A0A060XFL7_ONCMY Loading...

Homeobox A4

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis.

AlphaFold DB , UniProt , Accession A0A060XFL7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene hoxa4a, Length 246 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
1M56.4Low54.7Low247 Ų247156.7 Ų156.7100%1.21783%0.829SS**  0112.60-78.2171.7-175.200107.8
2I49.2Very low55Low176 Ų176159.4 Ų159.490%0.90382%0.822SS**  trans-90.9121.2-178.918.3172.7000107.9S4I2-S4 PolarHBondContact O-N 3.25Å
3M54Low55.8Low187 Ų187158.5 Ų158.592%0.92182%0.817SS**  trans-76.6109.6175.7-68174.570.700108.4S5M3-S5 PolarHBondContact O-N 3.49Å
4S46.5Very low56.4Low83 Ų83158.2 Ų158.258%0.5881%0.81SS**  trans-63.2126-179.9-175.50000111.6I2 Y6I2-S4 PolarHBondContact O-N 3.25Å; S4-Y6 PolarHBondContact O-N 3.04Å; S4-Y6 WeakPolarHBondContact OG-CE2 3.49Å
5S51.2Low56.6Low106 Ų106152.7 Ų152.774%0.74179%0.789SS**  trans-8787.1-179.546.50000111.8M3 L7M3-S5 PolarHBondContact O-N 3.49Å; S5-L7 PolarHBondContact O-N 3.47Å; S5-L7 VanDerWaalsContact O-N 3.16Å
6Y55.9Low57.6Low203 Ų203150 Ų15080%0.79679%0.787SS**  trans-86.172.5173-67.3-82.3000112S4S4-Y6 PolarHBondContact O-N 3.04Å; S4-Y6 WeakPolarHBondContact OG-CE2 3.49Å
7L66.3Low57.8Low155 Ų155151 Ų15181%0.81278%0.784SS**  trans-14822.5165.5-87.3-176.8000114S5S5-L7 PolarHBondContact O-N 3.47Å; S5-L7 VanDerWaalsContact O-N 3.16Å
8I61.6Low58.5Low154 Ų154146.7 Ų146.779%0.7977%0.767SS**SBendtrans-92.7-12.8-178.3-120.876.9000115
9N51.2Low58.6Low154 Ų154143.4 Ų143.482%0.82476%0.755SS**  trans-128.255.9-173.6-73.80.8000114.1
10S52.5Low58.5Low94 Ų94141.3 Ų141.366%0.65775%0.752SS**  trans-111.5121.5157.6-70.90000107.9Y12S10-Y12 PolarHBondContact O-N 2.7Å
11N57.2Low58.5Low165 Ų165140.1 Ų140.188%0.88275%0.746SS**  trans-6479.6160.9-79-61.1000107.2I13N11-I13 VanDerWaalsContact C-N 3.3Å; N11-I13 PolarHBondContact O-N 3.16Å
12Y57.6Low58.6Low189 Ų189134 Ų13474%0.74171%0.714SS**  trans-75.690.4174.2-165.8-93000106.3S10 E14S10-Y12 PolarHBondContact O-N 2.7Å; Y12-E14 VanDerWaalsContact C-N 3.3Å; Y12-E14 PolarHBondContact O-N 3.33Å
13I65.4Low58.9Low147 Ų147132.1 Ų132.175%0.75470%0.697SS**  trans-66.1102161.4-70.6114.4000105.4N11 P15N11-I13 VanDerWaalsContact C-N 3.3Å; N11-I13 PolarHBondContact O-N 3.16Å; I13-P15 WeakPolarHBondContact O-CD 3.3Å
14E64.5Low59Low155 Ų155130.7 Ų130.772%0.72469%0.688SS**  trans-51.9122164.5-176.8175.2-143.300107Y12 S16Y12-E14 VanDerWaalsContact C-N 3.3Å; Y12-E14 PolarHBondContact O-N 3.33Å; E14-S16 PolarHBondContact O-N 3.42Å
15P59.9Low59.5Low76 Ų76134.2 Ų134.249%0.49470%0.695SS.*  trans-60106.4174.723.8-30.8000107I13 F17I13-P15 WeakPolarHBondContact O-CD 3.3Å; P15-F17 VanDerWaalsContact C-N 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.25Å; P15-F17 HydrophobicContact CG-CE2 3.97Å; P15-F17 VanDerWaalsContact O-CD2 3.29Å; P15-F17 WeakPolarHBondContact O-CD2 3.44Å; P15-F17 PolarHBondContact O-N 3.38Å
16S72.7Confident59.3Low109 Ų109135.1 Ų135.176%0.76269%0.692SS**  trans-64.396171.4-179.80000106.4E14E14-S16 PolarHBondContact O-N 3.42Å
17F61.1Low59.2Low167 Ų167128.4 Ų128.473%0.73268%0.684SS**PPolyproline II helixtrans-64.7125.9163.9-75.1-84.9000106.1P15P15-F17 VanDerWaalsContact C-N 3.26Å; P15-F17 HydrophobicContact CB-CE2 4.25Å; P15-F17 HydrophobicContact CG-CE2 3.97Å; P15-F17 VanDerWaalsContact O-CD2 3.29Å; P15-F17 WeakPolarHBondContact O-CD2 3.44Å; P15-F17 PolarHBondContact O-N 3.38Å
18P69.4Low58.7Low74 Ų74130.4 Ų130.448%0.48168%0.682SS.*PPolyproline II helixtrans-50.9133.2176.8-22.130000108.8C20P18-C20 PolarHBondContact O-N 3.12Å
19P61.1Low58.5Low83 Ų83128.2 Ų128.254%0.53967%0.671SS.*PPolyproline II helixtrans-48.7133.7170.7-23.532.1000108.9D21 E22P19-D21 PolarHBondContact O-N 2.83Å; P19-E22 PolarHBondContact O-N 3.31Å; P19-E22 VanDerWaalsContact O-N 3.09Å
20C56.1Low58.6Low102 Ų102125.6 Ų125.669%0.68966%0.662SS**THydrogen-bonded Turntrans-56-20.6-173.2-149.80000113P18 E22 Y23P18-C20 PolarHBondContact O-N 3.12Å; C20-E22 PolarHBondContact O-N 3.16Å; C20-Y23 PolarHBondContact O-N 3.14Å
21D59.5Low58.8Low117 Ų117123.8 Ų123.863%0.62665%0.653SS**Hα-helixtrans-63-34.5178.5-67.7-50.5000113.5P19 Y23 Q24P19-D21 PolarHBondContact O-N 2.83Å; D21-Y23 PolarHBondContact O-N 3.21Å; D21-Q24 PolarHBondContact O-N 3.43Å
22E57.3Low58.7Low119 Ų119121.3 Ų121.356%0.55665%0.646SS**Hα-helixtrans-69.3-23.4178.1-90.1-171143.400112.8P19 C20 Q24 Q25P19-E22 PolarHBondContact O-N 3.31Å; P19-E22 VanDerWaalsContact O-N 3.09Å; C20-E22 PolarHBondContact O-N 3.16Å; E22-Q24 VanDerWaalsContact C-N 3.28Å; E22-Q24 PolarHBondContact O-N 3.24Å; E22-Q25 PolarHBondContact O-N 3.43Å
23Y56.7Low58.2Low135 Ų135117.2 Ų117.253%0.52964%0.641SS.*Hα-helixtrans-72.4-23178.6-114.6-89.3000113C20 D21 I29C20-Y23 PolarHBondContact O-N 3.14Å; D21-Y23 PolarHBondContact O-N 3.21Å; Y23-I29 HydrophobicContact CD1-CD1 3.89Å; Y23-I29 HydrophobicContact CD1-CG1 4.15Å
24Q55.6Low57.4Low157 Ų157117.3 Ų117.373%0.73464%0.638SS**Hα-helixtrans-83.3-24.4175.9-64.5-174.437.300112.2D21 E22D21-Q24 PolarHBondContact O-N 3.43Å; E22-Q24 VanDerWaalsContact C-N 3.28Å; E22-Q24 PolarHBondContact O-N 3.24Å
25Q56Low56.6Low157 Ų157120 Ų12073%0.73464%0.643SS**Hα-helixtrans-84.1-23.4-170.8-141.61488.900113.2E22E22-Q25 PolarHBondContact O-N 3.43Å
26N47.1Very low56.1Low125 Ų125126.2 Ų126.267%0.66866%0.658SS**THydrogen-bonded Turntrans-95.912.3-177.2-73.64.1000114.8Y28N26-Y28 PolarHBondContact O-N 3.02Å
27G54.8Low55Low62 Ų62129 Ų12964%0.63966%0.659SS**  trans58.913.217400000115.3I29G27-I29 PolarHBondContact O-N 3.42Å
28Y54.6Low54.4Low197 Ų197131.9 Ų131.977%0.77367%0.665SS**  trans-78-11.5-175.3-121.2-88.9000112.9N26N26-Y28 PolarHBondContact O-N 3.02Å
29I58.4Low53.2Low108 Ų108133.6 Ų133.655%0.55468%0.677SS**SBendtrans-110.1103.6170.5-55.2178.3000106.5Y23 G27 A31Y23-I29 HydrophobicContact CD1-CD1 3.89Å; Y23-I29 HydrophobicContact CD1-CG1 4.15Å; G27-I29 PolarHBondContact O-N 3.42Å; I29-A31 PolarHBondContact O-N 3.04Å
30P53.6Low52.9Low99 Ų99139.7 Ų139.764%0.64369%0.694SS**  trans-61.1136.1170.424.5-28.5000108.1
31A55.5Low52Low56 Ų56141.2 Ų141.246%0.46370%0.696SS.*  trans-50.7138.9178.600000109.9I29 T33 E34I29-A31 PolarHBondContact O-N 3.04Å; A31-T33 PolarHBondContact O-N 3.2Å; A31-E34 PolarHBondContact O-N 3.13Å
32P55.4Low51.7Low114 Ų114140.8 Ų140.874%0.7470%0.702SS**THydrogen-bonded Turntrans-65-3.3-176.526.8-34.3000113.5
33T47.6Very low51.2Low102 Ų102138.3 Ų138.363%0.62671%0.708SS**THydrogen-bonded Turntrans-75.4-29.817966.50000112.4A31A31-T33 PolarHBondContact O-N 3.2Å
34E47.8Very low50.3Low150 Ų150141.6 Ų141.670%0.70173%0.726SS**THydrogen-bonded Turntrans-84.7-14-174.6-65.6-153.417500114A31 Y36A31-E34 PolarHBondContact O-N 3.13Å; E34-Y36 VanDerWaalsContact C-N 3.26Å; E34-Y36 PolarHBondContact O-N 2.7Å
35Y48.6Very low49.9Very low210 Ų210139.9 Ų139.982%0.82473%0.728SS**THydrogen-bonded Turntrans-73.1-19.3178.9-163.8-96.4000113.1
36Y48Very low49.2Very low208 Ų208140.8 Ų140.882%0.81673%0.732SS**SBendtrans-102-10.9179.4-84.7-77.5000114.9E34 R38E34-Y36 VanDerWaalsContact C-N 3.26Å; E34-Y36 PolarHBondContact O-N 2.7Å; Y36-R38 PolarHBondContact O-N 2.78Å
37E50.4Low49Very low166 Ų166143.8 Ų143.878%0.77674%0.742SS**  trans-92.392.9171-78.3-141.8128.300110.3P39E37-P39 VanDerWaalsContact O-CD 3.27Å; E37-P39 WeakPolarHBondContact O-CD 3.44Å
38R48.6Very low48.3Very low229 Ų229147.9 Ų147.986%0.86475%0.749SS**  trans-67.5117.9165.4-171175.7-163.7168.83.7108.6Y36 K40Y36-R38 PolarHBondContact O-N 2.78Å; R38-K40 PolarHBondContact O-N 2.9Å
39P43.6Very low47.8Very low110 Ų110146.2 Ų146.271%0.71475%0.748SS**  trans-64.1120.7170-16.631000108.4E37 D41E37-P39 VanDerWaalsContact O-CD 3.27Å; E37-P39 WeakPolarHBondContact O-CD 3.44Å; P39-D41 PolarHBondContact O-N 3.28Å; P39-D41 VanDerWaalsContact O-N 3.08Å
40K54.8Low47Very low210 Ų210144.3 Ų144.391%0.91375%0.749SS**  trans-76.384.6163.3-65.5-171.2-176.5-179.60106.7R38R38-K40 PolarHBondContact O-N 2.9Å
41D37.6Very low46.6Very low135 Ų135144 Ų14472%0.72275%0.749SS**  trans-117.3106.6167.2-136.8-41.4000110.9P39P39-D41 PolarHBondContact O-N 3.28Å; P39-D41 VanDerWaalsContact O-N 3.08Å
42S53.5Low45.9Very low108 Ų108151.1 Ų151.176%0.75577%0.765SS**  trans-13.2121.5145.819.80000115.5
43G46.7Very low45.5Very low67 Ų67151.6 Ų151.669%0.69177%0.768SS**  trans1659.9163.800000120.7
44F37.7Very low45.4Very low203 Ų203157.3 Ų157.389%0.8978%0.778SS**  trans-119.9124.9170.5-93.4-87.5000110.9H46F44-H46 PolarHBondContact O-N 3.16Å; F44-H46 VanDerWaalsContact O-N 3.16Å
45P46.4Very low45Very low122 Ų122155.6 Ų155.679%0.79278%0.783SS**  trans-65.3118.1176.94.25.5000108.7H47P45-H47 PolarHBondContact O-N 3Å
46H42Very low45.1Very low176 Ų176152.2 Ų152.282%0.81578%0.779SS**  trans-61.8119.2163.9-114.7-88.4000107.1F44 D48F44-H46 PolarHBondContact O-N 3.16Å; F44-H46 VanDerWaalsContact O-N 3.16Å; H46-D48 PolarHBondContact O-N 3.09Å; H46-D48 VanDerWaalsContact O-N 3.16Å
47H43.1Very low44.9Very low188 Ų188152.8 Ų152.887%0.8778%0.782SS**  trans-66.1115.2170.2-137.3-80.2000107.2P45P45-H47 PolarHBondContact O-N 3Å
48D41.1Very low45.2Very low147 Ų147150.9 Ų150.979%0.78678%0.782SS**  trans-58.5145.9179-75.8-70.7000112.1H46 A50H46-D48 PolarHBondContact O-N 3.09Å; H46-D48 VanDerWaalsContact O-N 3.16Å; D48-A50 PolarHBondContact O-N 2.97Å
49E43.3Very low44.9Very low162 Ų162147.5 Ų147.576%0.75778%0.775SS**  trans-40.7115.9172.6-167.8-160.7149.300113.4S51E49-S51 PolarHBondContact OE1-OG 3.01Å
50A41Very low45Very low68 Ų68147 Ų14756%0.56277%0.772SS**  trans-101.8102.3152.300000107.3D48 Y52D48-A50 PolarHBondContact O-N 2.97Å; A50-Y52 HydrophobicContact CB-CE2 4.27Å; A50-Y52 VanDerWaalsContact O-CD2 3.3Å; A50-Y52 WeakPolarHBondContact O-CD2 3.29Å; A50-Y52 PolarHBondContact O-N 2.68Å
51S46.2Very low44.5Very low93 Ų93142.3 Ų142.365%0.6577%0.766SS**  trans-61.4101.5174.8-31.40000109.4E49E49-S51 PolarHBondContact OE1-OG 3.01Å
52Y41.2Very low44.5Very low206 Ų206145.1 Ų145.181%0.80877%0.768SS**  trans-83.1130.7166.1-66.9-82.2000109.3A50 R54A50-Y52 HydrophobicContact CB-CE2 4.27Å; A50-Y52 VanDerWaalsContact O-CD2 3.3Å; A50-Y52 WeakPolarHBondContact O-CD2 3.29Å; A50-Y52 PolarHBondContact O-N 2.68Å; Y52-R54 PolarHBondContact O-N 2.87Å
53P47.2Very low44.2Very low124 Ų124146.9 Ų146.981%0.80577%0.769SS**  trans-72132.6177.511.4-2.3000111.4
54R45.5Very low44.2Very low221 Ų221154.4 Ų154.483%0.83478%0.778SS**  trans-25.2146.8168.5-147.7178.3-166.2-168.83.2116.7Y52Y52-R54 PolarHBondContact O-N 2.87Å
55S39.2Very low44.3Very low115 Ų115147.2 Ų147.280%0.80476%0.761SS**  trans-124.6134.1151.9-72.80000110.1Y57S55-Y57 PolarHBondContact O-N 3.14Å
56N50.8Low44.2Very low139 Ų139149 Ų14974%0.74376%0.764SS**  trans-64.7105.6-164.9-61.9-39.5000113.1
57Y43.8Very low43.9Very low220 Ų220147.5 Ų147.586%0.86377%0.767SS**  trans-109.8107160.8-129.4-92.7000109.1S55 E59S55-Y57 PolarHBondContact O-N 3.14Å; Y57-E59 PolarHBondContact O-N 3.09Å
58T55.2Low44.1Very low126 Ų126143.8 Ų143.877%0.77376%0.76SS**  trans-83.4103.4169.6-36.20000106.8P60T58-P60 WeakPolarHBondContact O-CD 3.46Å
59E42.5Very low44Very low157 Ų157141.5 Ų141.573%0.73476%0.755SS**  trans-69.7121.9170.2-114.5-89.4130.600108.6Y57Y57-E59 PolarHBondContact O-N 3.09Å
60P47.2Very low43.8Very low99 Ų99141.1 Ų141.164%0.64376%0.758SS**  trans-83119170.618.3-5.4000109.5T58 Y62T58-P60 WeakPolarHBondContact O-CD 3.46Å; P60-Y62 PolarHBondContact O-N 3.41Å; P60-Y62 VanDerWaalsContact O-N 3.16Å
61S44.4Very low43.5Very low112 Ų112141.2 Ų141.278%0.78377%0.766SS**  trans-64112.7170.364.90000109.6D63S61-D63 PolarHBondContact O-N 3.37Å
62Y37.5Very low43.4Very low195 Ų195144.3 Ų144.377%0.76578%0.775SS**  trans-85.1100.8167.556-91000109.1P60 Y64P60-Y62 PolarHBondContact O-N 3.41Å; P60-Y62 VanDerWaalsContact O-N 3.16Å; Y62-Y64 HydrophobicContact CD2-CD2 4.19Å
63D46.6Very low43.5Very low145 Ų145140.8 Ų140.878%0.77577%0.77SS**  trans-75.5118.6168.1-169.962.5000108.5S61 G65S61-D63 PolarHBondContact O-N 3.37Å; D63-G65 PolarHBondContact O-N 3.47Å
64Y47.4Very low42.8Very low224 Ų224141 Ų14188%0.87876%0.764SS**  trans-93.389177.5-119-86.9000108.5Y62Y62-Y64 HydrophobicContact CD2-CD2 4.19Å
65G39.4Very low42.4Very low53 Ų53139.7 Ų139.755%0.54677%0.765SS.*  trans-160.892.1-17700000115.1D63D63-G65 PolarHBondContact O-N 3.47Å
66N42.9Very low42.4Very low160 Ų160139.7 Ų139.786%0.85676%0.76SS**  trans65.1110.8140.6-144.725000120.3
67V36.4Very low41.8Very low144 Ų144139.9 Ų139.987%0.87376%0.761SS**  trans-147.8136.1148.3-1230000111.1
68P48.2Very low41.4Very low110 Ų110138.8 Ų138.871%0.71476%0.755SS**  trans-98.3168.2178.737.7-32.4000113.7
69S38.8Very low40.8Very low99 Ų99141.1 Ų141.169%0.69276%0.757SS**  trans88.1124.3149.9-123.40000121
70N38.5Very low40.8Very low153 Ų153140.7 Ų140.782%0.81876%0.755SS**  trans83.7114.2138-64.5-4.1000121.4
71G34.2Very low40.2Very low71 Ų71140.7 Ų140.773%0.73276%0.764SS**  101.4101.8126.900000116.7
72L44.5Very low39.9Very low158 Ų158142.2 Ų142.283%0.82776%0.758SS**  -167.5102.4124.5-146.773.3000111.3
73D42.2Very low40.1Very low132 Ų132138.9 Ų138.971%0.70676%0.76SS**  trans-4147.6140.924.3-68.9000121.4
74D33.2Very low39.6Very low128 Ų128138.1 Ų138.168%0.68475%0.752SS**  trans87.1100.5145.6-139.362.5000119.5
75F36.8Very low39.2Very low194 Ų194133 Ų13385%0.85175%0.746SS**  -169118116.6-114.2-83.8000109.9
76T40.2Very low39.1Very low115 Ų115138 Ų13871%0.70676%0.759SS**  trans-66136.2167.135.50000111.1
77D38Very low38.7Very low143 Ų143134.5 Ų134.577%0.76575%0.752SS**  -174.6148.4116.8-147.1-83.9000111.1H79D77-H79 IonicContact OD1-CD2 3.89Å; D77-H79 IonicContact OD1-NE2 3.94Å
78R34.5Very low38.7Very low197 Ų197136.1 Ų136.174%0.74375%0.751SS**  trans-139.5110.9-149.6-171.9-147.5178.3-168.1-1.8109.6
79H43.9Very low37.9Very low174 Ų174137.4 Ų137.481%0.80675%0.751SS**  trans-143.8101156.1-67.3-70.7000108.5D77D77-H79 IonicContact OD1-CD2 3.89Å; D77-H79 IonicContact OD1-NE2 3.94Å
80Q41.7Very low37.7Very low149 Ų149140.7 Ų140.770%0.69676%0.755SS**  73.392.986.4-164.477.314.600113.7
81A33.9Very low37.5Very low99 Ų99137.1 Ų137.182%0.81876%0.755SS**  trans-172.8112.5139.700000111.2
82Q38.4Very low38Very low143 Ų143140 Ų14067%0.66876%0.76SS**  trans-86.1140.8169.2-173.6-164.528.700109.1Q84Q82-Q84 VanDerWaalsContact CD-NE2 3.34Å
83P41.5Very low37.6Very low125 Ų125141.3 Ų141.381%0.81275%0.754SS**  trans-101.9114.9154.78.310.4000109.9
84Q36.1Very low37.3Very low129 Ų129142.9 Ų142.960%0.60376%0.762SS**PPolyproline II helixtrans-70.6148.1166.7-71.6-81.3-7.700110.6Q82Q82-Q84 VanDerWaalsContact CD-NE2 3.34Å
85P40Very low37.6Very low116 Ų116141.6 Ų141.675%0.75376%0.755SS**PPolyproline II helixtrans-82.9125.1170.732.1-29.2000110.4
86I36Very low37.7Very low159 Ų159138.4 Ų138.482%0.81575%0.753SS**PPolyproline II helixtrans-88.3121.8168.8-75165.9000109
87A35.4Very low37.5Very low87 Ų87138.8 Ų138.872%0.71976%0.755SS**PPolyproline II helixtrans-94.6140.2163.700000109.6
88Q35.9Very low38.1Very low178 Ų178137.6 Ų137.683%0.83276%0.755SS**  trans-167.6101.6155.4-104164.328.700108
89N32.7Very low38Very low136 Ų136135.7 Ų135.773%0.72776%0.76SS**  80.310287.9-114.2-88.8000115.5
90H33.6Very low37.8Very low169 Ų169132.8 Ų132.878%0.78276%0.759SS**  trans18.5119.3139.2-34.8-49000122.4
91G33.8Very low37.5Very low78 Ų78129 Ų12980%0.80476%0.76SS**  trans77168131.500000120.5
92P45.4Very low37.9Very low130 Ų130130.9 Ų130.984%0.84476%0.762SS**  cis-124.2172-1.439-22.3000115.3
93R36.6Very low38Very low186 Ų186130.5 Ų130.570%0.70277%0.769SS**  trans-75.2133.9179.3-168.2-112.4-165.9-161.40.8111.7N95R93-N95 PolarHBondContact NH1-ND2 3.11Å; R93-N95 PolarHBondContact NH2-ND2 3.11Å; R93-N95 PolarHBondContact NH2-OD1 3.34Å
94L36.5Very low37.8Very low165 Ų165133.8 Ų133.886%0.86477%0.773SS**  trans-135.1116.8159.9-69.1177.4000109.7
95N39.5Very low37.8Very low102 Ų102134 Ų13455%0.54578%0.779SS.*  trans-77.8149160.8-82.913.2000108.5R93R93-N95 PolarHBondContact NH1-ND2 3.11Å; R93-N95 PolarHBondContact NH2-ND2 3.11Å; R93-N95 PolarHBondContact NH2-OD1 3.34Å
96P39.1Very low37.9Very low126 Ų126134.2 Ų134.282%0.81878%0.777SS**  -136.3152.9120.520.6-0.2000113.3
97V35.1Very low38.1Very low123 Ų123130.6 Ų130.675%0.74577%0.766SS**  trans-127.2159.9168171.80000104.8
98P50.2Low38.7Very low118 Ų118135.3 Ų135.377%0.76677%0.77SS**  cis-122.3163-13.423.8-3.7000112.7
99D31.8Very low38.5Very low158 Ų158133.4 Ų133.485%0.84577%0.766SS**  trans-146.2147.2141.7-161.113.9000110.8
100S41.6Very low39Very low112 Ų112133.3 Ų133.378%0.78377%0.774SS**  trans-69.7143.2-165.5-56.40000112.8
101G34.1Very low39.4Very low70 Ų70130.1 Ų130.172%0.72277%0.771SS**  trans174.978.8173.800000114.6
102V42.1Very low39.7Very low139 Ų139134.5 Ų134.584%0.84278%0.775SS**  trans-11.9117.8157.4-162.90000115.9
103V41.7Very low39.3Very low135 Ų135131.6 Ų131.682%0.81876%0.762SS**  trans-162115.5134.4-84.60000108.6D105V103-D105 PolarHBondContact O-N 3.45Å
104E36.4Very low39.7Very low194 Ų194129.3 Ų129.391%0.90777%0.769SS**  trans-69110.1171-71.3-170.813000109.5
105D35.6Very low39.9Very low134 Ų134128.9 Ų128.972%0.71776%0.762SS**  trans-87.9104.6169.3-177.342.9000109V103 S107V103-D105 PolarHBondContact O-N 3.45Å; D105-S107 PolarHBondContact O-N 3.02Å; D105-S107 PolarHBondContact OD2-OG 3.4Å
106V42.3Very low39.9Very low120 Ų120129.5 Ų129.573%0.72777%0.773SS**  trans-74.685168.2171.60000107.8K108V106-K108 HydrophobicContact CG1-CG 4.5Å; V106-K108 PolarHBondContact O-N 3.39Å; V106-K108 VanDerWaalsContact O-N 3.1Å
107S40.1Very low39.8Very low82 Ų82133.5 Ų133.557%0.57377%0.774SS**  trans-62.3104.4164.2-81.10000109.4D105 D109D105-S107 PolarHBondContact O-N 3.02Å; D105-S107 PolarHBondContact OD2-OG 3.4Å; S107-D109 VanDerWaalsContact C-N 3.3Å; S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.09Å
108K47.8Very low40.4Very low187 Ų187133.8 Ų133.881%0.81378%0.778SS**  trans-7782167-82.8171.1177.7158.10109.1V106 C110V106-K108 HydrophobicContact CG1-CG 4.5Å; V106-K108 PolarHBondContact O-N 3.39Å; V106-K108 VanDerWaalsContact O-N 3.1Å; K108-C110 PolarHBondContact O-N 3.1Å; K108-C110 VanDerWaalsContact O-N 3.16Å
109D33.4Very low40.2Very low138 Ų138131.7 Ų131.774%0.73878%0.778SS**  trans-70.9102.1160.4-78-32.7000108.7S107 S111S107-D109 VanDerWaalsContact C-N 3.3Å; S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.09Å; D109-S111 PolarHBondContact O-N 3Å
110C42.5Very low40.5Very low133 Ų133128.3 Ų128.390%0.89977%0.772SS**  trans-72.661.9161.7-84.50000109.9K108 L112K108-C110 PolarHBondContact O-N 3.1Å; K108-C110 VanDerWaalsContact O-N 3.16Å; C110-L112 PolarHBondContact O-N 3.28Å
111S41.6Very low41Very low102 Ų102132.6 Ų132.671%0.71378%0.779SS**  trans-87.794.2158.3-680000106D109 A113D109-S111 PolarHBondContact O-N 3Å; S111-A113 VanDerWaalsContact C-N 3.32Å; S111-A113 PolarHBondContact O-N 3.34Å
112L41.2Very low41.6Very low171 Ų171138.7 Ų138.790%0.89579%0.786SS**  trans-62101.1171.4-158.988.4000106.7C110 T114C110-L112 PolarHBondContact O-N 3.28Å; L112-T114 PolarHBondContact O-N 2.88Å
113A36.9Very low42.3Very low69 Ų69136.1 Ų136.157%0.5779%0.788SS**  trans-53.5122.8168.700000107.8S111 E115S111-A113 VanDerWaalsContact C-N 3.32Å; S111-A113 PolarHBondContact O-N 3.34Å; A113-E115 PolarHBondContact O-N 3.43Å
114T45.1Very low42.7Very low137 Ų137138.8 Ų138.884%0.8479%0.788SS**  trans-64.684163.1-61.80000107L112 C116L112-T114 PolarHBondContact O-N 2.88Å; T114-C116 PolarHBondContact O-N 2.84Å; T114-C116 VanDerWaalsContact O-N 3.15Å
115E39.8Very low43.9Very low156 Ų156137.2 Ų137.273%0.72978%0.781SS**  trans-65108.5167.2-75.3-70.9118.300107.7A113 Y117A113-E115 PolarHBondContact O-N 3.43Å; E115-Y117 PolarHBondContact O-N 3.09Å
116C40.3Very low45.6Very low115 Ų115135.4 Ų135.478%0.77778%0.776SS**  trans-77.9107.4178.2-165.50000108.9T114 P118T114-C116 PolarHBondContact O-N 2.84Å; T114-C116 VanDerWaalsContact O-N 3.15Å; C116-P118 WeakPolarHBondContact O-CD 3.48Å
117Y35.4Very low47.4Very low211 Ų211135.2 Ų135.283%0.82778%0.778SS**  trans-79.8120.7167.2-90.8-93.2000110E115 G119E115-Y117 PolarHBondContact O-N 3.09Å; Y117-G119 PolarHBondContact O-N 3.4Å
118P47.9Very low49.5Very low128 Ų128135.7 Ų135.783%0.83178%0.777SS**  trans-89.5104.7169.433.2-24.6000108.5C116C116-P118 WeakPolarHBondContact O-CD 3.48Å
119G46.2Very low51.5Low75 Ų75130.8 Ų130.877%0.77376%0.762SS**  trans15082.8167.900000114.8Y117Y117-G119 PolarHBondContact O-N 3.4Å
120A39.2Very low54.2Low86 Ų86130.4 Ų130.471%0.71175%0.752SS**  trans177.897.3145.200000108.9K122A120-K122 PolarHBondContact O-N 3.27Å
121Q50.8Low56.4Low202 Ų202128.9 Ų128.994%0.94474%0.74SS**  trans-83.2101.4161.5-65.5-129.2-15.500108.2
122K48.1Very low58.7Low198 Ų198133.8 Ų133.886%0.86174%0.743SS**SBendtrans-157.2119.5157.8-140.4179.8-177.7-1760109.5A120A120-K122 PolarHBondContact O-N 3.27Å
123G55.8Low60.9Low85 Ų85130.1 Ų130.188%0.87672%0.723SS**  trans20.894.5171.200000118.2E125G123-E125 PolarHBondContact O-N 3.08Å
124K50.8Low63.2Low192 Ų192133 Ų13384%0.83572%0.722SS**  trans-91.681.3174.2-62.4-177.5-177.9-177.10110.2
125E62.1Low64.9Low160 Ų160133.7 Ų133.775%0.74871%0.713SS**PPolyproline II helixtrans-60.6129156.8-102.6-91139.300107.5G123G123-E125 PolarHBondContact O-N 3.08Å
126P70.7Confident66.6Low96 Ų96132.1 Ų132.162%0.62371%0.714SS**PPolyproline II helixtrans-61.4139.4175.826.2-32.1000108.9V128P126-V128 PolarHBondContact O-N 3.47Å
127P79.1Confident67.8Low116 Ų116134 Ų13475%0.75371%0.711SS**PPolyproline II helixtrans-54.4126.5-177.918.6-29.8000110.9V129P127-V129 PolarHBondContact O-N 3.26Å
128V85.7Confident68.9Low92 Ų92127.1 Ų127.156%0.55869%0.691SS**  trans-62.6107.2-179179.60000109.6P126 Y130P126-V128 PolarHBondContact O-N 3.47Å; V128-Y130 HydrophobicContact CG1-CE1 4.16Å; V128-Y130 HydrophobicContact CG1-CE2 4.4Å; V128-Y130 PolarHBondContact O-N 3Å
129V88.6Confident69.2Low84 Ų84127 Ų12751%0.50969%0.688SS.*  trans-86.5103.7176.2-177.70000109.5P127 M133 K134P127-V129 PolarHBondContact O-N 3.26Å; V129-M133 HydrophobicContact CG1-CB 3.91Å; V129-K134 HydrophobicContact CG1-CG 4.01Å
130Y89.9Confident69.2Low130 Ų130129.7 Ų129.751%0.5169%0.685SS.*  trans-66151.7177.2-64.7-79.4000112.2V128 W132 M133V128-Y130 HydrophobicContact CG1-CE1 4.16Å; V128-Y130 HydrophobicContact CG1-CE2 4.4Å; V128-Y130 PolarHBondContact O-N 3Å; Y130-W132 VanDerWaalsContact CB-NE1 3.3Å; Y130-W132 AromaticContact CG-NE1 3.89Å; Y130-W132 PolarHBondContact O-N 3.41Å; Y130-W132 VanDerWaalsContact O-N 3.09Å; Y130-M133 HydrophobicContact CD2-SD 3.72Å; Y130-M133 HydrophobicContact CG-SD 4.37Å; Y130-M133 VanDerWaalsContact O-CB 3.32Å; Y130-M133 WeakPolarHBondContact O-CB 3.45Å; Y130-M133 PolarHBondContact O-N 3.23Å
131P89.1Confident69.9Low101 Ų101129.9 Ų129.966%0.65669%0.686SS**G310 helixtrans-53.9-34.3-176.6-29.135.9000115.1M133 K134P131-M133 VanDerWaalsContact C-N 3.31Å; P131-M133 PolarHBondContact O-N 3.43Å; P131-K134 WeakPolarHBondContact O-CB 3.44Å; P131-K134 PolarHBondContact O-N 2.93Å
132W89.5Confident69.9Low205 Ų205124.2 Ų124.278%0.77767%0.669SS**G310 helixtrans-71.8-23.2177.666-94.8000113.7Y130 K134Y130-W132 VanDerWaalsContact CB-NE1 3.3Å; Y130-W132 AromaticContact CG-NE1 3.89Å; Y130-W132 PolarHBondContact O-N 3.41Å; Y130-W132 VanDerWaalsContact O-N 3.09Å; W132-K134 VanDerWaalsContact C-N 3.25Å
133M87.9Confident69.6Low95 Ų95124.7 Ų124.747%0.46867%0.667SS.*G310 helixtrans-77.2-16.3176.1-59.5173.57100111.5V129 Y130 P131V129-M133 HydrophobicContact CG1-CB 3.91Å; Y130-M133 HydrophobicContact CD2-SD 3.72Å; Y130-M133 HydrophobicContact CG-SD 4.37Å; Y130-M133 VanDerWaalsContact O-CB 3.32Å; Y130-M133 WeakPolarHBondContact O-CB 3.45Å; Y130-M133 PolarHBondContact O-N 3.23Å; P131-M133 VanDerWaalsContact C-N 3.31Å; P131-M133 PolarHBondContact O-N 3.43Å
134K84.3Confident69.3Low130 Ų130126.1 Ų126.157%0.56566%0.663SS**SBendtrans-74.6130175.4-57.2-177.8-179.5-179.20108.9V129 P131 W132 V136V129-K134 HydrophobicContact CG1-CG 4.01Å; P131-K134 WeakPolarHBondContact O-CB 3.44Å; P131-K134 PolarHBondContact O-N 2.93Å; W132-K134 VanDerWaalsContact C-N 3.25Å; K134-V136 PolarHBondContact O-N 3Å
135K82.3Confident69.2Low150 Ų150120.4 Ų120.465%0.65266%0.659SS**  trans-67.1105.4176.6-82.7179.4175.91780109.8H137 V138K135-H137 VanDerWaalsContact C-N 3.28Å; K135-H137 PolarHBondContact O-N 3.21Å; K135-V138 HydrophobicContact CB-CG2 4.19Å; K135-V138 WeakPolarHBondContact O-CG2 3.36Å
136V74Confident68.9Low123 Ų123116.5 Ų116.575%0.74566%0.661SS**THydrogen-bonded Turntrans-70.5-19.9-179.3-178.30000113.5K134 V138K134-V136 PolarHBondContact O-N 3Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å
137H65.9Low68.2Low154 Ų154116.6 Ų116.671%0.71366%0.66SS**THydrogen-bonded Turntrans-85.25.5-173.3-65.6100.9000115.6K135 V139 R150K135-H137 VanDerWaalsContact C-N 3.28Å; K135-H137 PolarHBondContact O-N 3.21Å; H137-V139 PolarHBondContact O-N 3.02Å; H137-R150 PolarHBondContact O-NH2 3.49Å
138V60Low67.3Low68 Ų68116.4 Ų116.441%0.41266%0.659SS.*  trans-84.488.8171-101.70000108.9K135 V136K135-V138 HydrophobicContact CB-CG2 4.19Å; K135-V138 WeakPolarHBondContact O-CG2 3.36Å; V136-V138 VanDerWaalsContact C-N 3.33Å; V136-V138 PolarHBondContact O-N 3.46Å
139V53.3Low66.8Low124 Ų124120.4 Ų120.475%0.75267%0.669SS**SBendtrans-78.6115.9159.4-171.70000104.7H137H137-V139 PolarHBondContact O-N 3.02Å
140N47Very low66.3Low133 Ų133125.5 Ų125.571%0.71168%0.679SS**  trans72.486.1-166.9-76.53.5000116.3S142N140-S142 VanDerWaalsContact C-N 3.27Å
141A53.8Low66.1Low89 Ų89124.7 Ų124.774%0.73669%0.692SS**  trans-87.916.2164.700000113.1Y143A141-Y143 PolarHBondContact O-N 3.33Å
142S49.4Very low66.1Low83 Ų83131.1 Ų131.158%0.5870%0.703SS**  trans-95.471.8171.456.20000109N140N140-S142 VanDerWaalsContact C-N 3.27Å
143Y43.1Very low66.3Low209 Ų209127 Ų12782%0.8270%0.701SS**SBendtrans177119.1148.3-106.8-84.4000106.8A141A141-Y143 PolarHBondContact O-N 3.33Å
144S48Very low66.7Low115 Ų115126.6 Ų126.680%0.80471%0.713SS**  trans-43.7137.5167.846.50000113
145G48.9Very low67.4Low72 Ų72124.2 Ų124.274%0.74270%0.701SS**SBendtrans105.9100.4162.100000115.1V147G145-V147 PolarHBondContact O-N 3.17Å
146G56.8Low68.1Low78 Ų78120.7 Ų120.780%0.80469%0.692SS**  trans65.730.6145.800000118.9P148G146-P148 VanDerWaalsContact O-CD 3.26Å; G146-P148 WeakPolarHBondContact O-CD 3.23Å; G146-P148 VanDerWaalsContact O-N 3.11Å
147V55.6Low69.3Low97 Ų97124.4 Ų124.459%0.58869%0.693SS**PPolyproline II helixtrans-57.7118.6-178.7-165.50000111G145 K149G145-V147 PolarHBondContact O-N 3.17Å; V147-K149 PolarHBondContact O-N 3.04Å
148P61Low70.8Confident112 Ų112123.6 Ų123.673%0.72769%0.689SS**PPolyproline II helixtrans-60.7132.4-178.8-21.932.1000110.6G146 R150G146-P148 VanDerWaalsContact O-CD 3.26Å; G146-P148 WeakPolarHBondContact O-CD 3.23Å; G146-P148 VanDerWaalsContact O-N 3.11Å; P148-R150 PolarHBondContact O-N 2.98Å; P148-R150 VanDerWaalsContact O-N 3.14Å
149K73.9Confident72.6Confident177 Ų177121.7 Ų121.777%0.7768%0.675SS**PPolyproline II helixtrans-49.8125.1164.2-88.3153.1172.21700107.2V147 S151V147-K149 PolarHBondContact O-N 3.04Å; K149-S151 PolarHBondContact O-N 3.45Å
150R77.9Confident74.8Confident190 Ų190117.3 Ų117.372%0.71765%0.652SS**  trans-46108.8176-118.6-178-83.6179.6-5.3108.4H137 P148H137-R150 PolarHBondContact O-NH2 3.49Å; P148-R150 PolarHBondContact O-N 2.98Å; P148-R150 VanDerWaalsContact O-N 3.14Å
151S85.5Confident77.2Confident113 Ų113114.8 Ų114.879%0.7964%0.638SS**PPolyproline II helixtrans-65.7136.5-176-175.60000109.3K149K149-S151 PolarHBondContact O-N 3.45Å
152R90.8Very high79.3Confident236 Ų236113.8 Ų113.889%0.89162%0.619SS**PPolyproline II helixtrans-87.6117.3177.9-72.1-179.8177.1-97.71.9108.6
153T93.8Very high81.7Confident119 Ų119109.9 Ų109.973%0.7359%0.591SS**PPolyproline II helixtrans-77.6128169-44.40000109.7
154A95.7Very high84.3Confident87 Ų87103.6 Ų103.672%0.71957%0.569SS**PPolyproline II helixtrans-82.9146.5172.300000110.5
155Y98Very high86.7Confident79 Ų79104 Ų10431%0.3156%0.557SS.*PPolyproline II helixtrans-78.1147.2171.2-60.3-51.3000110.4L187 W195Y155-L187 HydrophobicContact CD1-CD1 4.08Å; Y155-L187 HydrophobicContact CD1-CD2 3.85Å; Y155-L187 HydrophobicContact CE1-CD1 3.92Å; Y155-L187 HydrophobicContact CE1-CD2 3.67Å; Y155-L187 HydrophobicContact CE1-CG 4.47Å; Y155-W195 AromaticContact CD2-CD1 3.85Å; Y155-W195 AromaticContact CE2-CD1 3.55Å
156T98.4Very high89.1Confident76 Ų76101.5 Ų101.547%0.46653%0.526SS..PPolyproline II helixtrans-68160.9172.9740000110.4Q158 Q159 A160T156-Q158 VanDerWaalsContact C-N 3.28Å; T156-Q158 PolarHBondContact O-N 3.33Å; T156-Q159 PolarHBondContact O-N 3.48Å; T156-Q159 VanDerWaalsContact OG1-CG 3.32Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.14Å; T156-Q159 PolarHBondContact OG1-N 2.85Å; T156-A160 PolarHBondContact O-N 3.38Å
157R98Very high91Very high202 Ų20298 Ų9876%0.76249%0.488SS*.Hα-helixtrans-57.5-42.9176.6-175.4173.7-179.3-85.8-0.7111.9A160 L161R157-A160 PolarHBondContact O-N 2.84Å; R157-L161 HydrophobicContact CG-CD1 4.14Å; R157-L161 WeakPolarHBondContact O-CG 3.25Å; R157-L161 PolarHBondContact O-N 2.89Å
158Q98.1Very high93.1Very high137 Ų13799.1 Ų99.164%0.6449%0.487SS*.Hα-helixtrans-61.7-44177.4-177.4-177.3-15.200111.6T156 A160 L161 E162 M185T156-Q158 VanDerWaalsContact C-N 3.28Å; T156-Q158 PolarHBondContact O-N 3.33Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 3.29Å; Q158-L161 PolarHBondContact O-N 3.43Å; Q158-E162 PolarHBondContact O-N 2.96Å; Q158-E162 VanDerWaalsContact O-N 3.13Å; Q158-M185 HydrophobicContact CG-CE 4.5Å
159Q98.4Very high94.8Very high27 Ų27101.7 Ų101.713%0.12649%0.487CS..Hα-helixtrans-59.6-45.3176.8-75171.1-21.600111.9T156 L161 L163 M185T156-Q159 PolarHBondContact O-N 3.48Å; T156-Q159 VanDerWaalsContact OG1-CG 3.32Å; T156-Q159 WeakPolarHBondContact OG1-CG 3.14Å; T156-Q159 PolarHBondContact OG1-N 2.85Å; Q159-L161 PolarHBondContact O-N 3.34Å; Q159-L163 WeakPolarHBondContact O-CB 3.36Å; Q159-L163 WeakPolarHBondContact O-CD1 3.44Å; Q159-L163 WeakPolarHBondContact O-CG 3.26Å; Q159-L163 PolarHBondContact O-N 2.78Å; Q159-L163 VanDerWaalsContact O-N 3.11Å; Q159-M185 VanDerWaalsContact CA-SD 3.59Å; Q159-M185 HydrophobicContact CB-SD 4.25Å; Q159-M185 HydrophobicContact CG-CB 4.5Å; Q159-M185 HydrophobicContact CG-CE 4.26Å; Q159-M185 HydrophobicContact CG-SD 4.32Å; Q159-M185 PolarHBondContact NE2-O 3.14Å
160A98.2Very high95.9Very high32 Ų3296.8 Ų96.826%0.26447%0.469SS..Hα-helixtrans-62.2-44178.900000112.3T156 R157 Q158 L163 E164T156-A160 PolarHBondContact O-N 3.38Å; R157-A160 PolarHBondContact O-N 2.84Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 3.29Å; A160-L163 PolarHBondContact O-N 3.11Å; A160-E164 WeakPolarHBondContact O-CB 3.49Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.02Å
161L98.3Very high96.9Very high80 Ų8092.4 Ų92.442%0.41945%0.452SS..Hα-helixtrans-65-46.2-178-71.5172.5000112.8R157 Q158 Q159 E164 K165R157-L161 HydrophobicContact CG-CD1 4.14Å; R157-L161 WeakPolarHBondContact O-CG 3.25Å; R157-L161 PolarHBondContact O-N 2.89Å; Q158-L161 PolarHBondContact O-N 3.43Å; Q159-L161 PolarHBondContact O-N 3.34Å; L161-E164 PolarHBondContact O-N 3.1Å; L161-K165 WeakPolarHBondContact O-CB 3.4Å; L161-K165 PolarHBondContact O-N 3.13Å
162E98.3Very high97.5Very high69 Ų6993.9 Ų93.932%0.32244%0.442SS..Hα-helixtrans-66.9-38.3178.2-72.5-64.3153.400111.5Q158 E164 K165 E166 M185Q158-E162 PolarHBondContact O-N 2.96Å; Q158-E162 VanDerWaalsContact O-N 3.13Å; E162-E164 VanDerWaalsContact C-N 3.33Å; E162-E164 PolarHBondContact O-N 3.22Å; E162-K165 WeakPolarHBondContact O-CB 3.45Å; E162-K165 PolarHBondContact O-N 2.85Å; E162-K165 IonicContact OE1-NZ 3.81Å; E162-K165 WeakPolarHBondContact OE2-CD 3.4Å; E162-K165 IonicContact OE2-NZ 3.71Å; E162-K165 PolarHBondContact OE2-NZ 3.27Å; E162-E166 WeakPolarHBondContact O-CG 3.42Å; E162-E166 PolarHBondContact O-N 3.28Å; E162-M185 HydrophobicContact CB-CE 3.5Å; E162-M185 HydrophobicContact CB-SD 3.42Å; E162-M185 WeakPolarHBondContact CB-SD 3.3Å; E162-M185 HydrophobicContact CG-CE 3.61Å; E162-M185 HydrophobicContact CG-SD 4.23Å
163L98.5Very high97.8Very high0 Ų084 Ų840%041%0.407CS..Hα-helixtrans-63-39.2173.1-71.4168.8000112.1Q159 A160 F167 I181 M185 L187 V192 W195 F196Q159-L163 WeakPolarHBondContact O-CB 3.36Å; Q159-L163 WeakPolarHBondContact O-CD1 3.44Å; Q159-L163 WeakPolarHBondContact O-CG 3.26Å; Q159-L163 PolarHBondContact O-N 2.78Å; Q159-L163 VanDerWaalsContact O-N 3.11Å; A160-L163 PolarHBondContact O-N 3.11Å; L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 2.93Å; L163-I181 HydrophobicContact CD2-CG2 3.93Å; L163-M185 HydrophobicContact CG-SD 4.25Å; L163-L187 HydrophobicContact CD1-CD1 4.12Å; L163-V192 HydrophobicContact CD2-CG1 4.33Å; L163-W195 VanDerWaalsContact C-CH2 3.47Å; L163-W195 HydrophobicContact CB-CD2 3.94Å; L163-W195 HydrophobicContact CB-CE3 3.94Å; L163-W195 HydrophobicContact CB-CH2 3.66Å; L163-W195 HydrophobicContact CB-CZ2 3.64Å; L163-W195 HydrophobicContact CB-CZ3 3.81Å; L163-W195 HydrophobicContact CD1-CD2 3.89Å; L163-W195 HydrophobicContact CD1-CG 3.84Å; L163-W195 HydrophobicContact CD2-CD2 4.48Å; L163-W195 HydrophobicContact CD2-CE3 4.4Å; L163-W195 HydrophobicContact CG-CD2 4.33Å; L163-W195 WeakPolarHBondContact O-CH2 3.48Å; L163-W195 WeakPolarHBondContact O-CZ3 3.4Å; L163-F196 HydrophobicContact CD2-CE2 4.09Å
164E98.4Very high98.1Very high78 Ų7882.4 Ų82.436%0.36440%0.397SS..Hα-helixtrans-65.8-45.4173.7-76.8-170.2179.200111.9A160 L161 E162 E166 F167 H168 W195A160-E164 WeakPolarHBondContact O-CB 3.49Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.02Å; L161-E164 PolarHBondContact O-N 3.1Å; E162-E164 VanDerWaalsContact C-N 3.33Å; E162-E164 PolarHBondContact O-N 3.22Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 3.45Å; E164-F167 WeakPolarHBondContact O-CB 3.41Å; E164-F167 PolarHBondContact O-N 2.71Å; E164-F167 VanDerWaalsContact O-N 3.13Å; E164-H168 PolarHBondContact O-N 3.11Å; E164-H168 PolarHBondContact O-ND1 3.07Å; E164-W195 HydrophobicContact CG-CH2 3.92Å; E164-W195 HydrophobicContact CG-CZ2 4.01Å
165K98.4Very high98.2Very high124 Ų12485 Ų8554%0.53939%0.388SS..Hα-helixtrans-55.2-49.1175.6176.9-173.5167-164.70111.4L161 E162 F167 H168 F169L161-K165 WeakPolarHBondContact O-CB 3.4Å; L161-K165 PolarHBondContact O-N 3.13Å; E162-K165 WeakPolarHBondContact O-CB 3.45Å; E162-K165 PolarHBondContact O-N 2.85Å; E162-K165 IonicContact OE1-NZ 3.81Å; E162-K165 WeakPolarHBondContact OE2-CD 3.4Å; E162-K165 IonicContact OE2-NZ 3.71Å; E162-K165 PolarHBondContact OE2-NZ 3.27Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.31Å; K165-H168 PolarHBondContact O-N 3.13Å; K165-F169 PolarHBondContact O-N 3.34Å; K165-F169 VanDerWaalsContact O-N 3.08Å
166E98.3Very high98.2Very high19 Ų1990.3 Ų90.39%0.08941%0.407CS..Hα-helixtrans-62.6-37.9176.5-72.5-64.2134.200112.4E162 E164 H168 F169 N170 R177 I181 F196E162-E166 WeakPolarHBondContact O-CG 3.42Å; E162-E166 PolarHBondContact O-N 3.28Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-E166 PolarHBondContact O-N 3.45Å; E166-H168 VanDerWaalsContact C-N 3.34Å; E166-H168 PolarHBondContact O-N 3.49Å; E166-F169 PolarHBondContact O-N 3.34Å; E166-N170 PolarHBondContact O-N 3.04Å; E166-N170 VanDerWaalsContact O-O 3.14Å; E166-R177 IonicContact OE1-CZ 2.7Å; E166-R177 IonicContact OE1-NE 3.83Å; E166-R177 IonicContact OE1-NH2 3.36Å; E166-R177 PolarHBondContact OE1-NH2 2.78Å; E166-R177 IonicContact OE2-CZ 3.13Å; E166-R177 IonicContact OE2-NE 3.23Å; E166-R177 PolarHBondContact OE2-NE 2.8Å; E166-R177 IonicContact OE2-NH2 2.9Å; E166-R177 PolarHBondContact OE2-NH2 2.92Å; E166-I181 HydrophobicContact CB-CD1 4.01Å; E166-I181 HydrophobicContact CG-CD1 3.68Å; E166-I181 HydrophobicContact CG-CG1 4.03Å; E166-F196 HydrophobicContact CB-CZ 4Å
167F98.5Very high98.2Very high3 Ų390.8 Ų90.81%0.01340%0.401CS..Hα-helixtrans-65.1-36.6177.5-177.4-99.1000113.1L163 E164 K165 N170 R171 W195 F196 R199 R200 W203L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 2.93Å; E164-F167 WeakPolarHBondContact O-CB 3.41Å; E164-F167 PolarHBondContact O-N 2.71Å; E164-F167 VanDerWaalsContact O-N 3.13Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.31Å; F167-N170 CarbonylContact O-C 3.3Å; F167-N170 VanDerWaalsContact O-C 3.3Å; F167-R171 HydrophobicContact CE1-CG 4.23Å; F167-R171 HydrophobicContact CE2-CB 4.03Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CZ-CB 4.27Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 PolarHBondContact O-N 3.44Å; F167-W195 HydrophobicContact CB-CH2 4.39Å; F167-W195 HydrophobicContact CB-CZ3 4.08Å; F167-F196 HydrophobicContact CB-CE1 4.2Å; F167-F196 HydrophobicContact CB-CZ 4.32Å; F167-F196 AromaticContact CD2-CD1 4Å; F167-F196 HydrophobicContact CD2-CD1 4Å; F167-F196 AromaticContact CD2-CE1 3.95Å; F167-F196 HydrophobicContact CD2-CE1 3.95Å; F167-R199 HydrophobicContact CB-CG 4.32Å; F167-R199 HydrophobicContact CD1-CG 3.69Å; F167-R199 HydrophobicContact CD2-CB 4.18Å; F167-R199 HydrophobicContact CD2-CG 3.53Å; F167-R199 HydrophobicContact CE1-CG 3.8Å; F167-R199 HydrophobicContact CE2-CB 4.21Å; F167-R199 HydrophobicContact CE2-CG 3.66Å; F167-R199 HydrophobicContact CG-CG 3.55Å; F167-R199 HydrophobicContact CZ-CG 3.78Å; F167-R200 HydrophobicContact CE2-CG 3.74Å; F167-R200 HydrophobicContact CZ-CG 4.31Å; F167-W203 HydrophobicContact CE1-CB 4.12Å; F167-W203 HydrophobicContact CE1-CG 4.11Å; F167-W203 HydrophobicContact CZ-CB 3.86Å; F167-W203 HydrophobicContact CZ-CG 4.04Å
168H97.9Very high98.2Very high121 Ų12183.8 Ų83.856%0.5637%0.374SS*.Hα-helixtrans-68.7-39.5174.4-69.792.5000111.2E164 K165 E166E164-H168 PolarHBondContact O-N 3.11Å; E164-H168 PolarHBondContact O-ND1 3.07Å; K165-H168 PolarHBondContact O-N 3.13Å; E166-H168 VanDerWaalsContact C-N 3.34Å; E166-H168 PolarHBondContact O-N 3.49Å
169F98.2Very high98.2Very high167 Ų16779.2 Ų79.273%0.73236%0.355SS*.Hα-helixtrans-62.9-50.3174.9179.5-104.2000111.7K165 E166K165-F169 PolarHBondContact O-N 3.34Å; K165-F169 VanDerWaalsContact O-N 3.08Å; E166-F169 PolarHBondContact O-N 3.34Å
170N97.2Very high98.2Very high73 Ų7381.1 Ų81.139%0.3936%0.364SS..  trans-146.9122.2174.8-169.5-8.8000111.4E166 F167 Y172E166-N170 PolarHBondContact O-N 3.04Å; E166-N170 VanDerWaalsContact O-O 3.14Å; F167-N170 CarbonylContact O-C 3.3Å; F167-N170 VanDerWaalsContact O-C 3.3Å; N170-Y172 PolarHBondContact ND2-O 3.45Å; N170-Y172 PolarHBondContact O-N 3.47Å; N170-Y172 VanDerWaalsContact O-N 3.14Å; N170-Y172 PolarHBondContact OD1-N 3.19Å; N170-Y172 VanDerWaalsContact OD1-N 3.09Å; N170-Y172 PolarHBondContact OD1-O 3.21Å
171R97.6Very high98.2Very high99 Ų9980 Ų8037%0.37435%0.354SS..SBendtrans-67.3-15.3-179.2-69.2171.3170.670.9-1113.2F167 R200F167-R171 HydrophobicContact CE1-CG 4.23Å; F167-R171 HydrophobicContact CE2-CB 4.03Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CZ-CB 4.27Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 PolarHBondContact O-N 3.44Å; R171-R200 WeakPolarHBondContact O-CD 3.42Å
172Y98.3Very high98.2Very high144 Ų14476.3 Ų76.357%0.56534%0.335SS*.SBendtrans-132.1133.2-178.3-63.6-106.3000109.9N170N170-Y172 PolarHBondContact ND2-O 3.45Å; N170-Y172 PolarHBondContact O-N 3.47Å; N170-Y172 VanDerWaalsContact O-N 3.14Å; N170-Y172 PolarHBondContact OD1-N 3.19Å; N170-Y172 VanDerWaalsContact OD1-N 3.09Å; N170-Y172 PolarHBondContact OD1-O 3.21Å
173L98.2Very high98.2Very high29 Ų2979.7 Ų79.715%0.15235%0.35CS..  trans-96.9139.4179.2-62.3-179.6000112R177 I181 V192 F196L173-R177 HydrophobicContact CD2-CG 3.94Å; L173-I181 HydrophobicContact CD1-CD1 3.8Å; L173-I181 HydrophobicContact CD2-CD1 3.71Å; L173-I181 HydrophobicContact CG-CD1 4.42Å; L173-V192 HydrophobicContact CD1-CG1 3.63Å; L173-F196 HydrophobicContact CD1-CD1 4.09Å; L173-F196 HydrophobicContact CD1-CD2 3.59Å; L173-F196 HydrophobicContact CD1-CE1 3.94Å; L173-F196 HydrophobicContact CD1-CE2 3.46Å; L173-F196 VanDerWaalsContact CD1-CE2 3.46Å; L173-F196 HydrophobicContact CD1-CG 3.92Å; L173-F196 HydrophobicContact CD1-CZ 3.64Å; L173-F196 HydrophobicContact CD2-CD1 4.4Å; L173-F196 HydrophobicContact CD2-CE1 3.69Å; L173-F196 HydrophobicContact CD2-CE2 4.36Å; L173-F196 HydrophobicContact CD2-CZ 3.67Å; L173-F196 HydrophobicContact CG-CD1 3.74Å; L173-F196 HydrophobicContact CG-CD2 4.18Å; L173-F196 HydrophobicContact CG-CE1 3.51Å; L173-F196 HydrophobicContact CG-CE2 4.01Å; L173-F196 HydrophobicContact CG-CG 4.07Å; L173-F196 HydrophobicContact CG-CZ 3.67Å
174T98.5Very high98.2Very high85 Ų8584.9 Ų84.952%0.52138%0.382SS..  trans-73.1167.4162.966.60000110.8R177 R178T174-R177 WeakPolarHBondContact OG1-CB 3.28Å; T174-R177 PolarHBondContact OG1-N 3.49Å; T174-R178 WeakPolarHBondContact O-CB 3.43Å; T174-R178 PolarHBondContact O-N 3.24Å; T174-R178 VanDerWaalsContact O-N 3.14Å
175R98.3Very high98.1Very high140 Ų14081.6 Ų81.653%0.52837%0.367SS..Hα-helixtrans-60.5-47177.8-179.365179.288.6-11.9112R178 V179 E189R175-R178 WeakPolarHBondContact O-CB 3.47Å; R175-R178 PolarHBondContact O-N 2.89Å; R175-V179 PolarHBondContact O-N 3.19Å; R175-E189 VanDerWaalsContact CZ-CD 3.49Å; R175-E189 IonicContact CZ-OE1 3.24Å; R175-E189 VanDerWaalsContact CZ-OE1 3.24Å; R175-E189 IonicContact CZ-OE2 2.95Å; R175-E189 IonicContact NE-OE2 3.74Å; R175-E189 IonicContact NH1-OE1 4Å; R175-E189 PolarHBondContact NH1-OE1 3.22Å; R175-E189 IonicContact NH1-OE2 2.68Å; R175-E189 PolarHBondContact NH1-OE2 3.36Å; R175-E189 VanDerWaalsContact NH2-CD 3.34Å; R175-E189 IonicContact NH2-OE1 2.87Å; R175-E189 PolarHBondContact NH2-OE1 3.35Å; R175-E189 IonicContact NH2-OE2 3.01Å; R175-E189 PolarHBondContact NH2-OE2 2.84Å; R175-E189 VanDerWaalsContact NH2-OE2 3.13Å
176R98.2Very high98Very high192 Ų19281.1 Ų81.173%0.72538%0.378SS*.Hα-helixtrans-62.2-50.4179.4178.6178169.3164.82.5111.5R178 V179 E180R176-R178 PolarHBondContact O-N 3.48Å; R176-V179 WeakPolarHBondContact O-CB 3.41Å; R176-V179 PolarHBondContact O-N 3.43Å; R176-E180 WeakPolarHBondContact CG-OE1 3.28Å; R176-E180 IonicContact NE-OE1 3.12Å; R176-E180 PolarHBondContact NE-OE1 3.05Å; R176-E180 VanDerWaalsContact NE-OE1 3.12Å; R176-E180 PolarHBondContact O-N 3.08Å
177R98.3Very high98Very high86 Ų8681.1 Ų81.133%0.32538%0.379SS..Hα-helixtrans-60.7-34.1-179.1-172.756.2175.6179.1-1.4112.6E166 L173 T174 V179 E180 I181E166-R177 IonicContact OE1-CZ 2.7Å; E166-R177 IonicContact OE1-NE 3.83Å; E166-R177 IonicContact OE1-NH2 3.36Å; E166-R177 PolarHBondContact OE1-NH2 2.78Å; E166-R177 IonicContact OE2-CZ 3.13Å; E166-R177 IonicContact OE2-NE 3.23Å; E166-R177 PolarHBondContact OE2-NE 2.8Å; E166-R177 IonicContact OE2-NH2 2.9Å; E166-R177 PolarHBondContact OE2-NH2 2.92Å; L173-R177 HydrophobicContact CD2-CG 3.94Å; T174-R177 WeakPolarHBondContact OG1-CB 3.28Å; T174-R177 PolarHBondContact OG1-N 3.49Å; R177-V179 VanDerWaalsContact C-N 3.34Å; R177-V179 PolarHBondContact O-N 3.39Å; R177-E180 VanDerWaalsContact CD-OE2 3.29Å; R177-E180 WeakPolarHBondContact CD-OE2 3.36Å; R177-E180 IonicContact CZ-OE2 2.78Å; R177-E180 IonicContact NH1-OE2 2.83Å; R177-E180 PolarHBondContact NH1-OE2 3.46Å; R177-E180 PolarHBondContact O-N 3.37Å; R177-I181 HydrophobicContact CG-CD1 3.92Å; R177-I181 HydrophobicContact CG-CG1 4.47Å; R177-I181 WeakPolarHBondContact O-CG1 3.38Å; R177-I181 PolarHBondContact O-N 3.29Å; R177-I181 VanDerWaalsContact O-N 3.09Å
178R98.4Very high98Very high55 Ų5583.6 Ų83.621%0.20840%0.396CS..Hα-helixtrans-61.2-40.3175-171.2-172.3-54.3173.27.6112.8T174 R175 R176 A182 E189 V192T174-R178 WeakPolarHBondContact O-CB 3.43Å; T174-R178 PolarHBondContact O-N 3.24Å; T174-R178 VanDerWaalsContact O-N 3.14Å; R175-R178 WeakPolarHBondContact O-CB 3.47Å; R175-R178 PolarHBondContact O-N 2.89Å; R176-R178 PolarHBondContact O-N 3.48Å; R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.17Å; R178-A182 PolarHBondContact O-N 2.88Å; R178-E189 HydrophobicContact CG-CB 4.3Å; R178-E189 HydrophobicContact CG-CG 4.49Å; R178-V192 HydrophobicContact CG-CB 4.26Å; R178-V192 HydrophobicContact CG-CG1 4.14Å
179V98.6Very high98Very high40 Ų4080.6 Ų80.624%0.24238%0.382CS..Hα-helixtrans-64-47.8177.2-178.60000110.1R175 R176 R177 I181 A182 H183R175-V179 PolarHBondContact O-N 3.19Å; R176-V179 WeakPolarHBondContact O-CB 3.41Å; R176-V179 PolarHBondContact O-N 3.43Å; R177-V179 VanDerWaalsContact C-N 3.34Å; R177-V179 PolarHBondContact O-N 3.39Å; V179-I181 PolarHBondContact O-N 2.89Å; V179-A182 WeakPolarHBondContact O-CB 3.45Å; V179-A182 PolarHBondContact O-N 3.26Å; V179-H183 PolarHBondContact O-CD2 3.02Å; V179-H183 PolarHBondContact O-N 3.36Å
180E98.3Very high98Very high67 Ų6781.2 Ų81.231%0.31338%0.38SS..Hα-helixtrans-56.2-50.9-179.6-65.2169.3-17200111R176 R177 A182 H183 T184R176-E180 WeakPolarHBondContact CG-OE1 3.28Å; R176-E180 IonicContact NE-OE1 3.12Å; R176-E180 PolarHBondContact NE-OE1 3.05Å; R176-E180 VanDerWaalsContact NE-OE1 3.12Å; R176-E180 PolarHBondContact O-N 3.08Å; R177-E180 VanDerWaalsContact CD-OE2 3.29Å; R177-E180 WeakPolarHBondContact CD-OE2 3.36Å; R177-E180 IonicContact CZ-OE2 2.78Å; R177-E180 IonicContact NH1-OE2 2.83Å; R177-E180 PolarHBondContact NH1-OE2 3.46Å; R177-E180 PolarHBondContact O-N 3.37Å; E180-A182 PolarHBondContact O-N 3.19Å; E180-H183 PolarHBondContact O-N 3.42Å; E180-T184 PolarHBondContact O-N 3.47Å; E180-T184 VanDerWaalsContact O-N 3.11Å; E180-T184 PolarHBondContact O-OG1 3.34Å; E180-T184 VanDerWaalsContact O-OG1 3.11Å
181I98.1Very high98.1Very high9 Ų980.7 Ų80.75%0.04638%0.375CS..Hα-helixtrans-63.2-42.4178.9-64.5166.8000111.5L163 E166 L173 R177 V179 H183 T184 M185 V192L163-I181 HydrophobicContact CD2-CG2 3.93Å; E166-I181 HydrophobicContact CB-CD1 4.01Å; E166-I181 HydrophobicContact CG-CD1 3.68Å; E166-I181 HydrophobicContact CG-CG1 4.03Å; L173-I181 HydrophobicContact CD1-CD1 3.8Å; L173-I181 HydrophobicContact CD2-CD1 3.71Å; L173-I181 HydrophobicContact CG-CD1 4.42Å; R177-I181 HydrophobicContact CG-CD1 3.92Å; R177-I181 HydrophobicContact CG-CG1 4.47Å; R177-I181 WeakPolarHBondContact O-CG1 3.38Å; R177-I181 PolarHBondContact O-N 3.29Å; R177-I181 VanDerWaalsContact O-N 3.09Å; V179-I181 PolarHBondContact O-N 2.89Å; I181-H183 VanDerWaalsContact C-N 3.3Å; I181-H183 PolarHBondContact O-N 2.83Å; I181-T184 PolarHBondContact O-N 2.86Å; I181-M185 HydrophobicContact CG2-CG 3.96Å; I181-M185 VanDerWaalsContact O-CB 3.25Å; I181-M185 WeakPolarHBondContact O-CB 3.39Å; I181-M185 WeakPolarHBondContact O-CG 3.5Å; I181-M185 PolarHBondContact O-N 3.31Å; I181-V192 HydrophobicContact CG2-CG1 4.1Å; I181-V192 HydrophobicContact CG2-CG2 4.29Å
182A98.3Very high98.1Very high3 Ų376 Ų763%0.02536%0.357CS..Hα-helixtrans-57.4-44.7179.400000111.5R178 V179 E180 C186 L187 E189 V192R178-A182 VanDerWaalsContact O-CB 3.23Å; R178-A182 WeakPolarHBondContact O-CB 3.17Å; R178-A182 PolarHBondContact O-N 2.88Å; V179-A182 WeakPolarHBondContact O-CB 3.45Å; V179-A182 PolarHBondContact O-N 3.26Å; E180-A182 PolarHBondContact O-N 3.19Å; A182-C186 PolarHBondContact O-N 3.33Å; A182-C186 VanDerWaalsContact O-N 3.1Å; A182-L187 CarbonylContact C-O 3.49Å; A182-L187 WeakPolarHBondContact CA-O 3.37Å; A182-L187 VanDerWaalsContact CB-O 3.26Å; A182-L187 WeakPolarHBondContact CB-O 3.14Å; A182-L187 PolarHBondContact O-N 3.47Å; A182-L187 VanDerWaalsContact O-O 3.1Å; A182-E189 HydrophobicContact CB-CG 4.23Å; A182-V192 HydrophobicContact CB-CG2 4.14Å
183H98.3Very high98.1Very high139 Ų13974.4 Ų74.464%0.64435%0.354SS*.Hα-helixtrans-67.5-48.1179.2-67-173.6000111.8V179 E180 I181 M185 C186V179-H183 PolarHBondContact O-CD2 3.02Å; V179-H183 PolarHBondContact O-N 3.36Å; E180-H183 PolarHBondContact O-N 3.42Å; I181-H183 VanDerWaalsContact C-N 3.3Å; I181-H183 PolarHBondContact O-N 2.83Å; H183-M185 PolarHBondContact O-N 2.92Å; H183-C186 PolarHBondContact O-N 3.36Å
184T97.4Very high98.1Very high109 Ų10975.6 Ų75.667%0.66936%0.359SS*.Hα-helixtrans-63.6-30.4-179.7-52.70000112.8E180 I181E180-T184 PolarHBondContact O-N 3.47Å; E180-T184 VanDerWaalsContact O-N 3.11Å; E180-T184 PolarHBondContact O-OG1 3.34Å; E180-T184 VanDerWaalsContact O-OG1 3.11Å; I181-T184 PolarHBondContact O-N 2.86Å
185M96.4Very high98.1Very high9 Ų973.2 Ų73.24%0.04434%0.341CS..Hα-helixtrans-96.3-4.1-176.2-61.9-96.478.200114.1Q158 Q159 E162 L163 I181 H183 L187Q158-M185 HydrophobicContact CG-CE 4.5Å; Q159-M185 VanDerWaalsContact CA-SD 3.59Å; Q159-M185 HydrophobicContact CB-SD 4.25Å; Q159-M185 HydrophobicContact CG-CB 4.5Å; Q159-M185 HydrophobicContact CG-CE 4.26Å; Q159-M185 HydrophobicContact CG-SD 4.32Å; Q159-M185 PolarHBondContact NE2-O 3.14Å; E162-M185 HydrophobicContact CB-CE 3.5Å; E162-M185 HydrophobicContact CB-SD 3.42Å; E162-M185 WeakPolarHBondContact CB-SD 3.3Å; E162-M185 HydrophobicContact CG-CE 3.61Å; E162-M185 HydrophobicContact CG-SD 4.23Å; L163-M185 HydrophobicContact CG-SD 4.25Å; I181-M185 HydrophobicContact CG2-CG 3.96Å; I181-M185 VanDerWaalsContact O-CB 3.25Å; I181-M185 WeakPolarHBondContact O-CB 3.39Å; I181-M185 WeakPolarHBondContact O-CG 3.5Å; I181-M185 PolarHBondContact O-N 3.31Å; H183-M185 PolarHBondContact O-N 2.92Å; M185-L187 VanDerWaalsContact C-N 3.26Å; M185-L187 HydrophobicContact CB-CB 4.45Å; M185-L187 HydrophobicContact CB-CD1 4.15Å; M185-L187 HydrophobicContact CB-CG 4.07Å; M185-L187 PolarHBondContact O-N 3.28Å
186C97.9Very high98.1Very high115 Ų11566.9 Ų66.978%0.77732%0.317SS*.THydrogen-bonded Turntrans52.543.5-170.4-58.30000112.7A182 H183A182-C186 PolarHBondContact O-N 3.33Å; A182-C186 VanDerWaalsContact O-N 3.1Å; H183-C186 PolarHBondContact O-N 3.36Å
187L97.5Very high98.2Very high19 Ų1962.5 Ų62.510%0.09931%0.305CS..  trans-118.6154176.6-65.7-179.9000109.9Y155 L163 A182 M185 Q191 V192Y155-L187 HydrophobicContact CD1-CD1 4.08Å; Y155-L187 HydrophobicContact CD1-CD2 3.85Å; Y155-L187 HydrophobicContact CE1-CD1 3.92Å; Y155-L187 HydrophobicContact CE1-CD2 3.67Å; Y155-L187 HydrophobicContact CE1-CG 4.47Å; L163-L187 HydrophobicContact CD1-CD1 4.12Å; A182-L187 CarbonylContact C-O 3.49Å; A182-L187 WeakPolarHBondContact CA-O 3.37Å; A182-L187 VanDerWaalsContact CB-O 3.26Å; A182-L187 WeakPolarHBondContact CB-O 3.14Å; A182-L187 PolarHBondContact O-N 3.47Å; A182-L187 VanDerWaalsContact O-O 3.1Å; M185-L187 VanDerWaalsContact C-N 3.26Å; M185-L187 HydrophobicContact CB-CB 4.45Å; M185-L187 HydrophobicContact CB-CD1 4.15Å; M185-L187 HydrophobicContact CB-CG 4.07Å; M185-L187 PolarHBondContact O-N 3.28Å; L187-Q191 HydrophobicContact CB-CB 4.35Å; L187-V192 HydrophobicContact CB-CG2 4.19Å
188S98.4Very high98.1Very high55 Ų5563.3 Ų63.339%0.38532%0.316SS..  trans-70150169.164.70000111.1R190 Q191 V192S188-R190 PolarHBondContact O-N 3.15Å; S188-R190 VanDerWaalsContact O-N 3.09Å; S188-Q191 WeakPolarHBondContact O-CB 3.34Å; S188-Q191 PolarHBondContact O-N 3.38Å; S188-Q191 VanDerWaalsContact OG-CG 3.28Å; S188-Q191 WeakPolarHBondContact OG-CG 3.32Å; S188-Q191 PolarHBondContact OG-N 2.9Å; S188-Q191 PolarHBondContact OG-OE1 3.09Å; S188-V192 PolarHBondContact O-N 3.39Å; S188-V192 VanDerWaalsContact O-N 3.1Å
189E98.4Very high98.1Very high57 Ų5762.5 Ų62.527%0.26631%0.313SS..Hα-helixtrans-53.1-34.9173-68.8-166-140.300113.2R175 R178 A182 V192 K193R175-E189 VanDerWaalsContact CZ-CD 3.49Å; R175-E189 IonicContact CZ-OE1 3.24Å; R175-E189 VanDerWaalsContact CZ-OE1 3.24Å; R175-E189 IonicContact CZ-OE2 2.95Å; R175-E189 IonicContact NE-OE2 3.74Å; R175-E189 IonicContact NH1-OE1 4Å; R175-E189 PolarHBondContact NH1-OE1 3.22Å; R175-E189 IonicContact NH1-OE2 2.68Å; R175-E189 PolarHBondContact NH1-OE2 3.36Å; R175-E189 VanDerWaalsContact NH2-CD 3.34Å; R175-E189 IonicContact NH2-OE1 2.87Å; R175-E189 PolarHBondContact NH2-OE1 3.35Å; R175-E189 IonicContact NH2-OE2 3.01Å; R175-E189 PolarHBondContact NH2-OE2 2.84Å; R175-E189 VanDerWaalsContact NH2-OE2 3.13Å; R178-E189 HydrophobicContact CG-CB 4.3Å; R178-E189 HydrophobicContact CG-CG 4.49Å; A182-E189 HydrophobicContact CB-CG 4.23Å; E189-V192 PolarHBondContact O-N 3.47Å; E189-K193 WeakPolarHBondContact O-CB 3.34Å; E189-K193 PolarHBondContact O-N 3.02Å
190R97.9Very high98.1Very high181 Ų18164.1 Ų64.168%0.68331%0.314SS*.Hα-helixtrans-64.4-43.1177.3-176.2177.6-176.8-85.1-1.7111.1S188 K193 I194S188-R190 PolarHBondContact O-N 3.15Å; S188-R190 VanDerWaalsContact O-N 3.09Å; R190-K193 PolarHBondContact O-N 3.4Å; R190-I194 HydrophobicContact CG-CD1 3.88Å; R190-I194 WeakPolarHBondContact O-CB 3.33Å; R190-I194 VanDerWaalsContact O-CG1 3.28Å; R190-I194 WeakPolarHBondContact O-CG1 3.36Å; R190-I194 PolarHBondContact O-N 2.88Å
191Q98.3Very high98.1Very high62 Ų6266.1 Ų66.129%0.2933%0.325SS..Hα-helixtrans-62.2-46.2176-77.6163.2-51.900110.8L187 S188 K193 I194 W195L187-Q191 HydrophobicContact CB-CB 4.35Å; S188-Q191 WeakPolarHBondContact O-CB 3.34Å; S188-Q191 PolarHBondContact O-N 3.38Å; S188-Q191 VanDerWaalsContact OG-CG 3.28Å; S188-Q191 WeakPolarHBondContact OG-CG 3.32Å; S188-Q191 PolarHBondContact OG-N 2.9Å; S188-Q191 PolarHBondContact OG-OE1 3.09Å; Q191-K193 VanDerWaalsContact C-N 3.34Å; Q191-K193 PolarHBondContact O-N 3.02Å; Q191-I194 PolarHBondContact O-N 3.18Å; Q191-W195 WeakPolarHBondContact O-CB 2.79Å; Q191-W195 PolarHBondContact O-N 3.4Å
192V98.3Very high98Very high0 Ų071.4 Ų71.40%035%0.348CS..Hα-helixtrans-59.8-44.8175.7-178.80000110.8L163 L173 R178 I181 A182 L187 S188 E189 I194 W195 F196L163-V192 HydrophobicContact CD2-CG1 4.33Å; L173-V192 HydrophobicContact CD1-CG1 3.63Å; R178-V192 HydrophobicContact CG-CB 4.26Å; R178-V192 HydrophobicContact CG-CG1 4.14Å; I181-V192 HydrophobicContact CG2-CG1 4.1Å; I181-V192 HydrophobicContact CG2-CG2 4.29Å; A182-V192 HydrophobicContact CB-CG2 4.14Å; L187-V192 HydrophobicContact CB-CG2 4.19Å; S188-V192 PolarHBondContact O-N 3.39Å; S188-V192 VanDerWaalsContact O-N 3.1Å; E189-V192 PolarHBondContact O-N 3.47Å; V192-I194 PolarHBondContact O-N 3.26Å; V192-W195 PolarHBondContact O-N 2.75Å; V192-F196 HydrophobicContact CG1-CD2 4.06Å; V192-F196 HydrophobicContact CG1-CE2 4.23Å; V192-F196 WeakPolarHBondContact O-CD2 3.4Å; V192-F196 PolarHBondContact O-N 2.89Å
193K98.3Very high97.9Very high111 Ų11175 Ų7548%0.48336%0.361SS..Hα-helixtrans-58.7-48.8176.4-175.9-172.7179.4-177.80112E189 R190 Q191 W195 F196 Q197E189-K193 WeakPolarHBondContact O-CB 3.34Å; E189-K193 PolarHBondContact O-N 3.02Å; R190-K193 PolarHBondContact O-N 3.4Å; Q191-K193 VanDerWaalsContact C-N 3.34Å; Q191-K193 PolarHBondContact O-N 3.02Å; K193-W195 VanDerWaalsContact C-N 3.35Å; K193-F196 PolarHBondContact O-N 3.25Å; K193-Q197 PolarHBondContact O-N 3.33Å
194I98.4Very high97.7Very high54 Ų5472.9 Ų72.928%0.27735%0.35SS..Hα-helixtrans-64.3-42.5179.7-70.9169.4000110.3R190 Q191 V192 F196 Q197 N198R190-I194 HydrophobicContact CG-CD1 3.88Å; R190-I194 WeakPolarHBondContact O-CB 3.33Å; R190-I194 VanDerWaalsContact O-CG1 3.28Å; R190-I194 WeakPolarHBondContact O-CG1 3.36Å; R190-I194 PolarHBondContact O-N 2.88Å; Q191-I194 PolarHBondContact O-N 3.18Å; V192-I194 PolarHBondContact O-N 3.26Å; I194-F196 PolarHBondContact O-N 3.08Å; I194-Q197 PolarHBondContact O-N 3.09Å; I194-N198 PolarHBondContact O-N 3.18Å; I194-N198 PolarHBondContact O-ND2 3.29Å
195W98.5Very high97.5Very high35 Ų3575.8 Ų75.813%0.13335%0.353CS..Hα-helixtrans-59.5-48.6177.9-169.1101.3000111.2Y155 L163 E164 F167 Q191 V192 K193 Q197 N198 R199Y155-W195 AromaticContact CD2-CD1 3.85Å; Y155-W195 AromaticContact CE2-CD1 3.55Å; L163-W195 VanDerWaalsContact C-CH2 3.47Å; L163-W195 HydrophobicContact CB-CD2 3.94Å; L163-W195 HydrophobicContact CB-CE3 3.94Å; L163-W195 HydrophobicContact CB-CH2 3.66Å; L163-W195 HydrophobicContact CB-CZ2 3.64Å; L163-W195 HydrophobicContact CB-CZ3 3.81Å; L163-W195 HydrophobicContact CD1-CD2 3.89Å; L163-W195 HydrophobicContact CD1-CG 3.84Å; L163-W195 HydrophobicContact CD2-CD2 4.48Å; L163-W195 HydrophobicContact CD2-CE3 4.4Å; L163-W195 HydrophobicContact CG-CD2 4.33Å; L163-W195 WeakPolarHBondContact O-CH2 3.48Å; L163-W195 WeakPolarHBondContact O-CZ3 3.4Å; E164-W195 HydrophobicContact CG-CH2 3.92Å; E164-W195 HydrophobicContact CG-CZ2 4.01Å; F167-W195 HydrophobicContact CB-CH2 4.39Å; F167-W195 HydrophobicContact CB-CZ3 4.08Å; Q191-W195 WeakPolarHBondContact O-CB 2.79Å; Q191-W195 PolarHBondContact O-N 3.4Å; V192-W195 PolarHBondContact O-N 2.75Å; K193-W195 VanDerWaalsContact C-N 3.35Å; W195-Q197 VanDerWaalsContact C-N 3.28Å; W195-Q197 PolarHBondContact O-N 3.16Å; W195-N198 PolarHBondContact O-N 3.38Å; W195-R199 HydrophobicContact CD2-CB 4.47Å; W195-R199 HydrophobicContact CE3-CB 3.88Å; W195-R199 HydrophobicContact CE3-CG 4.41Å; W195-R199 HydrophobicContact CH2-CB 4.03Å; W195-R199 HydrophobicContact CH2-CG 3.73Å; W195-R199 HydrophobicContact CZ3-CB 3.64Å; W195-R199 HydrophobicContact CZ3-CG 3.66Å; W195-R199 VanDerWaalsContact O-CB 3.3Å; W195-R199 WeakPolarHBondContact O-CB 3.46Å; W195-R199 PolarHBondContact O-N 3.31Å
196F98.7Very high97.2Very high7 Ų779.7 Ų79.73%0.03137%0.374CS..Hα-helixtrans-63.9-31.6176.6-91.9-103.5000113L163 E166 F167 L173 V192 K193 I194 R200L163-F196 HydrophobicContact CD2-CE2 4.09Å; E166-F196 HydrophobicContact CB-CZ 4Å; F167-F196 HydrophobicContact CB-CE1 4.2Å; F167-F196 HydrophobicContact CB-CZ 4.32Å; F167-F196 AromaticContact CD2-CD1 4Å; F167-F196 HydrophobicContact CD2-CD1 4Å; F167-F196 AromaticContact CD2-CE1 3.95Å; F167-F196 HydrophobicContact CD2-CE1 3.95Å; L173-F196 HydrophobicContact CD1-CD1 4.09Å; L173-F196 HydrophobicContact CD1-CD2 3.59Å; L173-F196 HydrophobicContact CD1-CE1 3.94Å; L173-F196 HydrophobicContact CD1-CE2 3.46Å; L173-F196 VanDerWaalsContact CD1-CE2 3.46Å; L173-F196 HydrophobicContact CD1-CG 3.92Å; L173-F196 HydrophobicContact CD1-CZ 3.64Å; L173-F196 HydrophobicContact CD2-CD1 4.4Å; L173-F196 HydrophobicContact CD2-CE1 3.69Å; L173-F196 HydrophobicContact CD2-CE2 4.36Å; L173-F196 HydrophobicContact CD2-CZ 3.67Å; L173-F196 HydrophobicContact CG-CD1 3.74Å; L173-F196 HydrophobicContact CG-CD2 4.18Å; L173-F196 HydrophobicContact CG-CE1 3.51Å; L173-F196 HydrophobicContact CG-CE2 4.01Å; L173-F196 HydrophobicContact CG-CG 4.07Å; L173-F196 HydrophobicContact CG-CZ 3.67Å; V192-F196 HydrophobicContact CG1-CD2 4.06Å; V192-F196 HydrophobicContact CG1-CE2 4.23Å; V192-F196 WeakPolarHBondContact O-CD2 3.4Å; V192-F196 PolarHBondContact O-N 2.89Å; K193-F196 PolarHBondContact O-N 3.25Å; I194-F196 PolarHBondContact O-N 3.08Å; F196-R200 WeakPolarHBondContact O-CB 3.22Å; F196-R200 VanDerWaalsContact O-CG 3.28Å; F196-R200 WeakPolarHBondContact O-CG 3.26Å; F196-R200 PolarHBondContact O-N 3.37Å; F196-R200 PolarHBondContact O-NE 2.88Å
197Q98.6Very high96.6Very high100 Ų10080 Ų8047%0.46736%0.364SS..Hα-helixtrans-68.3-48173.9-167.6157.337.100111.4K193 I194 W195 R199 R200 M201K193-Q197 PolarHBondContact O-N 3.33Å; I194-Q197 PolarHBondContact O-N 3.09Å; W195-Q197 VanDerWaalsContact C-N 3.28Å; W195-Q197 PolarHBondContact O-N 3.16Å; Q197-R199 VanDerWaalsContact C-N 3.34Å; Q197-R199 PolarHBondContact O-N 3.27Å; Q197-R200 PolarHBondContact O-N 3.46Å; Q197-M201 WeakPolarHBondContact O-CG 3.45Å; Q197-M201 PolarHBondContact O-N 3.21Å
198N98.2Very high95.1Very high103 Ų10385.3 Ų85.355%0.55139%0.386SS*.Hα-helixtrans-61.5-42.8175.5-68.6-19.5000111.5I194 W195 R200 M201 K202I194-N198 PolarHBondContact O-N 3.18Å; I194-N198 PolarHBondContact O-ND2 3.29Å; W195-N198 PolarHBondContact O-N 3.38Å; N198-R200 PolarHBondContact O-N 3.45Å; N198-M201 PolarHBondContact O-N 2.87Å; N198-K202 PolarHBondContact O-N 3.42Å
199R98.3Very high93.3Very high38 Ų3890 Ų9014%0.14341%0.406CS..Hα-helixtrans-63.6-42.2179.9-175.364.9-171.5105.6-7.8111.9F167 W195 Q197 K202 W203F167-R199 HydrophobicContact CB-CG 4.32Å; F167-R199 HydrophobicContact CD1-CG 3.69Å; F167-R199 HydrophobicContact CD2-CB 4.18Å; F167-R199 HydrophobicContact CD2-CG 3.53Å; F167-R199 HydrophobicContact CE1-CG 3.8Å; F167-R199 HydrophobicContact CE2-CB 4.21Å; F167-R199 HydrophobicContact CE2-CG 3.66Å; F167-R199 HydrophobicContact CG-CG 3.55Å; F167-R199 HydrophobicContact CZ-CG 3.78Å; W195-R199 HydrophobicContact CD2-CB 4.47Å; W195-R199 HydrophobicContact CE3-CB 3.88Å; W195-R199 HydrophobicContact CE3-CG 4.41Å; W195-R199 HydrophobicContact CH2-CB 4.03Å; W195-R199 HydrophobicContact CH2-CG 3.73Å; W195-R199 HydrophobicContact CZ3-CB 3.64Å; W195-R199 HydrophobicContact CZ3-CG 3.66Å; W195-R199 VanDerWaalsContact O-CB 3.3Å; W195-R199 WeakPolarHBondContact O-CB 3.46Å; W195-R199 PolarHBondContact O-N 3.31Å; Q197-R199 VanDerWaalsContact C-N 3.34Å; Q197-R199 PolarHBondContact O-N 3.27Å; R199-K202 PolarHBondContact O-N 3.35Å; R199-W203 WeakPolarHBondContact O-CB 3.26Å; R199-W203 PolarHBondContact O-N 3.23Å
200R97.8Very high91Very high74 Ų7492.3 Ų92.328%0.27943%0.426SS..Hα-helixtrans-63.1-40.1172.7-75.8-178.8-67.2164.33.5112.2F167 R171 F196 Q197 N198 W203 K204F167-R200 HydrophobicContact CE2-CG 3.74Å; F167-R200 HydrophobicContact CZ-CG 4.31Å; R171-R200 WeakPolarHBondContact O-CD 3.42Å; F196-R200 WeakPolarHBondContact O-CB 3.22Å; F196-R200 VanDerWaalsContact O-CG 3.28Å; F196-R200 WeakPolarHBondContact O-CG 3.26Å; F196-R200 PolarHBondContact O-N 3.37Å; F196-R200 PolarHBondContact O-NE 2.88Å; Q197-R200 PolarHBondContact O-N 3.46Å; N198-R200 PolarHBondContact O-N 3.45Å; R200-W203 PolarHBondContact O-N 3.29Å; R200-K204 WeakPolarHBondContact O-CB 3.27Å; R200-K204 PolarHBondContact O-N 2.9Å
201M97.7Very high88.4Confident109 Ų10990.1 Ų90.154%0.53743%0.428SS..Hα-helixtrans-64-42.1176.2-68.3-63.3-102.700111.9Q197 N198 K204 K205Q197-M201 WeakPolarHBondContact O-CG 3.45Å; Q197-M201 PolarHBondContact O-N 3.21Å; N198-M201 PolarHBondContact O-N 2.87Å; M201-K204 PolarHBondContact O-N 2.84Å; M201-K204 PolarHBondContact SD-NZ 3.15Å; M201-K205 PolarHBondContact O-N 3.46Å
202K96.4Very high86.1Confident119 Ų11993.4 Ų93.452%0.51745%0.452SS..Hα-helixtrans-63.3-51.4173.6-179.7177177.6-171.60111.6N198 R199 K204 K205 D206N198-K202 PolarHBondContact O-N 3.42Å; R199-K202 PolarHBondContact O-N 3.35Å; K202-K204 VanDerWaalsContact C-N 3.25Å; K202-K204 PolarHBondContact O-N 3.35Å; K202-K205 WeakPolarHBondContact O-CA 3.39Å; K202-K205 WeakPolarHBondContact O-CB 2.94Å; K202-K205 PolarHBondContact O-N 2.84Å; K202-D206 WeakPolarHBondContact CE-OD2 3.49Å; K202-D206 VanDerWaalsContact CG-OD2 3.26Å; K202-D206 WeakPolarHBondContact CG-OD2 3.32Å; K202-D206 PolarHBondContact O-N 3.48Å
203W95.4Very high84Confident80 Ų80101.1 Ų101.130%0.30349%0.486SS..Hα-helixtrans-55.1-44.4175.9-178.482.9000111.4F167 R199 R200 K205 D206 H207F167-W203 HydrophobicContact CE1-CB 4.12Å; F167-W203 HydrophobicContact CE1-CG 4.11Å; F167-W203 HydrophobicContact CZ-CB 3.86Å; F167-W203 HydrophobicContact CZ-CG 4.04Å; R199-W203 WeakPolarHBondContact O-CB 3.26Å; R199-W203 PolarHBondContact O-N 3.23Å; R200-W203 PolarHBondContact O-N 3.29Å; W203-K205 VanDerWaalsContact C-N 3.27Å; W203-K205 PolarHBondContact O-N 3.1Å; W203-D206 PolarHBondContact O-N 3.02Å; W203-H207 AromaticContact CD1-CD2 3.13Å; W203-H207 AromaticContact CD1-NE2 3.31Å; W203-H207 VanDerWaalsContact CD1-NE2 3.31Å; W203-H207 AromaticContact CD2-CD2 3.98Å; W203-H207 AromaticContact CE2-CD2 3.61Å; W203-H207 AromaticContact CE2-CG 3.86Å; W203-H207 AromaticContact CG-CD2 3.7Å; W203-H207 HydrophobicContact CZ2-CB 4.29Å; W203-H207 AromaticContact NE1-CD2 3.02Å; W203-H207 PolarHBondContact NE1-CD2 2.96Å; W203-H207 AromaticContact NE1-CE1 3.81Å; W203-H207 AromaticContact NE1-CG 3.64Å; W203-H207 AromaticContact NE1-NE2 3.11Å; W203-H207 PolarHBondContact NE1-NE2 3.09Å; W203-H207 VanDerWaalsContact NE1-NE2 3.11Å; W203-H207 WeakPolarHBondContact O-CB 3.29Å; W203-H207 PolarHBondContact O-CD2 2.83Å; W203-H207 VanDerWaalsContact O-CD2 3.29Å; W203-H207 PolarHBondContact O-N 2.74Å
204K94.4Very high81.9Confident94 Ų94102.5 Ų102.541%0.40950%0.497SS..Hα-helixtrans-60.6-35.2175.8-175.6-173.873.6177.50111.7R200 M201 K202 K208R200-K204 WeakPolarHBondContact O-CB 3.27Å; R200-K204 PolarHBondContact O-N 2.9Å; M201-K204 PolarHBondContact O-N 2.84Å; M201-K204 PolarHBondContact SD-NZ 3.15Å; K202-K204 VanDerWaalsContact C-N 3.25Å; K202-K204 PolarHBondContact O-N 3.35Å; K204-K208 VanDerWaalsContact CG-NZ 3.27Å; K204-K208 WeakPolarHBondContact O-CE 3.47Å; K204-K208 WeakPolarHBondContact O-CG 3.47Å
205K93.7Very high79.5Confident169 Ų169110.7 Ų110.774%0.73553%0.525SS*.Hα-helixtrans-74-44.2177.1-175.8-178.1176.9-178.60111.4M201 K202 W203M201-K205 PolarHBondContact O-N 3.46Å; K202-K205 WeakPolarHBondContact O-CA 3.39Å; K202-K205 WeakPolarHBondContact O-CB 2.94Å; K202-K205 PolarHBondContact O-N 2.84Å; W203-K205 VanDerWaalsContact C-N 3.27Å; W203-K205 PolarHBondContact O-N 3.1Å
206D90.3Very high77.2Confident92 Ų92115.5 Ų115.549%0.49256%0.564SS.*Hα-helixtrans-73.2-29.7-175.2-57.2-15000112.2K202 W203K202-D206 WeakPolarHBondContact CE-OD2 3.49Å; K202-D206 VanDerWaalsContact CG-OD2 3.26Å; K202-D206 WeakPolarHBondContact CG-OD2 3.32Å; K202-D206 PolarHBondContact O-N 3.48Å; W203-D206 PolarHBondContact O-N 3.02Å
207H84.9Confident75.2Confident120 Ų120119.2 Ų119.256%0.55660%0.595SS**THydrogen-bonded Turntrans-103.916.6-179.1-67.9-89.9000114.3W203 L209W203-H207 AromaticContact CD1-CD2 3.13Å; W203-H207 AromaticContact CD1-NE2 3.31Å; W203-H207 VanDerWaalsContact CD1-NE2 3.31Å; W203-H207 AromaticContact CD2-CD2 3.98Å; W203-H207 AromaticContact CE2-CD2 3.61Å; W203-H207 AromaticContact CE2-CG 3.86Å; W203-H207 AromaticContact CG-CD2 3.7Å; W203-H207 HydrophobicContact CZ2-CB 4.29Å; W203-H207 AromaticContact NE1-CD2 3.02Å; W203-H207 PolarHBondContact NE1-CD2 2.96Å; W203-H207 AromaticContact NE1-CE1 3.81Å; W203-H207 AromaticContact NE1-CG 3.64Å; W203-H207 AromaticContact NE1-NE2 3.11Å; W203-H207 PolarHBondContact NE1-NE2 3.09Å; W203-H207 VanDerWaalsContact NE1-NE2 3.11Å; W203-H207 WeakPolarHBondContact O-CB 3.29Å; W203-H207 PolarHBondContact O-CD2 2.83Å; W203-H207 VanDerWaalsContact O-CD2 3.29Å; W203-H207 PolarHBondContact O-N 2.74Å; H207-L209 PolarHBondContact O-N 3.02Å
208K65.6Low72.7Confident132 Ų132120.1 Ų120.157%0.57461%0.613SS**SBendtrans-80.8118.6160.2-44.8-157.8165.8-69.80106.9K204K204-K208 VanDerWaalsContact CG-NZ 3.27Å; K204-K208 WeakPolarHBondContact O-CE 3.47Å; K204-K208 WeakPolarHBondContact O-CG 3.47Å
209L61.7Low70.3Confident152 Ų152121.4 Ų121.480%0.79663%0.63SS**  trans-32.4151.2160.2-71.6124.9000112.2H207 N211H207-L209 PolarHBondContact O-N 3.02Å; L209-N211 PolarHBondContact O-N 3.32Å; L209-N211 VanDerWaalsContact O-N 3.15Å
210P50Low67.8Low106 Ų106124.6 Ų124.669%0.68866%0.658SS**  trans-44.2127.4-177.620.3-34.2000109.5T212P210-T212 VanDerWaalsContact C-N 3.31Å; P210-T212 WeakPolarHBondContact O-CG2 3.09Å; P210-T212 PolarHBondContact O-N 3.16Å
211N42.3Very low65Low135 Ų135126.9 Ų126.972%0.72269%0.685SS**  trans-49.3107.9158.9179.623.4000106L209 K213L209-N211 PolarHBondContact O-N 3.32Å; L209-N211 VanDerWaalsContact O-N 3.15Å; N211-K213 PolarHBondContact O-N 3.38Å
212T51.3Low62Low132 Ų132125.5 Ų125.581%0.8170%0.699SS**SBendtrans-73.462.5177.863.50000108.3P210P210-T212 VanDerWaalsContact C-N 3.31Å; P210-T212 WeakPolarHBondContact O-CG2 3.09Å; P210-T212 PolarHBondContact O-N 3.16Å
213K54Low59.2Low162 Ų162124.7 Ų124.770%0.70472%0.715SS**SBendtrans-167120.2163-134.5170.4178.6-179.70106.9N211N211-K213 PolarHBondContact O-N 3.38Å
214I53.8Low56.6Low139 Ų139130.1 Ų130.171%0.71374%0.743SS**SBendtrans90.470.1167.1-40.6151.5000115.2
215R48.6Very low54Low227 Ų227134.2 Ų134.286%0.85776%0.764SS**  15272.2123.6-88.1179.2-105.1-135.8-2.3111.6A217R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.44Å
216S50Low51.3Low136 Ų136134.2 Ų134.295%0.95177%0.766SS**  trans-83.385.2148-51.30000107.1
217A55.1Low49Very low84 Ų84137.7 Ų137.769%0.69478%0.78SS**  trans-163.568.2169.300000110.9R215R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.44Å
218S46.8Very low47Very low120 Ų120138.7 Ų138.784%0.83979%0.785SS**SBendtrans172.671.1144.753.20000111.3
219S48.8Very low46.1Very low129 Ų129139.9 Ų139.990%0.90280%0.796SS**  trans-154.272.4152.238.10000109.8
220S44.5Very low45.1Very low106 Ų106140.8 Ų140.874%0.74179%0.793SS**  trans-122.8122.4153.157.40000103.9
221S39.4Very low44.7Very low122 Ų122142.4 Ų142.485%0.85380%0.801SS**  cis-170.4155.840.1-55.10000110.6
222G34.4Very low44.5Very low80 Ų80139.2 Ų139.283%0.82580%0.8SS**  trans125123.6154.600000113.1
223A39.2Very low44.1Very low102 Ų102139.8 Ų139.884%0.84380%0.804SS**  cis-159.5147.1-2.800000106.8
224Q40.9Very low43.6Very low194 Ų194139.9 Ų139.991%0.90781%0.806SS**  trans-66.3132.9168.5-65.5176.2-41.400109.9
225Q38.1Very low42.9Very low180 Ų180141.5 Ų141.584%0.84181%0.811SS**  trans-141.6112.2144.9-147.2169.454.300110.3
226Q38.3Very low42.9Very low168 Ų168138.9 Ų138.979%0.78581%0.808SS**  trans-91.5121.9172.8-169.6169.959.700106.3
227Q41.6Very low42.7Very low165 Ų165140.1 Ų140.177%0.77180%0.803SS**  trans-126110.2157.1-80.1-172.818.800108.7
228Q41.6Very low42.7Very low141 Ų141142 Ų14266%0.65981%0.806SS**  trans-68.9132.1161.6-68.717515.900108.3
229I47.3Very low43Very low157 Ų157142.1 Ų142.181%0.80580%0.804SS**  trans-125.8114.5145-58.4-178.3000106.8
230K41.8Very low43.5Very low172 Ų172142.4 Ų142.475%0.74880%0.8SS**  trans-77.8132.2168.4-69.3172.7176176.50108.7
231T40.7Very low44.3Very low140 Ų140142.7 Ų142.786%0.85980%0.8SS**  trans-174.9123.9136.543.30000103.7
232G39.3Very low44.7Very low67 Ų67143.5 Ų143.569%0.69180%0.804SS**  cis10079.329.100000109
233T42.6Very low45.4Very low145 Ų145144.3 Ų144.389%0.8980%0.803SS**  trans-176.9112.5138.738.10000112
234H42.8Very low45.8Very low163 Ų163143.9 Ų143.976%0.75580%0.799SS**  trans-25.9130.7146.4-170.9-105.9000115.1
235Q39.8Very low46.2Very low174 Ų174141.5 Ų141.581%0.81380%0.798SS**  -174.6136116.8-98.2-177.794.400113.1
236Q47.4Very low46.8Very low172 Ų172144.3 Ų144.380%0.80482%0.818SS**  trans-93.6123.4179.6170.817926.500108.8
237L46.8Very low47.2Very low162 Ų162143.2 Ų143.285%0.84882%0.819SS**  trans-142.1127.4160.1-78173.8000110.9
238V54.1Low47.5Very low124 Ų124142 Ų14275%0.75282%0.822SS**  trans-35.3159.5177.5-80.20000119.5
239P54.3Low47.8Very low121 Ų121142.1 Ų142.179%0.78683%0.831SS**PPolyproline II helixtrans-81.7136.6177.532.7-32.4000113
240T59.3Low47.9Very low136 Ų136141.2 Ų141.283%0.83483%0.832SS**PPolyproline II helixtrans-88.3133.1171.1-47.60000110.5
241P59.8Low48.2Very low112 Ų112139.3 Ų139.373%0.72784%0.838SS**PPolyproline II helixtrans-80.3150.1179.332-33.4000112.8
242C47.7Very low48.7Very low139 Ų139139.2 Ų139.294%0.93984%0.836SS**PPolyproline II helixtrans-68126.9169.8-1600000109.7
243A49.8Very low49.4Very low97 Ų97144.4 Ų144.480%0.80285%0.847SS**  trans-129.8130.6167.200000109.7
244A48.3Very low49.9Very low93 Ų93144.3 Ų144.377%0.76984%0.843SS**  trans-65.7156.517800000112.5
245T48.3Very low50.5Low144 Ų144142.8 Ų142.888%0.88385%0.851SS**  trans-153.9138.7142-630000108.9
246L50.9Low51.5Low239 Ų239139.9 Ų139.9100%1.25185%0.854SS**  trans-69.30170-77.8161.5000111.7

Retrieved 246 of 246 residues in 46.6 ms (Link to these results)