F200 HydrophobicContact CE2-CE1 4.36Å; F158-F200 AromaticContact CE2-CG 3.82Å; F158-F200 HydrophobicContact CE2-CG 3.82Å; F158-F200 HydrophobicContact CZ-CB 4.34Å; F158-F200 HydrophobicContact CZ-CD1 4.06Å; F158-F200 HydrophobicContact CZ-CG 4.27Å
159Q90.6Very high92.1Very high75 Ų7558.4 Ų58.435%0.3531%0.312SS..Hα-helixtrans-59.7-37.1172.1174.517519.300111.8A155 T163 W164 S169A155-Q159 VanDerWaalsContact O-CB 3.26Å; A155-Q159 WeakPolarHBondContact O-CB 3.05Å; A155-Q159 PolarHBondContact O-N 3.25Å; Q159-T163 WeakPolarHBondContact O-CA 3.38Å; Q159-T163 PolarHBondContact O-N 2.95Å; Q159-W164 WeakPolarHBondContact CG-O 3.21Å; Q159-S169 PolarHBondContact N-OG 3.31Å
160Q88.1Confident92.1Very high166 Ų16655.1 Ų55.178%0.77629%0.293SS*.Hα-helixtrans-78.4-35.8177.8-69.8-176.7-8.500112.7L156 I157 F158L156-Q160 WeakPolarHBondContact O-CG 3.47Å; L156-Q160 PolarHBondContact O-N 3.36Å; I157-Q160 PolarHBondContact O-N 3.14Å; F158-Q160 PolarHBondContact O-N 3.13Å
161T86.7Confident92.2Very high51 Ų5157.4 Ų57.431%0.31330%0.301SS..Hα-helixtrans-80.1-52.3-175.5-49.40000112.1I157 F158 L196I157-T161 PolarHBondContact O-N 3.46Å; I157-T161 PolarHBondContact O-OG1 3.49Å; F158-T161 PolarHBondContact O-N 3.05Å; T161-L196 HydrophobicContact CG2-CD1 4.47Å
162D84.8Confident92.1Very high2 Ų258.4 Ų58.41%0.01131%0.305CS..SBendtrans-101.23-173.4-67.2-79.6000113F158 W164 P187 E188F158-D162 VanDerWaalsContact CD1-OD2 3.3Å; F158-D162 WeakPolarHBondContact CD1-OD2 3.4Å; F158-D162 PolarHBondContact O-N 3.01Å; D162-W164 HydrophobicContact CB-CD2 4.05Å; D162-W164 HydrophobicContact CB-CG 4.35Å; D162-W164 HydrophobicContact CB-CZ2 4.17Å; D162-W164 VanDerWaalsContact O-CD1 3.22Å; D162-W164 PolarHBondContact O-N 3.38Å; D162-P187 WeakPolarHBondContact OD1-CA 3.36Å; D162-E188 WeakPolarHBondContact OD1-CB 3.49Å; D162-E188 PolarHBondContact OD1-N 3.38Å
163T82.7Confident92Very high117 Ų11757.2 Ų57.272%0.71830%0.295SS*.  trans5916.4176.567.50000116.2Q159Q159-T163 WeakPolarHBondContact O-CA 3.38Å; Q159-T163 PolarHBondContact O-N 2.95Å
164W87.8Confident92Very high47 Ų4753.6 Ų53.618%0.17828%0.282CS..  trans-70.4152175-61.3-15.7000112Q159 D162 D168 Y172 L185 V186Q159-W164 WeakPolarHBondContact CG-O 3.21Å; D162-W164 HydrophobicContact CB-CD2 4.05Å; D162-W164 HydrophobicContact CB-CG 4.35Å; D162-W164 HydrophobicContact CB-CZ2 4.17Å; D162-W164 VanDerWaalsContact O-CD1 3.22Å; D162-W164 PolarHBondContact O-N 3.38Å; W164-D168 HydrophobicContact CB-CB 4.32Å; W164-Y172 HydrophobicContact CZ3-CD1 4.02Å; W164-Y172 HydrophobicContact CZ3-CD2 4.26Å; W164-Y172 AromaticContact CZ3-CG 3.8Å; W164-Y172 HydrophobicContact CZ3-CG 3.8Å; W164-L185 HydrophobicContact CD2-CD2 4.46Å; W164-L185 HydrophobicContact CE3-CD2 4.12Å; W164-L185 HydrophobicContact CH2-CB 4.13Å; W164-L185 HydrophobicContact CZ3-CB 4.22Å; W164-L185 HydrophobicContact CZ3-CD2 4.28Å; W164-V186 VanDerWaalsContact CH2-C 3.49Å; W164-V186 VanDerWaalsContact CZ2-O 3.27Å; W164-V186 WeakPolarHBondContact CZ2-O 3.4Å
165P93.6Very high92.1Very high77 Ų7753.7 Ų53.750%0.528%0.282SS..  trans-62.3147.1169.428.2-33.6000110A167 D168 S169P165-A167 PolarHBondContact O-N 2.83Å; P165-D168 HydrophobicContact CG-CB 3.92Å; P165-D168 VanDerWaalsContact CG-OD2 3.23Å; P165-D168 WeakPolarHBondContact CG-OD2 3.13Å; P165-D168 PolarHBondContact O-N 3.43Å; P165-S169 PolarHBondContact O-N 3.35Å; P165-S169 VanDerWaalsContact O-N 3.13Å; P165-S169 PolarHBondContact O-OG 2.95Å
166F94.4Very high92Very high82 Ų8255.2 Ų55.236%0.3629%0.291SS..Hα-helixtrans-51.6-36.1-175.5178.6-100.3000114A152 A155 L156 D168 S169 F170A152-F166 HydrophobicContact CB-CZ 4.49Å; A155-F166 HydrophobicContact CB-CD2 4.22Å; A155-F166 HydrophobicContact CB-CE2 3.78Å; A155-F166 HydrophobicContact CB-CZ 4.4Å; L156-F166 HydrophobicContact CD2-CD2 3.95Å; L156-F166 HydrophobicContact CD2-CE2 3.84Å; L156-F166 HydrophobicContact CG-CE2 4.07Å; F166-D168 VanDerWaalsContact C-N 3.35Å; F166-D168 PolarHBondContact O-N 2.8Å; F166-S169 PolarHBondContact O-N 2.88Å; F166-F170 HydrophobicContact CE1-CB 4.45Å; F166-F170 HydrophobicContact CZ-CD2 4.27Å; F166-F170 WeakPolarHBondContact O-CB 3.25Å; F166-F170 PolarHBondContact O-N 2.95Å
167A95.8Very high91.9Very high68 Ų6851.2 Ų51.256%0.56227%0.271SS*.Hα-helixtrans-62.2-40.5178.500000112.7P165 Y171P165-A167 PolarHBondContact O-N 2.83Å; A167-Y171 VanDerWaalsContact O-CB 3.31Å; A167-Y171 WeakPolarHBondContact O-CB 3.21Å; A167-Y171 PolarHBondContact O-N 3.31Å
168D95.5Very high91.9Very high74 Ų7450.8 Ų50.840%0.39627%0.268SS..Hα-helixtrans-74.7-41.3-179.7-72.5-3.1000110.7W164 P165 F166 F170 Y171 Y172 L185W164-D168 HydrophobicContact CB-CB 4.32Å; P165-D168 HydrophobicContact CG-CB 3.92Å; P165-D168 VanDerWaalsContact CG-OD2 3.23Å; P165-D168 WeakPolarHBondContact CG-OD2 3.13Å; P165-D168 PolarHBondContact O-N 3.43Å; F166-D168 VanDerWaalsContact C-N 3.35Å; F166-D168 PolarHBondContact O-N 2.8Å; D168-F170 VanDerWaalsContact C-N 3.34Å; D168-F170 PolarHBondContact O-N 3.42Å; D168-Y171 PolarHBondContact O-N 2.83Å; D168-Y172 WeakPolarHBondContact O-CB 3.32Å; D168-Y172 PolarHBondContact O-N 3.34Å; D168-L185 HydrophobicContact CB-CD2 3.73Å
169S94.3Very high91.9Very high0 Ų054.9 Ų54.90%029%0.293CS..Hα-helixtrans-61.6-42172.5-52.60000112A155 Q159 P165 F166 Y172 C173A155-S169 WeakPolarHBondContact O-CB 3.25Å; Q159-S169 PolarHBondContact N-OG 3.31Å; P165-S169 PolarHBondContact O-N 3.35Å; P165-S169 VanDerWaalsContact O-N 3.13Å; P165-S169 PolarHBondContact O-OG 2.95Å; F166-S169 PolarHBondContact O-N 2.88Å; S169-Y172 PolarHBondContact O-N 2.84Å; S169-C173 WeakPolarHBondContact O-CB 3.45Å; S169-C173 PolarHBondContact O-N 3.42Å; S169-C173 PolarHBondContact O-SG 3.19Å
170F95.6Very high92Very high55 Ų5556.3 Ų56.324%0.24130%0.302CS..Hα-helixtrans-65.7-43.6176.6-176-89.9000111.5L148 V151 A152 A155 F166 D168 C173 L174L148-F170 HydrophobicContact CD2-CZ 4.07Å; V151-F170 HydrophobicContact CB-CE2 4.16Å; V151-F170 HydrophobicContact CG1-CD2 3.68Å; V151-F170 HydrophobicContact CG1-CE1 4.48Å; V151-F170 HydrophobicContact CG1-CE2 3.49Å; V151-F170 VanDerWaalsContact CG1-CE2 3.49Å; V151-F170 HydrophobicContact CG1-CG 4.25Å; V151-F170 HydrophobicContact CG1-CZ 3.93Å; A152-F170 HydrophobicContact CB-CD2 4.49Å; A152-F170 HydrophobicContact CB-CE2 4.3Å; A155-F170 HydrophobicContact CB-CB 3.99Å; A155-F170 HydrophobicContact CB-CD2 4.33Å; F166-F170 HydrophobicContact CE1-CB 4.45Å; F166-F170 HydrophobicContact CZ-CD2 4.27Å; F166-F170 WeakPolarHBondContact O-CB 3.25Å; F166-F170 PolarHBondContact O-N 2.95Å; D168-F170 VanDerWaalsContact C-N 3.34Å; D168-F170 PolarHBondContact O-N 3.42Å; F170-C173 PolarHBondContact O-N 3.45Å; F170-L174 HydrophobicContact CE1-CD2 4.05Å; F170-L174 VanDerWaalsContact O-CB 3.29Å; F170-L174 WeakPolarHBondContact O-CB 3.37Å; F170-L174 PolarHBondContact O-N 3.23Å
171Y95.3Very high92.1Very high77 Ų7750.8 Ų50.830%0.30229%0.29SS..Hα-helixtrans-58.9-49174.2166.8-98.6000111.7A167 D168 C173 L174 V175 L182 D184 L185A167-Y171 VanDerWaalsContact O-CB 3.31Å; A167-Y171 WeakPolarHBondContact O-CB 3.21Å; A167-Y171 PolarHBondContact O-N 3.31Å; D168-Y171 PolarHBondContact O-N 2.83Å; Y171-C173 PolarHBondContact O-N 2.77Å; Y171-L174 PolarHBondContact O-N 2.93Å; Y171-V175 HydrophobicContact CD2-CG2 3.89Å; Y171-V175 HydrophobicContact CE2-CG2 3.65Å; Y171-V175 WeakPolarHBondContact O-CB 3.42Å; Y171-V175 WeakPolarHBondContact O-CG2 3.3Å; Y171-V175 PolarHBondContact O-N 2.82Å; Y171-L182 HydrophobicContact CE2-CD1 4.29Å; Y171-L182 WeakPolarHBondContact OH-CD1 3.32Å; Y171-D184 WeakPolarHBondContact CE1-OD1 3.13Å; Y171-D184 WeakPolarHBondContact CE1-OD2 3.28Å; Y171-D184 VanDerWaalsContact CZ-OD2 3.3Å; Y171-D184 PolarHBondContact OH-OD1 3.48Å; Y171-D184 PolarHBondContact OH-OD2 2.88Å; Y171-L185 HydrophobicContact CD1-CD1 4.31Å; Y171-L185 HydrophobicContact CD1-CD2 4.41Å; Y171-L185 HydrophobicContact CE1-CD1 4.06Å
172Y93.2Very high92.3Very high21 Ų2153.5 Ų53.58%0.08230%0.302CS..Hα-helixtrans-57-49.2176.2169.8-102.7000111.6F158 W164 D168 S169 L174 T176 L185 P187 F200F158-Y172 HydrophobicContact CD1-CE1 4.28Å; F158-Y172 HydrophobicContact CD2-CD1 4.44Å; F158-Y172 HydrophobicContact CD2-CE1 4.38Å; F158-Y172 AromaticContact CE1-CE1 3.93Å; F158-Y172 HydrophobicContact CE1-CE1 3.93Å; F158-Y172 HydrophobicContact CE2-CD1 4.49Å; F158-Y172 HydrophobicContact CE2-CE1 4.02Å; F158-Y172 HydrophobicContact CG-CD1 4.49Å; F158-Y172 AromaticContact CZ-CE1 3.79Å; F158-Y172 HydrophobicContact CZ-CE1 3.79Å; W164-Y172 HydrophobicContact CZ3-CD1 4.02Å; W164-Y172 HydrophobicContact CZ3-CD2 4.26Å; W164-Y172 AromaticContact CZ3-CG 3.8Å; W164-Y172 HydrophobicContact CZ3-CG 3.8Å; D168-Y172 WeakPolarHBondContact O-CB 3.32Å; D168-Y172 PolarHBondContact O-N 3.34Å; S169-Y172 PolarHBondContact O-N 2.84Å; Y172-L174 PolarHBondContact O-N 3.37Å; Y172-T176 WeakPolarHBondContact O-CB 3.39Å; Y172-T176 PolarHBondContact O-N 3.44Å; Y172-T176 PolarHBondContact O-OG1 2.89Å; Y172-L185 HydrophobicContact CD2-CB 4.15Å; Y172-L185 WeakPolarHBondContact CD2-O 3.26Å; Y172-L185 WeakPolarHBondContact CE2-O 3.45Å; Y172-P187 WeakPolarHBondContact OH-CD 3.37Å; Y172-F200 HydrophobicContact CE1-CE1 4.32Å
173C94.3Very high92.5Very high0 Ų056 Ų560%033%0.329CS..Hα-helixtrans-63.7-43.5-179.8-68.10000111.8V151 F158 S169 F170 Y171 A177 F200V151-C173 HydrophobicContact CG1-CB 3.75Å; F158-C173 WeakPolarHBondContact CD2-SG 3.29Å; S169-C173 WeakPolarHBondContact O-CB 3.45Å; S169-C173 PolarHBondContact O-N 3.42Å; S169-C173 PolarHBondContact O-SG 3.19Å; F170-C173 PolarHBondContact O-N 3.45Å; Y171-C173 PolarHBondContact O-N 2.77Å; C173-A177 WeakPolarHBondContact O-CB 3.49Å; C173-A177 PolarHBondContact O-N 2.9Å; C173-F200 HydrophobicContact CB-CE2 4.16Å; C173-F200 HydrophobicContact CB-CZ 3.82Å; C173-F200 WeakPolarHBondContact O-CZ 3.45Å
174L95Very high92.8Very high53 Ų5355 Ų5528%0.27732%0.319SS..Hα-helixtrans-66.4-48.8-178.7-175.563.2000111.8V151 F170 Y171 Y172 T176 A177 M178V151-L174 HydrophobicContact CG1-CB 3.96Å; V151-L174 HydrophobicContact CG1-CD1 4.49Å; V151-L174 HydrophobicContact CG2-CD1 4.28Å; F170-L174 HydrophobicContact CE1-CD2 4.05Å; F170-L174 VanDerWaalsContact O-CB 3.29Å; F170-L174 WeakPolarHBondContact O-CB 3.37Å; F170-L174 PolarHBondContact O-N 3.23Å; Y171-L174 PolarHBondContact O-N 2.93Å; Y172-L174 PolarHBondContact O-N 3.37Å; L174-T176 VanDerWaalsContact C-N 3.29Å; L174-T176 PolarHBondContact O-N 3.44Å; L174-A177 PolarHBondContact O-N 2.96Å; L174-M178 HydrophobicContact CD1-CG 4.03Å; L174-M178 HydrophobicContact CG-CG 4.45Å; L174-M178 VanDerWaalsContact O-CB 3.23Å; L174-M178 WeakPolarHBondContact O-CB 3.47Å; L174-M178 VanDerWaalsContact O-CG 3.23Å; L174-M178 WeakPolarHBondContact O-CG 3.4Å; L174-M178 PolarHBondContact O-N 3.33Å
175V94.2Very high92.9Very high12 Ų1254.5 Ų54.57%0.07332%0.32CS..Hα-helixtrans-63.8-36.6-179.9165.50000111.2Y171 T179 I180 G181 L182Y171-V175 HydrophobicContact CD2-CG2 3.89Å; Y171-V175 HydrophobicContact CE2-CG2 3.65Å; Y171-V175 WeakPolarHBondContact O-CB 3.42Å; Y171-V175 WeakPolarHBondContact O-CG2 3.3Å; Y171-V175 PolarHBondContact O-N 2.82Å; V175-T179 PolarHBondContact O-N 3.1Å; V175-I180 HydrophobicContact CG1-CB 3.94Å; V175-I180 HydrophobicContact CG1-CG2 4.14Å; V175-I180 PolarHBondContact O-N 3.09Å; V175-G181 VanDerWaalsContact CG1-N 3.35Å; V175-G181 PolarHBondContact O-N 2.88Å; V175-L182 HydrophobicContact CG1-CB 4.1Å; V175-L182 HydrophobicContact CG1-CD1 4.29Å; V175-L182 HydrophobicContact CG1-CG 3.94Å; V175-L182 HydrophobicContact CG2-CD1 4.4Å
176T93.1Very high92.6Very high33 Ų3355.6 Ų55.620%0.20233%0.325CS..Hα-helixtrans-73.5-47.7177.6-56.40000111.6Y172 L174 M178 T179 F200 I201Y172-T176 WeakPolarHBondContact O-CB 3.39Å; Y172-T176 PolarHBondContact O-N 3.44Å; Y172-T176 PolarHBondContact O-OG1 2.89Å; L174-T176 VanDerWaalsContact C-N 3.29Å; L174-T176 PolarHBondContact O-N 3.44Å; T176-M178 PolarHBondContact O-N 2.73Å; T176-T179 WeakPolarHBondContact O-CA 3.42Å; T176-T179 PolarHBondContact O-N 3.3Å; T176-F200 HydrophobicContact CG2-CE1 3.71Å; T176-F200 HydrophobicContact CG2-CZ 4.5Å; T176-I201 HydrophobicContact CG2-CG1 3.97Å
177A92.7Very high92.2Very high2 Ų252.4 Ų52.42%0.01731%0.312CS..Hα-helixtrans-61.8-43.4177.800000111.4V151 C173 L174 T179 F200 A208V151-A177 HydrophobicContact CG2-CB 4.37Å; C173-A177 WeakPolarHBondContact O-CB 3.49Å; C173-A177 PolarHBondContact O-N 2.9Å; L174-A177 PolarHBondContact O-N 2.96Å; A177-T179 PolarHBondContact O-N 3.43Å; A177-T179 VanDerWaalsContact O-N 3.08Å; A177-F200 HydrophobicContact CB-CZ 4.47Å; A177-A208 HydrophobicContact CB-CB 4.44Å; A177-A208 WeakPolarHBondContact O-CB 3.46Å
178M91.1Very high91.5Very high48 Ų4853.9 Ų53.924%0.23631%0.308CS..THydrogen-bonded Turntrans-71.73.6175.2-66.4-60-62.100113.6L147 L174 T176 I180 I212L147-M178 HydrophobicContact CD2-SD 3.92Å; L174-M178 HydrophobicContact CD1-CG 4.03Å; L174-M178 HydrophobicContact CG-CG 4.45Å; L174-M178 VanDerWaalsContact O-CB 3.23Å; L174-M178 WeakPolarHBondContact O-CB 3.47Å; L174-M178 VanDerWaalsContact O-CG 3.23Å; L174-M178 WeakPolarHBondContact O-CG 3.4Å; L174-M178 PolarHBondContact O-N 3.33Å; T176-M178 PolarHBondContact O-N 2.73Å; M178-I180 HydrophobicContact CB-CD1 3.97Å; M178-I180 HydrophobicContact CB-CG1 3.93Å; M178-I180 PolarHBondContact O-N 3.34Å; M178-I212 HydrophobicContact CE-CD1 4.29Å; M178-I212 HydrophobicContact CE-CG1 4.24Å
179T91Very high90.5Very high92 Ų9258.7 Ų58.756%0.56433%0.33SS*.THydrogen-bonded Turntrans55.722.5-178.764.50000114.1V175 T176 A177 L205V175-T179 PolarHBondContact O-N 3.1Å; T176-T179 WeakPolarHBondContact O-CA 3.42Å; T176-T179 PolarHBondContact O-N 3.3Å; A177-T179 PolarHBondContact O-N 3.43Å; A177-T179 VanDerWaalsContact O-N 3.08Å; T179-L205 HydrophobicContact CG2-CD1 3.62Å
180I93.4Very high89.5Confident105 Ų10564.6 Ų64.654%0.53836%0.357SS..  trans-72.3-43.2173.8-60172.1000109V175 M178 L182V175-I180 HydrophobicContact CG1-CB 3.94Å; V175-I180 HydrophobicContact CG1-CG2 4.14Å; V175-I180 PolarHBondContact O-N 3.09Å; M178-I180 HydrophobicContact CB-CD1 3.97Å; M178-I180 HydrophobicContact CB-CG1 3.93Å; M178-I180 PolarHBondContact O-N 3.34Å; I180-L182 HydrophobicContact CG2-CD2 4.1Å; I180-L182 HydrophobicContact CG2-CG 3.97Å; I180-L182 PolarHBondContact O-N 3.42Å
181G90Very high88.5Confident51 Ų5165 Ų6553%0.52638%0.378SS..  trans54.455.2167.900000115.4V175 G183V175-G181 VanDerWaalsContact CG1-N 3.35Å; V175-G181 PolarHBondContact O-N 2.88Å; G181-G183 PolarHBondContact O-N 3.34Å
182L91.3Very high87.6Confident107 Ų10765.1 Ų65.156%0.5639%0.389SS*.  trans-62.9-26.9-177.9-66.4172.6000113.6Y171 V175 I180 D184Y171-L182 HydrophobicContact CE2-CD1 4.29Å; Y171-L182 WeakPolarHBondContact OH-CD1 3.32Å; V175-L182 HydrophobicContact CG1-CB 4.1Å; V175-L182 HydrophobicContact CG1-CD1 4.29Å; V175-L182 HydrophobicContact CG1-CG 3.94Å; V175-L182 HydrophobicContact CG2-CD1 4.4Å; I180-L182 HydrophobicContact CG2-CD2 4.1Å; I180-L182 HydrophobicContact CG2-CG 3.97Å; I180-L182 PolarHBondContact O-N 3.42Å; L182-D184 PolarHBondContact O-N 3.46Å
183G87.7Confident87Confident56 Ų5664.2 Ų64.258%0.57739%0.386SS*.  trans70.514.9173.400000114.6G181G181-G183 PolarHBondContact O-N 3.34Å
184D90.2Very high86.5Confident94 Ų9467.7 Ų67.750%0.50340%0.404SS..SBendtrans-76-32.8173.655.1-25.7000112.5Y171 L182Y171-D184 WeakPolarHBondContact CE1-OD1 3.13Å; Y171-D184 WeakPolarHBondContact CE1-OD2 3.28Å; Y171-D184 VanDerWaalsContact CZ-OD2 3.3Å; Y171-D184 PolarHBondContact OH-OD1 3.48Å; Y171-D184 PolarHBondContact OH-OD2 2.88Å; L182-D184 PolarHBondContact O-N 3.46Å
185L88.9Confident86.2Confident38 Ų3867.5 Ų67.520%0.19941%0.41CS..SBendtrans-113.4131.7170.7-78.971.8000109.8W164 D168 Y171 Y172W164-L185 HydrophobicContact CD2-CD2 4.46Å; W164-L185 HydrophobicContact CE3-CD2 4.12Å; W164-L185 HydrophobicContact CH2-CB 4.13Å; W164-L185 HydrophobicContact CZ3-CB 4.22Å; W164-L185 HydrophobicContact CZ3-CD2 4.28Å; D168-L185 HydrophobicContact CB-CD2 3.73Å; Y171-L185 HydrophobicContact CD1-CD1 4.31Å; Y171-L185 HydrophobicContact CD1-CD2 4.41Å; Y171-L185 HydrophobicContact CE1-CD1 4.06Å; Y172-L185 HydrophobicContact CD2-CB 4.15Å; Y172-L185 WeakPolarHBondContact CD2-O 3.26Å; Y172-L185 WeakPolarHBondContact CE2-O 3.45Å
186V88.3Confident85.8Confident100 Ų10070.3 Ų70.361%0.60643%0.425SS*.  trans-140.3130.9-179.1-177.20000108.2W164W164-V186 VanDerWaalsContact CH2-C 3.49Å; W164-V186 VanDerWaalsContact CZ2-O 3.27Å; W164-V186 WeakPolarHBondContact CZ2-O 3.4Å
187P85.6Confident85.6Confident15 Ų1569.2 Ų69.210%0.09742%0.418CS..  trans-64.1155.3-178.227-35.4000111.2F158 D162 Y172F158-P187 HydrophobicContact CE1-CB 4.2Å; D162-P187 WeakPolarHBondContact OD1-CA 3.36Å; Y172-P187 WeakPolarHBondContact OH-CD 3.37Å
188E80.7Confident85.4Confident99 Ų9974.1 Ų74.146%0.46344%0.443SS..  trans-63.7149.6176.9-64.1-171.2171.100110.6D162 E190 S193D162-E188 WeakPolarHBondContact OD1-CB 3.49Å; D162-E188 PolarHBondContact OD1-N 3.38Å; E188-E190 PolarHBondContact O-N 2.88Å; E188-E190 VanDerWaalsContact O-N 3.15Å; E188-S193 PolarHBondContact O-OG 3.46Å
189M73.9Confident85.3Confident175 Ų17576.7 Ų76.786%0.86246%0.457SS*.  trans-88.829.6-171.213.8-169.1175.200112.6L194M189-L194 HydrophobicContact CB-CD1 4.34Å; M189-L194 HydrophobicContact CB-CD2 4.45Å
190E75.1Confident85.3Confident123 Ų12372.8 Ų72.858%0.57543%0.432SS*.  trans-73.7142.8170.9-58.4-161.1155.500110E188 S192 S193 L194E188-E190 PolarHBondContact O-N 2.88Å; E188-E190 VanDerWaalsContact O-N 3.15Å; E190-S192 PolarHBondContact O-N 3.32Å; E190-S192 VanDerWaalsContact O-N 3.09Å; E190-S193 PolarHBondContact N-OG 3.25Å; E190-S193 PolarHBondContact O-N 3.09Å; E190-S193 VanDerWaalsContact O-N 3.17Å; E190-S193 PolarHBondContact O-OG 3.29Å; E190-L194 WeakPolarHBondContact O-CG 3.29Å; E190-L194 PolarHBondContact O-N 2.84Å
191G73.4Confident85.2Confident65 Ų6571.6 Ų71.667%0.6743%0.426SS*.Hα-helixtrans-58.1-32.3-169.700000114.3A195G191-A195 PolarHBondContact O-N 3.39Å
192S77.6Confident85.1Confident78 Ų7876 Ų7655%0.54543%0.431SS..Hα-helixtrans-73.4-44.7177.343.30000112.9E190 L194 A195 L196E190-S192 PolarHBondContact O-N 3.32Å; E190-S192 VanDerWaalsContact O-N 3.09Å; S192-L194 VanDerWaalsContact C-N 3.34Å; S192-A195 PolarHBondContact O-N 3.35Å; S192-L196 WeakPolarHBondContact O-CG 3.27Å; S192-L196 PolarHBondContact O-N 2.91Å
193S79.6Confident85.1Confident2 Ų274.9 Ų74.91%0.01443%0.425CS..Hα-helixtrans-66-37178.753.90000111.5E188 E190 L196 S197E188-S193 PolarHBondContact O-OG 3.46Å; E190-S193 PolarHBondContact N-OG 3.25Å; E190-S193 PolarHBondContact O-N 3.09Å; E190-S193 VanDerWaalsContact O-N 3.17Å; E190-S193 PolarHBondContact O-OG 3.29Å; S193-L196 PolarHBondContact O-N 3.41Å; S193-S197 PolarHBondContact O-N 3.45Å
194L84.9Confident85.3Confident73 Ų7372.3 Ų72.338%0.38240%0.398SS..Hα-helixtrans-62.7-46.7176.2-70178.9000112.4M189 E190 S192 L196 S197 I198M189-L194 HydrophobicContact CB-CD1 4.34Å; M189-L194 HydrophobicContact CB-CD2 4.45Å; E190-L194 WeakPolarHBondContact O-CG 3.29Å; E190-L194 PolarHBondContact O-N 2.84Å; S192-L194 VanDerWaalsContact C-N 3.34Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.9Å; L194-S197 PolarHBondContact O-N 2.9Å; L194-S197 PolarHBondContact O-OG 3.17Å; L194-I198 WeakPolarHBondContact O-CG1 3.39Å; L194-I198 PolarHBondContact O-N 2.9Å; L194-I198 VanDerWaalsContact O-N 3.07Å
195A87.1Confident85.2Confident49 Ų4970.7 Ų70.741%0.40539%0.389SS..Hα-helixtrans-61.9-41.9178.100000111.8G191 S192 S197 I198 I199G191-A195 PolarHBondContact O-N 3.39Å; S192-A195 PolarHBondContact O-N 3.35Å; A195-S197 VanDerWaalsContact C-N 3.33Å; A195-S197 PolarHBondContact O-N 3.46Å; A195-I198 PolarHBondContact O-N 2.78Å; A195-I199 WeakPolarHBondContact O-CG1 3.21Å; A195-I199 PolarHBondContact O-N 3.32Å; A195-I199 VanDerWaalsContact O-N 3.13Å
196L87Confident85.3Confident71 Ų7169.8 Ų69.837%0.37238%0.384SS..Hα-helixtrans-60.8-41.9174.7-70.1175.2000111.7I157 T161 S192 S193 L194 I198 I199 F200I157-L196 HydrophobicContact CG2-CD1 4.24Å; T161-L196 HydrophobicContact CG2-CD1 4.47Å; S192-L196 WeakPolarHBondContact O-CG 3.27Å; S192-L196 PolarHBondContact O-N 2.91Å; S193-L196 PolarHBondContact O-N 3.41Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.9Å; L196-I198 PolarHBondContact O-N 2.94Å; L196-I199 PolarHBondContact O-N 2.8Å; L196-F200 VanDerWaalsContact O-CB 3.23Å; L196-F200 WeakPolarHBondContact O-CB 3.25Å; L196-F200 PolarHBondContact O-N 2.81Å
197S87.5Confident85.3Confident10 Ų1065.9 Ų65.97%0.0736%0.36CS..Hα-helixtrans-62.6-40.9177.777.40000112.7S193 L194 A195 F200 I201S193-S197 PolarHBondContact O-N 3.45Å; L194-S197 PolarHBondContact O-N 2.9Å; L194-S197 PolarHBondContact O-OG 3.17Å; A195-S197 VanDerWaalsContact C-N 3.33Å; A195-S197 PolarHBondContact O-N 3.46Å; S197-F200 PolarHBondContact O-N 3.3Å; S197-I201 WeakPolarHBondContact O-CB 3Å; S197-I201 WeakPolarHBondContact O-CD1 3.15Å; S197-I201 WeakPolarHBondContact O-CG1 3.32Å; S197-I201 PolarHBondContact O-N 3.38Å
198I89.4Confident85.6Confident106 Ų10665.2 Ų65.254%0.54436%0.356SS..Hα-helixtrans-65.7-46.7179.2-66.2166000110.7L194 A195 L196 F200 I201 F202L194-I198 WeakPolarHBondContact O-CG1 3.39Å; L194-I198 PolarHBondContact O-N 2.9Å; L194-I198 VanDerWaalsContact O-N 3.07Å; A195-I198 PolarHBondContact O-N 2.78Å; L196-I198 PolarHBondContact O-N 2.94Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 3.4Å; I198-I201 PolarHBondContact O-N 3.39Å; I198-F202 PolarHBondContact O-N 3.33Å
199I89.9Confident86Confident101 Ų10161.9 Ų61.952%0.51834%0.342SS..Hα-helixtrans-61.4-45.6177.7-68169.2000109.7A195 L196 I201 F202 L203A195-I199 WeakPolarHBondContact O-CG1 3.21Å; A195-I199 PolarHBondContact O-N 3.32Å; A195-I199 VanDerWaalsContact O-N 3.13Å; L196-I199 PolarHBondContact O-N 2.8Å; I199-I201 PolarHBondContact O-N 3.18Å; I199-F202 PolarHBondContact O-N 3.33Å; I199-L203 HydrophobicContact CG2-CD1 3.64Å; I199-L203 WeakPolarHBondContact O-CD1 3.33Å; I199-L203 PolarHBondContact O-N 2.88Å
200F90.1Very high86.6Confident10 Ų1054.3 Ų54.34%0.04431%0.305CS..Hα-helixtrans-58.6-47176.1163.7-108.1000112.3F150 C154 F158 Y172 C173 T176 A177 L196 S197 I198 F202 L203 G204F150-F200 HydrophobicContact CE1-CD2 4.16Å; F150-F200 AromaticContact CE1-CE2 3.86Å; F150-F200 HydrophobicContact CE1-CE2 3.86Å; F150-F200 HydrophobicContact CZ-CD2 4.07Å; F150-F200 HydrophobicContact CZ-CE2 4.25Å; C154-F200 HydrophobicContact CB-CD2 3.78Å; C154-F200 HydrophobicContact CB-CE2 3.81Å; C154-F200 VanDerWaalsContact SG-CD2 3.56Å; F158-F200 HydrophobicContact CE2-CB 4.18Å; F158-F200 AromaticContact CE2-CD1 3.83Å; F158-F200 HydrophobicContact CE2-CD1 3.83Å; F158-F200 HydrophobicContact CE2-CD2 4.34Å; F158-F200 HydrophobicContact CE2-CE1 4.36Å; F158-F200 AromaticContact CE2-CG 3.82Å; F158-F200 HydrophobicContact CE2-CG 3.82Å; F158-F200 HydrophobicContact CZ-CB 4.34Å; F158-F200 HydrophobicContact CZ-CD1 4.06Å; F158-F200 HydrophobicContact CZ-CG 4.27Å; Y172-F200 HydrophobicContact CE1-CE1 4.32Å; C173-F200 HydrophobicContact CB-CE2 4.16Å; C173-F200 HydrophobicContact CB-CZ 3.82Å; C173-F200 WeakPolarHBondContact O-CZ 3.45Å; T176-F200 HydrophobicContact CG2-CE1 3.71Å; T176-F200 HydrophobicContact CG2-CZ 4.5Å; A177-F200 HydrophobicContact CB-CZ 4.47Å; L196-F200 VanDerWaalsContact O-CB 3.23Å; L196-F200 WeakPolarHBondContact O-CB 3.25Å; L196-F200 PolarHBondContact O-N 2.81Å; S197-F200 PolarHBondContact O-N 3.3Å; I198-F200 VanDerWaalsContact C-N 3.32Å; I198-F200 PolarHBondContact O-N 3.4Å; F200-F202 VanDerWaalsContact C-N 3.28Å; F200-F202 PolarHBondContact O-N 2.94Å; F200-L203 PolarHBondContact O-N 3.3Å; F200-G204 WeakPolarHBondContact O-CA 3.46Å; F200-G204 PolarHBondContact O-N 3.43Å
201I90.7Very high87.2Confident81 Ų8148.6 Ų48.642%0.41528%0.278SS..Hα-helixtrans-59.8-42.8178.3-71.2161.9000110.2T176 S197 I198 I199 L205T176-I201 HydrophobicContact CG2-CG1 3.97Å; S197-I201 WeakPolarHBondContact O-CB 3Å; S197-I201 WeakPolarHBondContact O-CD1 3.15Å; S197-I201 WeakPolarHBondContact O-CG1 3.32Å; S197-I201 PolarHBondContact O-N 3.38Å; I198-I201 PolarHBondContact O-N 3.39Å; I199-I201 PolarHBondContact O-N 3.18Å; I201-L205 WeakPolarHBondContact O-CB 3.39Å; I201-L205 PolarHBondContact O-N 2.97Å
202F89.1Confident87.9Confident144 Ų14448.5 Ų48.563%0.63226%0.262SS*.Hα-helixtrans-63.2-54.7178.5-119.8-88.4000112.1I198 I199 F200 G204 L205 I206I198-F202 PolarHBondContact O-N 3.33Å; I199-F202 PolarHBondContact O-N 3.33Å; F200-F202 VanDerWaalsContact C-N 3.28Å; F200-F202 PolarHBondContact O-N 2.94Å; F202-G204 PolarHBondContact O-N 3.14Å; F202-L205 PolarHBondContact O-N 2.76Å; F202-I206 HydrophobicContact CD1-CD1 4.45Å; F202-I206 WeakPolarHBondContact O-CD1 3.4Å; F202-I206 WeakPolarHBondContact O-CG1 3.39Å; F202-I206 PolarHBondContact O-N 2.99Å
203L90.2Very high88.3Confident83 Ų8348.3 Ų48.344%0.43526%0.255SS..Hα-helixtrans-65.2-40.3179.8-83.684.2000111.9F150 I199 F200 L205 I206 I207F150-L203 HydrophobicContact CE2-CB 4.03Å; F150-L203 HydrophobicContact CE2-CD2 4.38Å; F150-L203 HydrophobicContact CZ-CB 3.81Å; I199-L203 HydrophobicContact CG2-CD1 3.64Å; I199-L203 WeakPolarHBondContact O-CD1 3.33Å; I199-L203 PolarHBondContact O-N 2.88Å; F200-L203 PolarHBondContact O-N 3.3Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L203-L205 PolarHBondContact O-N 3.43Å; L203-I206 PolarHBondContact O-N 2.89Å; L203-I207 WeakPolarHBondContact O-CG1 3.36Å; L203-I207 PolarHBondContact O-N 3.36Å
204G91.3Very high88.5Confident1 Ų149.5 Ų49.51%0.0126%0.263CS..Hα-helixtrans-62.3-41.8177.900000111.8F200 F202 I206 I207 A208F200-G204 WeakPolarHBondContact O-CA 3.46Å; F200-G204 PolarHBondContact O-N 3.43Å; F202-G204 PolarHBondContact O-N 3.14Å; G204-I206 VanDerWaalsContact C-N 3.35Å; G204-I206 PolarHBondContact O-N 3.41Å; G204-I207 PolarHBondContact O-N 3.43Å; G204-A208 WeakPolarHBondContact O-CB 3.3Å; G204-A208 PolarHBondContact O-N 3.14Å
205L90Very high88.6Confident61 Ų6147.5 Ų47.532%0.31925%0.252SS..Hα-helixtrans-62.1-42.9174.8-174.169.5000111.3V94 T179 I201 F202 L203 T209V94-L205 HydrophobicContact CG2-CD2 4.38Å; T179-L205 HydrophobicContact CG2-CD1 3.62Å; I201-L205 WeakPolarHBondContact O-CB 3.39Å; I201-L205 PolarHBondContact O-N 2.97Å; F202-L205 PolarHBondContact O-N 2.76Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L203-L205 PolarHBondContact O-N 3.43Å; L205-T209 HydrophobicContact CD1-CG2 4.14Å; L205-T209 HydrophobicContact CG-CG2 4.28Å; L205-T209 VanDerWaalsContact O-CB 3.25Å; L205-T209 WeakPolarHBondContact O-CB 3.26Å; L205-T209 WeakPolarHBondContact O-CG2 3.02Å; L205-T209 PolarHBondContact O-N 3.39Å; L205-T209 PolarHBondContact O-OG1 2.86Å
206I89.5Confident88.7Confident18 Ų1847.1 Ų47.19%0.09225%0.249CC..Hα-helixtrans-62.9-49.6179-69155.5000111.2F97 T101 F202 L203 G204 T209 M210F97-I206 HydrophobicContact CD1-CB 4.12Å; F97-I206 HydrophobicContact CD1-CD1 3.31Å; F97-I206 HydrophobicContact CD1-CG1 3.51Å; F97-I206 HydrophobicContact CD1-CG2 3.49Å; F97-I206 VanDerWaalsContact CD1-CG2 3.49Å; F97-I206 HydrophobicContact CE1-CB 4.39Å; F97-I206 HydrophobicContact CE1-CD1 3.21Å; F97-I206 HydrophobicContact CE1-CG1 3.91Å; F97-I206 HydrophobicContact CE1-CG2 3.76Å; F97-I206 HydrophobicContact CG-CD1 4.18Å; F97-I206 HydrophobicContact CG-CG1 4.38Å; F97-I206 HydrophobicContact CZ-CD1 4.01Å; T101-I206 HydrophobicContact CG2-CG2 4.02Å; T101-I206 WeakPolarHBondContact OG1-CG2 3.46Å; F202-I206 HydrophobicContact CD1-CD1 4.45Å; F202-I206 WeakPolarHBondContact O-CD1 3.4Å; F202-I206 WeakPolarHBondContact O-CG1 3.39Å; F202-I206 PolarHBondContact O-N 2.99Å; L203-I206 PolarHBondContact O-N 2.89Å; G204-I206 VanDerWaalsContact C-N 3.35Å; G204-I206 PolarHBondContact O-N 3.41Å; I206-T209 PolarHBondContact O-OG1 3.1Å; I206-M210 WeakPolarHBondContact O-CG 3.23Å; I206-M210 PolarHBondContact O-N 3.4Å; I206-M210 VanDerWaalsContact O-N 3.13Å
207I89.5Confident88.7Confident19 Ų1946.5 Ų46.510%0.09725%0.246CC..Hα-helixtrans-69.8-41.2-177-63.5168.6000110.4F105 I146 L147 F150 L203 G204 M210 C211F105-I207 HydrophobicContact CE2-CG1 4.41Å; I146-I207 HydrophobicContact CG2-CG2 4.42Å; L147-I207 HydrophobicContact CD1-CG2 3.99Å; F150-I207 HydrophobicContact CB-CD1 4.15Å; F150-I207 HydrophobicContact CD1-CD1 3.95Å; F150-I207 HydrophobicContact CD2-CD1 3.4Å; F150-I207 VanDerWaalsContact CD2-CD1 3.4Å; F150-I207 HydrophobicContact CE1-CD1 4.22Å; F150-I207 HydrophobicContact CE2-CD1 3.69Å; F150-I207 HydrophobicContact CG-CD1 3.54Å; F150-I207 HydrophobicContact CZ-CD1 4.09Å; L203-I207 WeakPolarHBondContact O-CG1 3.36Å; L203-I207 PolarHBondContact O-N 3.36Å; G204-I207 PolarHBondContact O-N 3.43Å; I207-M210 PolarHBondContact O-N 3.44Å; I207-C211 VanDerWaalsContact O-CB 3.24Å; I207-C211 WeakPolarHBondContact O-CB 3.01Å; I207-C211 PolarHBondContact O-N 3.2Å
208A90.6Very high88.6Confident1 Ų150 Ų501%0.00826%0.261CS..Hα-helixtrans-68.6-39.7178.500000112.4L147 A177 G204 M210 C211 I212L147-A208 HydrophobicContact CD1-CB 4.15Å; A177-A208 HydrophobicContact CB-CB 4.44Å; A177-A208 WeakPolarHBondContact O-CB 3.46Å; G204-A208 WeakPolarHBondContact O-CB 3.3Å; G204-A208 PolarHBondContact O-N 3.14Å; A208-M210 VanDerWaalsContact C-N 3.34Å; A208-M210 PolarHBondContact O-N 3.42Å; A208-C211 WeakPolarHBondContact O-CB 3.38Å; A208-C211 PolarHBondContact O-N 2.98Å; A208-I212 WeakPolarHBondContact O-CB 3.36Å; A208-I212 WeakPolarHBondContact O-CG1 3.19Å; A208-I212 PolarHBondContact O-N 3.17Å
209T88.8Confident88.6Confident29 Ų2951.6 Ų51.618%0.17826%0.261CS..Hα-helixtrans-61.6-43.4174.6490000110.9V94 L205 I206 C211 I212 D213V94-T209 HydrophobicContact CG1-CG2 4.14Å; L205-T209 HydrophobicContact CD1-CG2 4.14Å; L205-T209 HydrophobicContact CG-CG2 4.28Å; L205-T209 VanDerWaalsContact O-CB 3.25Å; L205-T209 WeakPolarHBondContact O-CB 3.26Å; L205-T209 WeakPolarHBondContact O-CG2 3.02Å; L205-T209 PolarHBondContact O-N 3.39Å; L205-T209 PolarHBondContact O-OG1 2.86Å; I206-T209 PolarHBondContact O-OG1 3.1Å; T209-C211 VanDerWaalsContact C-N 3.33Å; T209-C211 PolarHBondContact O-N 3.25Å; T209-I212 PolarHBondContact O-N 3.42Å; T209-D213 WeakPolarHBondContact O-CB 3.34Å; T209-D213 PolarHBondContact O-N 2.9Å
210M86.5Confident88.6Confident15 Ų1552.1 Ų52.17%0.07426%0.264CS..Hα-helixtrans-58.5-43173.2-80.4-66.889.700114.8S98 A102 I206 I207 A208 D213 S214S98-M210 VanDerWaalsContact C-CE 3.41Å; S98-M210 VanDerWaalsContact O-CG 3.32Å; S98-M210 WeakPolarHBondContact O-CG 3.37Å; S98-M210 WeakPolarHBondContact OG-CE 3.35Å; A102-M210 HydrophobicContact CB-SD 3.39Å; A102-M210 WeakPolarHBondContact CB-SD 3.2Å; I206-M210 WeakPolarHBondContact O-CG 3.23Å; I206-M210 PolarHBondContact O-N 3.4Å; I206-M210 VanDerWaalsContact O-N 3.13Å; I207-M210 PolarHBondContact O-N 3.44Å; A208-M210 VanDerWaalsContact C-N 3.34Å; A208-M210 PolarHBondContact O-N 3.42Å; M210-D213 HydrophobicContact CE-CB 4.2Å; M210-D213 VanDerWaalsContact CE-OD2 3.27Å; M210-D213 WeakPolarHBondContact CE-OD2 3.33Å; M210-S214 WeakPolarHBondContact O-CB 3.37Å; M210-S214 PolarHBondContact O-N 2.92Å; M210-S214 VanDerWaalsContact O-N 3.09Å; M210-S214 PolarHBondContact O-OG 3.03Å
211C87.8Confident88.4Confident3 Ų355.4 Ų55.42%0.0228%0.279CS..Hα-helixtrans-64.1-45.5177.3-175.60000111.4M144 L147 I207 A208 T209 M215M144-C211 WeakPolarHBondContact CE-SG 3.44Å; L147-C211 HydrophobicContact CD1-CB 4.38Å; I207-C211 VanDerWaalsContact O-CB 3.24Å; I207-C211 WeakPolarHBondContact O-CB 3.01Å; I207-C211 PolarHBondContact O-N 3.2Å; A208-C211 WeakPolarHBondContact O-CB 3.38Å; A208-C211 PolarHBondContact O-N 2.98Å; T209-C211 VanDerWaalsContact C-N 3.33Å; T209-C211 PolarHBondContact O-N 3.25Å; C211-M215 WeakPolarHBondContact O-CB 3.5Å; C211-M215 WeakPolarHBondContact O-CG 3.38Å; C211-M215 PolarHBondContact O-N 3Å
212I88.7Confident88.2Confident63 Ų6358 Ų5832%0.32329%0.287SS..Hα-helixtrans-65.3-44.4177.8-70165.3000111.1M178 A208 T209 S214 M215 A216M178-I212 HydrophobicContact CE-CD1 4.29Å; M178-I212 HydrophobicContact CE-CG1 4.24Å; A208-I212 WeakPolarHBondContact O-CB 3.36Å; A208-I212 WeakPolarHBondContact O-CG1 3.19Å; A208-I212 PolarHBondContact O-N 3.17Å; T209-I212 PolarHBondContact O-N 3.42Å; I212-S214 PolarHBondContact O-N 3.13Å; I212-M215 HydrophobicContact CG1-CE 4.17Å; I212-M215 PolarHBondContact O-N 3.11Å; I212-A216 VanDerWaalsContact O-CB 3.3Å; I212-A216 WeakPolarHBondContact O-CB 2.98Å; I212-A216 PolarHBondContact O-N 3.49Å
213D86.2Confident88.3Confident74 Ų7456.8 Ų56.840%0.39629%0.286SS..Hα-helixtrans-60.4-45.9179-70.6-19.7000110.9T209 M210 A216 I217T209-D213 WeakPolarHBondContact O-CB 3.34Å; T209-D213 PolarHBondContact O-N 2.9Å; M210-D213 HydrophobicContact CE-CB 4.2Å; M210-D213 VanDerWaalsContact CE-OD2 3.27Å; M210-D213 WeakPolarHBondContact CE-OD2 3.33Å; D213-A216 PolarHBondContact O-N 2.88Å; D213-I217 WeakPolarHBondContact O-CG1 3.36Å; D213-I217 PolarHBondContact O-N 3.49Å
214S84.6Confident88.2Confident27 Ų2758.1 Ų58.119%0.18929%0.29CS..Hα-helixtrans-67.2-40.2178.5-56.50000112.4L143 M210 I212 H218L143-S214 VanDerWaalsContact CD1-CB 3.43Å; L143-S214 VanDerWaalsContact CD1-OG 3.29Å; L143-S214 WeakPolarHBondContact CD1-OG 3.18Å; M210-S214 WeakPolarHBondContact O-CB 3.37Å; M210-S214 PolarHBondContact O-N 2.92Å; M210-S214 VanDerWaalsContact O-N 3.09Å; M210-S214 PolarHBondContact O-OG 3.03Å; I212-S214 PolarHBondContact O-N 3.13Å; S214-H218 PolarHBondContact O-N 3.33Å
215M86.5Confident88Confident31 Ų3165.8 Ų65.815%0.15332%0.32CS..Hα-helixtrans-61.7-43.8172.7-84.2-169.7-67.700111.7L140 M144 C211 I212 I217 H218 Y219L140-M215 HydrophobicContact CD1-CB 4.45Å; L140-M215 HydrophobicContact CD1-CG 3.7Å; M144-M215 HydrophobicContact CE-CE 3.89Å; M144-M215 HydrophobicContact CE-CG 3.48Å; M144-M215 VanDerWaalsContact CE-CG 3.48Å; M144-M215 HydrophobicContact CE-SD 3.47Å; M144-M215 WeakPolarHBondContact CE-SD 3.05Å; M144-M215 HydrophobicContact SD-SD 3.92Å; C211-M215 WeakPolarHBondContact O-CB 3.5Å; C211-M215 WeakPolarHBondContact O-CG 3.38Å; C211-M215 PolarHBondContact O-N 3Å; I212-M215 HydrophobicContact CG1-CE 4.17Å; I212-M215 PolarHBondContact O-N 3.11Å; M215-I217 VanDerWaalsContact C-N 3.32Å; M215-I217 PolarHBondContact O-N 2.89Å; M215-H218 PolarHBondContact O-N 2.87Å; M215-Y219 HydrophobicContact CB-CD2 4.04Å; M215-Y219 HydrophobicContact CB-CE2 3.9Å; M215-Y219 HydrophobicContact CG-CE2 4.2Å; M215-Y219 WeakPolarHBondContact O-CB 3.27Å; M215-Y219 WeakPolarHBondContact O-CD2 3.23Å; M215-Y219 PolarHBondContact O-N 2.88Å; M215-Y219 HydrophobicContact SD-CE2 4.25Å
216A88.6Confident88Confident41 Ų4168.9 Ų68.934%0.33933%0.331SS..Hα-helixtrans-58.9-45.8-176.500000110.9I212 D213 Y219 I220I212-A216 VanDerWaalsContact O-CB 3.3Å; I212-A216 WeakPolarHBondContact O-CB 2.98Å; I212-A216 PolarHBondContact O-N 3.49Å; D213-A216 PolarHBondContact O-N 2.88Å; A216-Y219 PolarHBondContact O-N 3.32Å; A216-I220 WeakPolarHBondContact O-CB 3.33Å; A216-I220 WeakPolarHBondContact O-CD1 3.49Å; A216-I220 WeakPolarHBondContact O-CG1 3.49Å; A216-I220 PolarHBondContact O-N 3.46Å
217I86.8Confident88Confident59 Ų5969.1 Ų69.130%0.30334%0.338SS..Hα-helixtrans-63.5-47.4179.7-56.9165.2000110.9E134 D213 M215 Y219 I220 E221E134-I217 WeakPolarHBondContact OE1-CG2 3.44Å; D213-I217 WeakPolarHBondContact O-CG1 3.36Å; D213-I217 PolarHBondContact O-N 3.49Å; M215-I217 VanDerWaalsContact C-N 3.32Å; M215-I217 PolarHBondContact O-N 2.89Å; I217-Y219 VanDerWaalsContact C-N 3.31Å; I217-Y219 PolarHBondContact O-N 3.05Å; I217-I220 WeakPolarHBondContact O-CB 3.37Å; I217-I220 PolarHBondContact O-N 3.5Å; I217-I220 VanDerWaalsContact O-N 3.11Å; I217-E221 WeakPolarHBondContact O-CG 3.15Å; I217-E221 PolarHBondContact O-N 3.08Å
218H85.3Confident87.9Confident84 Ų8476.1 Ų76.139%0.38936%0.363SS..Hα-helixtrans-62-36.9178.2-168.964.9000113.1L140 S214 M215 E221 K222L140-H218 HydrophobicContact CD2-CB 4.45Å; S214-H218 PolarHBondContact O-N 3.33Å; M215-H218 PolarHBondContact O-N 2.87Å; H218-E221 IonicContact ND1-OE2 3.57Å; H218-K222 PolarHBondContact O-N 3.15Å; H218-K222 VanDerWaalsContact O-N 3.13Å
219Y89Confident87.9Confident138 Ų13881.2 Ų81.254%0.54139%0.39SS..Hα-helixtrans-70.5-36.6175.1-75.7-55.7000112.5M215 A216 I217 E221 K222 I223M215-Y219 HydrophobicContact CB-CD2 4.04Å; M215-Y219 HydrophobicContact CB-CE2 3.9Å; M215-Y219 HydrophobicContact CG-CE2 4.2Å; M215-Y219 WeakPolarHBondContact O-CB 3.27Å; M215-Y219 WeakPolarHBondContact O-CD2 3.23Å; M215-Y219 PolarHBondContact O-N 2.88Å; M215-Y219 HydrophobicContact SD-CE2 4.25Å; A216-Y219 PolarHBondContact O-N 3.32Å; I217-Y219 VanDerWaalsContact C-N 3.31Å; I217-Y219 PolarHBondContact O-N 3.05Å; Y219-E221 VanDerWaalsContact C-N 3.33Å; Y219-K222 PolarHBondContact O-N 2.86Å; Y219-I223 WeakPolarHBondContact O-CB 3.48Å; Y219-I223 WeakPolarHBondContact O-CG2 3.44Å; Y219-I223 PolarHBondContact O-N 3.18Å
220I90.6Very high87.9Confident113 Ų11384.2 Ų84.258%0.57940%0.404SS*.Hα-helixtrans-62.6-41.6176-71.9162.4000110.6A216 I217 I223 H224A216-I220 WeakPolarHBondContact O-CB 3.33Å; A216-I220 WeakPolarHBondContact O-CD1 3.49Å; A216-I220 WeakPolarHBondContact O-CG1 3.49Å; A216-I220 PolarHBondContact O-N 3.46Å; I217-I220 WeakPolarHBondContact O-CB 3.37Å; I217-I220 PolarHBondContact O-N 3.5Å; I217-I220 VanDerWaalsContact O-N 3.11Å; I220-I223 WeakPolarHBondContact O-CG2 3.42Å; I220-H224 WeakPolarHBondContact O-CB 3.18Å; I220-H224 PolarHBondContact O-N 3.47Å
221E86.3Confident87.8Confident78 Ų7892.6 Ų92.636%0.36444%0.436SS..Hα-helixtrans-62.2-50.7174.2-67.6173.3160.700110.8I217 H218 Y219 I223 H224 Y225I217-E221 WeakPolarHBondContact O-CG 3.15Å; I217-E221 PolarHBondContact O-N 3.08Å; H218-E221 IonicContact ND1-OE2 3.57Å; Y219-E221 VanDerWaalsContact C-N 3.33Å; E221-I223 VanDerWaalsContact C-N 3.3Å; E221-I223 PolarHBondContact O-N 3.23Å; E221-H224 WeakPolarHBondContact O-CB 3.18Å; E221-H224 PolarHBondContact O-N 3.07Å; E221-H224 VanDerWaalsContact O-N 3.07Å; E221-Y225 HydrophobicContact CB-CE2 4.5Å; E221-Y225 WeakPolarHBondContact O-CD2 3.12Å; E221-Y225 PolarHBondContact O-N 3.49Å
222K86.5Confident87.7Confident136 Ų13693.2 Ų93.259%0.59144%0.443SS*.Hα-helixtrans-62-38-177.5-165.4168.6-172.21700112.3H218 Y219 Y225 F226H218-K222 PolarHBondContact O-N 3.15Å; H218-K222 VanDerWaalsContact O-N 3.13Å; Y219-K222 PolarHBondContact O-N 2.86Å; K222-Y225 PolarHBondContact O-N 3.41Å; K222-F226 VanDerWaalsContact O-CB 3.23Å; K222-F226 WeakPolarHBondContact O-CB 3.44Å; K222-F226 PolarHBondContact O-N 3.3Å
223I90.3Very high87.8Confident118 Ų11894.9 Ų94.961%0.60545%0.452SS*.Hα-helixtrans-69.9-34.7176.2-160.4158.2000111.7Y219 I220 E221 F226 G227Y219-I223 WeakPolarHBondContact O-CB 3.48Å; Y219-I223 WeakPolarHBondContact O-CG2 3.44Å; Y219-I223 PolarHBondContact O-N 3.18Å; I220-I223 WeakPolarHBondContact O-CG2 3.42Å; E221-I223 VanDerWaalsContact C-N 3.3Å; E221-I223 PolarHBondContact O-N 3.23Å; I223-F226 PolarHBondContact O-N 3.07Å; I223-G227 PolarHBondContact O-N 2.77Å
224H87.9Confident87.9Confident112 Ų11292.7 Ų92.752%0.51945%0.447SS..Hα-helixtrans-65-46.4173.3176.3-102.6000111.7I220 E221 F226 G227 R228I220-H224 WeakPolarHBondContact O-CB 3.18Å; I220-H224 PolarHBondContact O-N 3.47Å; E221-H224 WeakPolarHBondContact O-CB 3.18Å; E221-H224 PolarHBondContact O-N 3.07Å; E221-H224 VanDerWaalsContact O-N 3.07Å; H224-F226 PolarHBondContact O-N 3.31Å; H224-G227 PolarHBondContact O-N 2.61Å; H224-R228 PolarHBondContact O-N 3.29Å
225Y88.4Confident88.1Confident162 Ų16298.6 Ų98.664%0.63547%0.466SS*.Hα-helixtrans-62-42.6174.3-78.5-71.9000112.3E221 K222 G227 R228 N229E221-Y225 HydrophobicContact CB-CE2 4.5Å; E221-Y225 WeakPolarHBondContact O-CD2 3.12Å; E221-Y225 PolarHBondContact O-N 3.49Å; K222-Y225 PolarHBondContact O-N 3.41Å; Y225-G227 VanDerWaalsContact C-N 3.34Å; Y225-G227 PolarHBondContact O-N 3Å; Y225-R228 PolarHBondContact O-N 2.91Å; Y225-N229 PolarHBondContact O-N 3.03Å
226F89.9Confident88.2Confident125 Ų125100.5 Ų100.555%0.54848%0.477SS..Hα-helixtrans-63-41.8176.4-177.1-106000111.9K222 I223 H224 R228 N229 I230K222-F226 VanDerWaalsContact O-CB 3.23Å; K222-F226 WeakPolarHBondContact O-CB 3.44Å; K222-F226 PolarHBondContact O-N 3.3Å; I223-F226 PolarHBondContact O-N 3.07Å; H224-F226 PolarHBondContact O-N 3.31Å; F226-R228 PolarHBondContact O-N 2.92Å; F226-N229 WeakPolarHBondContact O-CB 3.42Å; F226-N229 PolarHBondContact O-N 3.39Å; F226-N229 VanDerWaalsContact O-N 3.15Å; F226-I230 HydrophobicContact CD1-CD1 3.91Å; F226-I230 HydrophobicContact CE1-CD1 3.43Å; F226-I230 VanDerWaalsContact CE1-CD1 3.43Å; F226-I230 HydrophobicContact CE1-CG1 4.23Å; F226-I230 HydrophobicContact CZ-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CG1 4.35Å; F226-I230 PolarHBondContact O-N 3.46Å; F226-I230 VanDerWaalsContact O-N 3.08Å
227G89.2Confident88.4Confident23 Ų23103.6 Ų103.624%0.23749%0.487CS..Hα-helixtrans-56.4-48.9173.200000111.9I223 H224 Y225 N229 I230 Y231I223-G227 PolarHBondContact O-N 2.77Å; H224-G227 PolarHBondContact O-N 2.61Å; Y225-G227 VanDerWaalsContact C-N 3.34Å; Y225-G227 PolarHBondContact O-N 3Å; G227-N229 VanDerWaalsContact C-N 3.29Å; G227-N229 PolarHBondContact O-N 3.35Å; G227-I230 WeakPolarHBondContact O-CB 3.45Å; G227-I230 PolarHBondContact O-N 3.18Å; G227-I230 VanDerWaalsContact O-N 3.1Å; G227-Y231 WeakPolarHBondContact O-CD2 3.04Å; G227-Y231 PolarHBondContact O-N 3.1Å
228R87.6Confident88.5Confident167 Ų167106.8 Ų106.863%0.6350%0.504SS*.Hα-helixtrans-58.9-38.1175.3-70.2-17870.5106.4-2.1112.7H224 Y225 F226 I230 Y231 G232H224-R228 PolarHBondContact O-N 3.29Å; Y225-R228 PolarHBondContact O-N 2.91Å; F226-R228 PolarHBondContact O-N 2.92Å; R228-I230 VanDerWaalsContact C-N 3.32Å; R228-I230 PolarHBondContact O-N 2.87Å; R228-Y231 PolarHBondContact O-N 2.89Å; R228-G232 PolarHBondContact O-N 3.43Å
229N90.1Very high88.8Confident107 Ų107105.3 Ų105.357%0.57251%0.507SS*.Hα-helixtrans-64.5-35.3176.2-173.667.3000112.6Y225 F226 G227 G232 L233Y225-N229 PolarHBondContact O-N 3.03Å; F226-N229 WeakPolarHBondContact O-CB 3.42Å; F226-N229 PolarHBondContact O-N 3.39Å; F226-N229 VanDerWaalsContact O-N 3.15Å; G227-N229 VanDerWaalsContact C-N 3.29Å; G227-N229 PolarHBondContact O-N 3.35Å; N229-G232 WeakPolarHBondContact O-CA 3.49Å; N229-G232 PolarHBondContact O-N 3.26Å; N229-L233 PolarHBondContact O-N 3.35Å
230I89Confident89Confident93 Ų93103.7 Ų103.748%0.47751%0.507SS..Hα-helixtrans-66.5-44.4175-68171.8000111.3F226 G227 R228 G232 L233 G234F226-I230 HydrophobicContact CD1-CD1 3.91Å; F226-I230 HydrophobicContact CE1-CD1 3.43Å; F226-I230 VanDerWaalsContact CE1-CD1 3.43Å; F226-I230 HydrophobicContact CE1-CG1 4.23Å; F226-I230 HydrophobicContact CZ-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CG1 4.35Å; F226-I230 PolarHBondContact O-N 3.46Å; F226-I230 VanDerWaalsContact O-N 3.08Å; G227-I230 WeakPolarHBondContact O-CB 3.45Å; G227-I230 PolarHBondContact O-N 3.18Å; G227-I230 VanDerWaalsContact O-N 3.1Å; R228-I230 VanDerWaalsContact C-N 3.32Å; R228-I230 PolarHBondContact O-N 2.87Å; I230-G232 PolarHBondContact O-N 3.49Å; I230-L233 PolarHBondContact O-N 3Å; I230-G234 PolarHBondContact O-N 2.82Å
231Y84.1Confident89.1Confident190 Ų190100.2 Ų100.275%0.74550%0.499SS*.Hα-helixtrans-61.1-37.9173.7-68-72000111.5G227 R228 G234 Y235G227-Y231 WeakPolarHBondContact O-CD2 3.04Å; G227-Y231 PolarHBondContact O-N 3.1Å; R228-Y231 PolarHBondContact O-N 2.89Å; Y231-G234 PolarHBondContact O-N 3.39Å; Y231-Y235 PolarHBondContact O-N 3.32Å; Y231-Y235 VanDerWaalsContact O-N 3.16Å
232G87Confident89.3Confident17 Ų17102 Ų10218%0.17551%0.511CS..Hα-helixtrans-51.9-57.9169.300000112.7R228 N229 I230 G234 Y235 I236R228-G232 PolarHBondContact O-N 3.43Å; N229-G232 WeakPolarHBondContact O-CA 3.49Å; N229-G232 PolarHBondContact O-N 3.26Å; I230-G232 PolarHBondContact O-N 3.49Å; G232-G234 PolarHBondContact O-N 3.2Å; G232-Y235 VanDerWaalsContact C-CE1 3.5Å; G232-Y235 WeakPolarHBondContact O-CD1 3.25Å; G232-Y235 WeakPolarHBondContact O-CE1 2.97Å; G232-Y235 VanDerWaalsContact O-CG 3.23Å; G232-Y235 PolarHBondContact O-N 3.12Å; G232-Y235 VanDerWaalsContact O-N 3.12Å; G232-I236 PolarHBondContact O-N 3.25Å
233L89.8Confident89.5Confident97 Ų97104.6 Ų104.651%0.50852%0.517SS..Hα-helixtrans-61.3-36-179-169.962.9000112.1N229 I230 Y235 I236 L237N229-L233 PolarHBondContact O-N 3.35Å; I230-L233 PolarHBondContact O-N 3Å; L233-Y235 PolarHBondContact O-N 3.34Å; L233-I236 PolarHBondContact O-N 3.23Å; L233-L237 HydrophobicContact CG-CD1 4.03Å; L233-L237 HydrophobicContact CG-CG 4.32Å; L233-L237 WeakPolarHBondContact O-CB 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.25Å; L233-L237 WeakPolarHBondContact O-CG 2.71Å; L233-L237 PolarHBondContact O-N 3.42Å
234G89.2Confident89.5Confident28 Ų28101.6 Ų101.629%0.28951%0.51SS..Hα-helixtrans-57.9-44.3173.800000113.4I230 Y231 G232 L237 N238I230-G234 PolarHBondContact O-N 2.82Å; Y231-G234 PolarHBondContact O-N 3.39Å; G232-G234 PolarHBondContact O-N 3.2Å; G234-L237 PolarHBondContact O-N 2.89Å; G234-N238 WeakPolarHBondContact O-CB 3.32Å; G234-N238 VanDerWaalsContact O-CG 3.27Å; G234-N238 PolarHBondContact O-N 3.06Å; G234-N238 PolarHBondContact O-ND2 3.43Å
235Y88.8Confident89.5Confident151 Ų15198.8 Ų98.859%0.59250%0.503SS*.Hα-helixtrans-65-41.1176.586.4-106.6000111.4Y231 G232 L233 N238 A239Y231-Y235 PolarHBondContact O-N 3.32Å; Y231-Y235 VanDerWaalsContact O-N 3.16Å; G232-Y235 VanDerWaalsContact C-CE1 3.5Å; G232-Y235 WeakPolarHBondContact O-CD1 3.25Å; G232-Y235 WeakPolarHBondContact O-CE1 2.97Å; G232-Y235 VanDerWaalsContact O-CG 3.23Å; G232-Y235 PolarHBondContact O-N 3.12Å; G232-Y235 VanDerWaalsContact O-N 3.12Å; L233-Y235 PolarHBondContact O-N 3.34Å; Y235-N238 PolarHBondContact O-N 3.49Å; Y235-A239 VanDerWaalsContact O-CB 3.29Å; Y235-A239 WeakPolarHBondContact O-CB 3.43Å; Y235-A239 PolarHBondContact O-N 2.99Å
236I88.4Confident89.6Confident72 Ų7294 Ų9437%0.36949%0.493SS..Hα-helixtrans-64.1-45.7179.5-60.1173.7000109.4G232 L233 N238 A239 L240G232-I236 PolarHBondContact O-N 3.25Å; L233-I236 PolarHBondContact O-N 3.23Å; I236-N238 PolarHBondContact O-N 2.77Å; I236-A239 PolarHBondContact O-N 3.3Å; I236-L240 VanDerWaalsContact O-CB 3.32Å; I236-L240 WeakPolarHBondContact O-CB 3.29Å; I236-L240 PolarHBondContact O-N 3.5Å
237L92.5Very high89.5Confident106 Ų10693.8 Ų93.856%0.55550%0.495SS*.Hα-helixtrans-62.3-43.2179.5-73.8171000111.8L233 G234 L240 G241L233-L237 HydrophobicContact CG-CD1 4.03Å; L233-L237 HydrophobicContact CG-CG 4.32Å; L233-L237 WeakPolarHBondContact O-CB 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.25Å; L233-L237 WeakPolarHBondContact O-CG 2.71Å; L233-L237 PolarHBondContact O-N 3.42Å; G234-L237 PolarHBondContact O-N 2.89Å; L237-L240 PolarHBondContact O-N 3.16Å; L237-G241 PolarHBondContact O-N 3.34Å
238N89Confident89.5Confident125 Ų12599.3 Ų99.367%0.66851%0.513SS*.Hα-helixtrans-65-43.6176-71.8-28.9000111.4G234 Y235 I236 L240 G241 D242G234-N238 WeakPolarHBondContact O-CB 3.32Å; G234-N238 VanDerWaalsContact O-CG 3.27Å; G234-N238 PolarHBondContact O-N 3.06Å; G234-N238 PolarHBondContact O-ND2 3.43Å; Y235-N238 PolarHBondContact O-N 3.49Å; I236-N238 PolarHBondContact O-N 2.77Å; N238-L240 VanDerWaalsContact C-N 3.35Å; N238-L240 PolarHBondContact O-N 2.82Å; N238-G241 PolarHBondContact O-N 2.96Å; N238-D242 PolarHBondContact O-N 3.3Å
239A91.6Very high89.6Confident53 Ų5398 Ų9844%0.43851%0.514SS..Hα-helixtrans-64.7-37.717600000112.5Y235 I236 R243Y235-A239 VanDerWaalsContact O-CB 3.29Å; Y235-A239 WeakPolarHBondContact O-CB 3.43Å; Y235-A239 PolarHBondContact O-N 2.99Å; I236-A239 PolarHBondContact O-N 3.3Å; A239-R243 WeakPolarHBondContact O-CG 3.28Å; A239-R243 PolarHBondContact O-N 3.19Å
240L92.8Very high89.6Confident105 Ų105100.1 Ų100.155%0.5551%0.514SS..Hα-helixtrans-69-40.9175.5-141.695000111I236 L237 N238 D242 R243 A244I236-L240 VanDerWaalsContact O-CB 3.32Å; I236-L240 WeakPolarHBondContact O-CB 3.29Å; I236-L240 PolarHBondContact O-N 3.5Å; L237-L240 PolarHBondContact O-N 3.16Å; N238-L240 VanDerWaalsContact C-N 3.35Å; N238-L240 PolarHBondContact O-N 2.82Å; L240-D242 VanDerWaalsContact C-N 3.35Å; L240-R243 PolarHBondContact O-N 3.02Å; L240-A244 VanDerWaalsContact O-CB 3.29Å; L240-A244 WeakPolarHBondContact O-CB 3.29Å; L240-A244 PolarHBondContact O-N 3.48Å
241G92.4Very high89.4Confident39 Ų39101 Ų10140%0.40252%0.517SS..Hα-helixtrans-60.2-43.6176.100000112.1L237 N238 A244 S245L237-G241 PolarHBondContact O-N 3.34Å; N238-G241 PolarHBondContact O-N 2.96Å; G241-A244 PolarHBondContact O-N 3.08Å; G241-S245 PolarHBondContact O-N 3.41Å; G241-S245 PolarHBondContact O-OG 3.09Å
242D91.3Very high89.6Confident117 Ų11797.2 Ų97.263%0.62651%0.509SS*.Hα-helixtrans-68.8-37.6177.3-163.747.3000112.4N238 L240 A244 S245 S246N238-D242 PolarHBondContact O-N 3.3Å; L240-D242 VanDerWaalsContact C-N 3.35Å; D242-A244 VanDerWaalsContact C-N 3.34Å; D242-A244 PolarHBondContact O-N 3.39Å; D242-S245 WeakPolarHBondContact CA-OG 3.49Å; D242-S245 PolarHBondContact O-OG 2.97Å; D242-S246 WeakPolarHBondContact O-CB 3.43Å; D242-S246 PolarHBondContact O-N 3.12Å
243R90.7Very high89.6Confident190 Ų190103.2 Ų103.272%0.71753%0.53SS*.Hα-helixtrans-67.5-34.7170.8-70.5-146.5-71.1-170.7-3.5112.6A239 L240 M247A239-R243 WeakPolarHBondContact O-CG 3.28Å; A239-R243 PolarHBondContact O-N 3.19Å; L240-R243 PolarHBondContact O-N 3.02Å; R243-M247 WeakPolarHBondContact O-CB 3.33Å; R243-M247 PolarHBondContact O-N 3.43Å
244A90.8Very high89.4Confident55 Ų55100.6 Ų100.646%0.45552%0.517SS..Hα-helixtrans-69.1-41.1177.700000112L240 G241 D242 M247 K248L240-A244 VanDerWaalsContact O-CB 3.29Å; L240-A244 WeakPolarHBondContact O-CB 3.29Å; L240-A244 PolarHBondContact O-N 3.48Å; G241-A244 PolarHBondContact O-N 3.08Å; D242-A244 VanDerWaalsContact C-N 3.34Å; D242-A244 PolarHBondContact O-N 3.39Å; A244-M247 PolarHBondContact O-N 2.97Å; A244-K248 PolarHBondContact O-N 3.03Å
245S87.1Confident89.2Confident53 Ų53104 Ų10437%0.37153%0.525SS..Hα-helixtrans-64.3-45.2174.460.80000111.2G241 D242 M247 K248 E249G241-S245 PolarHBondContact O-N 3.41Å; G241-S245 PolarHBondContact O-OG 3.09Å; D242-S245 WeakPolarHBondContact CA-OG 3.49Å; D242-S245 PolarHBondContact O-OG 2.97Å; S245-M247 VanDerWaalsContact C-N 3.32Å; S245-M247 PolarHBondContact O-N 3.06Å; S245-K248 WeakPolarHBondContact O-CB 3.48Å; S245-K248 PolarHBondContact O-N 3.49Å; S245-K248 VanDerWaalsContact O-N 3.14Å; S245-E249 PolarHBondContact O-N 3.24Å
246S91.6Very high89.2Confident62 Ų62101.9 Ų101.943%0.43452%0.524SS..Hα-helixtrans-59.4-42.3175.7-173.30000112.2D242 K248 E249 W250D242-S246 WeakPolarHBondContact O-CB 3.43Å; D242-S246 PolarHBondContact O-N 3.12Å; S246-K248 VanDerWaalsContact C-N 3.34Å; S246-K248 PolarHBondContact O-N 3.41Å; S246-E249 PolarHBondContact O-N 2.91Å; S246-W250 PolarHBondContact O-N 3.39Å
247M87.2Confident88.9Confident120 Ų120102 Ų10259%0.59153%0.525SS*.Hα-helixtrans-66.8-35.1177.3-165.9168.967.800112.2R243 A244 S245 W250 M251R243-M247 WeakPolarHBondContact O-CB 3.33Å; R243-M247 PolarHBondContact O-N 3.43Å; A244-M247 PolarHBondContact O-N 2.97Å; S245-M247 VanDerWaalsContact C-N 3.32Å; S245-M247 PolarHBondContact O-N 3.06Å; M247-W250 PolarHBondContact O-N 2.92Å; M247-M251 HydrophobicContact CG-CE 4.22Å; M247-M251 WeakPolarHBondContact O-CB 3.39Å; M247-M251 PolarHBondContact O-N 3Å
248K89Confident88.6Confident139 Ų139100.1 Ų100.160%0.60451%0.513SS*.Hα-helixtrans-63.1-44.5174-175-177.3177-175.60111.6A244 S245 S246 M251 L252A244-K248 PolarHBondContact O-N 3.03Å; S245-K248 WeakPolarHBondContact O-CB 3.48Å; S245-K248 PolarHBondContact O-N 3.49Å; S245-K248 VanDerWaalsContact O-N 3.14Å; S246-K248 VanDerWaalsContact C-N 3.34Å; S246-K248 PolarHBondContact O-N 3.41Å; K248-M251 PolarHBondContact O-N 3.3Å; K248-L252 WeakPolarHBondContact O-CG 3.31Å; K248-L252 PolarHBondContact O-N 2.87Å
249E90.6Very high88.5Confident140 Ų14099.2 Ų99.265%0.65451%0.508SS*.Hα-helixtrans-62.8-43.1175.6-70.4-174.9179.100112.1S245 S246 L252 K253S245-E249 PolarHBondContact O-N 3.24Å; S246-E249 PolarHBondContact O-N 2.91Å; E249-L252 PolarHBondContact O-N 3.4Å; E249-K253 WeakPolarHBondContact O-CB 3.41Å; E249-K253 PolarHBondContact O-N 2.82Å
250W88.1Confident88.3Confident151 Ų151103.8 Ų103.857%0.57252%0.518SS*.Hα-helixtrans-62.6-43176.6-107.276.6000112.3S246 M247 L252 K253 I254S246-W250 PolarHBondContact O-N 3.39Å; M247-W250 PolarHBondContact O-N 2.92Å; W250-L252 VanDerWaalsContact C-N 3.35Å; W250-L252 PolarHBondContact O-N 2.86Å; W250-K253 PolarHBondContact O-N 3.39Å; W250-I254 HydrophobicContact CE3-CD1 3.69Å; W250-I254 HydrophobicContact CE3-CG1 4.32Å; W250-I254 HydrophobicContact CZ3-CD1 4.12Å; W250-I254 WeakPolarHBondContact O-CB 3.37Å; W250-I254 WeakPolarHBondContact O-CG1 3.39Å; W250-I254 PolarHBondContact O-N 3.48Å
251M86.7Confident88Confident111 Ų111106.3 Ų106.355%0.54752%0.522SS..Hα-helixtrans-59.9-44174.3-93.4-171-76.600111.9M247 K248 K253 I254 H255M247-M251 HydrophobicContact CG-CE 4.22Å; M247-M251 WeakPolarHBondContact O-CB 3.39Å; M247-M251 PolarHBondContact O-N 3Å; K248-M251 PolarHBondContact O-N 3.3Å; M251-K253 PolarHBondContact O-N 3.03Å; M251-I254 PolarHBondContact O-N 3.38Å; M251-H255 WeakPolarHBondContact O-CB 3.36Å; M251-H255 PolarHBondContact O-N 3.5Å
252L87.7Confident87.6Confident111 Ų111107.5 Ų107.558%0.58153%0.533SS*.Hα-helixtrans-64.5-40.2177.2-72.5172.8000112K248 E249 W250 H255 N256K248-L252 WeakPolarHBondContact O-CG 3.31Å; K248-L252 PolarHBondContact O-N 2.87Å; E249-L252 PolarHBondContact O-N 3.4Å; W250-L252 VanDerWaalsContact C-N 3.35Å; W250-L252 PolarHBondContact O-N 2.86Å; L252-H255 PolarHBondContact O-N 3.14Å; L252-N256 WeakPolarHBondContact O-CB 3.41Å; L252-N256 PolarHBondContact O-N 2.88Å
253K87.2Confident87.1Confident142 Ų142104 Ų10462%0.61751%0.514SS*.Hα-helixtrans-65.1-43.9176.3-175.7174.3-73.9177.80111.5E249 W250 M251 N256 L257E249-K253 WeakPolarHBondContact O-CB 3.41Å; E249-K253 PolarHBondContact O-N 2.82Å; W250-K253 PolarHBondContact O-N 3.39Å; M251-K253 PolarHBondContact O-N 3.03Å; K253-N256 PolarHBondContact O-N 3.39Å; K253-L257 HydrophobicContact CG-CD1 4.49Å; K253-L257 WeakPolarHBondContact O-CG 3.15Å; K253-L257 PolarHBondContact O-N 2.84Å
254I85Confident86.7Confident43 Ų4398.9 Ų98.922%0.22151%0.505CS..Hα-helixtrans-61.5-47.2176.2-80169.8000110.7W250 M251 N256 L257 Q258 L268 I272W250-I254 HydrophobicContact CE3-CD1 3.69Å; W250-I254 HydrophobicContact CE3-CG1 4.32Å; W250-I254 HydrophobicContact CZ3-CD1 4.12Å; W250-I254 WeakPolarHBondContact O-CB 3.37Å; W250-I254 WeakPolarHBondContact O-CG1 3.39Å; W250-I254 PolarHBondContact O-N 3.48Å; M251-I254 PolarHBondContact O-N 3.38Å; I254-N256 VanDerWaalsContact C-N 3.33Å; I254-N256 PolarHBondContact O-N 3.29Å; I254-L257 PolarHBondContact O-N 3.06Å; I254-Q258 WeakPolarHBondContact O-CB 3.33Å; I254-Q258 PolarHBondContact O-N 3.47Å; I254-L268 HydrophobicContact CB-CD2 4.26Å; I254-L268 HydrophobicContact CG1-CD2 4.17Å; I254-L268 HydrophobicContact CG2-CD2 3.31Å; I254-I272 HydrophobicContact CD1-CD1 4.32Å
255H85Confident86.2Confident99 Ų99100.4 Ų100.446%0.45851%0.512SS..Hα-helixtrans-61.9-42.1179.9-175.939.5000111.6M251 L252 L257 Q258 D259M251-H255 WeakPolarHBondContact O-CB 3.36Å; M251-H255 PolarHBondContact O-N 3.5Å; L252-H255 PolarHBondContact O-N 3.14Å; H255-L257 PolarHBondContact O-N 3.3Å; H255-Q258 WeakPolarHBondContact O-CB 3.41Å; H255-Q258 PolarHBondContact O-N 3.2Å; H255-Q258 VanDerWaalsContact O-N 3.17Å; H255-D259 IonicContact CE1-OD1 3.43Å; H255-D259 PolarHBondContact CE1-OD1 3.29Å; H255-D259 IonicContact CE1-OD2 3.68Å; H255-D259 PolarHBondContact CE1-OD2 2.79Å; H255-D259 IonicContact ND1-OD1 3.98Å; H255-D259 IonicContact ND1-OD2 3.32Å; H255-D259 IonicContact NE2-OD2 3.58Å; H255-D259 PolarHBondContact O-N 3Å
256N87.8Confident86Confident106 Ų106102.5 Ų102.557%0.56752%0.516SS*.Hα-helixtrans-62.1-42.3174.7-172.4-23.6000112.3L252 K253 I254 Q258 D259 K260L252-N256 WeakPolarHBondContact O-CB 3.41Å; L252-N256 PolarHBondContact O-N 2.88Å; K253-N256 PolarHBondContact O-N 3.39Å; I254-N256 VanDerWaalsContact C-N 3.33Å; I254-N256 PolarHBondContact O-N 3.29Å; N256-Q258 VanDerWaalsContact C-N 3.31Å; N256-Q258 PolarHBondContact O-N 3.43Å; N256-D259 PolarHBondContact O-N 3.44Å; N256-K260 VanDerWaalsContact O-CB 3.3Å; N256-K260 WeakPolarHBondContact O-CB 2.91Å; N256-K260 PolarHBondContact O-N 3.17Å
257L83.9Confident85.6Confident74 Ų74105 Ų10539%0.38752%0.521SS..Hα-helixtrans-63.4-39.1173.9-71.1173.3000111.9K253 I254 H255 Y261K253-L257 HydrophobicContact CG-CD1 4.49Å; K253-L257 WeakPolarHBondContact O-CG 3.15Å; K253-L257 PolarHBondContact O-N 2.84Å; I254-L257 PolarHBondContact O-N 3.06Å; H255-L257 PolarHBondContact O-N 3.3Å; L257-Y261 HydrophobicContact CD2-CD2 4.46Å; L257-Y261 HydrophobicContact CD2-CE2 4.14Å; L257-Y261 WeakPolarHBondContact O-CD2 3.4Å; L257-Y261 PolarHBondContact O-N 3.47Å
258Q85.3Confident85.3Confident67 Ų67100.4 Ų100.431%0.31350%0.498SS..Hα-helixtrans-62.1-46.5176.9-157.5-177.8-57.500111.1I254 H255 N256 G262 L263I254-Q258 WeakPolarHBondContact O-CB 3.33Å; I254-Q258 PolarHBondContact O-N 3.47Å; H255-Q258 WeakPolarHBondContact O-CB 3.41Å; H255-Q258 PolarHBondContact O-N 3.2Å; H255-Q258 VanDerWaalsContact O-N 3.17Å; N256-Q258 VanDerWaalsContact C-N 3.31Å; N256-Q258 PolarHBondContact O-N 3.43Å; Q258-G262 CarbonylContact O-C 3.59Å; Q258-G262 WeakPolarHBondContact O-CA 3.38Å; Q258-G262 PolarHBondContact O-N 3.46Å; Q258-L263 WeakPolarHBondContact CG-O 3.28Å; Q258-L263 PolarHBondContact O-N 3.42Å
259D87.5Confident85Confident106 Ų10698.9 Ų98.957%0.56749%0.492SS*.Hα-helixtrans-68.5-40.3179.8-74-1.4000112.1H255 N256 Y261H255-D259 IonicContact CE1-OD1 3.43Å; H255-D259 PolarHBondContact CE1-OD1 3.29Å; H255-D259 IonicContact CE1-OD2 3.68Å; H255-D259 PolarHBondContact CE1-OD2 2.79Å; H255-D259 IonicContact ND1-OD1 3.98Å; H255-D259 IonicContact ND1-OD2 3.32Å; H255-D259 IonicContact NE2-OD2 3.58Å; H255-D259 PolarHBondContact O-N 3Å; N256-D259 PolarHBondContact O-N 3.44Å; D259-Y261 PolarHBondContact O-N 3.46Å
260K87.5Confident84.8Confident149 Ų14997.4 Ų97.465%0.64849%0.485SS*.Hα-helixtrans-69.1-32.8-176.9-169.3174-174.9-1780113.4N256N256-K260 VanDerWaalsContact O-CB 3.3Å; N256-K260 WeakPolarHBondContact O-CB 2.91Å; N256-K260 PolarHBondContact O-N 3.17Å
261Y85.2Confident84.5Confident159 Ų15994.6 Ų94.662%0.62448%0.48SS*.Hα-helixtrans-118.81.6-174.6-64.5-78.7000113.4L257 D259 L263L257-Y261 HydrophobicContact CD2-CD2 4.46Å; L257-Y261 HydrophobicContact CD2-CE2 4.14Å; L257-Y261 WeakPolarHBondContact O-CD2 3.4Å; L257-Y261 PolarHBondContact O-N 3.47Å; D259-Y261 PolarHBondContact O-N 3.46Å; Y261-L263 VanDerWaalsContact C-N 3.26Å; Y261-L263 HydrophobicContact CD2-CD1 4.37Å; Y261-L263 HydrophobicContact CG-CD1 4.25Å; Y261-L263 PolarHBondContact O-N 3.12Å
262G84Confident84.3Confident63 Ų6391.7 Ų91.765%0.64947%0.466SS*.THydrogen-bonded Turntrans61.227.1-179.300000114.6Q258Q258-G262 CarbonylContact O-C 3.59Å; Q258-G262 WeakPolarHBondContact O-CA 3.38Å; Q258-G262 PolarHBondContact O-N 3.46Å
263L80.4Confident84.3Confident43 Ų4390.7 Ų90.723%0.22546%0.461CS..  trans-67.4140.2-178-66.5111.7000110.7Q258 Y261 Q267 I271Q258-L263 WeakPolarHBondContact CG-O 3.28Å; Q258-L263 PolarHBondContact O-N 3.42Å; Y261-L263 VanDerWaalsContact C-N 3.26Å; Y261-L263 HydrophobicContact CD2-CD1 4.37Å; Y261-L263 HydrophobicContact CG-CD1 4.25Å; Y261-L263 PolarHBondContact O-N 3.12Å; L263-Q267 HydrophobicContact CD2-CB 4.45Å; L263-I271 HydrophobicContact CD2-CD1 3.83Å
264T82.8Confident84.2Confident84 Ų8485.2 Ų85.252%0.51545%0.445SS..  trans-80.7153.5168.552.40000110.5E266 Q267 L268T264-E266 PolarHBondContact O-N 2.94Å; T264-E266 VanDerWaalsContact O-N 3.12Å; T264-Q267 PolarHBondContact O-N 3.47Å; T264-Q267 VanDerWaalsContact OG1-CG 3.31Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.47Å; T264-L268 PolarHBondContact O-N 2.95Å; T264-L268 VanDerWaalsContact O-N 3.09Å
265S80.5Confident84.1Confident86 Ų8685.6 Ų85.660%0.60145%0.451SS*.Hα-helixtrans-53.4-33.8179.5500000112.9K269S265-K269 VanDerWaalsContact O-CB 3.28Å; S265-K269 WeakPolarHBondContact O-CB 3.41Å; S265-K269 PolarHBondContact O-N 2.87Å
266E83.5Confident84.1Confident97 Ų9785.2 Ų85.245%0.45345%0.452SS..Hα-helixtrans-71.9-38.8178.1-156.359-14600112.5T264 K269 Q270T264-E266 PolarHBondContact O-N 2.94Å; T264-E266 VanDerWaalsContact O-N 3.12Å; E266-K269 PolarHBondContact O-N 2.91Å; E266-K269 IonicContact OE1-NZ 2.61Å; E266-Q270 WeakPolarHBondContact O-CG 3.38Å; E266-Q270 PolarHBondContact O-N 3.36Å; E266-Q270 VanDerWaalsContact O-N 3.08Å
267Q82.5Confident84Confident115 Ų11588.3 Ų88.354%0.53746%0.456SS..Hα-helixtrans-65.6-45176.1-68.8-65.1-46.800111L263 T264 K269 Q270 I271L263-Q267 HydrophobicContact CD2-CB 4.45Å; T264-Q267 PolarHBondContact O-N 3.47Å; T264-Q267 VanDerWaalsContact OG1-CG 3.31Å; T264-Q267 WeakPolarHBondContact OG1-CG 3.47Å; Q267-K269 VanDerWaalsContact C-N 3.31Å; Q267-K269 PolarHBondContact O-N 3.31Å; Q267-Q270 PolarHBondContact O-N 3.09Å; Q267-I271 WeakPolarHBondContact O-CG1 3.49Å; Q267-I271 PolarHBondContact O-N 3.03Å; Q267-I271 VanDerWaalsContact O-N 3.09Å
268L81.2Confident83.8Confident23 Ų2391.9 Ų91.912%0.1246%0.464CS..Hα-helixtrans-61.9-41.3177.3-172.172.7000111.6I254 T264 Q270 I271 I272I254-L268 HydrophobicContact CB-CD2 4.26Å; I254-L268 HydrophobicContact CG1-CD2 4.17Å; I254-L268 HydrophobicContact CG2-CD2 3.31Å; T264-L268 PolarHBondContact O-N 2.95Å; T264-L268 VanDerWaalsContact O-N 3.09Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; L268-Q270 PolarHBondContact O-N 3.45Å; L268-I271 PolarHBondContact O-N 3.33Å; L268-I272 HydrophobicContact CD2-CD1 4.29Å; L268-I272 HydrophobicContact CG-CD1 3.95Å; L268-I272 HydrophobicContact CG-CG1 4.49Å; L268-I272 WeakPolarHBondContact O-CG1 3.5Å; L268-I272 PolarHBondContact O-N 3.47Å
269K82.9Confident83.8Confident107 Ų10797.7 Ų97.747%0.46548%0.483SS..Hα-helixtrans-59.8-43.7176.6-177.6-178.7173.5-164.20112S265 E266 Q267 I271 I272 I273S265-K269 VanDerWaalsContact O-CB 3.28Å; S265-K269 WeakPolarHBondContact O-CB 3.41Å; S265-K269 PolarHBondContact O-N 2.87Å; E266-K269 PolarHBondContact O-N 2.91Å; E266-K269 IonicContact OE1-NZ 2.61Å; Q267-K269 VanDerWaalsContact C-N 3.31Å; Q267-K269 PolarHBondContact O-N 3.31Å; K269-I271 VanDerWaalsContact C-N 3.33Å; K269-I271 PolarHBondContact O-N 2.94Å; K269-I272 PolarHBondContact O-N 3.2Å; K269-I273 HydrophobicContact CG-CD1 3.85Å; K269-I273 WeakPolarHBondContact O-CB 3.36Å; K269-I273 VanDerWaalsContact O-CG1 3.28Å; K269-I273 WeakPolarHBondContact O-CG1 3.3Å; K269-I273 PolarHBondContact O-N 2.92Å
270Q85.7Confident83.4Confident109 Ų109101.8 Ų101.851%0.50949%0.491SS..Hα-helixtrans-62.3-40.5175.7-68.5-62.9-25.100111.9E266 Q267 L268 G274E266-Q270 WeakPolarHBondContact O-CG 3.38Å; E266-Q270 PolarHBondContact O-N 3.36Å; E266-Q270 VanDerWaalsContact O-N 3.08Å; Q267-Q270 PolarHBondContact O-N 3.09Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; L268-Q270 PolarHBondContact O-N 3.45Å; Q270-G274 PolarHBondContact O-N 3.26Å
271I81.7Confident83.2Confident92 Ų9298.4 Ų98.447%0.47248%0.477SS..Hα-helixtrans-63.3-46.2176.8-66.5168.1000111L263 Q267 L268 K269 G274 S275L263-I271 HydrophobicContact CD2-CD1 3.83Å; Q267-I271 WeakPolarHBondContact O-CG1 3.49Å; Q267-I271 PolarHBondContact O-N 3.03Å; Q267-I271 VanDerWaalsContact O-N 3.09Å; L268-I271 PolarHBondContact O-N 3.33Å; K269-I271 VanDerWaalsContact C-N 3.33Å; K269-I271 PolarHBondContact O-N 2.94Å; I271-G274 PolarHBondContact O-N 3.49Å; I271-S275 PolarHBondContact O-N 3.03Å; I271-S275 PolarHBondContact O-OG 3.5Å
272I83.5Confident82.9Confident51 Ų5195.4 Ų95.426%0.26247%0.472SS..Hα-helixtrans-66.1-42.9-179.4-66.5169.7000111.2I254 L268 K269 G274 S275 N276I254-I272 HydrophobicContact CD1-CD1 4.32Å; L268-I272 HydrophobicContact CD2-CD1 4.29Å; L268-I272 HydrophobicContact CG-CD1 3.95Å; L268-I272 HydrophobicContact CG-CG1 4.49Å; L268-I272 WeakPolarHBondContact O-CG1 3.5Å; L268-I272 PolarHBondContact O-N 3.47Å; K269-I272 PolarHBondContact O-N 3.2Å; I272-G274 VanDerWaalsContact C-N 3.34Å; I272-S275 WeakPolarHBondContact CA-OG 3.49Å; I272-S275 PolarHBondContact O-N 2.91Å; I272-S275 PolarHBondContact O-OG 3.21Å; I272-N276 WeakPolarHBondContact O-CB 3.46Å; I272-N276 PolarHBondContact O-N 3.01Å
273I86.2Confident82.7Confident90 Ų9095.7 Ų95.746%0.46246%0.464SS..Hα-helixtrans-62.9-44.9176.5-68.9170.5000109.9K269 S275 N276 R277K269-I273 HydrophobicContact CG-CD1 3.85Å; K269-I273 WeakPolarHBondContact O-CB 3.36Å; K269-I273 VanDerWaalsContact O-CG1 3.28Å; K269-I273 WeakPolarHBondContact O-CG1 3.3Å; K269-I273 PolarHBondContact O-N 2.92Å; I273-S275 VanDerWaalsContact C-N 3.34Å; I273-S275 PolarHBondContact O-N 3.2Å; I273-N276 PolarHBondContact O-N 2.95Å; I273-R277 PolarHBondContact O-N 3.36Å
274G87.1Confident82.5Confident27 Ų27100.6 Ų100.628%0.27849%0.486SS..Hα-helixtrans-60.7-39.7175.800000112.9Q270 I271 I272 R278Q270-G274 PolarHBondContact O-N 3.26Å; I271-G274 PolarHBondContact O-N 3.49Å; I272-G274 VanDerWaalsContact C-N 3.34Å; G274-R278 PolarHBondContact O-N 3.3Å
275S82.7Confident81.9Confident50 Ų50101.7 Ų101.735%0.3549%0.488SS..Hα-helixtrans-68.7-39.9177680000112.4I271 I272 I273 R277 R278 R279I271-S275 PolarHBondContact O-N 3.03Å; I271-S275 PolarHBondContact O-OG 3.5Å; I272-S275 WeakPolarHBondContact CA-OG 3.49Å; I272-S275 PolarHBondContact O-N 2.91Å; I272-S275 PolarHBondContact O-OG 3.21Å; I273-S275 VanDerWaalsContact C-N 3.34Å; I273-S275 PolarHBondContact O-N 3.2Å; S275-R277 VanDerWaalsContact C-N 3.33Å; S275-R277 PolarHBondContact O-N 3.31Å; S275-R278 PolarHBondContact O-N 3.43Å; S275-R279 PolarHBondContact O-N 3.17Å; S275-R279 VanDerWaalsContact O-N 3.11Å
276N84.8Confident81.2Confident91 Ų91101.2 Ų101.249%0.48749%0.485SS..Hα-helixtrans-66.4-35.5177.9-79.8-13.8000112.1I272 I273 R279 R280I272-N276 WeakPolarHBondContact O-CB 3.46Å; I272-N276 PolarHBondContact O-N 3.01Å; I273-N276 PolarHBondContact O-N 2.95Å; N276-R279 PolarHBondContact O-N 3.44Å; N276-R280 PolarHBondContact O-N 2.84Å
277R86.1Confident80.1Confident171 Ų17199.5 Ų99.565%0.64549%0.487SS*.Hα-helixtrans-62.5-49175.6-157.5-176.691.8176.80.1111.4I273 S275 R279 R280 E281I273-R277 PolarHBondContact O-N 3.36Å; S275-R277 VanDerWaalsContact C-N 3.33Å; S275-R277 PolarHBondContact O-N 3.31Å; R277-R279 PolarHBondContact O-N 3.47Å; R277-R280 PolarHBondContact O-N 3.01Å; R277-E281 IonicContact CZ-OE1 3.6Å; R277-E281 IonicContact NE-OE1 3.63Å; R277-E281 PolarHBondContact NE-OE1 3.49Å; R277-E281 IonicContact NH2-OE1 2.95Å; R277-E281 WeakPolarHBondContact O-CG 3.46Å; R277-E281 PolarHBondContact O-N 3.28Å; R277-E281 VanDerWaalsContact O-N 3.1Å
278R79.6Confident78.8Confident150 Ų15097.1 Ų97.157%0.56649%0.487SS*.Hα-helixtrans-58.3-45177-76.2-170.8-72.8-98.60.9112.6G274 S275 R280 E281 D282G274-R278 PolarHBondContact O-N 3.3Å; S275-R278 PolarHBondContact O-N 3.43Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 3.26Å; R278-E281 WeakPolarHBondContact O-CB 3.46Å; R278-E281 PolarHBondContact O-N 2.98Å; R278-E281 VanDerWaalsContact O-N 3.1Å; R278-D282 PolarHBondContact O-N 3.1Å
279R84.5Confident77.4Confident188 Ų188103.7 Ų103.771%0.70952%0.517SS*.Hα-helixtrans-61.4-33.8179-163178.5-172.6-161.51.3113S275 N276 R277 S283S275-R279 PolarHBondContact O-N 3.17Å; S275-R279 VanDerWaalsContact O-N 3.11Å; N276-R279 PolarHBondContact O-N 3.44Å; R277-R279 PolarHBondContact O-N 3.47Å; R279-S283 WeakPolarHBondContact O-CB 3.48Å; R279-S283 PolarHBondContact O-N 3.41Å; R279-S283 VanDerWaalsContact O-N 3.13Å; R279-S283 PolarHBondContact O-OG 3.1Å
280R80Confident75.7Confident193 Ų193105.9 Ų105.973%0.72853%0.529SS*.Hα-helixtrans-69.9-42174-76.3-175.1178.9-171.8-0.3111.8N276 R277 R278 D282 S283 Q284N276-R280 PolarHBondContact O-N 2.84Å; R277-R280 PolarHBondContact O-N 3.01Å; R278-R280 VanDerWaalsContact C-N 3.26Å; R278-R280 PolarHBondContact O-N 3.26Å; R280-D282 VanDerWaalsContact C-N 3.34Å; R280-D282 PolarHBondContact O-N 3.13Å; R280-S283 PolarHBondContact O-N 2.78Å; R280-Q284 WeakPolarHBondContact O-CG 3.48Å; R280-Q284 PolarHBondContact O-N 3.11Å
281E81.7Confident73.6Confident77 Ų77105.4 Ų105.436%0.3654%0.537SS..Hα-helixtrans-59-45.8176.2-67.7164.1-17500110.4R277 R278 S283 Q284 L285R277-E281 IonicContact CZ-OE1 3.6Å; R277-E281 IonicContact NE-OE1 3.63Å; R277-E281 PolarHBondContact NE-OE1 3.49Å; R277-E281 IonicContact NH2-OE1 2.95Å; R277-E281 WeakPolarHBondContact O-CG 3.46Å; R277-E281 PolarHBondContact O-N 3.28Å; R277-E281 VanDerWaalsContact O-N 3.1Å; R278-E281 WeakPolarHBondContact O-CB 3.46Å; R278-E281 PolarHBondContact O-N 2.98Å; R278-E281 VanDerWaalsContact O-N 3.1Å; E281-S283 PolarHBondContact O-N 3.48Å; E281-Q284 PolarHBondContact O-N 3.03Å; E281-L285 WeakPolarHBondContact O-CG 3.5Å; E281-L285 PolarHBondContact O-N 3.45Å
282D80.4Confident71.4Confident96 Ų96110.7 Ų110.751%0.51355%0.553SS.*Hα-helixtrans-64.8-37.3177.3-62.3-25.2000113.2R278 R280 L285 S286R278-D282 PolarHBondContact O-N 3.1Å; R280-D282 VanDerWaalsContact C-N 3.34Å; R280-D282 PolarHBondContact O-N 3.13Å; D282-L285 PolarHBondContact O-N 3.31Å; D282-S286 WeakPolarHBondContact O-CB 3.42Å; D282-S286 PolarHBondContact O-N 3.43Å; D282-S286 PolarHBondContact O-OG 2.89Å
283S78.2Confident69.2Low69 Ų69113.6 Ų113.648%0.48357%0.573SS.*Hα-helixtrans-68.9-36.6178.4-58.20000111.6R279 R280 E281 S286 A287R279-S283 WeakPolarHBondContact O-CB 3.48Å; R279-S283 PolarHBondContact O-N 3.41Å; R279-S283 VanDerWaalsContact O-N 3.13Å; R279-S283 PolarHBondContact O-OG 3.1Å; R280-S283 PolarHBondContact O-N 2.78Å; E281-S283 PolarHBondContact O-N 3.48Å; S283-S286 PolarHBondContact O-N 2.94Å; S283-A287 WeakPolarHBondContact O-CB 3.49Å; S283-A287 PolarHBondContact O-N 3.45Å
284Q76.3Confident66.9Low146 Ų146114.8 Ų114.868%0.68259%0.587SS**Hα-helixtrans-69.5-40.9175.1-74.1-171.8-3300111.9R280 E281 S286 A287 A288R280-Q284 WeakPolarHBondContact O-CG 3.48Å; R280-Q284 PolarHBondContact O-N 3.11Å; E281-Q284 PolarHBondContact O-N 3.03Å; Q284-S286 VanDerWaalsContact C-N 3.3Å; Q284-S286 PolarHBondContact O-N 3.47Å; Q284-A287 PolarHBondContact O-N 3.33Å; Q284-A288 WeakPolarHBondContact O-CB 3.35Å; Q284-A288 PolarHBondContact O-N 2.98Å
285L71.3Confident64.5Low108 Ų108121.6 Ų121.657%0.56562%0.617SS**Hα-helixtrans-59.1-43172.8-77.5157.9000111.3E281 D282 A288 H289E281-L285 WeakPolarHBondContact O-CG 3.5Å; E281-L285 PolarHBondContact O-N 3.45Å; D282-L285 PolarHBondContact O-N 3.31Å; L285-A288 PolarHBondContact O-N 2.9Å; L285-H289 PolarHBondContact O-CD2 3.47Å; L285-H289 VanDerWaalsContact O-CD2 3.3Å; L285-H289 PolarHBondContact O-N 2.98Å; L285-H289 VanDerWaalsContact O-N 3.11Å
286S65.5Low62.5Low76 Ų76122.9 Ų122.953%0.53164%0.638SS.*Hα-helixtrans-66.9-40.8177.3-57.10000112.7D282 S283 Q284 H289 Q290D282-S286 WeakPolarHBondContact O-CB 3.42Å; D282-S286 PolarHBondContact O-N 3.43Å; D282-S286 PolarHBondContact O-OG 2.89Å; S283-S286 PolarHBondContact O-N 2.94Å; Q284-S286 VanDerWaalsContact C-N 3.3Å; Q284-S286 PolarHBondContact O-N 3.47Å; S286-H289 PolarHBondContact O-N 3.3Å; S286-Q290 PolarHBondContact O-N 3.02Å
287A59.3Low59.9Low61 Ų61127 Ų12750%0.50465%0.652SS.*Hα-helixtrans-66.6-39.9176.500000112.2S283 Q284 H289 Q290 S291S283-A287 WeakPolarHBondContact O-CB 3.49Å; S283-A287 PolarHBondContact O-N 3.45Å; Q284-A287 PolarHBondContact O-N 3.33Å; A287-H289 PolarHBondContact O-N 3.26Å; A287-Q290 PolarHBondContact O-N 3.26Å; A287-S291 PolarHBondContact O-N 3.11Å; A287-S291 PolarHBondContact O-OG 3.07Å
288A56.1Low57.3Low64 Ų64127 Ų12753%0.52966%0.656SS.*Hα-helixtrans-62.3-33.9174.700000112Q284 L285 Q290 S291Q284-A288 WeakPolarHBondContact O-CB 3.35Å; Q284-A288 PolarHBondContact O-N 2.98Å; L285-A288 PolarHBondContact O-N 2.9Å; A288-Q290 VanDerWaalsContact C-N 3.29Å; A288-Q290 PolarHBondContact O-N 3.37Å; A288-S291 PolarHBondContact O-OG 3.3Å
289H51.8Low55.5Low162 Ų162125 Ų12575%0.7567%0.672SS**Hα-helixtrans-71.2-19.2173.3-92-106.5000113.9L285 S286 A287L285-H289 PolarHBondContact O-CD2 3.47Å; L285-H289 VanDerWaalsContact O-CD2 3.3Å; L285-H289 PolarHBondContact O-N 2.98Å; L285-H289 VanDerWaalsContact O-N 3.11Å; S286-H289 PolarHBondContact O-N 3.3Å; A287-H289 PolarHBondContact O-N 3.26Å
290Q47.3Very low53.5Low153 Ų153125 Ų12572%0.71568%0.678SS**Hα-helixtrans-95.8-16.1-178-153.4157.1800113.6S286 A287 A288 Y292S286-Q290 PolarHBondContact O-N 3.02Å; A287-Q290 PolarHBondContact O-N 3.26Å; A288-Q290 VanDerWaalsContact C-N 3.29Å; A288-Q290 PolarHBondContact O-N 3.37Å; Q290-Y292 PolarHBondContact O-N 3.28Å
291S41.8Very low51.3Low99 Ų99122.4 Ų122.469%0.69268%0.677SS**SBendtrans-71.412.7169.729.40000114.9A287 A288A287-S291 PolarHBondContact O-N 3.11Å; A287-S291 PolarHBondContact O-OG 3.07Å; A288-S291 PolarHBondContact O-OG 3.3Å
292Y36.3Very low49.2Very low202 Ų202126.9 Ų126.979%0.79270%0.703SS**  trans-121.965.8173.7-148.6-89.8000110.5Q290Q290-Y292 PolarHBondContact O-N 3.28Å
293T36.7Very low47.3Very low112 Ų112134.8 Ų134.869%0.68774%0.737SS**  trans-125.9111160.957.10000108.1
294P37.4Very low45.7Very low116 Ų116138.1 Ų138.175%0.75375%0.75SS**  trans-62.5136.6-177.2-19.430.6000112G296P294-G296 PolarHBondContact O-N 3.4Å
295D37Very low44.1Very low170 Ų170137.6 Ų137.691%0.90975%0.753SS**SBendtrans-48.9124.2174.8-52.1-52000111.5
296G39.4Very low42.6Very low77 Ų77139.3 Ų139.379%0.79476%0.764SS**  trans167.2-4.8168.600000121.1P294P294-G296 PolarHBondContact O-N 3.4Å
297F31.7Very low41.3Very low178 Ų178143 Ų14378%0.78178%0.778SS**SBendtrans-128.5-15.3-174.9-159.3-104.3000118.1
298F31.8Very low40.2Very low169 Ų169148.1 Ų148.174%0.74180%0.795SS**SBendtrans-117.714.6-178.4-90.6-77.3000116.2F300F298-F300 VanDerWaalsContact C-N 3.3Å; F298-F300 PolarHBondContact O-N 3.44Å
299A41.6Very low39.1Very low109 Ų109153.7 Ų153.790%0.90181%0.812SS**THydrogen-bonded Turntrans-88.519.6171.300000114.2
300F41.8Very low38.2Very low188 Ų188153.1 Ų153.183%0.82582%0.817SS**THydrogen-bonded Turntrans-118.68.3178.1-168-104.2000114.5F298F298-F300 VanDerWaalsContact C-N 3.3Å; F298-F300 PolarHBondContact O-N 3.44Å
301I34.3Very low37.5Very low139 Ų139153.2 Ų153.271%0.71383%0.825SS**SBendtrans-130.967.6172-50.6-174.8000109.1
302D37.5Very low37.1Very low170 Ų170157.7 Ų157.791%0.90984%0.836SS**  trans-171.574139.6-129.73.4000108.3
303Q40Very low37.2Very low262 Ų262153.6 Ų153.6100%1.22484%0.84SS**  trans-138.10162.6-149-178.328.700106.5

Retrieved 303 of 303 residues in 194.7 ms (Link to these results)