A0A077Z0I9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0I9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 220 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
1M38.9Very low34.9Very low228 Ų228175.2 Ų175.2100%1.12384%0.837SS**  097.60-156173.2-178.600107.5
2I38.7Very low34.6Very low166 Ų166173.7 Ų173.785%0.85183%0.828SS**  trans-92.5110.1-177.9-69.6163.9000107.3R4I2-R4 PolarHBondContact O-N 3.38Å
3L40.6Very low34.3Very low141 Ų141171 Ų17174%0.73883%0.83SS**  trans-80107.9172.5-89.188.5000109.4
4R33.5Very low34.1Very low234 Ų234176.4 Ų176.488%0.88384%0.838SS**  trans-71.4121.7158.9-86.7-174.8168.3-136.8-0.2108.5I2I2-R4 PolarHBondContact O-N 3.38Å
5R38.8Very low34.8Very low242 Ų242172.4 Ų172.491%0.91383%0.832SS**  trans-110.9128159.5-92-179172.2-125.30.6108.6
6S36.1Very low34.5Very low89 Ų89167.9 Ų167.962%0.62282%0.824SS**  trans-129153-18035.40000108.8
7Y30.1Very low34.8Very low222 Ų222170.7 Ų170.787%0.87183%0.831SS**  trans78.9142.8173.6-61.7-81.1000116.1
8S27.5Very low34.5Very low103 Ų103171.8 Ų171.872%0.7283%0.834SS**  cis-166.6160.54.335.20000109.5
9F31.9Very low34.5Very low212 Ų212174.6 Ų174.693%0.9384%0.835SS**  trans-53.7131.8172.4-74.4-100.5000112.8
10Q31.7Very low34.5Very low153 Ų153170.2 Ų170.272%0.71583%0.829SS**  trans-137.497.9159.9-163.7156.3-3.200109.5Q12Q10-Q12 HydrophobicContact CG-CG 4.26Å; Q10-Q12 VanDerWaalsContact NE2-NE2 3.18Å; Q10-Q12 PolarHBondContact O-N 3.16Å; Q10-Q12 VanDerWaalsContact O-N 3.16Å
11T35.8Very low34.6Very low137 Ų137172.6 Ų172.684%0.8483%0.829SS**  trans-61.3104158.1460000108.2
12Q31.5Very low34.2Very low157 Ų157167.2 Ų167.273%0.73481%0.814SS**  trans-129.9117.3161.5-90.8-1784.700110.1Q10Q10-Q12 HydrophobicContact CG-CG 4.26Å; Q10-Q12 VanDerWaalsContact NE2-NE2 3.18Å; Q10-Q12 PolarHBondContact O-N 3.16Å; Q10-Q12 VanDerWaalsContact O-N 3.16Å
13T31Very low34.1Very low139 Ų139163.8 Ų163.885%0.85381%0.811SS**  trans-58.3126.2170.7380000111.7
14R31.1Very low33.6Very low247 Ų247162 Ų16293%0.93281%0.81SS**  trans-155.9134.1146.6-112.2-177.4177.5-161.3-1.3111.3
15P45Very low33.6Very low116 Ų116158.7 Ų158.775%0.75381%0.808SS**  trans-96.1148.2-174.937-31000111.6
16S29Very low33.2Very low101 Ų101152.2 Ų152.271%0.70680%0.8SS**  trans-178.986.815041.10000111.5
17F40.5Very low33.1Very low215 Ų215159.3 Ų159.394%0.94381%0.813SS**  -134.1105.7123.2-88.5-74.4000107.1
18Q29.7Very low33.3Very low191 Ų191154 Ų15489%0.89381%0.809SS**  trans-54.7129.8163-65.2169.9-48.200108.7
19R34.9Very low33.7Very low225 Ų225159.8 Ų159.885%0.84982%0.816SS**  -176.4108.4111.9-160.3170.9-162.9-158.35.1109
20A33.2Very low33.8Very low86 Ų86153.9 Ų153.971%0.71180%0.801SS**  trans-62.5134.2170.400000110.8
21R37.2Very low33.9Very low220 Ų220155.6 Ų155.683%0.8381%0.806SS**  trans-144.586.5137.7-71.2-159.8164.6-153.8-6.3108.2A23R21-A23 PolarHBondContact O-N 2.77Å
22S30.2Very low33.8Very low115 Ų115155.1 Ų155.180%0.80480%0.803SS**  trans-56.9112.1151.713.30000107.3
23A35.7Very low34.1Very low95 Ų95153.5 Ų153.579%0.78580%0.804SS**  trans-129.279.3158.700000106.8R21 I25R21-A23 PolarHBondContact O-N 2.77Å; A23-I25 PolarHBondContact O-N 3.46Å
24S30.2Very low34.4Very low104 Ų104151.3 Ų151.373%0.72779%0.794SS**  trans-63.6118.4145.949.70000107.5
25I34.2Very low34.9Very low164 Ų164145.2 Ų145.284%0.84179%0.787SS**  trans-175.5128.4134.5-90.6148.4000108.1A23A23-I25 PolarHBondContact O-N 3.46Å
26S31.4Very low34.4Very low106 Ų106145.2 Ų145.274%0.74179%0.789SS**  trans-56.1137.2171.3-46.90000113.5
27R33.5Very low34.7Very low238 Ų238150.6 Ų150.690%0.89880%0.796SS**  164.5117116.9-91.1179.4171.7-135.6-1111.8
28S33.6Very low34.5Very low111 Ų111146.8 Ų146.878%0.77679%0.79SS**  trans68109.2143.1-50.70000122
29Y36.4Very low34.5Very low224 Ų224145.7 Ų145.788%0.87879%0.787SS**  trans68.3120.9137.9-106.8-92.9000122.3
30S33.7Very low34.5Very low87 Ų87141.1 Ų141.161%0.60879%0.786SS**  trans62.491.4150.856.70000118.4V32S30-V32 PolarHBondContact O-N 3.22Å
31F33.9Very low34.4Very low189 Ų189146.8 Ų146.883%0.82979%0.789SS**  trans-64119.3150.552.7-86.9000109V33F31-V33 HydrophobicContact CD2-CG2 3.91Å; F31-V33 PolarHBondContact O-N 3.43Å
32V34.1Very low34.3Very low127 Ų127142.3 Ų142.377%0.7779%0.792SS**  trans-84.3101.4169.2-159.70000105.6S30S30-V32 PolarHBondContact O-N 3.22Å
33V37.9Very low34.4Very low123 Ų123143.8 Ų143.875%0.74579%0.786SS**  trans-95.698.9167.9174.40000106.9F31F31-V33 HydrophobicContact CD2-CG2 3.91Å; F31-V33 PolarHBondContact O-N 3.43Å
34S36.3Very low34.3Very low94 Ų94145.1 Ų145.166%0.65779%0.79SS**PPolyproline II helixtrans-54.4127.7174.6-52.10000110.8
35P42.4Very low34.5Very low119 Ų119145.4 Ų145.477%0.77379%0.787SS**PPolyproline II helixtrans-71.6132.2172.827.1-31.3000110.7Y37P35-Y37 PolarHBondContact O-N 2.76Å
36S35.1Very low34.6Very low116 Ų116142.9 Ų142.981%0.81178%0.779SS**PPolyproline II helixtrans-56.9121.3176-51.80000111.4T38S36-T38 PolarHBondContact O-N 3.02Å
37Y34Very low34.9Very low214 Ų214147.3 Ų147.384%0.83979%0.785SS**PPolyproline II helixtrans-58.1118164.4-97.7-104.1000110.2P35P35-Y37 PolarHBondContact O-N 2.76Å
38T36.9Very low34.9Very low134 Ų134140.6 Ų140.682%0.82277%0.774SS**  trans-138.2107.2151.138.70000109.3S36S36-T38 PolarHBondContact O-N 3.02Å
39M30.6Very low34.8Very low168 Ų168144.4 Ų144.483%0.82878%0.782SS**  trans-74.1144.4167.3-64.6-130.2111.300110
40P34.7Very low34.9Very low129 Ų129138.3 Ų138.384%0.83878%0.779SS**  trans-121.4122.6139.126.8-12.5000111.2
41R30.3Very low35.1Very low205 Ų205139.7 Ų139.777%0.77479%0.785SS**  trans-58.3137165.9-156178.1-178.1169-2.8110.2E43R41-E43 IonicContact NE-OE1 2.79Å
42S34.4Very low35.2Very low127 Ų127140.8 Ų140.889%0.88878%0.784SS**  trans-168.8102.2148.2-780000109.5
43E33.3Very low35.3Very low145 Ų145140.2 Ų140.268%0.67879%0.786SS**  trans-73.6133.1176.3-64.1152.6-158.700109.3R41R41-E43 IonicContact NE-OE1 2.79Å
44S33.2Very low35Very low123 Ų123143.1 Ų143.186%0.8679%0.785SS**  trans-137.5117.4153.560.40000109.1
45V34.3Very low35.1Very low110 Ų110146.9 Ų146.967%0.66779%0.794SS**  trans-104.2121.6-169.2175.90000106.6
46V36.3Very low34.8Very low111 Ų111146.4 Ų146.467%0.67379%0.791SS**  trans-139.4-20.1161.7-167.60000114.6
47F37.4Very low35.1Very low200 Ų200145.8 Ų145.888%0.87779%0.786SS**  trans-13070180-67.2-74.8000113.3
48S33.4Very low35.1Very low96 Ų96142.2 Ų142.267%0.67178%0.782SS**  trans-89.792.6161.352.60000110
49M33.2Very low35.2Very low191 Ų191145.5 Ų145.594%0.94179%0.785SS**  trans-158.6122.7158.4-70.2-143.5112.200105.2
50A38.6Very low35.4Very low97 Ų97149 Ų14980%0.80279%0.791SS**  cis-164.3-174.44000000109.6
51P37.5Very low35.5Very low116 Ų116153.2 Ų153.275%0.75379%0.792SS**  -102.6159.1-129.240.2-39.6000117.8S53P51-S53 PolarHBondContact O-N 3.41Å
52R35.3Very low35.8Very low211 Ų211152.1 Ų152.180%0.79679%0.793SS**  trans-8.9109.2149.6-64.3173.7169.9-145-0.8115.9Y54R52-Y54 PolarHBondContact NH1-OH 3.16Å
53S36.2Very low36.2Very low116 Ų116151.1 Ų151.181%0.81178%0.783SS**  trans-108.6112.7155.156.30000109.3P51 M55P51-S53 PolarHBondContact O-N 3.41Å; S53-M55 PolarHBondContact O-N 3.39Å
54Y32.2Very low36.5Very low183 Ų183151.1 Ų151.172%0.71879%0.786SS**  trans-69.8113.4168.5-72-100.2000108.7R52R52-Y54 PolarHBondContact NH1-OH 3.16Å
55M36.8Very low37Very low173 Ų173152.1 Ų152.185%0.85278%0.78SS**  trans-158.1149.5153.7-93.2-52.5100.300110.4S53S53-M55 PolarHBondContact O-N 3.39Å
56P37.3Very low37.1Very low110 Ų110151.6 Ų151.671%0.71478%0.778SS**  trans-86.9156.6-148.233.4-36.1000114.7N58P56-N58 PolarHBondContact O-N 3.37Å
57S42Very low37.4Very low102 Ų102150.9 Ų150.971%0.71378%0.775SS**  trans-45.9114167.1510000112.7
58N33.5Very low37.2Very low140 Ų140147.2 Ų147.275%0.74977%0.769SS**  trans154.897.2134.7-79.4-13.3000108.3P56P56-N58 PolarHBondContact O-N 3.37Å
59F37.9Very low37.5Very low203 Ų203153.3 Ų153.389%0.8978%0.779SS**  trans-168.4121.8130.4-94.3-67.2000107.3Y61F59-Y61 PolarHBondContact O-N 3.36Å
60Y35Very low37.5Very low240 Ų240146.5 Ų146.594%0.94176%0.757SS**  trans-24.789.5161.8-99.4-112.3000113.2
61Y38Very low37.5Very low219 Ų219149.2 Ų149.286%0.85976%0.764SS**  trans-129123.3164.9-128.7-95.2000107.9F59F59-Y61 PolarHBondContact O-N 3.36Å
62K36.2Very low37.6Very low182 Ų182149 Ų14979%0.79176%0.76SS**  trans-44.6143.8-175.2-64.1178.9175.3-175.50110.9I64K62-I64 PolarHBondContact O-N 2.95Å
63P41.6Very low37.5Very low106 Ų106142.5 Ų142.569%0.68876%0.759SS**  trans-52.8122176.423.5-33000108.5I65P63-I65 HydrophobicContact CB-CG1 4.32Å; P63-I65 HydrophobicContact CG-CG1 4.35Å; P63-I65 PolarHBondContact O-N 3.05Å
64I41Very low37.6Very low144 Ų144146 Ų14674%0.73876%0.755SS**  trans-64.991.9164.8-65.4170.5000104.6K62 T66K62-I64 PolarHBondContact O-N 2.95Å; I64-T66 HydrophobicContact CG2-CG2 3.95Å; I64-T66 PolarHBondContact O-N 2.95Å
65I42.5Very low37.8Very low144 Ų144142 Ų14274%0.73875%0.753SS**  trans-75.979.8169.1-55.5171.5000104.9P63 P67P63-I65 HydrophobicContact CB-CG1 4.32Å; P63-I65 HydrophobicContact CG-CG1 4.35Å; P63-I65 PolarHBondContact O-N 3.05Å; I65-P67 VanDerWaalsContact O-CD 3.3Å; I65-P67 WeakPolarHBondContact O-CD 3.41Å
66T36.8Very low38Very low100 Ų100137 Ų13761%0.61373%0.734SS**  trans-61.3118.4161.231.90000107.2I64 T68I64-T66 HydrophobicContact CG2-CG2 3.95Å; I64-T66 PolarHBondContact O-N 2.95Å; T66-T68 PolarHBondContact O-N 3.08Å
67P42Very low38Very low95 Ų95140.1 Ų140.162%0.61773%0.731SS**  trans-68.298.417428-32.1000108.5I65 Y69I65-P67 VanDerWaalsContact O-CD 3.3Å; I65-P67 WeakPolarHBondContact O-CD 3.41Å; P67-Y69 PolarHBondContact O-N 3.35Å
68T34.4Very low37.8Very low123 Ų123145 Ų14576%0.75574%0.735SS**  trans-65.4113.1163.345.40000107.6T66 G70T66-T68 PolarHBondContact O-N 3.08Å; T68-G70 PolarHBondContact O-N 3.45Å
69Y39.7Very low38.3Very low225 Ų225142.1 Ų142.188%0.88273%0.726SS**  trans-70.255.2166-65.6-89.1000110.2P67P67-Y69 PolarHBondContact O-N 3.35Å
70G32.5Very low38.6Very low47 Ų47137.2 Ų137.249%0.48571%0.71SS.*  trans-82.6135.1161.500000107.5T68 V72T68-G70 PolarHBondContact O-N 3.45Å; G70-V72 PolarHBondContact O-N 2.58Å
71V38.7Very low38.7Very low155 Ų155134 Ų13494%0.93970%0.696SS**  trans-66.173.2175.1-176.70000108.6G73V71-G73 PolarHBondContact O-N 3.05Å; V71-G73 VanDerWaalsContact O-N 3.15Å
72V40.8Very low38.9Very low111 Ų111128.8 Ų128.867%0.67368%0.675SS**  trans-74.6105.1169-179.60000104.9G70 R74G70-V72 PolarHBondContact O-N 2.58Å; V72-R74 HydrophobicContact CG1-CG 4.08Å; V72-R74 PolarHBondContact O-N 3.14Å
73G31.5Very low39.3Very low75 Ų75121.5 Ų121.577%0.77365%0.646SS**  trans-63.260.7175.500000112.5V71 S75V71-G73 PolarHBondContact O-N 3.05Å; V71-G73 VanDerWaalsContact O-N 3.15Å; G73-S75 PolarHBondContact O-N 3.42Å
74R38.6Very low39.2Very low190 Ų190121.1 Ų121.172%0.71764%0.635SS**  trans-64.6110161.9-71.9-169.2173.5-156.8-2.1105.5V72 P76V72-R74 HydrophobicContact CG1-CG 4.08Å; V72-R74 PolarHBondContact O-N 3.14Å; R74-P76 VanDerWaalsContact O-N 3.14Å
75S36.9Very low39.3Very low99 Ų99115 Ų11569%0.69261%0.605SS**  trans-30.9121.6159.2166.80000108.3G73 R77G73-S75 PolarHBondContact O-N 3.42Å; S75-R77 PolarHBondContact O-N 2.78Å
76P40.6Very low39.2Very low67 Ų67115.1 Ų115.144%0.43560%0.596SS.*  trans-53.6109.7-175.7-8.511000108R74 Y78R74-P76 VanDerWaalsContact O-N 3.14Å; P76-Y78 PolarHBondContact O-N 3Å
77R38.2Very low39Very low175 Ų175118 Ų11866%0.6660%0.596SS**  trans-68.6107.4167.2-69.5-171.1179.7178-1.2104.1S75 S79 D80S75-R77 PolarHBondContact O-N 2.78Å; R77-S79 PolarHBondContact O-N 2.86Å; R77-D80 PolarHBondContact O-N 3.29Å; R77-D80 VanDerWaalsContact O-N 3.07Å
78Y36.8Very low38.6Very low204 Ų204117.3 Ų117.380%0.859%0.594SS**THydrogen-bonded Turntrans-54.90.8179.8-74.4-83.3000114.7P76P76-Y78 PolarHBondContact O-N 3Å
79S45.5Very low38.4Very low81 Ų81114.5 Ų114.557%0.56659%0.59SS**THydrogen-bonded Turntrans-85.7-17.3173.568.50000115.3R77R77-S79 PolarHBondContact O-N 2.86Å
80D42.7Very low37.9Very low100 Ų100114.6 Ų114.654%0.53559%0.59SS.*SBendtrans-93.9-23-167.878.5-14.5000115.6R77R77-D80 PolarHBondContact O-N 3.29Å; R77-D80 VanDerWaalsContact O-N 3.07Å
81R37.7Very low38Very low173 Ų173116.3 Ų116.365%0.65361%0.608SS**SBendtrans-78.4-23-179.5-77.7-173.2-164.4-172.53.6113.6Y179R81-Y179 PolarHBondContact O-OH 3.26Å
82Y42.6Very low37.6Very low108 Ų108116 Ų11642%0.42460%0.596SS.*SBendtrans-142.2110-178.3-64.6-83.8000108.6H84 V154Y82-H84 PolarHBondContact O-N 3.12Å; Y82-V154 HydrophobicContact CD1-CG2 4.38Å
83P43.4Very low37.9Very low29 Ų29120 Ų12019%0.18861%0.608CS.*  trans-61.1112.9168.827-32.2000106.2V85 A175 Y179P83-V85 PolarHBondContact O-N 3.15Å; P83-A175 HydrophobicContact CB-CB 3.86Å; P83-A175 HydrophobicContact CG-CB 3.85Å; P83-Y179 VanDerWaalsContact CD-CZ 3.45Å; P83-Y179 WeakPolarHBondContact CD-OH 3.49Å; P83-Y179 HydrophobicContact CG-CD2 3.76Å; P83-Y179 HydrophobicContact CG-CE2 3.45Å; P83-Y179 VanDerWaalsContact CG-CE2 3.45Å
84H39.8Very low38.1Very low98 Ų98121.2 Ų121.245%0.45460%0.6SS.*  trans-59.1107.7165.8-76.4-95.6000106.4Y82 R86 R151Y82-H84 PolarHBondContact O-N 3.12Å; H84-R86 PolarHBondContact O-N 3.14Å; H84-R151 PolarHBondContact CE1-NH1 3.15Å; H84-R151 PolarHBondContact NE2-NH1 3.36Å
85V43.9Very low38.3Very low16 Ų16117 Ų11710%0.09760%0.597CS.*  trans-60.4106.4164.2175.10000105.4P83 Y87 M157 L165 L171P83-V85 PolarHBondContact O-N 3.15Å; V85-Y87 HydrophobicContact CB-CE2 4.29Å; V85-Y87 HydrophobicContact CG1-CD2 4.19Å; V85-Y87 HydrophobicContact CG1-CE2 3.77Å; V85-Y87 PolarHBondContact O-N 3.25Å; V85-M157 HydrophobicContact CG2-CE 4.21Å; V85-L165 HydrophobicContact CG1-CD1 3.56Å; V85-L165 HydrophobicContact CG1-CD2 4.32Å; V85-L171 HydrophobicContact CG2-CD1 4.49Å
86R39.9Very low38.3Very low146 Ų146115.4 Ų115.455%0.55160%0.597SS**  trans-75.293.5-177.4-69.6-177.4170.3-161.6-5.5108H84 S88H84-R86 PolarHBondContact O-N 3.14Å; R86-S88 PolarHBondContact O-N 2.94Å
87Y31.8Very low38Very low160 Ų160120 Ų12063%0.62762%0.617SS**  trans-75.678.3160.5-65.1-82.5000108.1V85V85-Y87 HydrophobicContact CB-CE2 4.29Å; V85-Y87 HydrophobicContact CG1-CD2 4.19Å; V85-Y87 HydrophobicContact CG1-CE2 3.77Å; V85-Y87 PolarHBondContact O-N 3.25Å
88S35.3Very low37.6Very low81 Ų81116 Ų11657%0.56662%0.616SS**  trans-150.381.8159.168.30000107.2R86 Y90R86-S88 PolarHBondContact O-N 2.94Å; S88-Y90 PolarHBondContact O-N 2.56Å
89G28.7Very low37.7Very low65 Ų65114.2 Ų114.267%0.6762%0.618SS**  trans-61.2111.4150.400000106.5
90Y29.1Very low37.3Very low227 Ų227117.2 Ų117.289%0.8963%0.626SS**SBendtrans168.6119.6146.3-91.4-69.6000105.2S88 E92S88-Y90 PolarHBondContact O-N 2.56Å; Y90-E92 PolarHBondContact O-N 2.79Å
91G36.1Very low36.9Very low83 Ų83119 Ų11986%0.85664%0.636SS**  trans-59.8125.4-173.300000111.8
92E29.4Very low36.6Very low149 Ų149120.3 Ų120.370%0.69664%0.642SS**  trans-140.7117.7160.6-155.6173.8-152.900106.9Y90 T94Y90-E92 PolarHBondContact O-N 2.79Å; E92-T94 PolarHBondContact O-N 3.12Å
93E47.5Very low36.3Very low195 Ų195120.1 Ų120.191%0.91166%0.656SS**SBendtrans-76.822.4-163.1-49.8-155.1-176.100114
94T35.5Very low35.6Very low100 Ų100123.5 Ų123.561%0.61368%0.681SS**  trans-132.788.4-179.728.70000110.8E92 G96E92-T94 PolarHBondContact O-N 3.12Å; T94-G96 PolarHBondContact O-N 3.17Å
95P43.5Very low35.1Very low101 Ų101126 Ų12666%0.65670%0.697SS**THydrogen-bonded Turntrans-74.524.4-176.130.6-35.1000114.6
96G36.7Very low34.7Very low66 Ų66133.8 Ų133.868%0.6874%0.738SS**THydrogen-bonded Turntrans-106.7-19.4-171.400000117.2T94T94-G96 PolarHBondContact O-N 3.17Å
97L34.4Very low34.2Very low164 Ų164137.2 Ų137.286%0.85975%0.751SS**SBendtrans-135.92-165.6-74.3170.9000117.6I99L97-I99 PolarHBondContact O-N 2.95Å
98S29.8Very low34.3Very low91 Ų91139.8 Ų139.864%0.63676%0.759SS**  trans-91.472.8178.951.20000113.2
99I38.5Very low34.1Very low166 Ų166142.5 Ų142.585%0.85177%0.768SS**  trans-109.655.8156.7-49.2175.6000107.9L97L97-I99 PolarHBondContact O-N 2.95Å
100I37.3Very low34.3Very low143 Ų143146.2 Ų146.273%0.73377%0.767SS**  trans-143.5132.5168.6-51.7178.9000107.4
101N33.7Very low34.5Very low137 Ų137145.9 Ų145.973%0.73377%0.766SS**  trans86.863.1173.1-63.1-19.7000118.5
102Y32.6Very low34.3Very low202 Ų202146.6 Ų146.679%0.79275%0.754SS**  trans-90.792.5133.6-73.2-77.2000108.4
103S34.7Very low34.6Very low103 Ų103147.8 Ų147.872%0.7276%0.759SS**  trans-133.889.7161.869.20000109.2
104S30.4Very low33.7Very low101 Ų101144.9 Ų144.971%0.70675%0.75SS**  trans-122.5110.2161.461.70000109
105N27.7Very low33.8Very low149 Ų149150.5 Ų150.580%0.79776%0.761SS**  trans67.879.8152.2-50.2-25.5000118.6
106L35.5Very low33.6Very low181 Ų181153.1 Ų153.195%0.94876%0.762SS**SBendtrans-139.3141.5135.8-83.5113.4000109.1
107R29.7Very low33.9Very low217 Ų217154 Ų15482%0.81976%0.756SS**  trans-37.4134.1-163.4-71.5-176.8147.6-155.6-6.4116.1N109R107-N109 PolarHBondContact O-N 3.37Å
108R35Very low34.5Very low214 Ų214153.9 Ų153.981%0.80875%0.749SS**  trans-57.377.9161-177.2-166.6-94.7-151.5-2.1109.6
109N31.4Very low35.1Very low139 Ų139159 Ų15974%0.74375%0.754SS**  trans-96.2105.3163.1-74.6-17.3000107.1R107 Y111R107-N109 PolarHBondContact O-N 3.37Å; N109-Y111 PolarHBondContact O-N 3.34Å
110H32.3Very low35.4Very low143 Ų143154 Ų15466%0.66273%0.73SS**  trans-58.4122.8176.2-66.7-71000111.3
111Y33Very low35.8Very low220 Ų220154 Ų15486%0.86372%0.721SS**  -159117.7129-128.4-96.7000110.8N109N109-Y111 PolarHBondContact O-N 3.34Å
112T31.1Very low36.3Very low98 Ų98151.5 Ų151.560%0.60171%0.706SS**  trans12.1116.917055.60000121.5N114T112-N114 PolarHBondContact O-N 2.65Å
113Q35.6Very low36.8Very low174 Ų174146.4 Ų146.481%0.81369%0.692SS**  -26.199.6128.6-168.3179.622.200112.2
114N30.2Very low37.4Very low133 Ų133146 Ų14671%0.71168%0.679SS**  trans-138.695149-84-44.9000105.3T112 K116T112-N114 PolarHBondContact O-N 2.65Å; N114-K116 PolarHBondContact O-N 2.78Å
115Y37.7Very low38.2Very low218 Ų218143.7 Ų143.786%0.85566%0.661SS**  trans-55.785155.2-84.7-93.9000106.5P117Y115-P117 WeakPolarHBondContact O-CD 3.21Å; Y115-P117 VanDerWaalsContact O-N 3.17Å
116K37.6Very low39Very low156 Ų156142.4 Ų142.468%0.67865%0.653SS**  trans-71106.2163.2-103.7178.9159.7-117.30104.6N114 D120N114-K116 PolarHBondContact O-N 2.78Å; K116-D120 IonicContact NZ-OD2 3.03Å; K116-D120 PolarHBondContact NZ-OD2 3.07Å
117P43.9Very low39.5Very low84 Ų84137 Ų13755%0.54563%0.631SS.*  trans-65.7147.4-167.528.5-32.5000108.5Y115 R119 D120Y115-P117 WeakPolarHBondContact O-CD 3.21Å; Y115-P117 VanDerWaalsContact O-N 3.17Å; P117-R119 PolarHBondContact O-N 3.18Å; P117-D120 PolarHBondContact O-N 3.15Å; P117-D120 VanDerWaalsContact O-N 3.12Å
118F47.8Very low40.2Very low162 Ų162132.4 Ų132.471%0.71162%0.622SS**THydrogen-bonded Turntrans-25.7-19.2166.7-171.9-100.9000118.1Y121F118-Y121 PolarHBondContact O-N 2.85Å
119R41.3Very low40.7Very low199 Ų199131.9 Ų131.975%0.75162%0.621SS**Hα-helixtrans-55.3-45.6169.7-90.8-171.4170.8179.3-2.6113.9P117 Y121 M122 D123P117-R119 PolarHBondContact O-N 3.18Å; R119-Y121 PolarHBondContact O-N 3.29Å; R119-M122 PolarHBondContact O-N 2.74Å; R119-M122 VanDerWaalsContact O-N 3.15Å; R119-D123 PolarHBondContact O-N 3.45Å
120D44.8Very low41.3Very low62 Ų62133.2 Ų133.233%0.33262%0.623SS.*Hα-helixtrans-56-46.5-179.5-82-4000107.9K116 P117 M122 D123 H124K116-D120 IonicContact NZ-OD2 3.03Å; K116-D120 PolarHBondContact NZ-OD2 3.07Å; P117-D120 PolarHBondContact O-N 3.15Å; P117-D120 VanDerWaalsContact O-N 3.12Å; D120-M122 VanDerWaalsContact C-N 3.25Å; D120-M122 PolarHBondContact O-N 3.01Å; D120-M122 VanDerWaalsContact O-N 3.12Å; D120-D123 WeakPolarHBondContact O-CA 3.16Å; D120-D123 WeakPolarHBondContact O-CB 3.26Å; D120-D123 PolarHBondContact O-N 2.69Å; D120-H124 PolarHBondContact O-CE1 2.83Å; D120-H124 PolarHBondContact O-N 2.81Å; D120-H124 VanDerWaalsContact O-N 3.14Å; D120-H124 PolarHBondContact O-ND1 2.69Å
121Y45.8Very low41.7Very low141 Ų141129.9 Ų129.955%0.55361%0.612SS**Hα-helixtrans-55-32.8-177.6-155.8-97.4000114.9F118 R119 H124 T125F118-Y121 PolarHBondContact O-N 2.85Å; R119-Y121 PolarHBondContact O-N 3.29Å; Y121-H124 WeakPolarHBondContact CA-CE1 3.45Å; Y121-H124 WeakPolarHBondContact CA-NE2 3.43Å; Y121-H124 AromaticContact CD2-NE2 3.64Å; Y121-H124 PolarHBondContact N-CE1 3Å; Y121-T125 HydrophobicContact CE1-CG2 4.44Å; Y121-T125 WeakPolarHBondContact O-CG2 3.26Å; Y121-T125 PolarHBondContact O-N 2.73Å; Y121-T125 PolarHBondContact O-OG1 3.43Å
122M43.9Very low42.2Very low85 Ų85127.3 Ų127.342%0.41961%0.614SS.*Hα-helixtrans-75.3-38.2173.9-68.5-70.2105.300111.8R119 D120 H124 T125 L126R119-M122 PolarHBondContact O-N 2.74Å; R119-M122 VanDerWaalsContact O-N 3.15Å; D120-M122 VanDerWaalsContact C-N 3.25Å; D120-M122 PolarHBondContact O-N 3.01Å; D120-M122 VanDerWaalsContact O-N 3.12Å; M122-H124 PolarHBondContact O-N 3.19Å; M122-T125 PolarHBondContact O-N 2.7Å; M122-T125 PolarHBondContact O-OG1 3.47Å; M122-T125 VanDerWaalsContact O-OG1 3.05Å; M122-L126 PolarHBondContact O-N 3.5Å; M122-L126 VanDerWaalsContact O-N 3.08Å
123D43.4Very low42.8Very low95 Ų95128.4 Ų128.451%0.50862%0.615SS.*Hα-helixtrans-65.3-39179.6-66-24000111.8R119 D120 S127R119-D123 PolarHBondContact O-N 3.45Å; D120-D123 WeakPolarHBondContact O-CA 3.16Å; D120-D123 WeakPolarHBondContact O-CB 3.26Å; D120-D123 PolarHBondContact O-N 2.69Å; D123-S127 WeakPolarHBondContact O-CB 3.19Å; D123-S127 PolarHBondContact O-N 3.21Å; D123-S127 PolarHBondContact O-OG 3.07Å
124H46.5Very low43.2Very low95 Ų95129.8 Ų129.844%0.4462%0.618SS.*Hα-helixtrans-76.8-26.5177.332.1-72.7000114D120 Y121 M122 L128D120-H124 PolarHBondContact O-CE1 2.83Å; D120-H124 PolarHBondContact O-N 2.81Å; D120-H124 VanDerWaalsContact O-N 3.14Å; D120-H124 PolarHBondContact O-ND1 2.69Å; Y121-H124 WeakPolarHBondContact CA-CE1 3.45Å; Y121-H124 WeakPolarHBondContact CA-NE2 3.43Å; Y121-H124 AromaticContact CD2-NE2 3.64Å; Y121-H124 PolarHBondContact N-CE1 3Å; M122-H124 PolarHBondContact O-N 3.19Å; H124-L128 VanDerWaalsContact O-CD1 3.26Å; H124-L128 WeakPolarHBondContact O-CD1 3.41Å; H124-L128 WeakPolarHBondContact O-CG 3.44Å; H124-L128 PolarHBondContact O-N 2.71Å
125T47.6Very low44Very low53 Ų53130.3 Ų130.333%0.32562%0.621SS.*Hα-helixtrans-74.7-32.6174.349.10000112.6Y121 M122 Y129Y121-T125 HydrophobicContact CE1-CG2 4.44Å; Y121-T125 WeakPolarHBondContact O-CG2 3.26Å; Y121-T125 PolarHBondContact O-N 2.73Å; Y121-T125 PolarHBondContact O-OG1 3.43Å; M122-T125 PolarHBondContact O-N 2.7Å; M122-T125 PolarHBondContact O-OG1 3.47Å; M122-T125 VanDerWaalsContact O-OG1 3.05Å; T125-Y129 WeakPolarHBondContact O-CD2 3.2Å
126L44Very low44.2Very low122 Ų122126.1 Ų126.164%0.63962%0.618SS**Hα-helixtrans-79.6-34.2173.8-67172.7000112.9M122 L128 Y129M122-L126 PolarHBondContact O-N 3.5Å; M122-L126 VanDerWaalsContact O-N 3.08Å; L126-L128 VanDerWaalsContact C-N 3.31Å; L126-L128 PolarHBondContact O-N 3.35Å; L126-Y129 PolarHBondContact O-N 2.9Å
127S47.1Very low44.7Very low67 Ų67123.3 Ų123.347%0.46962%0.615SS.*Hα-helixtrans-67-28.9178.2-59.20000113.6D123 Y129 H130 T131D123-S127 WeakPolarHBondContact O-CB 3.19Å; D123-S127 PolarHBondContact O-N 3.21Å; D123-S127 PolarHBondContact O-OG 3.07Å; S127-Y129 VanDerWaalsContact C-N 3.27Å; S127-Y129 PolarHBondContact O-N 2.99Å; S127-H130 PolarHBondContact O-N 2.93Å; S127-T131 PolarHBondContact O-N 3.11Å
128L45.2Very low44.6Very low121 Ų121124.5 Ų124.563%0.63463%0.626SS**THydrogen-bonded Turntrans-65-28.8179.1-78.8163.7000112.7H124 L126 H130H124-L128 VanDerWaalsContact O-CD1 3.26Å; H124-L128 WeakPolarHBondContact O-CD1 3.41Å; H124-L128 WeakPolarHBondContact O-CG 3.44Å; H124-L128 PolarHBondContact O-N 2.71Å; L126-L128 VanDerWaalsContact C-N 3.31Å; L126-L128 PolarHBondContact O-N 3.35Å; L128-H130 VanDerWaalsContact C-N 3.29Å; L128-H130 PolarHBondContact O-N 2.95Å
129Y43.5Very low44.4Very low203 Ų203127.7 Ų127.780%0.79664%0.635SS**THydrogen-bonded Turntrans-75.9-13.7177.4-76.7-80.7000113.9T125 L126 S127T125-Y129 WeakPolarHBondContact O-CD2 3.2Å; L126-Y129 PolarHBondContact O-N 2.9Å; S127-Y129 VanDerWaalsContact C-N 3.27Å; S127-Y129 PolarHBondContact O-N 2.99Å
130H44.4Very low44.3Very low167 Ų167121.2 Ų121.277%0.77363%0.63SS**THydrogen-bonded Turntrans-111.3-6.8-174.9-778000114.5S127 L128S127-H130 PolarHBondContact O-N 2.93Å; L128-H130 VanDerWaalsContact C-N 3.29Å; L128-H130 PolarHBondContact O-N 2.95Å
131T42Very low44.3Very low72 Ų72128.8 Ų128.844%0.44266%0.656SS.*  trans-100.2106.4175.461.80000109S127 L133S127-T131 PolarHBondContact O-N 3.11Å; T131-L133 HydrophobicContact CG2-CD1 4.32Å; T131-L133 PolarHBondContact O-N 2.78Å
132N41.9Very low44.1Very low167 Ų167127.3 Ų127.389%0.89367%0.666SS**  trans-65.830.9165.5-70.9-59.1000112K134N132-K134 PolarHBondContact O-N 3.03Å; N132-K134 VanDerWaalsContact O-N 3.16Å
133L45.4Very low44.4Very low121 Ų121130.4 Ų130.463%0.63468%0.683SS**  trans-81.197.6176.2-70.2172.4000106.6T131 L135T131-L133 HydrophobicContact CG2-CD1 4.32Å; T131-L133 PolarHBondContact O-N 2.78Å; L133-L135 HydrophobicContact CB-CG 4.42Å; L133-L135 PolarHBondContact O-N 2.79Å
134K42.8Very low44.7Very low202 Ų202130.2 Ų130.288%0.87869%0.687SS**  trans-6278.4165.1-66179.8-180179.50108.6N132 T136N132-K134 PolarHBondContact O-N 3.03Å; N132-K134 VanDerWaalsContact O-N 3.16Å; K134-T136 VanDerWaalsContact C-N 3.29Å; K134-T136 PolarHBondContact O-N 3.42Å
135L48.2Very low44.4Very low145 Ų145137.2 Ų137.276%0.75971%0.71SS**  trans-74.292.9166.9-64.5178.1000106.2L133 P137L133-L135 HydrophobicContact CB-CG 4.42Å; L133-L135 PolarHBondContact O-N 2.79Å; L135-P137 WeakPolarHBondContact O-CD 3.19Å
136T42.1Very low44.5Very low130 Ų130144.4 Ų144.480%0.79873%0.732SS**  trans-52.4110165.730.20000108K134 S138K134-T136 VanDerWaalsContact C-N 3.29Å; K134-T136 PolarHBondContact O-N 3.42Å; T136-S138 PolarHBondContact O-N 2.94Å
137P47.5Very low44.6Very low96 Ų96141.3 Ų141.362%0.62373%0.73SS**  trans-66.4114.5178.326.5-30.3000107.2L135 Y139L135-P137 WeakPolarHBondContact O-CD 3.19Å; P137-Y139 HydrophobicContact CG-CE2 4.28Å; P137-Y139 VanDerWaalsContact O-CD2 3.26Å; P137-Y139 WeakPolarHBondContact O-CD2 3.33Å; P137-Y139 PolarHBondContact O-N 2.83Å
138S40.4Very low44.6Very low110 Ų110146 Ų14677%0.76974%0.744SS**  trans-60.6105.9166-179.10000106.8T136 G140T136-S138 PolarHBondContact O-N 2.94Å; S138-G140 PolarHBondContact O-N 3.17Å
139Y45.6Very low45Very low228 Ų228145 Ų14589%0.89474%0.744SS**SBendtrans-64.379.7-178.6-87.4-97.5000110P137P137-Y139 HydrophobicContact CG-CE2 4.28Å; P137-Y139 VanDerWaalsContact O-CD2 3.26Å; P137-Y139 WeakPolarHBondContact O-CD2 3.33Å; P137-Y139 PolarHBondContact O-N 2.83Å
140G38Very low45Very low64 Ų64141.9 Ų141.966%0.6675%0.746SS**  trans-136.60.2170.900000113.6S138 S142S138-G140 PolarHBondContact O-N 3.17Å; G140-S142 PolarHBondContact O-N 2.96Å
141Y44.1Very low45.2Very low221 Ų221138.1 Ų138.187%0.86773%0.725SS**  trans-71.893.6173.4-89.9-86.4000109.4L143Y141-L143 PolarHBondContact O-N 2.88Å
142S41.8Very low45.4Very low109 Ų109139.2 Ų139.276%0.76273%0.734SS**  trans-63.4115.9156.663.20000106.8G140G140-S142 PolarHBondContact O-N 2.96Å
143L50.4Low45.6Very low150 Ų150135 Ų13579%0.78571%0.706SS**  trans-50.3130.5170.4-73160.5000107.1Y141 R145Y141-L143 PolarHBondContact O-N 2.88Å; L143-R145 PolarHBondContact O-N 2.96Å
144P50.3Low45.9Very low91 Ų91129.7 Ų129.759%0.59168%0.679SS**  trans-51.7113.1169.3-20.830.2000106.2Y146P144-Y146 VanDerWaalsContact C-N 3.27Å; P144-Y146 WeakPolarHBondContact O-CD2 3.48Å; P144-Y146 PolarHBondContact O-N 3.08Å
145R40.4Very low46.4Very low243 Ų243127.5 Ų127.592%0.91767%0.671SS**  trans-58.9104.8170.6-84.2-173.6-178.7-133.51.9104.2L143 G147L143-R145 PolarHBondContact O-N 2.96Å; R145-G147 PolarHBondContact O-N 2.98Å
146Y49.9Very low47Very low204 Ų204128.7 Ų128.780%0.867%0.672SS**  trans-65.967.3160.8-63.8-84.3000106.7P144 H148P144-Y146 VanDerWaalsContact C-N 3.27Å; P144-Y146 WeakPolarHBondContact O-CD2 3.48Å; P144-Y146 PolarHBondContact O-N 3.08Å; Y146-H148 PolarHBondContact O-N 3.32Å
147G45.9Very low48.6Very low56 Ų56123.9 Ų123.958%0.57764%0.641SS**  trans-51.6125157.300000104.8R145R145-G147 PolarHBondContact O-N 2.98Å
148H47.1Very low50.1Low165 Ų165120.9 Ų120.976%0.76463%0.628SS**  trans-51.8133-175.8-36.9-18.6000105.6Y146 V150Y146-H148 PolarHBondContact O-N 3.32Å; H148-V150 WeakPolarHBondContact O-CG2 3.01Å; H148-V150 PolarHBondContact O-N 2.94Å
149P52.7Low52.2Low100 Ų100118.6 Ų118.665%0.64961%0.609SS**  trans-55.4106.4-17222.6-33.5000108R151P149-R151 HydrophobicContact CB-CG 4.28Å; P149-R151 PolarHBondContact O-N 3.33Å
150V44.4Very low54.2Low138 Ų138112.2 Ų112.284%0.83659%0.591SS**  trans-73.680.7175.1-177.60000104.3H148 P152H148-V150 WeakPolarHBondContact O-CG2 3.01Å; H148-V150 PolarHBondContact O-N 2.94Å; V150-P152 WeakPolarHBondContact O-CD 3.19Å
151R48.3Very low56.5Low88 Ų88113.7 Ų113.733%0.33258%0.584SS.*  trans-71111.4177-79.1179.5166.3-138.44.9106.6H84 P149 Y153H84-R151 PolarHBondContact CE1-NH1 3.15Å; H84-R151 PolarHBondContact NE2-NH1 3.36Å; P149-R151 HydrophobicContact CB-CG 4.28Å; P149-R151 PolarHBondContact O-N 3.33Å; R151-Y153 HydrophobicContact CB-CD1 4.19Å; R151-Y153 HydrophobicContact CB-CD2 4.31Å; R151-Y153 HydrophobicContact CB-CE1 3.63Å; R151-Y153 HydrophobicContact CB-CE2 3.76Å; R151-Y153 VanDerWaalsContact CB-CZ 3.43Å; R151-Y153 WeakPolarHBondContact CD-OH 3.3Å; R151-Y153 HydrophobicContact CG-CE1 3.89Å; R151-Y153 HydrophobicContact CG-CE2 4.13Å; R151-Y153 VanDerWaalsContact CG-CZ 3.47Å; R151-Y153 WeakPolarHBondContact CG-OH 3.21Å; R151-Y153 PolarHBondContact NE-OH 2.98Å; R151-Y153 VanDerWaalsContact NE-OH 3.11Å; R151-Y153 PolarHBondContact NH1-OH 2.93Å; R151-Y153 PolarHBondContact O-N 3.47Å
152P47.1Very low58.4Low95 Ų95103.2 Ų103.262%0.61754%0.542SS*.  trans-71.27.4-167.425.5-33.4000115.7V150V150-P152 WeakPolarHBondContact O-CD 3.19Å
153Y45.8Very low60.5Low78 Ų7898.4 Ų98.431%0.30651%0.508SS..SBendtrans-117.327.9-151.639.6-102.2000117.8R151R151-Y153 HydrophobicContact CB-CD1 4.19Å; R151-Y153 HydrophobicContact CB-CD2 4.31Å; R151-Y153 HydrophobicContact CB-CE1 3.63Å; R151-Y153 HydrophobicContact CB-CE2 3.76Å; R151-Y153 VanDerWaalsContact CB-CZ 3.43Å; R151-Y153 WeakPolarHBondContact CD-OH 3.3Å; R151-Y153 HydrophobicContact CG-CE1 3.89Å; R151-Y153 HydrophobicContact CG-CE2 4.13Å; R151-Y153 VanDerWaalsContact CG-CZ 3.47Å; R151-Y153 WeakPolarHBondContact CG-OH 3.21Å; R151-Y153 PolarHBondContact NE-OH 2.98Å; R151-Y153 VanDerWaalsContact NE-OH 3.11Å; R151-Y153 PolarHBondContact NH1-OH 2.93Å; R151-Y153 PolarHBondContact O-N 3.47Å
154V50.9Low62.3Low11 Ų1195 Ų957%0.06749%0.49CS..SBendtrans-135.9-42.1169.3-174.90000113.4Y82 H156 Y179 W180Y82-V154 HydrophobicContact CD1-CG2 4.38Å; V154-H156 VanDerWaalsContact C-N 3.33Å; V154-H156 PolarHBondContact O-N 2.96Å; V154-Y179 HydrophobicContact CG1-CD1 3.59Å; V154-Y179 HydrophobicContact CG1-CE1 4.24Å; V154-Y179 HydrophobicContact CG1-CG 3.74Å; V154-W180 HydrophobicContact CG1-CH2 3.72Å; V154-W180 HydrophobicContact CG1-CZ2 3.85Å; V154-W180 HydrophobicContact CG1-CZ3 4.46Å; V154-W180 WeakPolarHBondContact O-CZ2 3.4Å
155H53.1Low64Low156 Ų15691.6 Ų91.672%0.72247%0.468SS*.THydrogen-bonded Turntrans-76.4-15.3-172.6-96.3-67.7000115.7
156H60.4Low66.1Low169 Ų16984.6 Ų84.678%0.78244%0.442SS*.THydrogen-bonded Turntrans-103.2-5.9-177.3-58.3-60.6000114V154V154-H156 VanDerWaalsContact C-N 3.33Å; V154-H156 PolarHBondContact O-N 2.96Å
157M75.5Confident67.8Low29 Ų2979.9 Ų79.914%0.14343%0.425CS..SBendtrans-76.1129.9178.8-174.2163.977.600109.7V85 D161 A162 L165 L171 W180V85-M157 HydrophobicContact CG2-CE 4.21Å; M157-D161 HydrophobicContact CG-CB 3.65Å; M157-D161 HydrophobicContact SD-CB 4.19Å; M157-A162 HydrophobicContact CE-CB 3.56Å; M157-L165 HydrophobicContact CE-CD1 3.68Å; M157-L165 HydrophobicContact SD-CD1 3.35Å; M157-L165 WeakPolarHBondContact SD-CD1 3.45Å; M157-L171 HydrophobicContact CE-CD1 3.95Å; M157-W180 HydrophobicContact CB-CZ2 3.89Å; M157-W180 HydrophobicContact CE-CD2 4.27Å; M157-W180 HydrophobicContact CE-CH2 3.37Å; M157-W180 HydrophobicContact CE-CZ2 3.04Å; M157-W180 HydrophobicContact CE-CZ3 4.13Å; M157-W180 HydrophobicContact CG-CZ2 4.35Å; M157-W180 PolarHBondContact O-NE1 3.04Å; M157-W180 HydrophobicContact SD-CZ2 4.33Å
158G80.8Confident69.8Low34 Ų3484.3 Ų84.335%0.35143%0.429SS..  trans-62.5158.2175.100000112.1D160 D161 A162G158-D160 VanDerWaalsContact C-N 3.3Å; G158-D160 PolarHBondContact O-N 3.43Å; G158-D161 PolarHBondContact O-N 3.44Å; G158-A162 PolarHBondContact O-N 2.86Å; G158-A162 VanDerWaalsContact O-N 3.13Å
159V84.3Confident71.5Confident62 Ų6287.6 Ų87.638%0.37643%0.434SS..Hα-helixtrans-63.6-38.5176.6179.20000110.8A162 I163 W180 L181V159-A162 WeakPolarHBondContact O-CB 3.26Å; V159-A162 PolarHBondContact O-N 3.41Å; V159-I163 HydrophobicContact CG1-CD1 4Å; V159-I163 VanDerWaalsContact O-CG1 3.31Å; V159-I163 WeakPolarHBondContact O-CG1 3.39Å; V159-I163 PolarHBondContact O-N 2.83Å; V159-W180 HydrophobicContact CG2-CB 4.48Å; V159-L181 HydrophobicContact CG1-CD2 4.34Å
160D86.7Confident72.8Confident94 Ų9484.4 Ų84.450%0.50341%0.414SS..Hα-helixtrans-65-44.9179.6-60.4-56.4000111.5G158 A162 I163 D164 R217G158-D160 VanDerWaalsContact C-N 3.3Å; G158-D160 PolarHBondContact O-N 3.43Å; D160-A162 VanDerWaalsContact C-N 3.28Å; D160-A162 PolarHBondContact O-N 2.97Å; D160-I163 WeakPolarHBondContact O-CB 3.49Å; D160-I163 PolarHBondContact O-N 3.09Å; D160-I163 VanDerWaalsContact O-N 3.13Å; D160-D164 PolarHBondContact O-N 2.63Å; D160-R217 IonicContact OD1-NH1 3Å; D160-R217 PolarHBondContact OD1-NH1 3.03Å
161D86.6Confident74.6Confident95 Ų9578.6 Ų78.651%0.50838%0.378SS..Hα-helixtrans-60.1-39174.8-62.4-24.6000112.1M157 G158 I163 D164 L165M157-D161 HydrophobicContact CG-CB 3.65Å; M157-D161 HydrophobicContact SD-CB 4.19Å; G158-D161 PolarHBondContact O-N 3.44Å; D161-I163 VanDerWaalsContact C-N 3.35Å; D161-D164 PolarHBondContact O-N 2.75Å; D161-L165 WeakPolarHBondContact O-CG 3.38Å; D161-L165 PolarHBondContact O-N 3.41Å
162A84Confident76.4Confident0 Ų078.4 Ų78.40%039%0.387CS..Hα-helixtrans-64.6-39.5176.900000112.2M157 G158 V159 D160 L165 Y166 L176 W180M157-A162 HydrophobicContact CE-CB 3.56Å; G158-A162 PolarHBondContact O-N 2.86Å; G158-A162 VanDerWaalsContact O-N 3.13Å; V159-A162 WeakPolarHBondContact O-CB 3.26Å; V159-A162 PolarHBondContact O-N 3.41Å; D160-A162 VanDerWaalsContact C-N 3.28Å; D160-A162 PolarHBondContact O-N 2.97Å; A162-L165 PolarHBondContact O-N 3.3Å; A162-Y166 PolarHBondContact O-N 3.04Å; A162-L176 HydrophobicContact CB-CD1 3.71Å; A162-W180 HydrophobicContact CB-CB 4.19Å; A162-W180 HydrophobicContact CB-CD2 3.47Å; A162-W180 VanDerWaalsContact CB-CD2 3.47Å; A162-W180 HydrophobicContact CB-CE3 4.01Å; A162-W180 HydrophobicContact CB-CG 3.51Å
163I86.7Confident78.2Confident8 Ų877.1 Ų77.14%0.04138%0.38CS..Hα-helixtrans-65.9-41.6175.5-67.9164000110.2V159 D160 D161 L165 Y166 K167 L176 F214V159-I163 HydrophobicContact CG1-CD1 4Å; V159-I163 VanDerWaalsContact O-CG1 3.31Å; V159-I163 WeakPolarHBondContact O-CG1 3.39Å; V159-I163 PolarHBondContact O-N 2.83Å; D160-I163 WeakPolarHBondContact O-CB 3.49Å; D160-I163 PolarHBondContact O-N 3.09Å; D160-I163 VanDerWaalsContact O-N 3.13Å; D161-I163 VanDerWaalsContact C-N 3.35Å; I163-L165 VanDerWaalsContact C-N 3.35Å; I163-L165 PolarHBondContact O-N 3.09Å; I163-Y166 WeakPolarHBondContact O-CB 3.47Å; I163-Y166 PolarHBondContact O-N 3.28Å; I163-Y166 VanDerWaalsContact O-N 3.16Å; I163-K167 HydrophobicContact CG2-CD 4.36Å; I163-K167 WeakPolarHBondContact O-CG 3.33Å; I163-K167 PolarHBondContact O-N 2.96Å; I163-L176 HydrophobicContact CG1-CD1 4.45Å; I163-F214 HydrophobicContact CD1-CE2 3.98Å
164D87.9Confident80Confident78 Ų7877.3 Ų77.342%0.41739%0.393SS..Hα-helixtrans-63.4-40.2177.3-84.1-0.4000112.3D160 D161 Y166 K167 K168D160-D164 PolarHBondContact O-N 2.63Å; D161-D164 PolarHBondContact O-N 2.75Å; D164-Y166 VanDerWaalsContact C-N 3.32Å; D164-K167 PolarHBondContact O-N 3.03Å; D164-K168 WeakPolarHBondContact O-CB 3.31Å; D164-K168 VanDerWaalsContact O-CG 3.29Å; D164-K168 WeakPolarHBondContact O-CG 3.5Å; D164-K168 PolarHBondContact O-N 2.99Å
165L85.6Confident81.5Confident21 Ų2177 Ų7711%0.1139%0.392CS..Hα-helixtrans-66.7-34.7173.4-74.6165.4000112.6V85 M157 D161 A162 I163 K168 R169 C170 L171V85-L165 HydrophobicContact CG1-CD1 3.56Å; V85-L165 HydrophobicContact CG1-CD2 4.32Å; M157-L165 HydrophobicContact CE-CD1 3.68Å; M157-L165 HydrophobicContact SD-CD1 3.35Å; M157-L165 WeakPolarHBondContact SD-CD1 3.45Å; D161-L165 WeakPolarHBondContact O-CG 3.38Å; D161-L165 PolarHBondContact O-N 3.41Å; A162-L165 PolarHBondContact O-N 3.3Å; I163-L165 VanDerWaalsContact C-N 3.35Å; I163-L165 PolarHBondContact O-N 3.09Å; L165-K168 CarbonylContact O-C 3.55Å; L165-K168 PolarHBondContact O-N 3.24Å; L165-R169 PolarHBondContact O-N 3.35Å; L165-C170 HydrophobicContact CB-CB 4.34Å; L165-C170 HydrophobicContact CD2-CB 3.76Å; L165-C170 PolarHBondContact O-N 3.38Å; L165-L171 HydrophobicContact CB-CB 4.07Å; L165-L171 HydrophobicContact CB-CD1 4.43Å; L165-L171 PolarHBondContact O-N 2.87Å
166Y84.2Confident82.9Confident95 Ų9570.1 Ų70.137%0.37336%0.36SS..Hα-helixtrans-64.4-46172.2176-106000111.2A162 I163 D164 K168 R169 L176A162-Y166 PolarHBondContact O-N 3.04Å; I163-Y166 WeakPolarHBondContact O-CB 3.47Å; I163-Y166 PolarHBondContact O-N 3.28Å; I163-Y166 VanDerWaalsContact O-N 3.16Å; D164-Y166 VanDerWaalsContact C-N 3.32Å; Y166-K168 VanDerWaalsContact C-N 3.27Å; Y166-K168 PolarHBondContact O-N 3.39Å; Y166-R169 PolarHBondContact O-N 2.96Å; Y166-L176 HydrophobicContact CD1-CD2 4.09Å; Y166-L176 HydrophobicContact CD2-CD2 4.32Å; Y166-L176 HydrophobicContact CG-CD2 3.88Å
167K86.2Confident84Confident106 Ų10665.6 Ų65.646%0.46134%0.344SS..Hα-helixtrans-57.8-39.8173.5-72.1178.5178.3-177.70111.6I163 D164 R169 R217I163-K167 HydrophobicContact CG2-CD 4.36Å; I163-K167 WeakPolarHBondContact O-CG 3.33Å; I163-K167 PolarHBondContact O-N 2.96Å; D164-K167 PolarHBondContact O-N 3.03Å; K167-R169 PolarHBondContact O-N 2.95Å; K167-R217 PolarHBondContact NZ-O 2.83Å
168K87.1Confident84.4Confident149 Ų14970.1 Ų70.165%0.64836%0.363SS*.THydrogen-bonded Turntrans-75.72.2175.7-69.2172.8-177.6173.30114.5D164 L165 Y166 C170D164-K168 WeakPolarHBondContact O-CB 3.31Å; D164-K168 VanDerWaalsContact O-CG 3.29Å; D164-K168 WeakPolarHBondContact O-CG 3.5Å; D164-K168 PolarHBondContact O-N 2.99Å; L165-K168 CarbonylContact O-C 3.55Å; L165-K168 PolarHBondContact O-N 3.24Å; Y166-K168 VanDerWaalsContact C-N 3.27Å; Y166-K168 PolarHBondContact O-N 3.39Å; K168-C170 PolarHBondContact O-N 2.79Å
169R82.4Confident84.5Confident233 Ų23371.2 Ų71.288%0.87936%0.357SS*.THydrogen-bonded Turntrans59.418.1-175.4-55.3-177.4174.4176.9-0.9114.7L165 Y166 K167 L171L165-R169 PolarHBondContact O-N 3.35Å; Y166-R169 PolarHBondContact O-N 2.96Å; K167-R169 PolarHBondContact O-N 2.95Å; R169-L171 VanDerWaalsContact C-N 3.27Å
170C81.7Confident84.4Confident34 Ų3469.6 Ų69.623%0.2334%0.344CS..SBendtrans-82.8-7.7176.2-60.80000112.7L165 K168L165-C170 HydrophobicContact CB-CB 4.34Å; L165-C170 HydrophobicContact CD2-CB 3.76Å; L165-C170 PolarHBondContact O-N 3.38Å; K168-C170 PolarHBondContact O-N 2.79Å
171L81.2Confident84.1Confident15 Ų1568.3 Ų68.38%0.07934%0.337CS..SBendtrans-138.6136.5-173.4-168.9141.5000110.3V85 M157 L165 R169 A175 L176 W180V85-L171 HydrophobicContact CG2-CD1 4.49Å; M157-L171 HydrophobicContact CE-CD1 3.95Å; L165-L171 HydrophobicContact CB-CB 4.07Å; L165-L171 HydrophobicContact CB-CD1 4.43Å; L165-L171 PolarHBondContact O-N 2.87Å; R169-L171 VanDerWaalsContact C-N 3.27Å; L171-A175 HydrophobicContact CD2-CB 4.22Å; L171-A175 HydrophobicContact CG-CB 4.31Å; L171-L176 HydrophobicContact CD2-CB 3.49Å; L171-L176 VanDerWaalsContact CD2-CB 3.49Å; L171-L176 HydrophobicContact CD2-CD1 4.13Å; L171-L176 HydrophobicContact CD2-CG 4.36Å; L171-W180 HydrophobicContact CD1-CE3 4.36Å; L171-W180 HydrophobicContact CD1-CH2 4.03Å; L171-W180 HydrophobicContact CD1-CZ3 3.68Å
172T86.3Confident83.8Confident84 Ų8467 Ų6752%0.51533%0.333SS..  trans-79.4145.4179.665.20000110.7S174 A175 L176T172-S174 PolarHBondContact O-N 3.24Å; T172-S174 PolarHBondContact OG1-OG 2.89Å; T172-S174 VanDerWaalsContact OG1-OG 3.09Å; T172-A175 WeakPolarHBondContact O-CB 3.44Å; T172-A175 PolarHBondContact O-N 3.44Å; T172-A175 WeakPolarHBondContact OG1-CB 3.23Å; T172-A175 PolarHBondContact OG1-N 2.81Å; T172-L176 PolarHBondContact O-N 3.14Å
173S84.4Confident83.3Confident68 Ų6869.7 Ų69.748%0.47635%0.35SS..Hα-helixtrans-53.1-39.517653.60000112.2A175 L176 V177S173-A175 VanDerWaalsContact C-N 3.33Å; S173-A175 PolarHBondContact O-N 3.14Å; S173-L176 PolarHBondContact O-N 3.45Å; S173-V177 WeakPolarHBondContact O-CG2 3.32Å; S173-V177 PolarHBondContact O-N 3.34Å
174S84.4Confident82.7Confident83 Ų8371.7 Ų71.758%0.5836%0.363SS*.Hα-helixtrans-60.7-38.6176.569.60000113.4T172 K178T172-S174 PolarHBondContact O-N 3.24Å; T172-S174 PolarHBondContact OG1-OG 2.89Å; T172-S174 VanDerWaalsContact OG1-OG 3.09Å; S174-K178 VanDerWaalsContact O-CB 3.31Å; S174-K178 WeakPolarHBondContact O-CB 3.36Å; S174-K178 PolarHBondContact O-N 3.5Å; S174-K178 VanDerWaalsContact O-N 3.09Å
175A83Confident81.9Confident5 Ų577 Ų774%0.04138%0.382CS..Hα-helixtrans-70.7-42.4176.400000111.1P83 L171 T172 S173 V177 K178 Y179P83-A175 HydrophobicContact CB-CB 3.86Å; P83-A175 HydrophobicContact CG-CB 3.85Å; L171-A175 HydrophobicContact CD2-CB 4.22Å; L171-A175 HydrophobicContact CG-CB 4.31Å; T172-A175 WeakPolarHBondContact O-CB 3.44Å; T172-A175 PolarHBondContact O-N 3.44Å; T172-A175 WeakPolarHBondContact OG1-CB 3.23Å; T172-A175 PolarHBondContact OG1-N 2.81Å; S173-A175 VanDerWaalsContact C-N 3.33Å; S173-A175 PolarHBondContact O-N 3.14Å; A175-V177 VanDerWaalsContact C-N 3.3Å; A175-V177 PolarHBondContact O-N 3.14Å; A175-K178 PolarHBondContact O-N 3.18Å; A175-Y179 HydrophobicContact CB-CD2 4.37Å; A175-Y179 VanDerWaalsContact O-CD2 3.32Å; A175-Y179 WeakPolarHBondContact O-CD2 3.31Å; A175-Y179 PolarHBondContact O-N 3.03Å
176L81.9Confident80.9Confident10 Ų1081.9 Ų81.95%0.05241%0.408CS..Hα-helixtrans-56.7-49.9178.5-174.165.5000110.2A162 I163 Y166 L171 T172 S173 W180 L181A162-L176 HydrophobicContact CB-CD1 3.71Å; I163-L176 HydrophobicContact CG1-CD1 4.45Å; Y166-L176 HydrophobicContact CD1-CD2 4.09Å; Y166-L176 HydrophobicContact CD2-CD2 4.32Å; Y166-L176 HydrophobicContact CG-CD2 3.88Å; L171-L176 HydrophobicContact CD2-CB 3.49Å; L171-L176 VanDerWaalsContact CD2-CB 3.49Å; L171-L176 HydrophobicContact CD2-CD1 4.13Å; L171-L176 HydrophobicContact CD2-CG 4.36Å; T172-L176 PolarHBondContact O-N 3.14Å; S173-L176 PolarHBondContact O-N 3.45Å; L176-W180 HydrophobicContact CD1-CB 4.32Å; L176-W180 PolarHBondContact O-N 3.06Å; L176-L181 HydrophobicContact CD2-CD1 4.15Å; L176-L181 HydrophobicContact CG-CD1 3.99Å; L176-L181 HydrophobicContact CG-CG 4.22Å; L176-L181 PolarHBondContact O-N 3.27Å; L176-L181 VanDerWaalsContact O-N 3.14Å
177V84Confident80.1Confident74 Ų7481 Ų8145%0.44841%0.407SS..Iπ-helixtrans-61.4-49.4180174.60000110.5S173 A175 L181 T182S173-V177 WeakPolarHBondContact O-CG2 3.32Å; S173-V177 PolarHBondContact O-N 3.34Å; A175-V177 VanDerWaalsContact C-N 3.3Å; A175-V177 PolarHBondContact O-N 3.14Å; V177-L181 HydrophobicContact CG2-CD1 4.22Å; V177-L181 CarbonylContact O-C 3.59Å; V177-L181 PolarHBondContact O-N 2.82Å; V177-T182 VanDerWaalsContact O-CB 3.23Å; V177-T182 WeakPolarHBondContact O-CB 3.4Å; V177-T182 PolarHBondContact O-N 2.9Å; V177-T182 PolarHBondContact O-OG1 3.46Å
178K83Confident79.2Confident124 Ų12479.5 Ų79.554%0.53940%0.404SS..Iπ-helixtrans-67.9-39.8-172.5-175178.2178.2-171.50114.2S174 A175S174-K178 VanDerWaalsContact O-CB 3.31Å; S174-K178 WeakPolarHBondContact O-CB 3.36Å; S174-K178 PolarHBondContact O-N 3.5Å; S174-K178 VanDerWaalsContact O-N 3.09Å; A175-K178 PolarHBondContact O-N 3.18Å
179Y82.6Confident78.5Confident57 Ų5780.2 Ų80.222%0.22440%0.402CS..Iπ-helixtrans-102.9-27.2-169.8-64.6-79.9000114R81 P83 V154 A175R81-Y179 PolarHBondContact O-OH 3.26Å; P83-Y179 VanDerWaalsContact CD-CZ 3.45Å; P83-Y179 WeakPolarHBondContact CD-OH 3.49Å; P83-Y179 HydrophobicContact CG-CD2 3.76Å; P83-Y179 HydrophobicContact CG-CE2 3.45Å; P83-Y179 VanDerWaalsContact CG-CE2 3.45Å; V154-Y179 HydrophobicContact CG1-CD1 3.59Å; V154-Y179 HydrophobicContact CG1-CE1 4.24Å; V154-Y179 HydrophobicContact CG1-CG 3.74Å; A175-Y179 HydrophobicContact CB-CD2 4.37Å; A175-Y179 VanDerWaalsContact O-CD2 3.32Å; A175-Y179 WeakPolarHBondContact O-CD2 3.31Å; A175-Y179 PolarHBondContact O-N 3.03Å
180W82.5Confident77.8Confident28 Ų2876 Ų7611%0.10639%0.386CS..Iπ-helixtrans-116.7-31.9-176-70.5-85000114.5V154 M157 V159 A162 L171 L176V154-W180 HydrophobicContact CG1-CH2 3.72Å; V154-W180 HydrophobicContact CG1-CZ2 3.85Å; V154-W180 HydrophobicContact CG1-CZ3 4.46Å; V154-W180 WeakPolarHBondContact O-CZ2 3.4Å; M157-W180 HydrophobicContact CB-CZ2 3.89Å; M157-W180 HydrophobicContact CE-CD2 4.27Å; M157-W180 HydrophobicContact CE-CH2 3.37Å; M157-W180 HydrophobicContact CE-CZ2 3.04Å; M157-W180 HydrophobicContact CE-CZ3 4.13Å; M157-W180 HydrophobicContact CG-CZ2 4.35Å; M157-W180 PolarHBondContact O-NE1 3.04Å; M157-W180 HydrophobicContact SD-CZ2 4.33Å; V159-W180 HydrophobicContact CG2-CB 4.48Å; A162-W180 HydrophobicContact CB-CB 4.19Å; A162-W180 HydrophobicContact CB-CD2 3.47Å; A162-W180 VanDerWaalsContact CB-CD2 3.47Å; A162-W180 HydrophobicContact CB-CE3 4.01Å; A162-W180 HydrophobicContact CB-CG 3.51Å; L171-W180 HydrophobicContact CD1-CE3 4.36Å; L171-W180 HydrophobicContact CD1-CH2 4.03Å; L171-W180 HydrophobicContact CD1-CZ3 3.68Å; L176-W180 HydrophobicContact CD1-CB 4.32Å; L176-W180 PolarHBondContact O-N 3.06Å
181L81.5Confident77.1Confident67 Ų6781 Ų8135%0.35140%0.404SS..Iπ-helixtrans-99.3-27.5-178.1-53.3176.5000113.6V159 L176 V177 P183 F214V159-L181 HydrophobicContact CG1-CD2 4.34Å; L176-L181 HydrophobicContact CD2-CD1 4.15Å; L176-L181 HydrophobicContact CG-CD1 3.99Å; L176-L181 HydrophobicContact CG-CG 4.22Å; L176-L181 PolarHBondContact O-N 3.27Å; L176-L181 VanDerWaalsContact O-N 3.14Å; V177-L181 HydrophobicContact CG2-CD1 4.22Å; V177-L181 CarbonylContact O-C 3.59Å; V177-L181 PolarHBondContact O-N 2.82Å; L181-P183 VanDerWaalsContact O-CD 3.31Å; L181-P183 WeakPolarHBondContact O-CD 3.39Å; L181-F214 HydrophobicContact CD1-CZ 4.22Å; L181-F214 HydrophobicContact CD2-CE2 4.01Å; L181-F214 HydrophobicContact CD2-CZ 4.03Å
182T80.2Confident76.8Confident69 Ų6989.3 Ų89.342%0.42344%0.435SS..SBendtrans-83.8112.8177.6-54.90000108.2V177 T184V177-T182 VanDerWaalsContact O-CB 3.23Å; V177-T182 WeakPolarHBondContact O-CB 3.4Å; V177-T182 PolarHBondContact O-N 2.9Å; V177-T182 PolarHBondContact O-OG1 3.46Å; T182-T184 PolarHBondContact O-N 3.06Å
183P73Confident76Confident56 Ų5688.9 Ų88.936%0.36443%0.427SS..  trans-63.3128.1177.828.5-35.1000108.9L181 L188L181-P183 VanDerWaalsContact O-CD 3.31Å; L181-P183 WeakPolarHBondContact O-CD 3.39Å; P183-L188 HydrophobicContact CB-CD2 3.78Å; P183-L188 HydrophobicContact CB-CG 3.9Å; P183-L188 HydrophobicContact CG-CD1 4.28Å; P183-L188 HydrophobicContact CG-CD2 3.69Å; P183-L188 HydrophobicContact CG-CG 4.02Å
184T73Confident75.1Confident50 Ų5091.3 Ų91.331%0.30743%0.434SS..  trans-66.5152.2177.4590000109.8T182 L186 E187 L188T182-T184 PolarHBondContact O-N 3.06Å; T184-L186 PolarHBondContact O-N 2.99Å; T184-L186 VanDerWaalsContact O-N 3.08Å; T184-E187 PolarHBondContact N-OE2 3.14Å; T184-E187 PolarHBondContact O-N 3.18Å; T184-E187 WeakPolarHBondContact OG1-CB 3.39Å; T184-E187 VanDerWaalsContact OG1-CD 3.3Å; T184-E187 VanDerWaalsContact OG1-CG 3.26Å; T184-E187 WeakPolarHBondContact OG1-CG 3.32Å; T184-E187 PolarHBondContact OG1-N 3.34Å; T184-E187 PolarHBondContact OG1-OE2 3.13Å; T184-L188 PolarHBondContact O-N 2.87Å
185K71.7Confident74.1Confident188 Ų18894.8 Ų94.882%0.81744%0.438SS*.Hα-helixtrans-53.7-34.1177.5-70-174.8179.4-178.10112.3R189K185-R189 WeakPolarHBondContact O-CB 3.3Å; K185-R189 PolarHBondContact O-N 3.47Å
186L64.1Low73.1Confident124 Ų124101.6 Ų101.665%0.64947%0.469SS*.Hα-helixtrans-69.4-39176.4-66.8177.4000112.7T184 R190T184-L186 PolarHBondContact O-N 2.99Å; T184-L186 VanDerWaalsContact O-N 3.08Å; L186-R190 WeakPolarHBondContact O-CG 3.5Å; L186-R190 PolarHBondContact O-N 3.18Å
187E67.1Low71.8Confident77 Ų77110 Ų11036%0.3650%0.5SS..Hα-helixtrans-69.7-39.5173-75.7167.5155.100112.3T184 R189 R190 K191T184-E187 PolarHBondContact N-OE2 3.14Å; T184-E187 PolarHBondContact O-N 3.18Å; T184-E187 WeakPolarHBondContact OG1-CB 3.39Å; T184-E187 VanDerWaalsContact OG1-CD 3.3Å; T184-E187 VanDerWaalsContact OG1-CG 3.26Å; T184-E187 WeakPolarHBondContact OG1-CG 3.32Å; T184-E187 PolarHBondContact OG1-N 3.34Å; T184-E187 PolarHBondContact OG1-OE2 3.13Å; E187-R189 VanDerWaalsContact C-N 3.3Å; E187-R189 PolarHBondContact O-N 3.21Å; E187-R190 PolarHBondContact O-N 2.88Å; E187-K191 WeakPolarHBondContact O-CB 3.36Å; E187-K191 WeakPolarHBondContact O-CG 3.45Å; E187-K191 PolarHBondContact O-N 3.3Å
188L68.9Low70.4Confident74 Ų74113 Ų11339%0.38751%0.509SS..Hα-helixtrans-61-42.3174-72.7176.8000111.3P183 T184 K191 R192P183-L188 HydrophobicContact CB-CD2 3.78Å; P183-L188 HydrophobicContact CB-CG 3.9Å; P183-L188 HydrophobicContact CG-CD1 4.28Å; P183-L188 HydrophobicContact CG-CD2 3.69Å; P183-L188 HydrophobicContact CG-CG 4.02Å; T184-L188 PolarHBondContact O-N 2.87Å; L188-K191 PolarHBondContact O-N 3.48Å; L188-R192 WeakPolarHBondContact O-CG 3.35Å; L188-R192 PolarHBondContact O-N 3.28Å
189R71.9Confident69Low165 Ų165112 Ų11262%0.62352%0.516SS*.Hα-helixtrans-61.2-50.5174.6-176.6176.8176.5164.36111.2K185 E187 K191 R192 E193K185-R189 WeakPolarHBondContact O-CB 3.3Å; K185-R189 PolarHBondContact O-N 3.47Å; E187-R189 VanDerWaalsContact C-N 3.3Å; E187-R189 PolarHBondContact O-N 3.21Å; R189-K191 VanDerWaalsContact C-N 3.32Å; R189-K191 PolarHBondContact O-N 2.97Å; R189-R192 WeakPolarHBondContact O-CB 3.27Å; R189-R192 PolarHBondContact O-N 3.33Å; R189-R192 VanDerWaalsContact O-N 3.15Å; R189-E193 WeakPolarHBondContact CG-OE1 3.04Å; R189-E193 IonicContact CZ-OE1 3.52Å; R189-E193 IonicContact NE-OE1 3.95Å; R189-E193 PolarHBondContact NE-OE1 2.98Å; R189-E193 WeakPolarHBondContact O-CG 3.37Å; R189-E193 PolarHBondContact O-N 3.35Å
190R68.4Low67.5Low144 Ų144115.9 Ų115.954%0.54354%0.54SS..Hα-helixtrans-59.7-37.9175.3-77.7-172.6-72157.1-2.7113.2L186 E187 E193 L194L186-R190 WeakPolarHBondContact O-CG 3.5Å; L186-R190 PolarHBondContact O-N 3.18Å; E187-R190 PolarHBondContact O-N 2.88Å; R190-E193 PolarHBondContact O-N 3.33Å; R190-L194 WeakPolarHBondContact O-CB 3.48Å; R190-L194 VanDerWaalsContact O-CG 3.27Å; R190-L194 WeakPolarHBondContact O-CG 3.38Å; R190-L194 PolarHBondContact O-N 3.16Å
191K67.2Low65.8Low138 Ų138124 Ų12460%0.657%0.572SS**Hα-helixtrans-67.3-37.6175.6-79.3-173.2177.1-174.50112.4E187 L188 R189 K195E187-K191 WeakPolarHBondContact O-CB 3.36Å; E187-K191 WeakPolarHBondContact O-CG 3.45Å; E187-K191 PolarHBondContact O-N 3.3Å; L188-K191 PolarHBondContact O-N 3.48Å; R189-K191 VanDerWaalsContact C-N 3.32Å; R189-K191 PolarHBondContact O-N 2.97Å; K191-K195 VanDerWaalsContact O-CB 3.3Å; K191-K195 WeakPolarHBondContact O-CB 3.43Å; K191-K195 PolarHBondContact O-N 3.47Å
192R73.1Confident64Low191 Ų191131.6 Ų131.672%0.72160%0.596SS**Hα-helixtrans-64.7-46.6172.8-74179-174.6-177.90.2110.7L188 R189 L194 K195 E196L188-R192 WeakPolarHBondContact O-CG 3.35Å; L188-R192 PolarHBondContact O-N 3.28Å; R189-R192 WeakPolarHBondContact O-CB 3.27Å; R189-R192 PolarHBondContact O-N 3.33Å; R189-R192 VanDerWaalsContact O-N 3.15Å; R192-L194 PolarHBondContact O-N 3.2Å; R192-K195 PolarHBondContact O-N 2.84Å; R192-E196 WeakPolarHBondContact O-CB 3.29Å; R192-E196 PolarHBondContact O-N 2.91Å
193E70.4Confident62.4Low74 Ų74133.2 Ų133.235%0.34661%0.608SS.*Hα-helixtrans-59.2-47175.4-69.3166.7-174.800110.5R189 R190 K195 E196 W197R189-E193 WeakPolarHBondContact CG-OE1 3.04Å; R189-E193 IonicContact CZ-OE1 3.52Å; R189-E193 IonicContact NE-OE1 3.95Å; R189-E193 PolarHBondContact NE-OE1 2.98Å; R189-E193 WeakPolarHBondContact O-CG 3.37Å; R189-E193 PolarHBondContact O-N 3.35Å; R190-E193 PolarHBondContact O-N 3.33Å; E193-K195 PolarHBondContact O-N 3.47Å; E193-E196 WeakPolarHBondContact O-CB 3.31Å; E193-E196 PolarHBondContact O-N 3.01Å; E193-E196 VanDerWaalsContact O-N 3.14Å; E193-W197 PolarHBondContact O-N 3.33Å; E193-W197 VanDerWaalsContact O-N 3.14Å
194L65.3Low61.1Low119 Ų119138.4 Ų138.462%0.62363%0.629SS**Hα-helixtrans-61.4-41.1175.2-75.3168.6000113.3R190 R192 E196 W197 E198R190-L194 WeakPolarHBondContact O-CB 3.48Å; R190-L194 VanDerWaalsContact O-CG 3.27Å; R190-L194 WeakPolarHBondContact O-CG 3.38Å; R190-L194 PolarHBondContact O-N 3.16Å; R192-L194 PolarHBondContact O-N 3.2Å; L194-E196 VanDerWaalsContact C-N 3.26Å; L194-E196 PolarHBondContact O-N 3.03Å; L194-W197 PolarHBondContact O-N 2.97Å; L194-W197 VanDerWaalsContact O-N 3.14Å; L194-E198 PolarHBondContact O-N 2.99Å
195K64.5Low59.7Low156 Ų156146 Ų14668%0.67865%0.653SS**Hα-helixtrans-67.2-29.4175.5-172.3178.5179-177.40112K191 R192 E193 W197 E198 P199K191-K195 VanDerWaalsContact O-CB 3.3Å; K191-K195 WeakPolarHBondContact O-CB 3.43Å; K191-K195 PolarHBondContact O-N 3.47Å; R192-K195 PolarHBondContact O-N 2.84Å; E193-K195 PolarHBondContact O-N 3.47Å; K195-W197 VanDerWaalsContact C-N 3.27Å; K195-E198 PolarHBondContact O-N 3.39Å; K195-P199 WeakPolarHBondContact O-CD 3.44Å
196E60.7Low58.2Low148 Ų148146.7 Ų146.769%0.69266%0.66SS**Hα-helixtrans-70-26.1173.2-166.5169.3-166.500111.9R192 E193 L194 P199R192-E196 WeakPolarHBondContact O-CB 3.29Å; R192-E196 PolarHBondContact O-N 2.91Å; E193-E196 WeakPolarHBondContact O-CB 3.31Å; E193-E196 PolarHBondContact O-N 3.01Å; E193-E196 VanDerWaalsContact O-N 3.14Å; L194-E196 VanDerWaalsContact C-N 3.26Å; L194-E196 PolarHBondContact O-N 3.03Å; E196-P199 WeakPolarHBondContact O-CD 3.48Å
197W54.2Low57.4Low186 Ų186145 Ų14571%0.70566%0.658SS**Hα-helixtrans-84.9-18.9170.6-61.3113000114.3E193 L194 K195E193-W197 PolarHBondContact O-N 3.33Å; E193-W197 VanDerWaalsContact O-N 3.14Å; L194-W197 PolarHBondContact O-N 2.97Å; L194-W197 VanDerWaalsContact O-N 3.14Å; K195-W197 VanDerWaalsContact C-N 3.27Å
198E55.5Low56.4Low137 Ų137147.3 Ų147.364%0.6468%0.68SS**G310 helixtrans-62.6-23177.7-98.7-152.816300117.1L194 K195 L200 Y201L194-E198 PolarHBondContact O-N 2.99Å; K195-E198 PolarHBondContact O-N 3.39Å; E198-L200 PolarHBondContact O-N 3.13Å; E198-Y201 PolarHBondContact O-N 3Å
199P53.3Low55.6Low104 Ų104154.7 Ų154.768%0.67570%0.702SS**G310 helixtrans-62.5-12.7179.5-1931.2000113.9K195 E196K195-P199 WeakPolarHBondContact O-CD 3.44Å; E196-P199 WeakPolarHBondContact O-CD 3.48Å
200L51.5Low54.6Low139 Ų139151.1 Ų151.173%0.72870%0.703SS**G310 helixtrans-93.8-10.4-179.4-64.1-178.6000114.8E198E198-L200 PolarHBondContact O-N 3.13Å
201Y45.6Very low53.7Low197 Ų197151.3 Ų151.377%0.77371%0.714SS**  trans-136.587.5174.5-88.2-92.2000109.5E198 P203E198-Y201 PolarHBondContact O-N 3Å; Y201-P203 VanDerWaalsContact O-CD 3.26Å; Y201-P203 WeakPolarHBondContact O-CD 3.26Å
202R45.5Very low52.9Low227 Ų227153.7 Ų153.786%0.85772%0.719SS**  trans-93.296.9161.6-169.3-176.6-145.9-156.44.5107.5M204R202-M204 PolarHBondContact O-N 3.22Å
203P45.2Very low52.1Low104 Ų104148.8 Ų148.868%0.67571%0.707SS**  trans-70.7118167-5.322.9000107Y201 Y205Y201-P203 VanDerWaalsContact O-CD 3.26Å; Y201-P203 WeakPolarHBondContact O-CD 3.26Å; P203-Y205 PolarHBondContact O-N 3.02Å
204M45.7Very low51.7Low164 Ų164149.6 Ų149.681%0.80871%0.71SS**SBendtrans-66.531.5176.4-90.3-169.775.700114.3R202R202-M204 PolarHBondContact O-N 3.22Å
205Y45.2Very low51.5Low210 Ų210147.4 Ų147.482%0.82470%0.704SS**  trans-130.289.1178.3-61.9-75.3000109.8P203 S207P203-Y205 PolarHBondContact O-N 3.02Å; Y205-S207 VanDerWaalsContact C-N 3.3Å; Y205-S207 PolarHBondContact O-N 3.41Å
206E39.3Very low51.4Low203 Ų203143.3 Ų143.395%0.94970%0.695SS**  trans-61.493.8158.6-79.8-178.4154.100108.3
207S47.7Very low51.4Low88 Ų88141.6 Ų141.662%0.61568%0.682SS**  trans-86.1129.2156.1172.30000107.2Y205 R209Y205-S207 VanDerWaalsContact C-N 3.3Å; Y205-S207 PolarHBondContact O-N 3.41Å; S207-R209 PolarHBondContact O-N 3.1Å
208P46Very low52Low125 Ų125136.6 Ų136.681%0.81267%0.669SS**  trans-70.186.1-179.929.8-32.7000108.1S210P208-S210 PolarHBondContact O-N 3.17Å
209R50.8Low52.3Low229 Ų229135.6 Ų135.686%0.86467%0.672SS**  trans-70.191.7167.1-75.9-172.6176.6178.90.6106.3S207 L211S207-R209 PolarHBondContact O-N 3.1Å; R209-L211 PolarHBondContact O-N 3.36Å
210S50.6Low52.1Low91 Ų91141.2 Ų141.264%0.63670%0.695SS**  trans-4.798.9154.6174.40000109.9P208 R212P208-S210 PolarHBondContact O-N 3.17Å; S210-R212 PolarHBondContact O-N 2.83Å
211L50.1Low52.1Low147 Ų147141.3 Ų141.377%0.7769%0.693SS**  trans-56.580.9158.6-80.3155.7000105.6R209 D213R209-L211 PolarHBondContact O-N 3.36Å; L211-D213 PolarHBondContact O-N 2.9Å
212R51.4Low52.5Low188 Ų188138.4 Ų138.471%0.70969%0.689SS**  trans-67.873.9155.2-77.7-169.9174.4-166.7-1.5104.8S210 F214S210-R212 PolarHBondContact O-N 2.83Å; R212-F214 PolarHBondContact O-N 3.2Å
213D55.8Low52.9Low88 Ų88133.4 Ų133.447%0.47168%0.68SS.*  trans-50.5134.4175.1-79.5-31.1000107.4L211 S215 S216L211-D213 PolarHBondContact O-N 2.9Å; D213-S215 PolarHBondContact O-N 3.44Å; D213-S216 WeakPolarHBondContact O-CB 3.45Å; D213-S216 PolarHBondContact O-N 2.96Å; D213-S216 PolarHBondContact O-OG 2.75Å
214F61.1Low53.3Low92 Ų92135.2 Ų135.240%0.40468%0.68SS.*Hα-helixtrans-51.7-29.5178.3-179.7-97.1000111.8I163 L181 R212 S216 R217 L218I163-F214 HydrophobicContact CD1-CE2 3.98Å; L181-F214 HydrophobicContact CD1-CZ 4.22Å; L181-F214 HydrophobicContact CD2-CE2 4.01Å; L181-F214 HydrophobicContact CD2-CZ 4.03Å; R212-F214 PolarHBondContact O-N 3.2Å; F214-S216 VanDerWaalsContact C-N 3.33Å; F214-S216 PolarHBondContact O-N 3.38Å; F214-R217 WeakPolarHBondContact O-CB 3.48Å; F214-R217 PolarHBondContact O-N 3.12Å; F214-R217 VanDerWaalsContact O-N 3.1Å; F214-L218 HydrophobicContact CD1-CD1 4.12Å; F214-L218 HydrophobicContact CE1-CD1 3.58Å; F214-L218 HydrophobicContact CE1-CG 4.09Å; F214-L218 HydrophobicContact CZ-CD1 4.3Å; F214-L218 HydrophobicContact CZ-CG 4.47Å
215S61.4Low53.8Low73 Ų73133.4 Ų133.451%0.5167%0.672SS.*Hα-helixtrans-55.3-45.3173.864.50000112.3D213 R217 L218 V219D213-S215 PolarHBondContact O-N 3.44Å; S215-R217 PolarHBondContact O-N 2.8Å; S215-L218 PolarHBondContact O-N 2.65Å; S215-L218 VanDerWaalsContact O-N 3.12Å; S215-V219 PolarHBondContact O-N 2.69Å
216S63.6Low54.4Low69 Ų69128.3 Ų128.348%0.48366%0.662SS.*Hα-helixtrans-64.5-20.8179690000113.6D213 F214D213-S216 WeakPolarHBondContact O-CB 3.45Å; D213-S216 PolarHBondContact O-N 2.96Å; D213-S216 PolarHBondContact O-OG 2.75Å; F214-S216 VanDerWaalsContact C-N 3.33Å; F214-S216 PolarHBondContact O-N 3.38Å
217R60.8Low55.4Low112 Ų112122.9 Ų122.942%0.42364%0.642SS.*Hα-helixtrans-81.8-18.5177.2-57.9-172.5-175.3-156.12113.5D160 K167 F214 S215D160-R217 IonicContact OD1-NH1 3Å; D160-R217 PolarHBondContact OD1-NH1 3.03Å; K167-R217 PolarHBondContact NZ-O 2.83Å; F214-R217 WeakPolarHBondContact O-CB 3.48Å; F214-R217 PolarHBondContact O-N 3.12Å; F214-R217 VanDerWaalsContact O-N 3.1Å; S215-R217 PolarHBondContact O-N 2.8Å
218L65.8Low56Low82 Ų82125.6 Ų125.643%0.42964%0.644SS.*Hα-helixtrans-95.5-18.6179.8-67.9-177.8000113.2F214 S215 L220F214-L218 HydrophobicContact CD1-CD1 4.12Å; F214-L218 HydrophobicContact CE1-CD1 3.58Å; F214-L218 HydrophobicContact CE1-CG 4.09Å; F214-L218 HydrophobicContact CZ-CD1 4.3Å; F214-L218 HydrophobicContact CZ-CG 4.47Å; S215-L218 PolarHBondContact O-N 2.65Å; S215-L218 VanDerWaalsContact O-N 3.12Å; L218-L220 PolarHBondContact O-N 2.96Å
219V61.8Low56.9Low115 Ų115125.7 Ų125.770%0.69763%0.63SS**  trans-77.6119.3173.8-1760000108S215S215-V219 PolarHBondContact O-N 2.69Å
220L49.3Very low57.4Low222 Ų222116.3 Ų116.3100%1.16261%0.609SS**  trans-70.50173.4-75.9165.7000111.1L218L218-L220 PolarHBondContact O-N 2.96Å

Retrieved 220 of 220 residues in 41.5 ms (Link to these results)