X5DP92_HUMAN Loading...

Benzodiazapine receptor peripheral-associated protein 1 isoform G

AlphaFold DB , UniProt , Accession X5DP92, Species HUMAN (Homo sapiens, Human), Gene BZRAP1, Length 719 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.1Very low37.9Very low215 Ų215150.5 Ų150.5100%1.05982%0.815SS**  074.70-56.5-163.9-78.700108.6
2E39.2Very low38Very low160 Ų160151.9 Ų151.975%0.74882%0.822SS**  cis65.713645-59.4162.4109.100112.8
3Q42.5Very low38.7Very low156 Ų156149.5 Ų149.573%0.72982%0.819SS**  cis-145.5126.7-11.5-98.2158.447.100105.2
4L44.5Very low38.5Very low156 Ų156145 Ų14582%0.81782%0.824SS**  65.8124.888.1-93.6178.4000117.4
5T36Very low38.2Very low113 Ų113141.5 Ų141.569%0.69382%0.82SS**  trans89.8121146110000124.4
6T31.3Very low37.8Very low132 Ų132144.6 Ų144.681%0.8183%0.827SS**  trans71.9132.1137.8350000125.1
7L37.2Very low37.7Very low163 Ų163146 Ų14685%0.85383%0.825SS**  trans-70.7159.6152.2-65.9161.2000110.9
8P40.5Very low37.8Very low123 Ų123144.7 Ų144.780%0.79982%0.824SS**  -144.4173.599.239.3-25.9000115.1
9R37.1Very low37.8Very low243 Ų243150.7 Ų150.792%0.91783%0.832SS**  trans-111.5130.9169.7179.1-169.9-177.5-163.71.5109.5
10P41.5Very low37.4Very low121 Ų121147.3 Ų147.379%0.78682%0.824SS**  trans-145.8170.9136.438.4-24.1000114.2
11G30.4Very low37.5Very low73 Ų73146.8 Ų146.875%0.75382%0.819SS**  trans114.6118.2154.800000117.3
12D38.6Very low37.7Very low168 Ų168142.8 Ų142.890%0.89881%0.809SS**  trans-82.8145.5155-77.3-58.3000110.3
13P46.8Very low37.6Very low121 Ų121139.2 Ų139.279%0.78680%0.798SS**  trans-116.982.8163.436-24.6000111.5A15P13-A15 VanDerWaalsContact C-N 3.31Å; P13-A15 PolarHBondContact O-N 3.13Å; P13-A15 VanDerWaalsContact O-N 3.07Å
14G35.8Very low37Very low86 Ų86143.3 Ų143.389%0.88781%0.807SS**  trans-79.967.2171.600000113.3
15A34.8Very low36.3Very low92 Ų92142.4 Ų142.476%0.7680%0.799SS**  trans-165.7110.5167.900000113.4P13P13-A15 VanDerWaalsContact C-N 3.31Å; P13-A15 PolarHBondContact O-N 3.13Å; P13-A15 VanDerWaalsContact O-N 3.07Å
16M31.7Very low35.8Very low192 Ų192142.5 Ų142.595%0.94680%0.804SS**  trans-154.9141.1152.9-166.3162.2-76.900109.7
17E36.7Very low35.5Very low168 Ų168147.9 Ų147.979%0.78581%0.809SS**PPolyproline II helixtrans-81.3148.3-165.1-60.2-174.9125.900114.7
18P39.6Very low35.7Very low123 Ų123146.1 Ų146.180%0.79981%0.806SS**PPolyproline II helixtrans-78.2123.6165.132.1-31.5000111
19W36.2Very low36.1Very low258 Ų258146.6 Ų146.698%0.97781%0.809SS**PPolyproline II helixtrans-66146.7172.7-82.957.3000111.9
20A31.2Very low35.6Very low82 Ų82138.2 Ų138.268%0.67880%0.798SS**PPolyproline II helixtrans-96.6132.1-159.100000115.6
21L39.8Very low35.3Very low137 Ų137144.5 Ų144.572%0.71781%0.806SS**  trans61.5154.9135.4-58.8167.7000118.6T23L21-T23 HydrophobicContact CD1-CG2 3.96Å; L21-T23 HydrophobicContact CD2-CG2 3.9Å; L21-T23 HydrophobicContact CG-CG2 4.37Å
22P40.4Very low35.2Very low131 Ų131144.9 Ų144.985%0.85181%0.81SS**  -117.7153.177.6-5.226.5000115.3
23T36.6Very low34.6Very low85 Ų85140.7 Ų140.752%0.52181%0.806SS.*  trans-92.2149.4176.950.30000113.3L21L21-T23 HydrophobicContact CD1-CG2 3.96Å; L21-T23 HydrophobicContact CD2-CG2 3.9Å; L21-T23 HydrophobicContact CG-CG2 4.37Å
24W30Very low34.1Very low243 Ų243143.9 Ų143.992%0.9281%0.81SS**  trans-133.196.8149.7-89.380.1000111.5
25H30.1Very low34.6Very low137 Ų137145.3 Ų145.363%0.63480%0.804SS**  trans21.6122.1155.6-49.2-67.5000121.7
26S25.9Very low34.2Very low115 Ų115146.2 Ų146.280%0.80481%0.805SS**  trans-113.9142.8140.158.30000109.2
27W25.4Very low34.3Very low244 Ų244142.5 Ų142.592%0.92480%0.798SS**  trans-111.7143.2173.2-100.734.6000110.2
28T40.8Very low33.9Very low127 Ų127139.5 Ų139.578%0.77980%0.802SS**  trans-127.9155.6168.657.90000108.9
29P48.6Very low33.5Very low133 Ų133138.1 Ų138.186%0.86480%0.801SS**  -145172.9105.936.6-21.2000112.6
30G26.9Very low33.8Very low67 Ų67131.6 Ų131.669%0.69179%0.792SS**  cis-162.8141.9-600000108.5
31R34.4Very low33.7Very low253 Ų253133.2 Ų133.296%0.95580%0.798SS**  59.8116.793.5-176.1179.9-75.1-88.23.8115.7
32G28.1Very low33.3Very low81 Ų81133.9 Ų133.984%0.83580%0.801SS**  trans114.7120.416000000113.8
33G27.8Very low32.7Very low79 Ų79131.3 Ų131.381%0.81479%0.79SS**  cis-173.7153.2-7.900000111.7
34E36Very low32.4Very low188 Ų188134.5 Ų134.588%0.87981%0.805SS**  trans-86.7164.6166.3-106.3-170.1-176.500109.9
35P45Very low32.4Very low116 Ų116128.7 Ų128.775%0.75380%0.796SS**  cis-147.1-176.83943-23.2000118.3
36S27.5Very low33.3Very low112 Ų112127.5 Ų127.578%0.78380%0.801SS**  trans116.2144.9138.5-153.90000117
37S33.3Very low34.5Very low113 Ų113127.6 Ų127.679%0.7980%0.798SS**  trans-99.4127.7-173.856.70000112.4
38A28Very low34.6Very low106 Ų106121 Ų12188%0.87680%0.796SS**  trans-154.7133.1156.400000111.9
39A32Very low34Very low94 Ų94119.8 Ų119.878%0.77780%0.798SS**  trans-118.7148.2149.900000105.1
40P42Very low33.2Very low120 Ų120121.8 Ų121.878%0.77980%0.801SS**  -136.9-177.357.539.1-22.2000114.9
41S28.4Very low33.4Very low117 Ų117127.3 Ų127.382%0.81881%0.809SS**  trans-114.9144.5167.5-177.70000109.8
42I32.3Very low32.9Very low151 Ų151123.8 Ų123.877%0.77481%0.808SS**  trans-130.8162.1178.5-67.4-179.8000108.6
43A28.3Very low32.8Very low76 Ų76127.3 Ų127.363%0.62880%0.803SS**  trans-45.5166.3-178.100000115.8
44D30.1Very low32.8Very low153 Ų153130.7 Ų130.782%0.81880%0.797SS**  cis-153.817141.6-113.4-55.7000117.5
45T30.1Very low32.4Very low121 Ų121130.3 Ų130.374%0.74280%0.801SS**  trans-97.4-173-178.120.60000113
46P49.4Very low31.4Very low112 Ų112135.1 Ų135.173%0.72780%0.804SS**  cis-130.2-124.7-39.237.4-16.8000108.8
47P50.7Low31.5Very low117 Ų117133.8 Ų133.876%0.7679%0.794SS**  cis-124.9164.3-46.436.7-21.8000114.8
48A26.8Very low31.1Very low106 Ų106136.4 Ų136.488%0.87679%0.794SS**  trans-158.9134.9142.200000109.8
49A29Very low31Very low100 Ų100139.3 Ų139.383%0.82679%0.789SS**  trans-141.5139.317800000111.1
50L31.7Very low30.6Very low176 Ų176139.3 Ų139.392%0.92178%0.784SS**  trans-141.5153.3153.7-88.5-175.8000109.8
51Q30.1Very low30Very low182 Ų182139 Ų13985%0.8578%0.784SS**  trans-92.4159.1-170.4-59.3151.3-2900111.1
52L24.9Very low30.1Very low179 Ų179142.9 Ų142.994%0.93779%0.786SS**  trans-157.1171.2130.7-113.4169.6000111.4
53Q26.2Very low30.8Very low155 Ų155140.7 Ų140.772%0.72478%0.782SS**  trans-117.5170.1-151.7-172.7169.6-13.300112.9
54E27.3Very low30.7Very low151 Ų151147 Ų14771%0.70680%0.795SS**  trans-23.1147171.9-57.516299.100118.1
55L27.2Very low30.5Very low180 Ų180142.5 Ų142.594%0.94279%0.785SS**  -159.8170.2114.5-105.8167.4000111.8
56R25.2Very low30.2Very low217 Ų217145.2 Ų145.282%0.81980%0.795SS**  trans-131.7157.7-170.7-168.2-150-77.1-163.1-3.2109.8
57S28Very low29.1Very low83 Ų83143.2 Ų143.258%0.5879%0.794SS**  trans72.5153.3161.4-71.80000115.5
58E26.3Very low28.1Very low169 Ų169143.2 Ų143.279%0.7980%0.798SS**  cis-158.8-173.2-13.6-123163.3105.200111.5
59E24.1Very low28.2Very low167 Ų167144.1 Ų144.178%0.7880%0.797SS**  trans80.9144150.8-99.1-146.188.600123.7
60S24.3Very low28.2Very low94 Ų94149.6 Ų149.666%0.65780%0.797SS**  trans37138.2136.1-83.40000121.4
61S29.4Very low28.6Very low112 Ų112146.8 Ų146.878%0.78379%0.789SS**  cis-171.3177.321.951.60000113.5
62K30.1Very low28.6Very low199 Ų199143.3 Ų143.387%0.86578%0.78SS**  trans-119.4156.1154.4-112.1177.2179.2171.80106.2
63P48.2Very low28.7Very low106 Ų106138.5 Ų138.569%0.68877%0.774SS**  -156.5-168.554.542.7-21.1000116.9
64K25.3Very low28.8Very low207 Ų207134.6 Ų134.690%0.978%0.775SS**  trans67.7156166.2-63.8177.9179.2-1790116.5
65G25.6Very low28.9Very low59 Ų59134.1 Ų134.161%0.60878%0.783SS**  cis169.3147-10.900000112.7
66D24.3Very low29.3Very low179 Ų179132.9 Ų132.996%0.95778%0.777SS**  trans60.1144.9169.1-49.7-37.8000118.2
67G26.5Very low29.9Very low69 Ų69128.8 Ų128.871%0.71178%0.779SS**  cis177.3157.4-10.600000114.4
68S28.6Very low29.9Very low118 Ų118134.3 Ų134.383%0.82580%0.795SS**  trans54.6121.2157.3179.90000121.4
69S29.9Very low30Very low125 Ų125129.5 Ų129.587%0.87479%0.791SS**  -153161.5127.6-90.10000113.2
70R30Very low30.1Very low214 Ų214126.1 Ų126.181%0.80879%0.792SS**  trans-84.5178.9-173.8-121.5-178.9174.8178.8-7111.3V72R70-V72 HydrophobicContact CG-CG2 4.26Å; R70-V72 VanDerWaalsContact NE-CG2 3.31Å
71P39.5Very low30.2Very low117 Ų117130.4 Ų130.476%0.7680%0.802SS**  cis-126.8-178.136.247.9-32.9000112.4
72V30.7Very low30.1Very low109 Ų109129.8 Ų129.866%0.66180%0.803SS**  cis71.9126.526.1177.30000115.2R70R70-V72 HydrophobicContact CG-CG2 4.26Å; R70-V72 VanDerWaalsContact NE-CG2 3.31Å
73G25.4Very low29.8Very low79 Ų79125.6 Ų125.681%0.81480%0.798SS**  trans134.4111.4-178.300000110
74G29.4Very low28.9Very low73 Ų73128.4 Ų128.475%0.75381%0.806SS**  trans-141139.2174.500000109.2
75T29.2Very low29.3Very low141 Ų141124.3 Ų124.387%0.86580%0.801SS**  trans-155.5145.4174.814.10000108.6
76D35.5Very low29.5Very low154 Ų154127.2 Ų127.282%0.82481%0.811SS**  trans-76175.1175.6-50.8-89.4000111.9
77P38.3Very low29.8Very low131 Ų131127.3 Ų127.385%0.85181%0.811SS**  trans-130.99914734.8-21.8000112.9
78E28Very low29.8Very low198 Ų198127.3 Ų127.393%0.92581%0.811SS**  trans-90.1146.4139-171.8173.9-127.100106.4
79G27.2Very low30Very low69 Ų69130.5 Ų130.571%0.71181%0.813SS**  cis178.8140.4-8.600000109.8
80A26.6Very low29.9Very low96 Ų96133.1 Ų133.179%0.79381%0.812SS**  trans-164.9100.4169.500000107.9
81E26.8Very low29.6Very low184 Ų184127.4 Ų127.486%0.8681%0.81SS**  70.290.684.8-69.8-145.6136.500115
82A26Very low29.1Very low99 Ų99126.9 Ų126.982%0.81881%0.81SS**  trans-143.910514900000107.4
83C25.5Very low29Very low110 Ų110127.3 Ų127.374%0.74382%0.817SS**  trans-74.6134.3-166.6-630000113.7
84L28.5Very low29.2Very low166 Ų166129.6 Ų129.687%0.86982%0.821SS**  trans-117.7110.8160.1-72.1176.8000108.9
85P33Very low29.1Very low121 Ų121129.5 Ų129.579%0.78682%0.82SS**  trans-72.3138.8178.328.9-33.2000111.2
86S31.3Very low29.5Very low119 Ų119128.9 Ų128.983%0.83282%0.818SS**  trans-139.581.5170.1-78.20000110
87L29.3Very low29Very low181 Ų181125.5 Ų125.595%0.94881%0.812SS**  trans-149.4140.7174-14380000106.9
88G26.4Very low28.5Very low70 Ų70125.8 Ų125.872%0.72282%0.815SS**  cis-154.9-179.5-7.800000109.5
89Q33.1Very low28.8Very low184 Ų184124.9 Ų124.986%0.8681%0.811SS**  trans-94.8161.5179.1-64.6-177.2-12.100112.6
90Q27.5Very low28.9Very low180 Ų180131 Ų13184%0.84181%0.812SS**  trans81.5100.6161-50.8-172.18.200119.6
91A24.2Very low29.9Very low95 Ų95131.1 Ų131.179%0.78581%0.806SS**  -158.6114.8121.400000106.7
92S28.3Very low30.6Very low106 Ų106127.5 Ų127.574%0.74179%0.789SS**  88.892.368.5-670000113.9
93S30.3Very low31.3Very low117 Ų117129.4 Ų129.482%0.81879%0.785SS**  trans44.6103.3141.660.70000121.2
94S27.8Very low32.2Very low127 Ų127132.2 Ų132.289%0.88879%0.787SS**  -157.7159.1126.954.60000110.1
95G29.1Very low32.9Very low71 Ų71131.4 Ų131.473%0.73278%0.779SS**  trans-93.7-158.8-177.900000113.4
96P36.3Very low33.5Very low129 Ų129129.2 Ų129.284%0.83876%0.763SS**  cis-119.8-170.51041.6-28.8000114.3
97A26.6Very low34.3Very low83 Ų83128.4 Ų128.469%0.68675%0.746SS**  trans-67151.6179.500000113.5Q99A97-Q99 VanDerWaalsContact C-N 3.28Å; A97-Q99 PolarHBondContact O-N 3.47Å
98C27.7Very low35.1Very low137 Ų137122.8 Ų122.893%0.92673%0.726SS**  trans-66.687.3162-580000109.8R100C98-R100 PolarHBondContact O-N 3.27Å
99Q32.8Very low36Very low178 Ų178127.8 Ų127.883%0.83273%0.728SS**  trans-63.7128.4162.6-67.9-179.3-7.900108.1A97 P101A97-Q99 VanDerWaalsContact C-N 3.28Å; A97-Q99 PolarHBondContact O-N 3.47Å; Q99-P101 WeakPolarHBondContact O-CD 3.42Å
100R29.9Very low36.9Very low197 Ų197123.4 Ų123.474%0.74371%0.71SS**  trans-111.393.3173.5-178.2-177.7-179.5165.33.4107.8C98 E102C98-R100 PolarHBondContact O-N 3.27Å; R100-E102 VanDerWaalsContact C-N 3.3Å; R100-E102 HydrophobicContact CG-CB 4.42Å; R100-E102 HydrophobicContact CG-CG 4.28Å; R100-E102 IonicContact CZ-OE2 3.19Å; R100-E102 IonicContact NE-OE2 2.75Å; R100-E102 PolarHBondContact NE-OE2 3.27Å; R100-E102 IonicContact NH2-OE2 3.73Å; R100-E102 PolarHBondContact NH2-OE2 2.8Å; R100-E102 PolarHBondContact O-N 3.01Å
101P46.6Very low37.8Very low100 Ų100122.4 Ų122.465%0.64970%0.703SS**THydrogen-bonded Turntrans-80.876.1-177.133.7-34.8000110.2Q99Q99-P101 WeakPolarHBondContact O-CD 3.42Å
102E41.5Very low38.9Very low108 Ų108121.9 Ų121.951%0.50570%0.699SS.*THydrogen-bonded Turntrans-131.3-12.4177.9-70-172.9150.800114.4R100 V106R100-E102 VanDerWaalsContact C-N 3.3Å; R100-E102 HydrophobicContact CG-CB 4.42Å; R100-E102 HydrophobicContact CG-CG 4.28Å; R100-E102 IonicContact CZ-OE2 3.19Å; R100-E102 IonicContact NE-OE2 2.75Å; R100-E102 PolarHBondContact NE-OE2 3.27Å; R100-E102 IonicContact NH2-OE2 3.73Å; R100-E102 PolarHBondContact NH2-OE2 2.8Å; R100-E102 PolarHBondContact O-N 3.01Å; E102-V106 WeakPolarHBondContact O-CG2 3.32Å
103D41.2Very low39.9Very low139 Ų139125.5 Ų125.574%0.74370%0.701SS**SBendtrans-93.2-25.3176.9-73.2-54000113.2
104E44.3Very low40.7Very low169 Ų169126.6 Ų126.679%0.7970%0.697SS**Hα-helixtrans-85.6-38.9-177.3-69.5-168.5142.900114.3V106 E107 A108E104-V106 PolarHBondContact O-N 3.27Å; E104-E107 PolarHBondContact O-N 3.46Å; E104-A108 PolarHBondContact O-N 2.84Å; E104-A108 VanDerWaalsContact O-N 3.09Å
105E44.7Very low41.9Very low149 Ų149127.9 Ų127.970%0.69669%0.694SS**Hα-helixtrans-63.3-33177.3-69.2-164.2133.500111.9A108 F109E105-A108 PolarHBondContact O-N 2.74Å; E105-F109 WeakPolarHBondContact O-CB 3.34Å; E105-F109 PolarHBondContact O-N 3.44Å
106V45.6Very low42.6Very low75 Ų75132.9 Ų132.946%0.45570%0.7SS.*Hα-helixtrans-72.7-31.4179.3-176.80000112.1E102 E104 L110E102-V106 WeakPolarHBondContact O-CG2 3.32Å; E104-V106 PolarHBondContact O-N 3.27Å; V106-L110 WeakPolarHBondContact O-CD1 3.37Å; V106-L110 WeakPolarHBondContact O-CG 3.42Å
107E46.8Very low43.2Very low102 Ų102131.2 Ų131.248%0.47769%0.692SS.*Hα-helixtrans-66.2-48.2168.1-94.2-74.1138.800110.9E104 F109 L110 K111E104-E107 PolarHBondContact O-N 3.46Å; E107-F109 PolarHBondContact O-N 3.43Å; E107-L110 PolarHBondContact O-N 2.9Å; E107-K111 PolarHBondContact O-N 2.97Å
108A46.1Very low44.3Very low63 Ų63137 Ų13752%0.52170%0.702SS.*Hα-helixtrans-60.1-43.8-179.200000112.6E104 E105 L110 K111 A112E104-A108 PolarHBondContact O-N 2.84Å; E104-A108 VanDerWaalsContact O-N 3.09Å; E105-A108 PolarHBondContact O-N 2.74Å; A108-L110 VanDerWaalsContact C-N 3.33Å; A108-L110 PolarHBondContact O-N 2.94Å; A108-K111 PolarHBondContact O-N 3.09Å; A108-A112 PolarHBondContact O-N 3.32Å
109F45.5Very low45.7Very low174 Ų174132.5 Ų132.576%0.76368%0.679SS**Hα-helixtrans-66.4-32.4-177.5-143.9-87.2000113.3E105 E107E105-F109 WeakPolarHBondContact O-CB 3.34Å; E105-F109 PolarHBondContact O-N 3.44Å; E107-F109 PolarHBondContact O-N 3.43Å
110L51.8Low46.8Very low92 Ų92128.7 Ų128.748%0.48266%0.664SS.*Hα-helixtrans-74.3-37.2175.5-71.7170.9000111.8V106 E107 A108 A112 K113V106-L110 WeakPolarHBondContact O-CD1 3.37Å; V106-L110 WeakPolarHBondContact O-CG 3.42Å; E107-L110 PolarHBondContact O-N 2.9Å; A108-L110 VanDerWaalsContact C-N 3.33Å; A108-L110 PolarHBondContact O-N 2.94Å; L110-A112 VanDerWaalsContact C-N 3.31Å; L110-A112 PolarHBondContact O-N 2.96Å; L110-K113 PolarHBondContact O-N 3.45Å
111K47.6Very low48Very low159 Ų159128.7 Ų128.769%0.69166%0.664SS**Hα-helixtrans-67.3-30.4-177.7-143.4164.5-166.4159.50113.2E107 A108 K113E107-K111 PolarHBondContact O-N 2.97Å; A108-K111 PolarHBondContact O-N 3.09Å; K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 3.01Å
112A47Very low48.6Very low84 Ų84128.2 Ų128.269%0.69466%0.661SS**THydrogen-bonded Turntrans-71.7-16.4178.200000114.4A108 L110A108-A112 PolarHBondContact O-N 3.32Å; L110-A112 VanDerWaalsContact C-N 3.31Å; L110-A112 PolarHBondContact O-N 2.96Å
113K48.2Very low49.6Very low183 Ų183127.2 Ų127.280%0.79666%0.659SS**THydrogen-bonded Turntrans-109.823.6-170.1-149.5174.4-179.4177.40114.9L110 K111L110-K113 PolarHBondContact O-N 3.45Å; K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 3.01Å
114L48.8Very low51.3Low139 Ų139125.4 Ų125.473%0.72865%0.649SS**  trans-96.37.3173.7-84.2166.8000114.4
115N51.6Low53.1Low154 Ų154122.6 Ų122.682%0.82464%0.636SS**  trans-10958.3176.3-73.6-17.5000112.3
116M44.7Very low54.9Low176 Ų176120.9 Ų120.987%0.86763%0.631SS**SBendtrans-155.1148.5150.5-96.8-46.3-179.800111.6
117S47.4Very low56.7Low94 Ų94121.9 Ų121.966%0.65763%0.633SS**  trans-83.9147.8-161.3500000117
118F49.7Very low58.7Low204 Ų204124.3 Ų124.390%0.89564%0.638SS**SBendtrans73.182.9149.1-85.5-122.7000117.9D120F118-D120 WeakPolarHBondContact CA-OD2 3.46Å; F118-D120 PolarHBondContact N-OD2 2.88Å
119G57.4Low60.7Low44 Ų44123.7 Ų123.745%0.45463%0.633SS.*  trans-165.716.2163.600000115.5R121G119-R121 PolarHBondContact O-N 3.29Å; G119-R121 VanDerWaalsContact O-N 3.17Å
120D56.9Low62.7Low97 Ų97119.4 Ų119.452%0.51962%0.618SS.*THydrogen-bonded Turntrans-100.134.3-134.4-51.9-65.5000116.9F118 L124F118-D120 WeakPolarHBondContact CA-OD2 3.46Å; F118-D120 PolarHBondContact N-OD2 2.88Å; D120-L124 WeakPolarHBondContact O-CB 3.47Å
121R54.8Low64.5Low198 Ų198116.8 Ų116.875%0.74761%0.612SS**THydrogen-bonded Turntrans-94.4-62170.7-145.1179.2-166.6-168.14.4113.4G119 N123 L124 E125G119-R121 PolarHBondContact O-N 3.29Å; G119-R121 VanDerWaalsContact O-N 3.17Å; R121-N123 VanDerWaalsContact C-N 3.29Å; R121-N123 PolarHBondContact O-N 2.78Å; R121-L124 PolarHBondContact O-N 3.46Å; R121-L124 VanDerWaalsContact O-N 3.16Å; R121-E125 PolarHBondContact O-N 3.1Å; R121-E125 VanDerWaalsContact O-N 3.17Å
122P59.9Low66.7Low90 Ų90112.8 Ų112.858%0.58460%0.596SS**Hα-helixtrans-63.1-34.817826-35000112.5L124 E125 L126P122-L124 VanDerWaalsContact C-N 3.35Å; P122-L124 PolarHBondContact O-N 3.41Å; P122-E125 PolarHBondContact O-N 2.89Å; P122-L126 WeakPolarHBondContact O-CB 3.28Å; P122-L126 PolarHBondContact O-N 3.05Å
123N61.4Low68.8Low87 Ų87113.4 Ų113.447%0.46559%0.587SS.*Hα-helixtrans-61.7-40.5174.9-75.6-20.3000112.3R121 L126 L127R121-N123 VanDerWaalsContact C-N 3.29Å; R121-N123 PolarHBondContact O-N 2.78Å; N123-L126 PolarHBondContact O-N 3.11Å; N123-L127 WeakPolarHBondContact O-CB 3.49Å; N123-L127 VanDerWaalsContact O-CG 3.25Å; N123-L127 WeakPolarHBondContact O-CG 3.41Å; N123-L127 PolarHBondContact O-N 2.88Å
124L77.4Confident71Confident100 Ų100111.1 Ų111.152%0.52457%0.574SS.*Hα-helixtrans-72.1-33.9-178.9-164.274000112D120 R121 P122 R128D120-L124 WeakPolarHBondContact O-CB 3.47Å; R121-L124 PolarHBondContact O-N 3.46Å; R121-L124 VanDerWaalsContact O-N 3.16Å; P122-L124 VanDerWaalsContact C-N 3.35Å; P122-L124 PolarHBondContact O-N 3.41Å; L124-R128 WeakPolarHBondContact O-CB 3.18Å; L124-R128 PolarHBondContact O-N 3.11Å
125E80.7Confident73.2Confident111 Ų111110.7 Ų110.752%0.51957%0.568SS.*Hα-helixtrans-70.5-40.2173.1-71.3169.5-16600111.5R121 P122 R128 A129R121-E125 PolarHBondContact O-N 3.1Å; R121-E125 VanDerWaalsContact O-N 3.17Å; P122-E125 PolarHBondContact O-N 2.89Å; E125-R128 WeakPolarHBondContact O-CB 3.38Å; E125-R128 PolarHBondContact O-N 2.77Å; E125-A129 WeakPolarHBondContact O-CB 3.49Å; E125-A129 PolarHBondContact O-N 3.2Å
126L82.6Confident75.2Confident112 Ų112109.9 Ų109.959%0.58655%0.553SS**Hα-helixtrans-64.5-42.9174.1-16477000112.1P122 N123 R128 A129 L130P122-L126 WeakPolarHBondContact O-CB 3.28Å; P122-L126 PolarHBondContact O-N 3.05Å; N123-L126 PolarHBondContact O-N 3.11Å; L126-R128 VanDerWaalsContact C-N 3.32Å; L126-R128 PolarHBondContact O-N 2.8Å; L126-A129 PolarHBondContact O-N 2.82Å; L126-L130 WeakPolarHBondContact O-CB 3.19Å; L126-L130 WeakPolarHBondContact O-CG 3.38Å; L126-L130 PolarHBondContact O-N 3.09Å
127L84.1Confident77.4Confident96 Ų96104.1 Ų104.150%0.50353%0.53SS..Hα-helixtrans-62.9-38.1174.3-74.6168.8000111.9N123 L130 G131N123-L127 WeakPolarHBondContact O-CB 3.49Å; N123-L127 VanDerWaalsContact O-CG 3.25Å; N123-L127 WeakPolarHBondContact O-CG 3.41Å; N123-L127 PolarHBondContact O-N 2.88Å; L127-L130 PolarHBondContact O-N 3.26Å; L127-G131 PolarHBondContact O-N 3.3Å
128R88.3Confident79.6Confident153 Ų153101.8 Ų101.858%0.57752%0.516SS*.Hα-helixtrans-64.7-46.3173.5-169.7-177.7-55.8174.45.7111.7L124 E125 L126 L130 G131 E132L124-R128 WeakPolarHBondContact O-CB 3.18Å; L124-R128 PolarHBondContact O-N 3.11Å; E125-R128 WeakPolarHBondContact O-CB 3.38Å; E125-R128 PolarHBondContact O-N 2.77Å; L126-R128 VanDerWaalsContact C-N 3.32Å; L126-R128 PolarHBondContact O-N 2.8Å; R128-L130 VanDerWaalsContact C-N 3.32Å; R128-L130 PolarHBondContact O-N 3.08Å; R128-G131 WeakPolarHBondContact O-CA 3.46Å; R128-G131 PolarHBondContact O-N 3.2Å; R128-G131 VanDerWaalsContact O-N 3.11Å; R128-E132 PolarHBondContact O-N 3.47Å
129A87.8Confident81.7Confident50 Ų5096 Ų9641%0.41349%0.494SS..Hα-helixtrans-61.9-37.9176.700000112.3E125 L126 L133E125-A129 WeakPolarHBondContact O-CB 3.49Å; E125-A129 PolarHBondContact O-N 3.2Å; L126-A129 PolarHBondContact O-N 2.82Å; A129-L133 VanDerWaalsContact O-CB 3.27Å; A129-L133 WeakPolarHBondContact O-CB 3.29Å; A129-L133 PolarHBondContact O-N 3.25Å
130L88.6Confident83.3Confident85 Ų8598.3 Ų98.345%0.44550%0.496SS..Hα-helixtrans-65.8-39.1171.9-75.7167.7000112.3L126 L127 R128 L133 R134L126-L130 WeakPolarHBondContact O-CB 3.19Å; L126-L130 WeakPolarHBondContact O-CG 3.38Å; L126-L130 PolarHBondContact O-N 3.09Å; L127-L130 PolarHBondContact O-N 3.26Å; R128-L130 VanDerWaalsContact C-N 3.32Å; R128-L130 PolarHBondContact O-N 3.08Å; L130-L133 PolarHBondContact O-N 2.8Å; L130-R134 WeakPolarHBondContact O-CB 3.37Å; L130-R134 VanDerWaalsContact O-CG 3.28Å; L130-R134 WeakPolarHBondContact O-CG 3.32Å; L130-R134 PolarHBondContact O-N 3.21Å
131G89.6Confident85Confident36 Ų36101.1 Ų101.137%0.37150%0.503SS..Hα-helixtrans-61.4-50.3172.400000112.4L127 R128 L133 R134 Q135L127-G131 PolarHBondContact O-N 3.3Å; R128-G131 WeakPolarHBondContact O-CA 3.46Å; R128-G131 PolarHBondContact O-N 3.2Å; R128-G131 VanDerWaalsContact O-N 3.11Å; G131-L133 VanDerWaalsContact C-N 3.34Å; G131-L133 PolarHBondContact O-N 3.29Å; G131-R134 PolarHBondContact O-N 3.33Å; G131-Q135 WeakPolarHBondContact O-CB 3.1Å; G131-Q135 PolarHBondContact O-N 3.03Å
132E93.1Very high86.8Confident75 Ų7598.2 Ų98.235%0.3550%0.498SS..Hα-helixtrans-60.6-40.4175-71.5-179.7-147.900112.4R128 Q135 R136R128-E132 PolarHBondContact O-N 3.47Å; E132-Q135 PolarHBondContact O-N 3.43Å; E132-R136 WeakPolarHBondContact O-CB 3.06Å; E132-R136 VanDerWaalsContact O-CG 3.26Å; E132-R136 WeakPolarHBondContact O-CG 3.4Å; E132-R136 PolarHBondContact O-N 2.99Å; E132-R136 IonicContact OE2-CZ 3.69Å; E132-R136 VanDerWaalsContact OE2-CZ 3.24Å; E132-R136 IonicContact OE2-NH1 2.74Å; E132-R136 PolarHBondContact OE2-NH1 2.83Å; E132-R136 IonicContact OE2-NH2 3.82Å; E132-R136 PolarHBondContact OE2-NH2 3.05Å
133L92.4Very high88.1Confident98 Ų9898.7 Ų98.751%0.51349%0.492SS..Hα-helixtrans-66.8-44.3177.5-176.460.9000111.3A129 L130 G131 Q135 R136 C137A129-L133 VanDerWaalsContact O-CB 3.27Å; A129-L133 WeakPolarHBondContact O-CB 3.29Å; A129-L133 PolarHBondContact O-N 3.25Å; L130-L133 PolarHBondContact O-N 2.8Å; G131-L133 VanDerWaalsContact C-N 3.34Å; G131-L133 PolarHBondContact O-N 3.29Å; L133-Q135 VanDerWaalsContact C-N 3.3Å; L133-Q135 PolarHBondContact O-N 3.25Å; L133-R136 PolarHBondContact O-N 2.72Å; L133-C137 WeakPolarHBondContact O-CB 3.27Å; L133-C137 PolarHBondContact O-N 3.39Å; L133-C137 PolarHBondContact O-SG 3.08Å
134R93.8Very high89.3Confident135 Ų13598.1 Ų98.151%0.50949%0.489SS..Hα-helixtrans-57.3-43.2172.4-76.8174.4175-167.9-2.1111.1L130 G131 C137 A138L130-R134 WeakPolarHBondContact O-CB 3.37Å; L130-R134 VanDerWaalsContact O-CG 3.28Å; L130-R134 WeakPolarHBondContact O-CG 3.32Å; L130-R134 PolarHBondContact O-N 3.21Å; G131-R134 PolarHBondContact O-N 3.33Å; R134-C137 PolarHBondContact O-N 2.87Å; R134-A138 PolarHBondContact O-N 3.4Å
135Q94.1Very high89.7Confident129 Ų12998.7 Ų98.760%0.60349%0.489SS*.Hα-helixtrans-67.5-44178.2-166.1174.916.900112.4G131 E132 L133 C137 A138 I139G131-Q135 WeakPolarHBondContact O-CB 3.1Å; G131-Q135 PolarHBondContact O-N 3.03Å; E132-Q135 PolarHBondContact O-N 3.43Å; L133-Q135 VanDerWaalsContact C-N 3.3Å; L133-Q135 PolarHBondContact O-N 3.25Å; Q135-C137 VanDerWaalsContact C-N 3.33Å; Q135-C137 PolarHBondContact O-N 2.79Å; Q135-A138 WeakPolarHBondContact O-CB 3.32Å; Q135-A138 PolarHBondContact O-N 2.79Å; Q135-A138 VanDerWaalsContact O-N 3.16Å; Q135-I139 HydrophobicContact CG-CD1 4.31Å; Q135-I139 WeakPolarHBondContact O-CG1 3.44Å; Q135-I139 PolarHBondContact O-N 3.37Å
136R94.1Very high89.7Confident137 Ų13798.9 Ų98.952%0.51749%0.492SS..Hα-helixtrans-59.6-42.1172.2-73.2170.2-175.9125.313.2111.2E132 L133 A138 I139 L140E132-R136 WeakPolarHBondContact O-CB 3.06Å; E132-R136 VanDerWaalsContact O-CG 3.26Å; E132-R136 WeakPolarHBondContact O-CG 3.4Å; E132-R136 PolarHBondContact O-N 2.99Å; E132-R136 IonicContact OE2-CZ 3.69Å; E132-R136 VanDerWaalsContact OE2-CZ 3.24Å; E132-R136 IonicContact OE2-NH1 2.74Å; E132-R136 PolarHBondContact OE2-NH1 2.83Å; E132-R136 IonicContact OE2-NH2 3.82Å; E132-R136 PolarHBondContact OE2-NH2 3.05Å; L133-R136 PolarHBondContact O-N 2.72Å; R136-A138 PolarHBondContact O-N 2.97Å; R136-I139 PolarHBondContact O-N 3.21Å; R136-L140 WeakPolarHBondContact O-CB 3.43Å; R136-L140 VanDerWaalsContact O-CG 3.26Å; R136-L140 WeakPolarHBondContact O-CG 3.09Å; R136-L140 PolarHBondContact O-N 2.99Å
137C90.8Very high89.4Confident55 Ų5598.7 Ų98.737%0.37249%0.49SS..Hα-helixtrans-66.7-32.4174.8-71.80000113.3L133 R134 Q135 K141L133-C137 WeakPolarHBondContact O-CB 3.27Å; L133-C137 PolarHBondContact O-N 3.39Å; L133-C137 PolarHBondContact O-SG 3.08Å; R134-C137 PolarHBondContact O-N 2.87Å; Q135-C137 VanDerWaalsContact C-N 3.33Å; Q135-C137 PolarHBondContact O-N 2.79Å; C137-K141 WeakPolarHBondContact O-CB 3.5Å; C137-K141 WeakPolarHBondContact O-CD 3.35Å; C137-K141 WeakPolarHBondContact O-CG 3.42Å; C137-K141 PolarHBondContact O-N 3.12Å
138A94.1Very high89Confident46 Ų46102.3 Ų102.338%0.3850%0.497SS..Hα-helixtrans-67-49.7172.600000111.2R134 Q135 R136 L140 K141 E142R134-A138 PolarHBondContact O-N 3.4Å; Q135-A138 WeakPolarHBondContact O-CB 3.32Å; Q135-A138 PolarHBondContact O-N 2.79Å; Q135-A138 VanDerWaalsContact O-N 3.16Å; R136-A138 PolarHBondContact O-N 2.97Å; A138-L140 PolarHBondContact O-N 2.62Å; A138-K141 WeakPolarHBondContact O-CB 3.35Å; A138-K141 PolarHBondContact O-N 2.66Å; A138-K141 VanDerWaalsContact O-N 3.12Å; A138-E142 PolarHBondContact O-N 3.32Å
139I93.2Very high88.4Confident82 Ų82100.9 Ų100.942%0.42150%0.495SS..Hα-helixtrans-57.1-49.5176-65.7163000110.5Q135 R136 K141 E142 E143Q135-I139 HydrophobicContact CG-CD1 4.31Å; Q135-I139 WeakPolarHBondContact O-CG1 3.44Å; Q135-I139 PolarHBondContact O-N 3.37Å; R136-I139 PolarHBondContact O-N 3.21Å; I139-K141 VanDerWaalsContact C-N 3.29Å; I139-K141 PolarHBondContact O-N 3.17Å; I139-E142 PolarHBondContact O-N 3.34Å; I139-E142 VanDerWaalsContact O-N 3.1Å; I139-E143 HydrophobicContact CG2-CG 4.26Å; I139-E143 WeakPolarHBondContact O-CB 3.47Å; I139-E143 WeakPolarHBondContact O-CG 3.26Å; I139-E143 PolarHBondContact O-N 3Å
140L92.8Very high87.4Confident93 Ų93102 Ų10249%0.48750%0.501SS..Hα-helixtrans-63.5-29.7178.3-72.8167.5000113.4R136 A138 N144R136-L140 WeakPolarHBondContact O-CB 3.43Å; R136-L140 VanDerWaalsContact O-CG 3.26Å; R136-L140 WeakPolarHBondContact O-CG 3.09Å; R136-L140 PolarHBondContact O-N 2.99Å; A138-L140 PolarHBondContact O-N 2.62Å; L140-N144 VanDerWaalsContact O-CB 3.28Å; L140-N144 WeakPolarHBondContact O-CB 3.32Å; L140-N144 PolarHBondContact O-N 2.81Å; L140-N144 PolarHBondContact O-ND2 3.15Å
141K92Very high86.1Confident156 Ų156101.1 Ų101.168%0.67850%0.501SS*.Hα-helixtrans-69-44.3171.5-79.3168.4-179.4-179.70111C137 A138 I139 N144 Q145C137-K141 WeakPolarHBondContact O-CB 3.5Å; C137-K141 WeakPolarHBondContact O-CD 3.35Å; C137-K141 WeakPolarHBondContact O-CG 3.42Å; C137-K141 PolarHBondContact O-N 3.12Å; A138-K141 WeakPolarHBondContact O-CB 3.35Å; A138-K141 PolarHBondContact O-N 2.66Å; A138-K141 VanDerWaalsContact O-N 3.12Å; I139-K141 VanDerWaalsContact C-N 3.29Å; I139-K141 PolarHBondContact O-N 3.17Å; K141-N144 PolarHBondContact O-N 2.85Å; K141-Q145 WeakPolarHBondContact O-CB 3.17Å; K141-Q145 PolarHBondContact O-N 3.45Å
142E91.4Very high84.4Confident137 Ų137105.9 Ų105.964%0.6451%0.512SS*.Hα-helixtrans-65.5-46176.9-70.7-176.8177.700111.8A138 I139 N144 Q145 M146A138-E142 PolarHBondContact O-N 3.32Å; I139-E142 PolarHBondContact O-N 3.34Å; I139-E142 VanDerWaalsContact O-N 3.1Å; E142-N144 PolarHBondContact O-N 2.84Å; E142-Q145 CarbonylContact O-C 3.6Å; E142-Q145 WeakPolarHBondContact O-CB 3.43Å; E142-Q145 PolarHBondContact O-N 3.09Å; E142-Q145 VanDerWaalsContact O-N 3.09Å; E142-M146 WeakPolarHBondContact O-CB 3.4Å; E142-M146 WeakPolarHBondContact O-CG 3.47Å; E142-M146 PolarHBondContact O-N 3.25Å
143E88.9Confident83Confident100 Ų100105.2 Ų105.247%0.46751%0.514SS..Hα-helixtrans-58.7-45.4173.5-72.7-179.4161.500111.4I139 Q145 M146 L147I139-E143 HydrophobicContact CG2-CG 4.26Å; I139-E143 WeakPolarHBondContact O-CB 3.47Å; I139-E143 WeakPolarHBondContact O-CG 3.26Å; I139-E143 PolarHBondContact O-N 3Å; E143-Q145 VanDerWaalsContact C-N 3.31Å; E143-Q145 PolarHBondContact O-N 2.87Å; E143-M146 PolarHBondContact O-N 2.98Å; E143-L147 WeakPolarHBondContact O-CB 3.35Å; E143-L147 VanDerWaalsContact O-CG 3.26Å; E143-L147 WeakPolarHBondContact O-CG 3.45Å; E143-L147 PolarHBondContact O-N 3.34Å
144N85.2Confident81.7Confident75 Ų75106.4 Ų106.440%0.40152%0.517SS..Hα-helixtrans-60.2-40.3173-95.6-93.6000112.3L140 K141 E142 R148L140-N144 VanDerWaalsContact O-CB 3.28Å; L140-N144 WeakPolarHBondContact O-CB 3.32Å; L140-N144 PolarHBondContact O-N 2.81Å; L140-N144 PolarHBondContact O-ND2 3.15Å; K141-N144 PolarHBondContact O-N 2.85Å; E142-N144 PolarHBondContact O-N 2.84Å; N144-R148 WeakPolarHBondContact O-CB 3.38Å; N144-R148 VanDerWaalsContact O-CG 3.23Å; N144-R148 WeakPolarHBondContact O-CG 3.01Å; N144-R148 PolarHBondContact O-N 2.68Å
145Q86.3Confident80.7Confident111 Ų111103.1 Ų103.152%0.51951%0.512SS..Hα-helixtrans-67.1-38.5177.6-156.8-166.280.300111.2K141 E142 E143 K149K141-Q145 WeakPolarHBondContact O-CB 3.17Å; K141-Q145 PolarHBondContact O-N 3.45Å; E142-Q145 CarbonylContact O-C 3.6Å; E142-Q145 WeakPolarHBondContact O-CB 3.43Å; E142-Q145 PolarHBondContact O-N 3.09Å; E142-Q145 VanDerWaalsContact O-N 3.09Å; E143-Q145 VanDerWaalsContact C-N 3.31Å; E143-Q145 PolarHBondContact O-N 2.87Å; Q145-K149 WeakPolarHBondContact O-CB 3.48Å; Q145-K149 VanDerWaalsContact O-CG 3.23Å; Q145-K149 WeakPolarHBondContact O-CG 3.42Å; Q145-K149 PolarHBondContact O-N 3.26Å; Q145-K149 VanDerWaalsContact OE1-CE 3.29Å
146M80.8Confident79.9Confident116 Ų116101.5 Ų101.557%0.57150%0.504SS*.Hα-helixtrans-70.7-39.9176.2-71.1-62.7-75.100112.4E142 E143 K149 S150E142-M146 WeakPolarHBondContact O-CB 3.4Å; E142-M146 WeakPolarHBondContact O-CG 3.47Å; E142-M146 PolarHBondContact O-N 3.25Å; E143-M146 PolarHBondContact O-N 2.98Å; M146-K149 CarbonylContact O-C 3.55Å; M146-K149 PolarHBondContact O-N 3.07Å; M146-K149 HydrophobicContact SD-CD 3.97Å; M146-S150 WeakPolarHBondContact O-CB 3.35Å; M146-S150 PolarHBondContact O-N 2.83Å; M146-S150 PolarHBondContact O-OG 2.95Å; M146-S150 VanDerWaalsContact O-OG 3.13Å
147L76.5Confident79.4Confident107 Ų10798.7 Ų98.756%0.5650%0.497SS*.Hα-helixtrans-63.6-38.9172.8-73.2169.3000111.8E143 S150 S151E143-L147 WeakPolarHBondContact O-CB 3.35Å; E143-L147 VanDerWaalsContact O-CG 3.26Å; E143-L147 WeakPolarHBondContact O-CG 3.45Å; E143-L147 PolarHBondContact O-N 3.34Å; L147-S150 WeakPolarHBondContact CA-OG 3.49Å; L147-S150 PolarHBondContact O-N 3.31Å; L147-S150 PolarHBondContact O-OG 3.19Å; L147-S151 VanDerWaalsContact O-CB 3.26Å; L147-S151 WeakPolarHBondContact O-CB 3.45Å; L147-S151 PolarHBondContact O-N 3.4Å; L147-S151 PolarHBondContact O-OG 3.47Å
148R75.4Confident79.2Confident172 Ų172101.1 Ų101.165%0.64950%0.502SS*.Hα-helixtrans-64.7-41.7171.3-71.5169.7-171.1-166.92.3111.5N144 S150 F152N144-R148 WeakPolarHBondContact O-CB 3.38Å; N144-R148 VanDerWaalsContact O-CG 3.23Å; N144-R148 WeakPolarHBondContact O-CG 3.01Å; N144-R148 PolarHBondContact O-N 2.68Å; R148-S150 PolarHBondContact O-N 2.98Å; R148-F152 PolarHBondContact O-N 2.87Å
149K75.1Confident78.9Confident123 Ų123102.2 Ų102.254%0.53550%0.503SS..Hα-helixtrans-67.4-28.3175-72.1166.1-176.21720113.7Q145 M146 P153Q145-K149 WeakPolarHBondContact O-CB 3.48Å; Q145-K149 VanDerWaalsContact O-CG 3.23Å; Q145-K149 WeakPolarHBondContact O-CG 3.42Å; Q145-K149 PolarHBondContact O-N 3.26Å; Q145-K149 VanDerWaalsContact OE1-CE 3.29Å; M146-K149 CarbonylContact O-C 3.55Å; M146-K149 PolarHBondContact O-N 3.07Å; M146-K149 HydrophobicContact SD-CD 3.97Å; K149-P153 WeakPolarHBondContact O-CD 3.35Å
150S66.7Low78.7Confident75 Ų75104 Ų10452%0.52451%0.505SS..Hα-helixtrans-96.9-23.6-176.1690000114.6M146 L147 R148 P153M146-S150 WeakPolarHBondContact O-CB 3.35Å; M146-S150 PolarHBondContact O-N 2.83Å; M146-S150 PolarHBondContact O-OG 2.95Å; M146-S150 VanDerWaalsContact O-OG 3.13Å; L147-S150 WeakPolarHBondContact CA-OG 3.49Å; L147-S150 PolarHBondContact O-N 3.31Å; L147-S150 PolarHBondContact O-OG 3.19Å; R148-S150 PolarHBondContact O-N 2.98Å; S150-P153 VanDerWaalsContact C-CD 3.41Å; S150-P153 WeakPolarHBondContact O-CD 3.42Å
151S61.3Low78.7Confident65 Ų65105.9 Ų105.946%0.45551%0.505SS..Hα-helixtrans-83.3-29.5176.255.90000114L147 P153L147-S151 VanDerWaalsContact O-CB 3.26Å; L147-S151 WeakPolarHBondContact O-CB 3.45Å; L147-S151 PolarHBondContact O-N 3.4Å; L147-S151 PolarHBondContact O-OG 3.47Å; S151-P153 VanDerWaalsContact C-CD 3.42Å
152F54.4Low78.8Confident136 Ų136103.7 Ų103.760%0.59650%0.5SS*.Hα-helixtrans-81-23.4-179.4-89.1-101.6000118.8R148 E154 T155 E156R148-F152 PolarHBondContact O-N 2.87Å; F152-E154 VanDerWaalsContact C-N 3.32Å; F152-E154 PolarHBondContact O-N 3.1Å; F152-T155 PolarHBondContact O-N 2.95Å; F152-T155 PolarHBondContact O-OG1 3.46Å; F152-E156 VanDerWaalsContact O-CB 3.26Å; F152-E156 WeakPolarHBondContact O-CB 3.35Å; F152-E156 PolarHBondContact O-N 3.24Å
153P63.8Low78.9Confident61 Ų61104.4 Ų104.440%0.39650%0.502SS..Hα-helixtrans-69.5-33-172.328.4-31.6000111.4K149 S150 S151 E157K149-P153 WeakPolarHBondContact O-CD 3.35Å; S150-P153 VanDerWaalsContact C-CD 3.41Å; S150-P153 WeakPolarHBondContact O-CD 3.42Å; S151-P153 VanDerWaalsContact C-CD 3.42Å; P153-E157 WeakPolarHBondContact O-CB 3.14Å; P153-E157 WeakPolarHBondContact O-CG 3.44Å; P153-E157 PolarHBondContact O-N 2.73Å
154E65.6Low79.2Confident123 Ų123105.9 Ų105.958%0.57550%0.503SS*.Hα-helixtrans-68.6-44.2174.3-80.8-143.3172.200113.2F152 E157 K158F152-E154 VanDerWaalsContact C-N 3.32Å; F152-E154 PolarHBondContact O-N 3.1Å; E154-E157 PolarHBondContact O-N 3.09Å; E154-K158 WeakPolarHBondContact O-CB 3.48Å; E154-K158 VanDerWaalsContact O-CD 3.27Å; E154-K158 WeakPolarHBondContact O-CD 3.4Å; E154-K158 WeakPolarHBondContact O-CG 3.37Å; E154-K158 PolarHBondContact O-N 2.93Å; E154-K158 WeakPolarHBondContact OE2-CE 3.29Å; E154-K158 IonicContact OE2-NZ 3.75Å; E154-K158 PolarHBondContact OE2-NZ 2.94Å
155T73.1Confident79.7Confident66 Ų66108.5 Ų108.541%0.40551%0.51SS..Hα-helixtrans-69.2-40.5-179.753.70000110.3F152 K158 V159F152-T155 PolarHBondContact O-N 2.95Å; F152-T155 PolarHBondContact O-OG1 3.46Å; T155-K158 WeakPolarHBondContact O-CB 3.39Å; T155-K158 PolarHBondContact O-N 3.23Å; T155-V159 WeakPolarHBondContact O-CG2 3.49Å; T155-V159 PolarHBondContact O-N 3.41Å
156E77.3Confident80.2Confident95 Ų95108.5 Ų108.544%0.44451%0.514SS..Hα-helixtrans-66.8-38.3173.4-155.7-166.2-169.400112.1F152 V159 R160F152-E156 VanDerWaalsContact O-CB 3.26Å; F152-E156 WeakPolarHBondContact O-CB 3.35Å; F152-E156 PolarHBondContact O-N 3.24Å; E156-V159 PolarHBondContact O-N 2.8Å; E156-R160 WeakPolarHBondContact O-CB 3.34Å; E156-R160 WeakPolarHBondContact O-CG 3.4Å; E156-R160 PolarHBondContact O-N 2.87Å; E156-R160 IonicContact OE1-CZ 2.7Å; E156-R160 IonicContact OE1-NH1 3.6Å; E156-R160 IonicContact OE1-NH2 2.77Å; E156-R160 PolarHBondContact OE1-NH2 2.96Å; E156-R160 IonicContact OE2-CZ 3.75Å; E156-R160 IonicContact OE2-NH1 2.94Å; E156-R160 PolarHBondContact OE2-NH1 2.79Å; E156-R160 IonicContact OE2-NH2 3.61Å; E156-R160 PolarHBondContact OE2-NH2 3.39Å
157E82.2Confident80.9Confident78 Ų78105.8 Ų105.836%0.36451%0.51SS..Hα-helixtrans-60.5-45.4168.9-93.6-113.1-13000112P153 E154 V159 R160 R161P153-E157 WeakPolarHBondContact O-CB 3.14Å; P153-E157 WeakPolarHBondContact O-CG 3.44Å; P153-E157 PolarHBondContact O-N 2.73Å; E154-E157 PolarHBondContact O-N 3.09Å; E157-V159 VanDerWaalsContact C-N 3.34Å; E157-V159 PolarHBondContact O-N 2.77Å; E157-R160 PolarHBondContact O-N 2.82Å; E157-R161 VanDerWaalsContact CD-NH2 3.29Å; E157-R161 WeakPolarHBondContact O-CB 3.48Å; E157-R161 WeakPolarHBondContact O-CD 3.43Å; E157-R161 WeakPolarHBondContact O-CG 3.41Å; E157-R161 PolarHBondContact O-N 3.43Å; E157-R161 IonicContact OE1-NH2 3.22Å; E157-R161 PolarHBondContact OE1-NH2 2.82Å; E157-R161 VanDerWaalsContact OE1-NH2 3.16Å; E157-R161 IonicContact OE2-CZ 3.82Å; E157-R161 IonicContact OE2-NE 2.71Å; E157-R161 PolarHBondContact OE2-NE 3.32Å; E157-R161 IonicContact OE2-NH2 3.89Å; E157-R161 PolarHBondContact OE2-NH2 3.39Å
158K86.8Confident81.9Confident107 Ų107106.5 Ų106.547%0.46551%0.511SS..Hα-helixtrans-59.9-44.5176.1-72.4157.7-167.9166.60110.1E154 T155 R161 L162E154-K158 WeakPolarHBondContact O-CB 3.48Å; E154-K158 VanDerWaalsContact O-CD 3.27Å; E154-K158 WeakPolarHBondContact O-CD 3.4Å; E154-K158 WeakPolarHBondContact O-CG 3.37Å; E154-K158 PolarHBondContact O-N 2.93Å; E154-K158 WeakPolarHBondContact OE2-CE 3.29Å; E154-K158 IonicContact OE2-NZ 3.75Å; E154-K158 PolarHBondContact OE2-NZ 2.94Å; T155-K158 WeakPolarHBondContact O-CB 3.39Å; T155-K158 PolarHBondContact O-N 3.23Å; K158-R161 PolarHBondContact O-N 3.39Å; K158-L162 WeakPolarHBondContact O-CG 3.2Å; K158-L162 PolarHBondContact O-N 2.85Å
159V88.4Confident82.9Confident69 Ų69103.5 Ų103.542%0.41851%0.507SS..Hα-helixtrans-63-46.8172.9170.50000112T155 E156 E157 R161 L162 K163T155-V159 WeakPolarHBondContact O-CG2 3.49Å; T155-V159 PolarHBondContact O-N 3.41Å; E156-V159 PolarHBondContact O-N 2.8Å; E157-V159 VanDerWaalsContact C-N 3.34Å; E157-V159 PolarHBondContact O-N 2.77Å; V159-R161 PolarHBondContact O-N 3.06Å; V159-L162 PolarHBondContact O-N 3.33Å; V159-K163 HydrophobicContact CG1-CD 4.21Å; V159-K163 HydrophobicContact CG1-CG 4.41Å; V159-K163 WeakPolarHBondContact O-CG 3.37Å; V159-K163 PolarHBondContact O-N 3.48Å
160R89.7Confident83.9Confident118 Ų118100 Ų10045%0.44550%0.501SS..Hα-helixtrans-61.5-30.8175.2-73.9-177-174.8106.9-0.2112.2E156 E157 R164E156-R160 WeakPolarHBondContact O-CB 3.34Å; E156-R160 WeakPolarHBondContact O-CG 3.4Å; E156-R160 PolarHBondContact O-N 2.87Å; E156-R160 IonicContact OE1-CZ 2.7Å; E156-R160 IonicContact OE1-NH1 3.6Å; E156-R160 IonicContact OE1-NH2 2.77Å; E156-R160 PolarHBondContact OE1-NH2 2.96Å; E156-R160 IonicContact OE2-CZ 3.75Å; E156-R160 IonicContact OE2-NH1 2.94Å; E156-R160 PolarHBondContact OE2-NH1 2.79Å; E156-R160 IonicContact OE2-NH2 3.61Å; E156-R160 PolarHBondContact OE2-NH2 3.39Å; E157-R160 PolarHBondContact O-N 2.82Å; R160-R164 WeakPolarHBondContact O-CG 3.46Å; R160-R164 PolarHBondContact O-N 2.88Å; R160-R164 PolarHBondContact O-NE 2.82Å
161R92.3Very high85.3Confident134 Ų134100.1 Ų100.151%0.50650%0.498SS..Hα-helixtrans-76.1-38.7175.2-71.5165-170.2-122.54.2111.5E157 K158 V159 R164 K165E157-R161 VanDerWaalsContact CD-NH2 3.29Å; E157-R161 WeakPolarHBondContact O-CB 3.48Å; E157-R161 WeakPolarHBondContact O-CD 3.43Å; E157-R161 WeakPolarHBondContact O-CG 3.41Å; E157-R161 PolarHBondContact O-N 3.43Å; E157-R161 IonicContact OE1-NH2 3.22Å; E157-R161 PolarHBondContact OE1-NH2 2.82Å; E157-R161 VanDerWaalsContact OE1-NH2 3.16Å; E157-R161 IonicContact OE2-CZ 3.82Å; E157-R161 IonicContact OE2-NE 2.71Å; E157-R161 PolarHBondContact OE2-NE 3.32Å; E157-R161 IonicContact OE2-NH2 3.89Å; E157-R161 PolarHBondContact OE2-NH2 3.39Å; K158-R161 PolarHBondContact O-N 3.39Å; V159-R161 PolarHBondContact O-N 3.06Å; R161-R164 PolarHBondContact O-N 3.47Å; R161-K165 WeakPolarHBondContact O-CG 3.35Å; R161-K165 PolarHBondContact O-N 3.32Å
162L93.8Very high87Confident109 Ų109101.4 Ų101.457%0.57150%0.499SS*.Hα-helixtrans-65.7-45.3173-72.7169.1000111.8K158 V159 R164 K165 N166K158-L162 WeakPolarHBondContact O-CG 3.2Å; K158-L162 PolarHBondContact O-N 2.85Å; V159-L162 PolarHBondContact O-N 3.33Å; L162-R164 VanDerWaalsContact C-N 3.31Å; L162-R164 PolarHBondContact O-N 2.88Å; L162-K165 PolarHBondContact O-N 2.84Å; L162-N166 WeakPolarHBondContact O-CB 3.48Å; L162-N166 PolarHBondContact O-N 3.35Å
163K93.3Very high88.9Confident153 Ų15396.9 Ų96.967%0.66549%0.487SS*.Hα-helixtrans-56.9-42.4174.3-72.8-177.4177.5-175.10111.9V159 N166 A167V159-K163 HydrophobicContact CG1-CD 4.21Å; V159-K163 HydrophobicContact CG1-CG 4.41Å; V159-K163 WeakPolarHBondContact O-CG 3.37Å; V159-K163 PolarHBondContact O-N 3.48Å; K163-N166 PolarHBondContact O-N 2.9Å; K163-A167 PolarHBondContact O-N 3.27Å
164R95.9Very high90.5Very high131 Ų131100.6 Ų100.649%0.49450%0.497SS..Hα-helixtrans-62.7-48.3172.9-81.3174.2-77.8177.8-7.3112.8R160 R161 L162 N166 A167 E168R160-R164 WeakPolarHBondContact O-CG 3.46Å; R160-R164 PolarHBondContact O-N 2.88Å; R160-R164 PolarHBondContact O-NE 2.82Å; R161-R164 PolarHBondContact O-N 3.47Å; L162-R164 VanDerWaalsContact C-N 3.31Å; L162-R164 PolarHBondContact O-N 2.88Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.5Å; R164-A167 PolarHBondContact O-N 3.45Å; R164-E168 WeakPolarHBondContact O-CG 3.18Å; R164-E168 PolarHBondContact O-N 3.34Å
165K96.4Very high92Very high129 Ų129102.3 Ų102.356%0.56150%0.498SS*.Hα-helixtrans-59.3-39.2175.1-76.6-178.9174-173.50112.6R161 L162 E168 L169R161-K165 WeakPolarHBondContact O-CG 3.35Å; R161-K165 PolarHBondContact O-N 3.32Å; L162-K165 PolarHBondContact O-N 2.84Å; K165-E168 PolarHBondContact O-N 3.32Å; K165-L169 WeakPolarHBondContact O-CB 3.47Å; K165-L169 VanDerWaalsContact O-CG 3.3Å; K165-L169 WeakPolarHBondContact O-CG 3.41Å; K165-L169 PolarHBondContact O-N 2.91Å
166N95.4Very high93.1Very high111 Ų111104 Ų10459%0.59450%0.504SS*.Hα-helixtrans-67-41.3179.3-160-6000111L162 K163 R164 L169 A170L162-N166 WeakPolarHBondContact O-CB 3.48Å; L162-N166 PolarHBondContact O-N 3.35Å; K163-N166 PolarHBondContact O-N 2.9Å; R164-N166 VanDerWaalsContact C-N 3.3Å; R164-N166 PolarHBondContact O-N 3.5Å; N166-L169 PolarHBondContact O-N 2.91Å; N166-A170 WeakPolarHBondContact O-CB 3.32Å; N166-A170 PolarHBondContact O-N 2.94Å
167A96.6Very high94Very high59 Ų59103.6 Ų103.649%0.48850%0.502SS..Hα-helixtrans-62.6-40.8170.800000113K163 R164 A170 V171K163-A167 PolarHBondContact O-N 3.27Å; R164-A167 PolarHBondContact O-N 3.45Å; A167-A170 PolarHBondContact O-N 3.14Å; A167-V171 WeakPolarHBondContact O-CG2 3.27Å; A167-V171 PolarHBondContact O-N 2.9Å; A167-V171 VanDerWaalsContact O-N 3.09Å
168E96.3Very high94.6Very high123 Ų123104.4 Ų104.458%0.57551%0.506SS*.Hα-helixtrans-61.2-42.7173.1-72.8172-166.100111.7R164 K165 V171 I172R164-E168 WeakPolarHBondContact O-CG 3.18Å; R164-E168 PolarHBondContact O-N 3.34Å; K165-E168 PolarHBondContact O-N 3.32Å; E168-V171 PolarHBondContact O-N 3.34Å; E168-I172 VanDerWaalsContact O-CG1 3.32Å; E168-I172 WeakPolarHBondContact O-CG1 3.45Å; E168-I172 PolarHBondContact O-N 2.88Å
169L96.9Very high95Very high108 Ų108107.4 Ų107.457%0.56551%0.514SS*.Hα-helixtrans-64.7-42.5175.8-73.2169.7000112.2K165 N166 V171 I172 A173K165-L169 WeakPolarHBondContact O-CB 3.47Å; K165-L169 VanDerWaalsContact O-CG 3.3Å; K165-L169 WeakPolarHBondContact O-CG 3.41Å; K165-L169 PolarHBondContact O-N 2.91Å; N166-L169 PolarHBondContact O-N 2.91Å; L169-V171 VanDerWaalsContact C-N 3.31Å; L169-V171 PolarHBondContact O-N 2.7Å; L169-I172 CarbonylContact O-C 3.6Å; L169-I172 PolarHBondContact O-N 2.89Å; L169-I172 VanDerWaalsContact O-N 3.09Å; L169-A173 WeakPolarHBondContact O-CB 3.44Å; L169-A173 PolarHBondContact O-N 3.3Å
170A96.2Very high95.3Very high49 Ų49106.3 Ų106.341%0.40551%0.513SS..Hα-helixtrans-62.3-36.9176.300000112.5N166 A167 K174N166-A170 WeakPolarHBondContact O-CB 3.32Å; N166-A170 PolarHBondContact O-N 2.94Å; A167-A170 PolarHBondContact O-N 3.14Å; A170-K174 PolarHBondContact O-N 3.4Å; A170-K174 VanDerWaalsContact O-N 3.07Å
171V97Very high95.5Very high79 Ų79108.4 Ų108.448%0.47952%0.52SS..Hα-helixtrans-69.3-33.6173.1172.20000111.7A167 E168 L169 R175A167-V171 WeakPolarHBondContact O-CG2 3.27Å; A167-V171 PolarHBondContact O-N 2.9Å; A167-V171 VanDerWaalsContact O-N 3.09Å; E168-V171 PolarHBondContact O-N 3.34Å; L169-V171 VanDerWaalsContact C-N 3.31Å; L169-V171 PolarHBondContact O-N 2.7Å; V171-R175 WeakPolarHBondContact O-CB 3.21Å; V171-R175 WeakPolarHBondContact O-CD 3.28Å; V171-R175 WeakPolarHBondContact O-CG 3.48Å; V171-R175 PolarHBondContact O-N 3.29Å
172I95.9Very high95.6Very high91 Ų91107.5 Ų107.547%0.46752%0.52SS..Hα-helixtrans-69.9-44.5173.8-69163.7000110.7E168 L169 R175 L176E168-I172 VanDerWaalsContact O-CG1 3.32Å; E168-I172 WeakPolarHBondContact O-CG1 3.45Å; E168-I172 PolarHBondContact O-N 2.88Å; L169-I172 CarbonylContact O-C 3.6Å; L169-I172 PolarHBondContact O-N 2.89Å; L169-I172 VanDerWaalsContact O-N 3.09Å; I172-R175 PolarHBondContact O-N 2.79Å; I172-L176 HydrophobicContact CG2-CD1 4.03Å; I172-L176 HydrophobicContact CG2-CG 4.45Å; I172-L176 WeakPolarHBondContact O-CG 3.35Å; I172-L176 PolarHBondContact O-N 2.98Å
173A95.1Very high95.6Very high42 Ų42107.3 Ų107.335%0.34752%0.519SS..Hα-helixtrans-56.9-53.9177.100000111.4L169 R175 L176 E177L169-A173 WeakPolarHBondContact O-CB 3.44Å; L169-A173 PolarHBondContact O-N 3.3Å; A173-R175 VanDerWaalsContact C-N 3.26Å; A173-R175 PolarHBondContact O-N 3.4Å; A173-L176 CarbonylContact O-C 3.54Å; A173-L176 WeakPolarHBondContact O-CA 3.25Å; A173-L176 WeakPolarHBondContact O-CB 3.49Å; A173-L176 PolarHBondContact O-N 2.98Å; A173-E177 WeakPolarHBondContact O-CG 3.24Å; A173-E177 PolarHBondContact O-N 2.87Å
174K96.4Very high95.4Very high139 Ų139105.6 Ų105.660%0.60451%0.514SS*.Hα-helixtrans-56.7-37.8175.9-71.8-170.5175.5-168.20113A170 L176 E177 E178A170-K174 PolarHBondContact O-N 3.4Å; A170-K174 VanDerWaalsContact O-N 3.07Å; K174-L176 VanDerWaalsContact C-N 3.33Å; K174-L176 PolarHBondContact O-N 2.82Å; K174-E177 PolarHBondContact O-N 3.44Å; K174-E178 WeakPolarHBondContact O-CB 3.37Å; K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 3.49Å
175R97.2Very high95Very high158 Ų158103.5 Ų103.560%0.59651%0.51SS*.Hα-helixtrans-70.2-25.7175.2-74.3172177.6-144.7-3.4113.8V171 I172 A173 R179V171-R175 WeakPolarHBondContact O-CB 3.21Å; V171-R175 WeakPolarHBondContact O-CD 3.28Å; V171-R175 WeakPolarHBondContact O-CG 3.48Å; V171-R175 PolarHBondContact O-N 3.29Å; I172-R175 PolarHBondContact O-N 2.79Å; A173-R175 VanDerWaalsContact C-N 3.26Å; A173-R175 PolarHBondContact O-N 3.4Å; R175-R179 WeakPolarHBondContact O-CB 3.47Å; R175-R179 VanDerWaalsContact O-CD 3.31Å; R175-R179 WeakPolarHBondContact O-CD 3.33Å; R175-R179 WeakPolarHBondContact O-CG 3.39Å; R175-R179 PolarHBondContact O-N 2.86Å
176L96.4Very high94.4Very high102 Ų102100.7 Ų100.753%0.53450%0.503SS..Hα-helixtrans-79.2-41.5172.1-68.5171.7000110.7I172 A173 K174 R179 A180I172-L176 HydrophobicContact CG2-CD1 4.03Å; I172-L176 HydrophobicContact CG2-CG 4.45Å; I172-L176 WeakPolarHBondContact O-CG 3.35Å; I172-L176 PolarHBondContact O-N 2.98Å; A173-L176 CarbonylContact O-C 3.54Å; A173-L176 WeakPolarHBondContact O-CA 3.25Å; A173-L176 WeakPolarHBondContact O-CB 3.49Å; A173-L176 PolarHBondContact O-N 2.98Å; K174-L176 VanDerWaalsContact C-N 3.33Å; K174-L176 PolarHBondContact O-N 2.82Å; L176-R179 PolarHBondContact O-N 3.4Å; L176-A180 WeakPolarHBondContact O-CB 3.48Å; L176-A180 PolarHBondContact O-N 3.32Å
177E95.1Very high93.8Very high86 Ų86100.2 Ų100.240%0.40250%0.501SS..Hα-helixtrans-58.7-48.5171.6-67.9163.7-131.900111.7A173 K174 R179 A180 R181A173-E177 WeakPolarHBondContact O-CG 3.24Å; A173-E177 PolarHBondContact O-N 2.87Å; K174-E177 PolarHBondContact O-N 3.44Å; E177-R179 PolarHBondContact O-N 2.83Å; E177-A180 PolarHBondContact O-N 2.79Å; E177-R181 WeakPolarHBondContact O-CB 3.32Å; E177-R181 WeakPolarHBondContact O-CG 3.39Å; E177-R181 PolarHBondContact O-N 3.17Å; E177-R181 IonicContact OE2-NH2 2.57Å
178E96.4Very high93.1Very high96 Ų96102.7 Ų102.745%0.44951%0.505SS..Hα-helixtrans-57.4-37.9174.6-80.1178.6-132.600112.4K174 K182K174-E178 WeakPolarHBondContact O-CB 3.37Å; K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 3.49Å; E178-K182 WeakPolarHBondContact O-CB 3.44Å; E178-K182 WeakPolarHBondContact O-CD 3.26Å; E178-K182 WeakPolarHBondContact O-CG 3.46Å; E178-K182 PolarHBondContact O-N 2.95Å; E178-K182 IonicContact OE2-NZ 2.66Å; E178-K182 PolarHBondContact OE2-NZ 3.44Å
179R95.2Very high92.3Very high169 Ų169104.9 Ų104.964%0.63851%0.508SS*.Hα-helixtrans-72.5-41.1176.9-77.7170.7175-158.5-4.9111.6R175 L176 E177 K182 L183R175-R179 WeakPolarHBondContact O-CB 3.47Å; R175-R179 VanDerWaalsContact O-CD 3.31Å; R175-R179 WeakPolarHBondContact O-CD 3.33Å; R175-R179 WeakPolarHBondContact O-CG 3.39Å; R175-R179 PolarHBondContact O-N 2.86Å; L176-R179 PolarHBondContact O-N 3.4Å; E177-R179 PolarHBondContact O-N 2.83Å; R179-K182 PolarHBondContact O-N 3.29Å; R179-L183 WeakPolarHBondContact O-CB 3.33Å; R179-L183 VanDerWaalsContact O-CG 3.26Å; R179-L183 WeakPolarHBondContact O-CG 3.39Å; R179-L183 PolarHBondContact O-N 2.85Å
180A93.6Very high91.1Very high46 Ų46105 Ų10538%0.3851%0.513SS..Hα-helixtrans-61.6-46.8175.200000110.8L176 E177 L183 Q184L176-A180 WeakPolarHBondContact O-CB 3.48Å; L176-A180 PolarHBondContact O-N 3.32Å; E177-A180 PolarHBondContact O-N 2.79Å; A180-L183 PolarHBondContact O-N 3.31Å; A180-Q184 WeakPolarHBondContact O-CB 3.46Å; A180-Q184 VanDerWaalsContact O-CG 3.29Å; A180-Q184 WeakPolarHBondContact O-CG 3.23Å; A180-Q184 PolarHBondContact O-N 3.05Å
181R94.1Very high89.7Confident162 Ų162108.1 Ų108.161%0.61153%0.527SS*.Hα-helixtrans-60.3-45.8174.5-69178.3-164.4173.99.2111.9E177 L183 Q184 E185E177-R181 WeakPolarHBondContact O-CB 3.32Å; E177-R181 WeakPolarHBondContact O-CG 3.39Å; E177-R181 PolarHBondContact O-N 3.17Å; E177-R181 IonicContact OE2-NH2 2.57Å; R181-L183 VanDerWaalsContact C-N 3.34Å; R181-L183 PolarHBondContact O-N 3.34Å; R181-Q184 PolarHBondContact O-N 2.84Å; R181-E185 VanDerWaalsContact O-CB 3.29Å; R181-E185 WeakPolarHBondContact O-CB 3.26Å; R181-E185 PolarHBondContact O-N 3.34Å
182K94.8Very high87.8Confident115 Ų115108.5 Ų108.550%0.553%0.533SS..Hα-helixtrans-63.7-36.5176-75163.2-174.3159.30112.5E178 R179 T186E178-K182 WeakPolarHBondContact O-CB 3.44Å; E178-K182 WeakPolarHBondContact O-CD 3.26Å; E178-K182 WeakPolarHBondContact O-CG 3.46Å; E178-K182 PolarHBondContact O-N 2.95Å; E178-K182 IonicContact OE2-NZ 2.66Å; E178-K182 PolarHBondContact OE2-NZ 3.44Å; R179-K182 PolarHBondContact O-N 3.29Å; K182-T186 WeakPolarHBondContact O-CG2 3.38Å; K182-T186 PolarHBondContact O-N 3.48Å; K182-T186 PolarHBondContact O-OG1 2.91Å; K182-T186 VanDerWaalsContact O-OG1 3.11Å
183L92.8Very high85.6Confident105 Ų105106.5 Ų106.555%0.5553%0.53SS..Hα-helixtrans-69.1-43.4174.5-75167.9000112R179 A180 R181 E185 T186 N187R179-L183 WeakPolarHBondContact O-CB 3.33Å; R179-L183 VanDerWaalsContact O-CG 3.26Å; R179-L183 WeakPolarHBondContact O-CG 3.39Å; R179-L183 PolarHBondContact O-N 2.85Å; A180-L183 PolarHBondContact O-N 3.31Å; R181-L183 VanDerWaalsContact C-N 3.34Å; R181-L183 PolarHBondContact O-N 3.34Å; L183-E185 VanDerWaalsContact C-N 3.34Å; L183-T186 WeakPolarHBondContact CA-OG1 3.38Å; L183-T186 PolarHBondContact O-N 3.3Å; L183-T186 PolarHBondContact O-OG1 2.91Å; L183-N187 WeakPolarHBondContact O-CB 3.44Å; L183-N187 PolarHBondContact O-N 3.39Å; L183-N187 PolarHBondContact O-ND2 3.49Å; L183-N187 PolarHBondContact O-OD1 3.07Å
184Q89.2Confident83.5Confident117 Ų117110.3 Ų110.355%0.54755%0.551SS.*Hα-helixtrans-60-44.2172.7-73.8167.6-33.600111A180 R181 N187 L188A180-Q184 WeakPolarHBondContact O-CB 3.46Å; A180-Q184 VanDerWaalsContact O-CG 3.29Å; A180-Q184 WeakPolarHBondContact O-CG 3.23Å; A180-Q184 PolarHBondContact O-N 3.05Å; R181-Q184 PolarHBondContact O-N 2.84Å; Q184-N187 PolarHBondContact O-N 3.46Å; Q184-L188 WeakPolarHBondContact O-CB 3.29Å; Q184-L188 PolarHBondContact O-N 2.92Å
185E87.2Confident81.2Confident88 Ų88111.1 Ų111.141%0.41156%0.561SS.*Hα-helixtrans-63.1-43.9175.9-167.2-166.2165.600111.8R181 L183 L188 R189R181-E185 VanDerWaalsContact O-CB 3.29Å; R181-E185 WeakPolarHBondContact O-CB 3.26Å; R181-E185 PolarHBondContact O-N 3.34Å; L183-E185 VanDerWaalsContact C-N 3.34Å; E185-L188 PolarHBondContact O-N 3.15Å; E185-R189 WeakPolarHBondContact O-CB 3.42Å; E185-R189 VanDerWaalsContact O-CG 3.23Å; E185-R189 WeakPolarHBondContact O-CG 3.49Å; E185-R189 PolarHBondContact O-N 3.37Å; E185-R189 IonicContact OE1-CZ 3.08Å; E185-R189 IonicContact OE1-NE 3.18Å; E185-R189 PolarHBondContact OE1-NE 2.94Å; E185-R189 IonicContact OE1-NH2 2.68Å; E185-R189 PolarHBondContact OE1-NH2 3.46Å
186T83.9Confident79Confident69 Ų69109.1 Ų109.142%0.42357%0.569SS.*Hα-helixtrans-66.4-36.9174.250.10000112.5K182 L183 R189 V190K182-T186 WeakPolarHBondContact O-CG2 3.38Å; K182-T186 PolarHBondContact O-N 3.48Å; K182-T186 PolarHBondContact O-OG1 2.91Å; K182-T186 VanDerWaalsContact O-OG1 3.11Å; L183-T186 WeakPolarHBondContact CA-OG1 3.38Å; L183-T186 PolarHBondContact O-N 3.3Å; L183-T186 PolarHBondContact O-OG1 2.91Å; T186-R189 PolarHBondContact O-N 2.94Å; T186-V190 WeakPolarHBondContact O-CB 3.25Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.37Å; T186-V190 PolarHBondContact O-N 2.92Å
187N83.4Confident77Confident101 Ų101115.9 Ų115.954%0.5459%0.587SS.*Hα-helixtrans-66.6-44.2176.6-71.3-8.9000110.8L183 Q184 V190 V191L183-N187 WeakPolarHBondContact O-CB 3.44Å; L183-N187 PolarHBondContact O-N 3.39Å; L183-N187 PolarHBondContact O-ND2 3.49Å; L183-N187 PolarHBondContact O-OD1 3.07Å; Q184-N187 PolarHBondContact O-N 3.46Å; N187-V190 PolarHBondContact O-N 3Å; N187-V191 WeakPolarHBondContact O-CB 3.36Å; N187-V191 VanDerWaalsContact O-CG2 3.28Å; N187-V191 WeakPolarHBondContact O-CG2 3.39Å; N187-V191 PolarHBondContact O-N 3.25Å
188L82.8Confident75.3Confident111 Ų111117.7 Ų117.758%0.58161%0.607SS**Hα-helixtrans-59.5-47.8172-83159.1000111.3Q184 E185 V190 V191 S192Q184-L188 WeakPolarHBondContact O-CB 3.29Å; Q184-L188 PolarHBondContact O-N 2.92Å; E185-L188 PolarHBondContact O-N 3.15Å; L188-V190 VanDerWaalsContact C-N 3.26Å; L188-V190 PolarHBondContact O-N 2.74Å; L188-V191 PolarHBondContact O-N 2.94Å; L188-S192 VanDerWaalsContact O-CB 3.23Å; L188-S192 WeakPolarHBondContact O-CB 3.31Å; L188-S192 PolarHBondContact O-N 3.15Å; L188-S192 PolarHBondContact O-OG 3.08Å; L188-S192 VanDerWaalsContact O-OG 3.13Å
189R78.6Confident73.6Confident169 Ų169115.3 Ų115.364%0.63861%0.607SS**Hα-helixtrans-60.6-31.8176-72.4167.9179.2-1098.1113.2E185 T186 A193E185-R189 WeakPolarHBondContact O-CB 3.42Å; E185-R189 VanDerWaalsContact O-CG 3.23Å; E185-R189 WeakPolarHBondContact O-CG 3.49Å; E185-R189 PolarHBondContact O-N 3.37Å; E185-R189 IonicContact OE1-CZ 3.08Å; E185-R189 IonicContact OE1-NE 3.18Å; E185-R189 PolarHBondContact OE1-NE 2.94Å; E185-R189 IonicContact OE1-NH2 2.68Å; E185-R189 PolarHBondContact OE1-NH2 3.46Å; T186-R189 PolarHBondContact O-N 2.94Å; R189-A193 WeakPolarHBondContact O-CB 3.47Å; R189-A193 PolarHBondContact O-N 2.81Å
190V72.5Confident71.9Confident110 Ų110112.7 Ų112.767%0.66761%0.61SS**Hα-helixtrans-78.5-37.1175.9167.40000112.2T186 N187 L188T186-V190 WeakPolarHBondContact O-CB 3.25Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.37Å; T186-V190 PolarHBondContact O-N 2.92Å; N187-V190 PolarHBondContact O-N 3Å; L188-V190 VanDerWaalsContact C-N 3.26Å; L188-V190 PolarHBondContact O-N 2.74Å
191V66.9Low70.8Confident115 Ų115114.1 Ų114.170%0.69762%0.618SS**Hα-helixtrans-78.5-31.3179.4170.50000112.3N187 L188N187-V191 WeakPolarHBondContact O-CB 3.36Å; N187-V191 VanDerWaalsContact O-CG2 3.28Å; N187-V191 WeakPolarHBondContact O-CG2 3.39Å; N187-V191 PolarHBondContact O-N 3.25Å; L188-V191 PolarHBondContact O-N 2.94Å
192S56.7Low70Confident88 Ų88110.7 Ų110.762%0.61561%0.611SS**SBendtrans-90.6-2177.8-57.20000114L188L188-S192 VanDerWaalsContact O-CB 3.23Å; L188-S192 WeakPolarHBondContact O-CB 3.31Å; L188-S192 PolarHBondContact O-N 3.15Å; L188-S192 PolarHBondContact O-OG 3.08Å; L188-S192 VanDerWaalsContact O-OG 3.13Å
193A50.1Low69.1Low48 Ų48108.8 Ų108.840%0.39760%0.604SS.*SBendtrans-74128.8170.400000110R189 L195R189-A193 WeakPolarHBondContact O-CB 3.47Å; R189-A193 PolarHBondContact O-N 2.81Å; A193-L195 PolarHBondContact O-N 3.29Å
194P51.3Low68.6Low122 Ų122109.5 Ų109.579%0.79261%0.607SS**PPolyproline II helixtrans-58.1122.4176.7-25.134.6000111.4P196P194-P196 WeakPolarHBondContact O-CD 3.25Å
195L46.5Very low68.1Low157 Ų157107.5 Ų107.582%0.82261%0.606SS**PPolyproline II helixtrans-59.8117.9-174.2-98.873.3000112.2A193A193-L195 PolarHBondContact O-N 3.29Å
196P52Low68Low116 Ų116110.1 Ų110.175%0.75361%0.612SS**PPolyproline II helixtrans-72.6137.5163.2-9.127.2000109.1P194P194-P196 WeakPolarHBondContact O-CD 3.25Å
197R53.9Low68.3Low244 Ų244112.6 Ų112.692%0.92162%0.617SS**PPolyproline II helixtrans-60.1141174.2-80.7179.8168.9157.5-4110.7G199R197-G199 PolarHBondContact O-N 2.83Å
198P59.8Low68.6Low124 Ų124110.4 Ų110.481%0.80561%0.613SS**PPolyproline II helixtrans-73.4119.6-172.228.6-34.7000112.1
199G60.2Low68.9Low45 Ų45110.4 Ų110.446%0.46461%0.613SS.*  trans-165.5142.3172.800000111.1R197 S201R197-G199 PolarHBondContact O-N 2.83Å; G199-S201 VanDerWaalsContact C-N 3.26Å; G199-S201 PolarHBondContact O-N 3.46Å
200T59.7Low69.6Low114 Ų114105.2 Ų105.270%0.69961%0.606SS**SBendtrans56.4-55177.572.80000118.2E203 L204T200-E203 PolarHBondContact O-N 3Å; T200-L204 WeakPolarHBondContact O-CG 3.45Å; T200-L204 PolarHBondContact O-N 2.99Å
201S69.6Low70.6Confident77 Ų77108.3 Ų108.354%0.53861%0.606SS.*Hα-helixtrans-62.9-48.1-170.461.10000113.3G199 E203 L204 C205G199-S201 VanDerWaalsContact C-N 3.26Å; G199-S201 PolarHBondContact O-N 3.46Å; S201-E203 VanDerWaalsContact C-N 3.26Å; S201-E203 PolarHBondContact O-N 3.4Å; S201-L204 PolarHBondContact O-N 2.81Å; S201-C205 PolarHBondContact O-N 3.37Å; S201-C205 PolarHBondContact O-SG 3.06Å
202L77.2Confident71.8Confident89 Ų89106.4 Ų106.447%0.46659%0.589SS.*Hα-helixtrans-60.2-36.6176.4-174.866.8000112C205 R206L202-C205 PolarHBondContact O-N 3.27Å; L202-R206 WeakPolarHBondContact O-CG 3.46Å; L202-R206 PolarHBondContact O-N 2.65Å
203E77.8Confident73.5Confident76 Ų76110.6 Ų110.636%0.35559%0.592SS.*Hα-helixtrans-72.8-35.3178-75.4-55.1125.400112.7T200 S201 C205 R206 K207T200-E203 PolarHBondContact O-N 3Å; S201-E203 VanDerWaalsContact C-N 3.26Å; S201-E203 PolarHBondContact O-N 3.4Å; E203-C205 VanDerWaalsContact C-N 3.35Å; E203-R206 PolarHBondContact O-N 3.49Å; E203-R206 WeakPolarHBondContact OE1-CD 3.27Å; E203-R206 IonicContact OE1-CZ 3.59Å; E203-R206 IonicContact OE1-NE 3.14Å; E203-R206 IonicContact OE1-NH1 2.79Å; E203-R206 PolarHBondContact OE1-NH1 3.39Å; E203-K207 VanDerWaalsContact O-CB 3.3Å; E203-K207 WeakPolarHBondContact O-CB 3.37Å; E203-K207 WeakPolarHBondContact O-CD 3.31Å; E203-K207 WeakPolarHBondContact O-CG 3.43Å; E203-K207 PolarHBondContact O-N 3.35Å
204L80.4Confident75.7Confident119 Ų119111.2 Ų111.262%0.62360%0.597SS**Hα-helixtrans-64.2-40.9170-69.4171000111T200 S201 K207 A208T200-L204 WeakPolarHBondContact O-CG 3.45Å; T200-L204 PolarHBondContact O-N 2.99Å; S201-L204 PolarHBondContact O-N 2.81Å; L204-K207 PolarHBondContact O-N 2.92Å; L204-A208 VanDerWaalsContact O-CB 3.29Å; L204-A208 WeakPolarHBondContact O-CB 3.39Å; L204-A208 PolarHBondContact O-N 3.45Å
205C79.9Confident77.7Confident76 Ų76111.9 Ų111.951%0.51458%0.583SS.*Hα-helixtrans-63.7-45.2173.7-68.90000112.5S201 L202 E203 K207 A208 L209S201-C205 PolarHBondContact O-N 3.37Å; S201-C205 PolarHBondContact O-SG 3.06Å; L202-C205 PolarHBondContact O-N 3.27Å; E203-C205 VanDerWaalsContact C-N 3.35Å; C205-K207 PolarHBondContact O-N 3.37Å; C205-A208 PolarHBondContact O-N 3.15Å; C205-L209 WeakPolarHBondContact O-CG 3.47Å; C205-L209 PolarHBondContact O-N 3.17Å
206R85.7Confident80Confident142 Ų142107.8 Ų107.854%0.53656%0.563SS.*Hα-helixtrans-59.3-46.3174.6-76.6166.4169.1-178.2-4.4111.6L202 E203 A208 L209 A210L202-R206 WeakPolarHBondContact O-CG 3.46Å; L202-R206 PolarHBondContact O-N 2.65Å; E203-R206 PolarHBondContact O-N 3.49Å; E203-R206 WeakPolarHBondContact OE1-CD 3.27Å; E203-R206 IonicContact OE1-CZ 3.59Å; E203-R206 IonicContact OE1-NE 3.14Å; E203-R206 IonicContact OE1-NH1 2.79Å; E203-R206 PolarHBondContact OE1-NH1 3.39Å; R206-A208 PolarHBondContact O-N 3.39Å; R206-L209 PolarHBondContact O-N 2.91Å; R206-A210 WeakPolarHBondContact O-CB 3.21Å; R206-A210 PolarHBondContact O-N 2.93Å
207K90Very high82.1Confident121 Ų121108 Ų10853%0.52656%0.557SS.*Hα-helixtrans-66.5-34.4177.3-70.9167.8-174.2177.90112.4E203 L204 C205 R211E203-K207 VanDerWaalsContact O-CB 3.3Å; E203-K207 WeakPolarHBondContact O-CB 3.37Å; E203-K207 WeakPolarHBondContact O-CD 3.31Å; E203-K207 WeakPolarHBondContact O-CG 3.43Å; E203-K207 PolarHBondContact O-N 3.35Å; L204-K207 PolarHBondContact O-N 2.92Å; C205-K207 PolarHBondContact O-N 3.37Å; K207-R211 WeakPolarHBondContact O-CB 3.47Å; K207-R211 WeakPolarHBondContact O-CD 3.47Å; K207-R211 WeakPolarHBondContact O-CG 3.5Å; K207-R211 PolarHBondContact O-N 3.15Å
208A88.3Confident84Confident56 Ų5699.7 Ų99.746%0.46354%0.536SS..Hα-helixtrans-66.8-4517300000112.1L204 C205 R206 R211 Q212L204-A208 VanDerWaalsContact O-CB 3.29Å; L204-A208 WeakPolarHBondContact O-CB 3.39Å; L204-A208 PolarHBondContact O-N 3.45Å; C205-A208 PolarHBondContact O-N 3.15Å; R206-A208 PolarHBondContact O-N 3.39Å; A208-R211 PolarHBondContact O-N 3.46Å; A208-Q212 PolarHBondContact O-N 3.08Å
209L90.1Very high85.6Confident110 Ų11099.3 Ų99.358%0.57652%0.523SS*.Hα-helixtrans-64.5-40.5176.3-71.1169000112.3C205 R206 Q212 R213C205-L209 WeakPolarHBondContact O-CG 3.47Å; C205-L209 PolarHBondContact O-N 3.17Å; R206-L209 PolarHBondContact O-N 2.91Å; L209-Q212 PolarHBondContact O-N 2.86Å; L209-R213 WeakPolarHBondContact O-CG 3.25Å; L209-R213 PolarHBondContact O-N 3.48Å
210A93.1Very high87.1Confident60 Ų60101.1 Ų101.150%0.49653%0.525SS..Hα-helixtrans-62.5-44.7173.600000111.8R206 Q212 R213 A214R206-A210 WeakPolarHBondContact O-CB 3.21Å; R206-A210 PolarHBondContact O-N 2.93Å; A210-Q212 VanDerWaalsContact C-N 3.32Å; A210-Q212 PolarHBondContact O-N 3.28Å; A210-R213 PolarHBondContact O-N 3.09Å; A210-A214 WeakPolarHBondContact O-CB 3.47Å; A210-A214 PolarHBondContact O-N 3.39Å
211R92.6Very high88.7Confident175 Ų17597.9 Ų97.966%0.6651%0.51SS*.Hα-helixtrans-63.3-35174.7-75.7170.1175.6-175.2-2.9112.8K207 A208 R215K207-R211 WeakPolarHBondContact O-CB 3.47Å; K207-R211 WeakPolarHBondContact O-CD 3.47Å; K207-R211 WeakPolarHBondContact O-CG 3.5Å; K207-R211 PolarHBondContact O-N 3.15Å; A208-R211 PolarHBondContact O-N 3.46Å; R211-R215 WeakPolarHBondContact O-CG 3.44Å; R211-R215 PolarHBondContact O-N 3.33Å; R211-R215 VanDerWaalsContact O-N 3.16Å
212Q92.6Very high89.9Confident75 Ų7597.6 Ų97.635%0.3551%0.508SS..Hα-helixtrans-70-48.3176-168.455.639.800111.2A208 L209 A210 A214 R215 D216A208-Q212 PolarHBondContact O-N 3.08Å; L209-Q212 PolarHBondContact O-N 2.86Å; A210-Q212 VanDerWaalsContact C-N 3.32Å; A210-Q212 PolarHBondContact O-N 3.28Å; Q212-A214 PolarHBondContact O-N 2.88Å; Q212-R215 CarbonylContact O-C 3.59Å; Q212-R215 WeakPolarHBondContact O-CA 3.41Å; Q212-R215 WeakPolarHBondContact O-CB 3.44Å; Q212-R215 PolarHBondContact O-N 3.34Å; Q212-D216 PolarHBondContact NE2-OD1 3.49Å; Q212-D216 PolarHBondContact O-N 3.45Å
213R93.7Very high90.8Very high177 Ų17796 Ų9667%0.66851%0.507SS*.Hα-helixtrans-54.8-40.7174.3-71.2173.2178-175-1.9112.5L209 A210 R215 D216 L217L209-R213 WeakPolarHBondContact O-CG 3.25Å; L209-R213 PolarHBondContact O-N 3.48Å; A210-R213 PolarHBondContact O-N 3.09Å; R213-R215 VanDerWaalsContact C-N 3.34Å; R213-R215 PolarHBondContact O-N 2.9Å; R213-D216 PolarHBondContact O-N 3.05Å; R213-L217 WeakPolarHBondContact O-CB 3.47Å; R213-L217 VanDerWaalsContact O-CG 3.25Å; R213-L217 WeakPolarHBondContact O-CG 3.19Å; R213-L217 PolarHBondContact O-N 3.28Å
214A94.6Very high91.5Very high61 Ų6197.8 Ų97.850%0.50452%0.519SS..Hα-helixtrans-63.3-37.1175.200000112.8A210 Q212 S218A210-A214 WeakPolarHBondContact O-CB 3.47Å; A210-A214 PolarHBondContact O-N 3.39Å; Q212-A214 PolarHBondContact O-N 2.88Å; A214-S218 WeakPolarHBondContact O-CB 3.34Å; A214-S218 PolarHBondContact O-N 2.76Å; A214-S218 PolarHBondContact O-OG 2.95Å
215R94.3Very high92.2Very high135 Ų13597 Ų9751%0.50952%0.515SS..Hα-helixtrans-66.7-50.9172.5-69.8165.2-179163.5-4.4111.3R211 Q212 R213 L217 S218 E219R211-R215 WeakPolarHBondContact O-CG 3.44Å; R211-R215 PolarHBondContact O-N 3.33Å; R211-R215 VanDerWaalsContact O-N 3.16Å; Q212-R215 CarbonylContact O-C 3.59Å; Q212-R215 WeakPolarHBondContact O-CA 3.41Å; Q212-R215 WeakPolarHBondContact O-CB 3.44Å; Q212-R215 PolarHBondContact O-N 3.34Å; R213-R215 VanDerWaalsContact C-N 3.34Å; R213-R215 PolarHBondContact O-N 2.9Å; R215-L217 PolarHBondContact O-N 2.95Å; R215-S218 WeakPolarHBondContact CA-OG 3.35Å; R215-S218 CarbonylContact O-C 3.58Å; R215-S218 WeakPolarHBondContact O-CA 3.36Å; R215-S218 PolarHBondContact O-N 3.03Å; R215-S218 PolarHBondContact O-OG 3.33Å; R215-E219 WeakPolarHBondContact O-CG 3.45Å; R215-E219 PolarHBondContact O-N 3.36Å
216D94.8Very high93Very high72 Ų7295.7 Ų95.739%0.38551%0.51SS..Hα-helixtrans-56.3-39.4-179.4-50.4-32.8000111.4Q212 R213 T220Q212-D216 PolarHBondContact NE2-OD1 3.49Å; Q212-D216 PolarHBondContact O-N 3.45Å; R213-D216 PolarHBondContact O-N 3.05Å; D216-T220 WeakPolarHBondContact O-CG2 3.47Å; D216-T220 PolarHBondContact O-N 3.06Å; D216-T220 PolarHBondContact O-OG1 2.94Å
217L95.2Very high93.3Very high121 Ų12194.6 Ų94.663%0.63451%0.509SS*.Hα-helixtrans-69.8-40.2173.3-70.7171.1000112.8R213 R215 T220 A221R213-L217 WeakPolarHBondContact O-CB 3.47Å; R213-L217 VanDerWaalsContact O-CG 3.25Å; R213-L217 WeakPolarHBondContact O-CG 3.19Å; R213-L217 PolarHBondContact O-N 3.28Å; R215-L217 PolarHBondContact O-N 2.95Å; L217-T220 WeakPolarHBondContact CA-OG1 3.46Å; L217-T220 PolarHBondContact O-OG1 3.03Å; L217-T220 VanDerWaalsContact O-OG1 3.06Å; L217-A221 VanDerWaalsContact O-CB 3.31Å; L217-A221 WeakPolarHBondContact O-CB 3.38Å; L217-A221 PolarHBondContact O-N 3.33Å
218S94Very high93.6Very high68 Ų6892.9 Ų92.948%0.47651%0.505SS..Hα-helixtrans-68.1-36.3175.673.60000112.7A214 R215 S222A214-S218 WeakPolarHBondContact O-CB 3.34Å; A214-S218 PolarHBondContact O-N 2.76Å; A214-S218 PolarHBondContact O-OG 2.95Å; R215-S218 WeakPolarHBondContact CA-OG 3.35Å; R215-S218 CarbonylContact O-C 3.58Å; R215-S218 WeakPolarHBondContact O-CA 3.36Å; R215-S218 PolarHBondContact O-N 3.03Å; R215-S218 PolarHBondContact O-OG 3.33Å; S218-S222 WeakPolarHBondContact O-CB 3.28Å; S218-S222 PolarHBondContact O-N 2.75Å
219E94.4Very high94Very high117 Ų11797.7 Ų97.755%0.54752%0.516SS..Hα-helixtrans-68.8-45.5177.8-74.3178.5-150.800110.5R215 S222 A223R215-E219 WeakPolarHBondContact O-CG 3.45Å; R215-E219 PolarHBondContact O-N 3.36Å; E219-S222 PolarHBondContact O-N 3.23Å; E219-S222 PolarHBondContact O-OG 2.98Å; E219-A223 WeakPolarHBondContact O-CB 3.41Å; E219-A223 PolarHBondContact O-N 2.78Å
220T91.4Very high94.3Very high82 Ų8297.2 Ų97.250%0.50351%0.511SS..Hα-helixtrans-63.9-42.2174.8460000112.3D216 L217 S222 A223 L224D216-T220 WeakPolarHBondContact O-CG2 3.47Å; D216-T220 PolarHBondContact O-N 3.06Å; D216-T220 PolarHBondContact O-OG1 2.94Å; L217-T220 WeakPolarHBondContact CA-OG1 3.46Å; L217-T220 PolarHBondContact O-OG1 3.03Å; L217-T220 VanDerWaalsContact O-OG1 3.06Å; T220-S222 PolarHBondContact O-N 3.25Å; T220-A223 PolarHBondContact O-N 3.47Å; T220-L224 WeakPolarHBondContact O-CG 3.43Å; T220-L224 PolarHBondContact O-N 3.47Å
221A93.4Very high94.2Very high47 Ų4798.4 Ų98.439%0.38851%0.508SS..Hα-helixtrans-61-41.6172.100000112.4L217 A223 L224 L225L217-A221 VanDerWaalsContact O-CB 3.31Å; L217-A221 WeakPolarHBondContact O-CB 3.38Å; L217-A221 PolarHBondContact O-N 3.33Å; A221-A223 VanDerWaalsContact C-N 3.3Å; A221-A223 PolarHBondContact O-N 3.07Å; A221-L224 PolarHBondContact O-N 3.42Å; A221-L225 WeakPolarHBondContact O-CG 3.3Å; A221-L225 PolarHBondContact O-N 3.24Å
222S95.4Very high94.3Very high70 Ų7091.7 Ų91.749%0.4949%0.49SS..Hα-helixtrans-63.9-35.3176.384.30000112.6S218 E219 T220 A226S218-S222 WeakPolarHBondContact O-CB 3.28Å; S218-S222 PolarHBondContact O-N 2.75Å; E219-S222 PolarHBondContact O-N 3.23Å; E219-S222 PolarHBondContact O-OG 2.98Å; T220-S222 PolarHBondContact O-N 3.25Å; S222-A226 WeakPolarHBondContact O-CB 3.4Å; S222-A226 PolarHBondContact O-N 3.41Å
223A94.4Very high94.4Very high55 Ų5589.8 Ų89.846%0.45549%0.487SS..Hα-helixtrans-71.9-35.9178.200000112.1E219 T220 A221 A226 K227E219-A223 WeakPolarHBondContact O-CB 3.41Å; E219-A223 PolarHBondContact O-N 2.78Å; T220-A223 PolarHBondContact O-N 3.47Å; A221-A223 VanDerWaalsContact C-N 3.3Å; A221-A223 PolarHBondContact O-N 3.07Å; A223-A226 PolarHBondContact O-N 2.81Å; A223-K227 WeakPolarHBondContact O-CG 3.39Å; A223-K227 PolarHBondContact O-N 3.44Å; A223-K227 VanDerWaalsContact O-N 3.07Å
224L92.8Very high94.4Very high114 Ų11486 Ų8660%0.59748%0.479SS*.Hα-helixtrans-64.6-51.1170.7-69.3171.4000110.7T220 A221 A226 K227 D228T220-L224 WeakPolarHBondContact O-CG 3.43Å; T220-L224 PolarHBondContact O-N 3.47Å; A221-L224 PolarHBondContact O-N 3.42Å; L224-A226 PolarHBondContact O-N 2.99Å; L224-A226 VanDerWaalsContact O-N 3.15Å; L224-K227 CarbonylContact O-C 3.6Å; L224-K227 VanDerWaalsContact O-CA 3.3Å; L224-K227 WeakPolarHBondContact O-CA 3.31Å; L224-K227 VanDerWaalsContact O-CB 3.28Å; L224-K227 WeakPolarHBondContact O-CB 3.43Å; L224-K227 PolarHBondContact O-N 3.03Å; L224-D228 PolarHBondContact O-N 2.95Å
225L95.6Very high94.2Very high104 Ų10487.6 Ų87.655%0.54548%0.476SS..Hα-helixtrans-59.9-30.2176.3-68.5172.7000113.1A221 K229A221-L225 WeakPolarHBondContact O-CG 3.3Å; A221-L225 PolarHBondContact O-N 3.24Å; L225-K229 WeakPolarHBondContact O-CB 3.18Å; L225-K229 VanDerWaalsContact O-CG 3.25Å; L225-K229 WeakPolarHBondContact O-CG 3.29Å; L225-K229 PolarHBondContact O-N 2.87Å; L225-K229 VanDerWaalsContact O-N 3.08Å
226A96Very high94.2Very high48 Ų4889.3 Ų89.340%0.39748%0.483SS..Hα-helixtrans-71.5-29.7171.300000112.9S222 A223 L224 Q230S222-A226 WeakPolarHBondContact O-CB 3.4Å; S222-A226 PolarHBondContact O-N 3.41Å; A223-A226 PolarHBondContact O-N 2.81Å; L224-A226 PolarHBondContact O-N 2.99Å; L224-A226 VanDerWaalsContact O-N 3.15Å; A226-Q230 WeakPolarHBondContact O-CG 3.33Å; A226-Q230 PolarHBondContact O-N 2.85Å
227K93.3Very high94.1Very high119 Ų11990.8 Ų90.852%0.51749%0.487SS..Hα-helixtrans-73.7-42.1171.1-73-75.3154.2-160.20111.9A223 L224 K229 Q230 I231A223-K227 WeakPolarHBondContact O-CG 3.39Å; A223-K227 PolarHBondContact O-N 3.44Å; A223-K227 VanDerWaalsContact O-N 3.07Å; L224-K227 CarbonylContact O-C 3.6Å; L224-K227 VanDerWaalsContact O-CA 3.3Å; L224-K227 WeakPolarHBondContact O-CA 3.31Å; L224-K227 VanDerWaalsContact O-CB 3.28Å; L224-K227 WeakPolarHBondContact O-CB 3.43Å; L224-K227 PolarHBondContact O-N 3.03Å; K227-K229 VanDerWaalsContact C-N 3.29Å; K227-K229 PolarHBondContact O-N 3.49Å; K227-Q230 CarbonylContact O-C 3.56Å; K227-Q230 WeakPolarHBondContact O-CA 3.21Å; K227-Q230 WeakPolarHBondContact O-CB 3.38Å; K227-Q230 PolarHBondContact O-N 2.79Å; K227-I231 WeakPolarHBondContact O-CG1 3.47Å; K227-I231 PolarHBondContact O-N 2.74Å
228D94.5Very high93.7Very high84 Ų8488.8 Ų88.845%0.44948%0.483SS..Hα-helixtrans-63.3-38.3176.6-57.4-37.2000111.2L224 Q230 I231 A232L224-D228 PolarHBondContact O-N 2.95Å; D228-Q230 VanDerWaalsContact C-N 3.34Å; D228-Q230 PolarHBondContact O-N 2.85Å; D228-I231 PolarHBondContact O-N 3.16Å; D228-A232 VanDerWaalsContact O-CB 3.31Å; D228-A232 WeakPolarHBondContact O-CB 3.21Å; D228-A232 PolarHBondContact O-N 2.71Å
229K97.3Very high93.6Very high158 Ų15893.3 Ų93.369%0.68749%0.489SS*.Hα-helixtrans-62.2-36.7170.1-75170.5-177.2178.70113L225 K227 A233L225-K229 WeakPolarHBondContact O-CB 3.18Å; L225-K229 VanDerWaalsContact O-CG 3.25Å; L225-K229 WeakPolarHBondContact O-CG 3.29Å; L225-K229 PolarHBondContact O-N 2.87Å; L225-K229 VanDerWaalsContact O-N 3.08Å; K227-K229 VanDerWaalsContact C-N 3.29Å; K227-K229 PolarHBondContact O-N 3.49Å; K229-A233 WeakPolarHBondContact O-CB 3.3Å; K229-A233 PolarHBondContact O-N 2.77Å
230Q96.8Very high93.4Very high100 Ų10092.4 Ų92.447%0.46749%0.485SS..Hα-helixtrans-70.2-40173.8-74.5173.5-200112A226 K227 D228 A233 L234A226-Q230 WeakPolarHBondContact O-CG 3.33Å; A226-Q230 PolarHBondContact O-N 2.85Å; K227-Q230 CarbonylContact O-C 3.56Å; K227-Q230 WeakPolarHBondContact O-CA 3.21Å; K227-Q230 WeakPolarHBondContact O-CB 3.38Å; K227-Q230 PolarHBondContact O-N 2.79Å; D228-Q230 VanDerWaalsContact C-N 3.34Å; D228-Q230 PolarHBondContact O-N 2.85Å; Q230-A233 PolarHBondContact O-N 3.06Å; Q230-L234 WeakPolarHBondContact O-CB 3.36Å; Q230-L234 VanDerWaalsContact O-CG 3.31Å; Q230-L234 WeakPolarHBondContact O-CG 3.46Å; Q230-L234 PolarHBondContact O-N 3.42Å
231I91.4Very high93Very high85 Ų8593.5 Ų93.544%0.43649%0.487SS..Hα-helixtrans-64.4-45175.3-67.1163.9000110.1K227 D228 A233 L234 Q235K227-I231 WeakPolarHBondContact O-CG1 3.47Å; K227-I231 PolarHBondContact O-N 2.74Å; D228-I231 PolarHBondContact O-N 3.16Å; I231-A233 VanDerWaalsContact C-N 3.34Å; I231-A233 PolarHBondContact O-N 3.06Å; I231-L234 PolarHBondContact O-N 3.01Å; I231-Q235 HydrophobicContact CG2-CG 4.37Å; I231-Q235 WeakPolarHBondContact O-CB 3.38Å; I231-Q235 VanDerWaalsContact O-CG 3.27Å; I231-Q235 WeakPolarHBondContact O-CG 3.29Å; I231-Q235 PolarHBondContact O-N 3.2Å
232A94.4Very high92.5Very high34 Ų3497.4 Ų97.428%0.28150%0.498SS..Hα-helixtrans-65.1-34.1176.500000113D228 R236D228-A232 VanDerWaalsContact O-CB 3.31Å; D228-A232 WeakPolarHBondContact O-CB 3.21Å; D228-A232 PolarHBondContact O-N 2.71Å; A232-R236 WeakPolarHBondContact O-CD 3.25Å; A232-R236 VanDerWaalsContact O-CG 3.26Å; A232-R236 WeakPolarHBondContact O-CG 3.39Å; A232-R236 PolarHBondContact O-N 2.89Å; A232-R236 VanDerWaalsContact O-N 3.15Å
233A95.1Very high91.8Very high35 Ų3596.7 Ų96.729%0.28950%0.495SS..Hα-helixtrans-66.2-51.8171.600000111.2K229 Q230 I231 Q235 R236 E237K229-A233 WeakPolarHBondContact O-CB 3.3Å; K229-A233 PolarHBondContact O-N 2.77Å; Q230-A233 PolarHBondContact O-N 3.06Å; I231-A233 VanDerWaalsContact C-N 3.34Å; I231-A233 PolarHBondContact O-N 3.06Å; A233-Q235 VanDerWaalsContact C-N 3.28Å; A233-Q235 PolarHBondContact O-N 3.24Å; A233-R236 WeakPolarHBondContact O-CA 3.49Å; A233-R236 WeakPolarHBondContact O-CB 3.22Å; A233-R236 PolarHBondContact O-N 3.31Å; A233-E237 PolarHBondContact O-N 2.83Å
234L93.9Very high91.2Very high96 Ų96101 Ų10150%0.50350%0.5SS..Hα-helixtrans-60.5-35.5176.9-70.4168.7000112.5Q230 I231 R236 E237 C238Q230-L234 WeakPolarHBondContact O-CB 3.36Å; Q230-L234 VanDerWaalsContact O-CG 3.31Å; Q230-L234 WeakPolarHBondContact O-CG 3.46Å; Q230-L234 PolarHBondContact O-N 3.42Å; I231-L234 PolarHBondContact O-N 3.01Å; L234-R236 VanDerWaalsContact C-N 3.35Å; L234-E237 PolarHBondContact O-N 3.46Å; L234-C238 WeakPolarHBondContact O-CB 3.44Å; L234-C238 PolarHBondContact O-N 3.33Å; L234-C238 PolarHBondContact O-SG 3.35Å
235Q90.4Very high90Very high95 Ų95101.4 Ų101.444%0.44450%0.502SS..Hα-helixtrans-66.7-34173.3-76.8177.13.600112.6I231 A233 R239I231-Q235 HydrophobicContact CG2-CG 4.37Å; I231-Q235 WeakPolarHBondContact O-CB 3.38Å; I231-Q235 VanDerWaalsContact O-CG 3.27Å; I231-Q235 WeakPolarHBondContact O-CG 3.29Å; I231-Q235 PolarHBondContact O-N 3.2Å; A233-Q235 VanDerWaalsContact C-N 3.28Å; A233-Q235 PolarHBondContact O-N 3.24Å; Q235-R239 WeakPolarHBondContact O-CB 3.43Å; Q235-R239 WeakPolarHBondContact O-CD 3.42Å; Q235-R239 WeakPolarHBondContact O-CG 3.36Å; Q235-R239 PolarHBondContact O-N 3.44Å
236R93.4Very high88.7Confident172 Ų172101.7 Ų101.765%0.64951%0.508SS*.Hα-helixtrans-70.2-45.2172.1-69.3163.7-171.61691.8110.7A232 A233 L234 C238 R239 E240A232-R236 WeakPolarHBondContact O-CD 3.25Å; A232-R236 VanDerWaalsContact O-CG 3.26Å; A232-R236 WeakPolarHBondContact O-CG 3.39Å; A232-R236 PolarHBondContact O-N 2.89Å; A232-R236 VanDerWaalsContact O-N 3.15Å; A233-R236 WeakPolarHBondContact O-CA 3.49Å; A233-R236 WeakPolarHBondContact O-CB 3.22Å; A233-R236 PolarHBondContact O-N 3.31Å; L234-R236 VanDerWaalsContact C-N 3.35Å; R236-C238 VanDerWaalsContact C-N 3.35Å; R236-C238 PolarHBondContact O-N 2.92Å; R236-R239 PolarHBondContact O-N 3.19Å; R236-E240 WeakPolarHBondContact O-CB 3.31Å; R236-E240 PolarHBondContact O-N 2.85Å
237E93.1Very high87.2Confident102 Ų102106.6 Ų106.648%0.47753%0.527SS..Hα-helixtrans-58-44.9174.6-70.4170-14900111.3A233 L234 R239 E240 L241A233-E237 PolarHBondContact O-N 2.83Å; L234-E237 PolarHBondContact O-N 3.46Å; E237-R239 PolarHBondContact O-N 3.43Å; E237-E240 PolarHBondContact O-N 2.89Å; E237-L241 WeakPolarHBondContact O-CB 3.38Å; E237-L241 VanDerWaalsContact O-CG 3.23Å; E237-L241 WeakPolarHBondContact O-CG 3.39Å; E237-L241 PolarHBondContact O-N 3.35Å
238C86.8Confident85.3Confident80 Ų80105.4 Ų105.454%0.54153%0.529SS..Hα-helixtrans-61.7-42.7174.3-72.90000112.6L234 R236 Q242L234-C238 WeakPolarHBondContact O-CB 3.44Å; L234-C238 PolarHBondContact O-N 3.33Å; L234-C238 PolarHBondContact O-SG 3.35Å; R236-C238 VanDerWaalsContact C-N 3.35Å; R236-C238 PolarHBondContact O-N 2.92Å; C238-Q242 VanDerWaalsContact O-CB 3.25Å; C238-Q242 WeakPolarHBondContact O-CB 3.27Å; C238-Q242 PolarHBondContact O-N 3Å
239R91.1Very high83.2Confident162 Ų162104.5 Ų104.561%0.61154%0.54SS*.Hα-helixtrans-66.6-36.9175.7-72.2168.5-167.9169.17.1112.1Q235 R236 E237 Q242 A243Q235-R239 WeakPolarHBondContact O-CB 3.43Å; Q235-R239 WeakPolarHBondContact O-CD 3.42Å; Q235-R239 WeakPolarHBondContact O-CG 3.36Å; Q235-R239 PolarHBondContact O-N 3.44Å; R236-R239 PolarHBondContact O-N 3.19Å; E237-R239 PolarHBondContact O-N 3.43Å; R239-Q242 PolarHBondContact O-N 3.42Å; R239-A243 WeakPolarHBondContact O-CB 3.44Å; R239-A243 PolarHBondContact O-N 2.97Å
240E89.9Confident81.2Confident98 Ų98106.2 Ų106.246%0.45855%0.548SS..Hα-helixtrans-71.4-41177-163.4-165.9137.200111.2R236 E237 Q242 A243 R244R236-E240 WeakPolarHBondContact O-CB 3.31Å; R236-E240 PolarHBondContact O-N 2.85Å; E237-E240 PolarHBondContact O-N 2.89Å; E240-Q242 VanDerWaalsContact C-N 3.33Å; E240-A243 PolarHBondContact O-N 3.45Å; E240-R244 WeakPolarHBondContact O-CB 3.4Å; E240-R244 WeakPolarHBondContact O-CD 3.47Å; E240-R244 WeakPolarHBondContact O-CG 3.37Å; E240-R244 PolarHBondContact O-N 2.98Å; E240-R244 IonicContact OE1-CZ 4Å; E240-R244 IonicContact OE1-NE 3.03Å; E240-R244 PolarHBondContact OE1-NE 2.88Å; E240-R244 IonicContact OE1-NH2 2.62Å; E240-R244 PolarHBondContact OE1-NH2 2.88Å
241L84.8Confident79.2Confident105 Ų105109.7 Ų109.755%0.5556%0.564SS.*Hα-helixtrans-63.1-39.5171.4-72.7170.1000111.2E237 R244 L245E237-L241 WeakPolarHBondContact O-CB 3.38Å; E237-L241 VanDerWaalsContact O-CG 3.23Å; E237-L241 WeakPolarHBondContact O-CG 3.39Å; E237-L241 PolarHBondContact O-N 3.35Å; L241-R244 PolarHBondContact O-N 3.32Å; L241-L245 WeakPolarHBondContact O-CB 3.17Å; L241-L245 VanDerWaalsContact O-CG 3.26Å; L241-L245 WeakPolarHBondContact O-CG 3.38Å; L241-L245 PolarHBondContact O-N 3.49Å
242Q81.4Confident76.8Confident130 Ų130108.5 Ų108.561%0.60757%0.572SS**Hα-helixtrans-67.3-40.1174.9-168169.412.500111.9C238 R239 E240 L245 T246C238-Q242 VanDerWaalsContact O-CB 3.25Å; C238-Q242 WeakPolarHBondContact O-CB 3.27Å; C238-Q242 PolarHBondContact O-N 3Å; R239-Q242 PolarHBondContact O-N 3.42Å; E240-Q242 VanDerWaalsContact C-N 3.33Å; Q242-L245 PolarHBondContact O-N 3.48Å; Q242-T246 PolarHBondContact O-N 2.92Å; Q242-T246 PolarHBondContact O-OG1 3.23Å
243A81.8Confident74.8Confident54 Ų54113.1 Ų113.145%0.44660%0.599SS.*Hα-helixtrans-66.2-39.1172.700000112.3R239 E240 T246 L247R239-A243 WeakPolarHBondContact O-CB 3.44Å; R239-A243 PolarHBondContact O-N 2.97Å; E240-A243 PolarHBondContact O-N 3.45Å; A243-T246 WeakPolarHBondContact CA-OG1 3.41Å; A243-T246 PolarHBondContact O-N 3.32Å; A243-T246 PolarHBondContact O-OG1 3.16Å; A243-L247 WeakPolarHBondContact O-CB 3.44Å; A243-L247 PolarHBondContact O-N 2.98Å
244R81.5Confident72.8Confident147 Ų147119.9 Ų119.956%0.55563%0.625SS**Hα-helixtrans-63.9-40.3172.3-73.8164.4178.3-92.84.8111E240 L241 L247 V248E240-R244 WeakPolarHBondContact O-CB 3.4Å; E240-R244 WeakPolarHBondContact O-CD 3.47Å; E240-R244 WeakPolarHBondContact O-CG 3.37Å; E240-R244 PolarHBondContact O-N 2.98Å; E240-R244 IonicContact OE1-CZ 4Å; E240-R244 IonicContact OE1-NE 3.03Å; E240-R244 PolarHBondContact OE1-NE 2.88Å; E240-R244 IonicContact OE1-NH2 2.62Å; E240-R244 PolarHBondContact OE1-NH2 2.88Å; L241-R244 PolarHBondContact O-N 3.32Å; R244-L247 PolarHBondContact O-N 2.81Å; R244-V248 VanDerWaalsContact O-CB 3.27Å; R244-V248 WeakPolarHBondContact O-CB 3.46Å; R244-V248 WeakPolarHBondContact O-CG2 3.34Å; R244-V248 PolarHBondContact O-N 3.4Å
245L67.4Low70.6Confident122 Ų122125.8 Ų125.864%0.63964%0.641SS**Hα-helixtrans-64.7-40.6174.8-77.5164000112.3L241 Q242 L247 G249L241-L245 WeakPolarHBondContact O-CB 3.17Å; L241-L245 VanDerWaalsContact O-CG 3.26Å; L241-L245 WeakPolarHBondContact O-CG 3.38Å; L241-L245 PolarHBondContact O-N 3.49Å; Q242-L245 PolarHBondContact O-N 3.48Å; L245-L247 VanDerWaalsContact C-N 3.35Å; L245-G249 PolarHBondContact O-N 3.28Å
246T69.3Low68.8Low110 Ų110127.8 Ų127.868%0.67565%0.654SS**Hα-helixtrans-70-31.2174.353.90000112.6Q242 A243 G249Q242-T246 PolarHBondContact O-N 2.92Å; Q242-T246 PolarHBondContact O-OG1 3.23Å; A243-T246 WeakPolarHBondContact CA-OG1 3.41Å; A243-T246 PolarHBondContact O-N 3.32Å; A243-T246 PolarHBondContact O-OG1 3.16Å; T246-G249 PolarHBondContact O-N 2.85Å
247L64Low67.1Low151 Ų151125.6 Ų125.679%0.79165%0.651SS**Hα-helixtrans-74.8-35.6175-15375.4000112.8A243 R244 L245 G249A243-L247 WeakPolarHBondContact O-CB 3.44Å; A243-L247 PolarHBondContact O-N 2.98Å; R244-L247 PolarHBondContact O-N 2.81Å; L245-L247 VanDerWaalsContact C-N 3.35Å; L247-G249 PolarHBondContact O-N 3.34Å
248V53.4Low65.4Low93 Ų93126 Ų12656%0.56466%0.66SS**Hα-helixtrans-75.1-8.6172.2170.80000112R244 K250 E251R244-V248 VanDerWaalsContact O-CB 3.27Å; R244-V248 WeakPolarHBondContact O-CB 3.46Å; R244-V248 WeakPolarHBondContact O-CG2 3.34Å; R244-V248 PolarHBondContact O-N 3.4Å; V248-K250 PolarHBondContact O-N 3.06Å; V248-E251 PolarHBondContact O-N 2.99Å; V248-E251 VanDerWaalsContact O-N 3.09Å
249G49.3Very low64.1Low65 Ų65132.6 Ų132.667%0.6767%0.674SS**THydrogen-bonded Turntrans-61.819.1174.900000116.6L245 T246 L247L245-G249 PolarHBondContact O-N 3.28Å; T246-G249 PolarHBondContact O-N 2.85Å; L247-G249 PolarHBondContact O-N 3.34Å
250K55.3Low62.5Low195 Ų195127.4 Ų127.485%0.84866%0.658SS**THydrogen-bonded Turntrans-98-28166.5-79.2-72.7-177.4176.60113.5V248V248-K250 PolarHBondContact O-N 3.06Å
251E54.6Low61.2Low172 Ų172128.6 Ų128.680%0.80466%0.662SS**SBendtrans-141.1110.7-178.4-66.6-172.2179.400111.8V248V248-E251 PolarHBondContact O-N 2.99Å; V248-E251 VanDerWaalsContact O-N 3.09Å
252G41.4Very low60.7Low60 Ų60128.5 Ų128.562%0.61966%0.662SS**  trans159.678.8178.400000114.8Q254G252-Q254 PolarHBondContact O-N 3.13Å
253P53.8Low60.7Low131 Ų131129.3 Ų129.385%0.85166%0.659SS**  trans-81.673.7-171.134-36.8000113.5
254Q51.7Low60.6Low178 Ų178131.2 Ų131.283%0.83266%0.662SS**SBendtrans-149.910.7174.7-149.3140.460.800117.3G252G252-Q254 PolarHBondContact O-N 3.13Å
255W48.3Very low60.5Low220 Ų220128.7 Ų128.783%0.83366%0.659SS**  trans-121.510.3-173.6-74.8102.7000116.5H257W255-H257 VanDerWaalsContact C-N 3.33Å; W255-H257 PolarHBondContact O-N 3.49Å
256L52.8Low61.4Low137 Ų137130.5 Ų130.572%0.71766%0.657SS**THydrogen-bonded Turntrans-64.4-33.1-177.6-78.3165.7000114.2V258 R259L256-V258 PolarHBondContact O-N 2.85Å; L256-R259 PolarHBondContact O-N 3.16Å
257H57.8Low62.1Low125 Ų125128.7 Ų128.758%0.57964%0.641SS**Hα-helixtrans-60-25.2-158.9-15616.2000115.4W255 R259 D260 F261W255-H257 VanDerWaalsContact C-N 3.33Å; W255-H257 PolarHBondContact O-N 3.49Å; H257-R259 VanDerWaalsContact C-N 3.33Å; H257-R259 PolarHBondContact O-N 2.84Å; H257-D260 PolarHBondContact O-N 3.21Å; H257-F261 WeakPolarHBondContact O-CD2 3.47Å; H257-F261 WeakPolarHBondContact O-CE2 3.4Å
258V56.9Low63Low111 Ų111124.3 Ų124.367%0.67362%0.623SS**Hα-helixtrans-69.5-27179.8-176.70000112.7L256L256-V258 PolarHBondContact O-N 2.85Å
259R59.7Low64.3Low219 Ų219125 Ų12583%0.82662%0.62SS**Hα-helixtrans-93.8-11.3178.8-74.2-165.467.7-166.6-1.1114.6L256 H257L256-R259 PolarHBondContact O-N 3.16Å; H257-R259 VanDerWaalsContact C-N 3.33Å; H257-R259 PolarHBondContact O-N 2.84Å
260D58.1Low66.1Low53 Ų53130 Ų13028%0.28362%0.618SS.*Hα-helixtrans-84.4-14.9-178.5-68-49.5000113.2H257 D262 R263 L264H257-D260 PolarHBondContact O-N 3.21Å; D260-D262 PolarHBondContact O-N 3.12Å; D260-R263 WeakPolarHBondContact O-CB 3.47Å; D260-R263 PolarHBondContact O-N 2.97Å; D260-R263 VanDerWaalsContact O-N 3.13Å; D260-L264 HydrophobicContact CB-CD1 4.17Å; D260-L264 WeakPolarHBondContact O-CD1 3.23Å; D260-L264 PolarHBondContact O-N 3.44Å
261F62.2Low67.7Low123 Ų123124.3 Ų124.354%0.53960%0.595SS.*Hα-helixtrans-60-47.3-179.5-75.3-72.4000113.4H257 R263 L264 L265H257-F261 WeakPolarHBondContact O-CD2 3.47Å; H257-F261 WeakPolarHBondContact O-CE2 3.4Å; F261-R263 PolarHBondContact O-N 3.43Å; F261-L264 PolarHBondContact O-N 2.97Å; F261-L265 VanDerWaalsContact O-CB 3.27Å; F261-L265 WeakPolarHBondContact O-CB 3.48Å; F261-L265 PolarHBondContact O-N 2.81Å
262D73.9Confident69.4Low103 Ų103119.7 Ų119.755%0.55158%0.579SS**Hα-helixtrans-62.7-30.2176.5-68.2-51.8000112.4D260 R266D260-D262 PolarHBondContact O-N 3.12Å; D262-R266 WeakPolarHBondContact O-CB 3.35Å; D262-R266 VanDerWaalsContact O-CD 3.31Å; D262-R266 WeakPolarHBondContact O-CD 3.19Å; D262-R266 WeakPolarHBondContact O-CG 3.37Å; D262-R266 PolarHBondContact O-N 3.47Å; D262-R266 VanDerWaalsContact O-N 3.16Å
263R81Confident71.6Confident146 Ų146121.8 Ų121.855%0.55158%0.575SS**Hα-helixtrans-73-51.8176.4-177.2-179.9169.3-145.6-17.3110.7D260 F261 L265 R266 E267D260-R263 WeakPolarHBondContact O-CB 3.47Å; D260-R263 PolarHBondContact O-N 2.97Å; D260-R263 VanDerWaalsContact O-N 3.13Å; F261-R263 PolarHBondContact O-N 3.43Å; R263-L265 VanDerWaalsContact C-N 3.28Å; R263-L265 PolarHBondContact O-N 2.77Å; R263-R266 PolarHBondContact O-N 3.09Å; R263-E267 HydrophobicContact CG-CG 4.43Å; R263-E267 IonicContact CZ-OE1 2.79Å; R263-E267 IonicContact CZ-OE2 3.16Å; R263-E267 IonicContact NE-OE1 2.7Å; R263-E267 PolarHBondContact NE-OE1 3.1Å; R263-E267 IonicContact NE-OE2 3.21Å; R263-E267 IonicContact NH2-OE1 2.65Å; R263-E267 PolarHBondContact NH2-OE1 3.29Å; R263-E267 IonicContact NH2-OE2 2.88Å; R263-E267 WeakPolarHBondContact O-CB 3.46Å; R263-E267 WeakPolarHBondContact O-CG 3.32Å; R263-E267 PolarHBondContact O-N 2.8Å
264L80.1Confident73.4Confident95 Ų95121.3 Ų121.350%0.49756%0.556SS.*Hα-helixtrans-61.1-36176.8-93.575.6000112D260 F261 E267 S268D260-L264 HydrophobicContact CB-CD1 4.17Å; D260-L264 WeakPolarHBondContact O-CD1 3.23Å; D260-L264 PolarHBondContact O-N 3.44Å; F261-L264 PolarHBondContact O-N 2.97Å; L264-E267 PolarHBondContact O-N 3.2Å; L264-S268 WeakPolarHBondContact O-CB 3.41Å; L264-S268 PolarHBondContact O-N 2.98Å; L264-S268 PolarHBondContact O-OG 2.78Å
265L79.3Confident75.2Confident94 Ų94116.6 Ų116.649%0.49254%0.536SS..Hα-helixtrans-65.6-44.4175.7-173.759.7000111.4F261 R263 S268 Q269F261-L265 VanDerWaalsContact O-CB 3.27Å; F261-L265 WeakPolarHBondContact O-CB 3.48Å; F261-L265 PolarHBondContact O-N 2.81Å; R263-L265 VanDerWaalsContact C-N 3.28Å; R263-L265 PolarHBondContact O-N 2.77Å; L265-S268 WeakPolarHBondContact CA-OG 3.45Å; L265-S268 PolarHBondContact O-OG 2.67Å; L265-S268 VanDerWaalsContact O-OG 3.05Å; L265-Q269 WeakPolarHBondContact O-CB 3.35Å; L265-Q269 WeakPolarHBondContact O-CG 3.26Å; L265-Q269 PolarHBondContact O-N 3.13Å
266R86.6Confident76.6Confident160 Ų160111.4 Ų111.460%0.60452%0.521SS*.Hα-helixtrans-68-34.1174.9-69.6167.6-167.7-114.72.6112.5D262 R263 R270D262-R266 WeakPolarHBondContact O-CB 3.35Å; D262-R266 VanDerWaalsContact O-CD 3.31Å; D262-R266 WeakPolarHBondContact O-CD 3.19Å; D262-R266 WeakPolarHBondContact O-CG 3.37Å; D262-R266 PolarHBondContact O-N 3.47Å; D262-R266 VanDerWaalsContact O-N 3.16Å; R263-R266 PolarHBondContact O-N 3.09Å; R266-R270 VanDerWaalsContact O-CD 3.3Å; R266-R270 WeakPolarHBondContact O-CD 3.46Å; R266-R270 WeakPolarHBondContact O-CG 3.14Å; R266-R270 PolarHBondContact O-N 3.31Å; R266-R270 VanDerWaalsContact O-N 3.16Å
267E84.3Confident78Confident72 Ų72114 Ų11434%0.33652%0.522SS..Hα-helixtrans-72.6-44.4177.3-74.7174.1169.900111.7R263 L264 R270 E271R263-E267 HydrophobicContact CG-CG 4.43Å; R263-E267 IonicContact CZ-OE1 2.79Å; R263-E267 IonicContact CZ-OE2 3.16Å; R263-E267 IonicContact NE-OE1 2.7Å; R263-E267 PolarHBondContact NE-OE1 3.1Å; R263-E267 IonicContact NE-OE2 3.21Å; R263-E267 IonicContact NH2-OE1 2.65Å; R263-E267 PolarHBondContact NH2-OE1 3.29Å; R263-E267 IonicContact NH2-OE2 2.88Å; R263-E267 WeakPolarHBondContact O-CB 3.46Å; R263-E267 WeakPolarHBondContact O-CG 3.32Å; R263-E267 PolarHBondContact O-N 2.8Å; L264-E267 PolarHBondContact O-N 3.2Å; E267-R270 WeakPolarHBondContact O-CB 3.16Å; E267-R270 PolarHBondContact O-N 3.39Å; E267-E271 WeakPolarHBondContact O-CB 3.27Å; E267-E271 PolarHBondContact O-N 2.85Å
268S82.3Confident79.2Confident59 Ų59113 Ų11341%0.41352%0.517SS..Hα-helixtrans-64.2-38.9173.652.20000113.2L264 L265 R270 E271 V272L264-S268 WeakPolarHBondContact O-CB 3.41Å; L264-S268 PolarHBondContact O-N 2.98Å; L264-S268 PolarHBondContact O-OG 2.78Å; L265-S268 WeakPolarHBondContact CA-OG 3.45Å; L265-S268 PolarHBondContact O-OG 2.67Å; L265-S268 VanDerWaalsContact O-OG 3.05Å; S268-R270 PolarHBondContact O-N 2.83Å; S268-E271 PolarHBondContact O-N 3.22Å; S268-V272 WeakPolarHBondContact O-CG2 3.35Å; S268-V272 PolarHBondContact O-N 2.82Å
269Q81.1Confident80.3Confident108 Ų108112.3 Ų112.351%0.50551%0.509SS..Hα-helixtrans-62.3-40.4172.9-74.9170-4.600112.4L265 E271 L273L265-Q269 WeakPolarHBondContact O-CB 3.35Å; L265-Q269 WeakPolarHBondContact O-CG 3.26Å; L265-Q269 PolarHBondContact O-N 3.13Å; Q269-E271 VanDerWaalsContact C-N 3.33Å; Q269-L273 WeakPolarHBondContact O-CG 3.45Å; Q269-L273 PolarHBondContact O-N 2.94Å; Q269-L273 VanDerWaalsContact O-N 3.13Å
270R87.9Confident81Confident168 Ų168104.1 Ų104.163%0.63449%0.488SS*.Hα-helixtrans-63.9-39.5172.8-72.2163.2-178.2-179.6-1.2111.7R266 E267 S268 L273 R274R266-R270 VanDerWaalsContact O-CD 3.3Å; R266-R270 WeakPolarHBondContact O-CD 3.46Å; R266-R270 WeakPolarHBondContact O-CG 3.14Å; R266-R270 PolarHBondContact O-N 3.31Å; R266-R270 VanDerWaalsContact O-N 3.16Å; E267-R270 WeakPolarHBondContact O-CB 3.16Å; E267-R270 PolarHBondContact O-N 3.39Å; S268-R270 PolarHBondContact O-N 2.83Å; R270-L273 PolarHBondContact O-N 3.49Å; R270-R274 WeakPolarHBondContact O-CB 3.47Å; R270-R274 PolarHBondContact O-N 3.42Å
271E87.6Confident81.9Confident76 Ų76106.6 Ų106.636%0.35550%0.5SS..Hα-helixtrans-68.6-39.5180-164.158.5-160.400112E267 S268 Q269 L273 R274 L275E267-E271 WeakPolarHBondContact O-CB 3.27Å; E267-E271 PolarHBondContact O-N 2.85Å; S268-E271 PolarHBondContact O-N 3.22Å; Q269-E271 VanDerWaalsContact C-N 3.33Å; E271-L273 PolarHBondContact O-N 3.39Å; E271-R274 VanDerWaalsContact CD-NE 3.31Å; E271-R274 WeakPolarHBondContact O-CB 3.12Å; E271-R274 PolarHBondContact O-N 2.79Å; E271-R274 IonicContact OE1-CZ 3.68Å; E271-R274 IonicContact OE1-NE 2.73Å; E271-R274 PolarHBondContact OE1-NE 3.03Å; E271-R274 IonicContact OE1-NH2 3.33Å; E271-R274 PolarHBondContact OE1-NH2 3.33Å; E271-R274 IonicContact OE2-CZ 2.81Å; E271-R274 IonicContact OE2-NE 2.92Å; E271-R274 PolarHBondContact OE2-NE 2.91Å; E271-L275 HydrophobicContact CG-CD1 4.44Å; E271-L275 WeakPolarHBondContact O-CB 3.33Å; E271-L275 VanDerWaalsContact O-CG 3.31Å; E271-L275 WeakPolarHBondContact O-CG 3.21Å; E271-L275 PolarHBondContact O-N 3.35Å
272V90.8Very high82.5Confident76 Ų76108.1 Ų108.146%0.46150%0.503SS..Hα-helixtrans-58.6-45.6169.9169.30000111.2S268 R274 L275 Q276S268-V272 WeakPolarHBondContact O-CG2 3.35Å; S268-V272 PolarHBondContact O-N 2.82Å; V272-R274 VanDerWaalsContact C-N 3.32Å; V272-R274 PolarHBondContact O-N 3.47Å; V272-L275 PolarHBondContact O-N 3.29Å; V272-Q276 HydrophobicContact CG1-CG 4.37Å; V272-Q276 WeakPolarHBondContact O-CB 3.36Å; V272-Q276 VanDerWaalsContact O-CG 3.32Å; V272-Q276 WeakPolarHBondContact O-CG 3.38Å; V272-Q276 PolarHBondContact O-N 3.24Å
273L88.6Confident82.1Confident104 Ų104107.2 Ų107.255%0.54550%0.498SS..Hα-helixtrans-65.4-33.3176.2-70.4169.1000112.7Q269 R270 E271 R277Q269-L273 WeakPolarHBondContact O-CG 3.45Å; Q269-L273 PolarHBondContact O-N 2.94Å; Q269-L273 VanDerWaalsContact O-N 3.13Å; R270-L273 PolarHBondContact O-N 3.49Å; E271-L273 PolarHBondContact O-N 3.39Å; L273-R277 WeakPolarHBondContact O-CB 3.42Å; L273-R277 PolarHBondContact O-N 3.36Å
274R91.6Very high81Confident120 Ų120106.4 Ų106.445%0.45350%0.5SS..Hα-helixtrans-65.7-46.8174-166.3-179.879.182.41.5111R270 E271 V272 R277 Q278R270-R274 WeakPolarHBondContact O-CB 3.47Å; R270-R274 PolarHBondContact O-N 3.42Å; E271-R274 VanDerWaalsContact CD-NE 3.31Å; E271-R274 WeakPolarHBondContact O-CB 3.12Å; E271-R274 PolarHBondContact O-N 2.79Å; E271-R274 IonicContact OE1-CZ 3.68Å; E271-R274 IonicContact OE1-NE 2.73Å; E271-R274 PolarHBondContact OE1-NE 3.03Å; E271-R274 IonicContact OE1-NH2 3.33Å; E271-R274 PolarHBondContact OE1-NH2 3.33Å; E271-R274 IonicContact OE2-CZ 2.81Å; E271-R274 IonicContact OE2-NE 2.92Å; E271-R274 PolarHBondContact OE2-NE 2.91Å; V272-R274 VanDerWaalsContact C-N 3.32Å; V272-R274 PolarHBondContact O-N 3.47Å; R274-R277 PolarHBondContact O-N 2.81Å; R274-Q278 PolarHBondContact O-N 2.83Å
275L88.1Confident80Confident79 Ų79112.2 Ų112.241%0.41452%0.516SS..Hα-helixtrans-67.1-42.5178-68.7168.7000111.8E271 V272 R277 Q278 I279E271-L275 HydrophobicContact CG-CD1 4.44Å; E271-L275 WeakPolarHBondContact O-CB 3.33Å; E271-L275 VanDerWaalsContact O-CG 3.31Å; E271-L275 WeakPolarHBondContact O-CG 3.21Å; E271-L275 PolarHBondContact O-N 3.35Å; V272-L275 PolarHBondContact O-N 3.29Å; L275-R277 VanDerWaalsContact C-N 3.32Å; L275-R277 PolarHBondContact O-N 3.41Å; L275-Q278 PolarHBondContact O-N 3.06Å; L275-Q278 VanDerWaalsContact O-N 3.13Å; L275-I279 WeakPolarHBondContact O-CG1 3.39Å; L275-I279 PolarHBondContact O-N 3.29Å
276Q78.9Confident78.8Confident111 Ų111113.3 Ų113.352%0.51952%0.518SS..Hα-helixtrans-60.4-40173.4-76.2176.5-16.900112V272 I279 A280V272-Q276 HydrophobicContact CG1-CG 4.37Å; V272-Q276 WeakPolarHBondContact O-CB 3.36Å; V272-Q276 VanDerWaalsContact O-CG 3.32Å; V272-Q276 WeakPolarHBondContact O-CG 3.38Å; V272-Q276 PolarHBondContact O-N 3.24Å; Q276-I279 PolarHBondContact O-N 2.64Å; Q276-A280 WeakPolarHBondContact O-CB 3.32Å; Q276-A280 PolarHBondContact O-N 3.3Å
277R82.3Confident76.7Confident192 Ų192111 Ų11173%0.72552%0.522SS*.Hα-helixtrans-65.1-39.8171.7-83.5-179.3166.4171.1-3.5112.8L273 R274 L275 A280 L281L273-R277 WeakPolarHBondContact O-CB 3.42Å; L273-R277 PolarHBondContact O-N 3.36Å; R274-R277 PolarHBondContact O-N 2.81Å; L275-R277 VanDerWaalsContact C-N 3.32Å; L275-R277 PolarHBondContact O-N 3.41Å; R277-A280 PolarHBondContact O-N 2.93Å; R277-L281 WeakPolarHBondContact O-CB 3.45Å; R277-L281 VanDerWaalsContact O-CG 3.25Å; R277-L281 WeakPolarHBondContact O-CG 3.32Å; R277-L281 PolarHBondContact O-N 3.27Å
278Q81.4Confident74.6Confident104 Ų104114.2 Ų114.249%0.48654%0.541SS..Hα-helixtrans-64-39.9174.5-74.5-171.6-57.300112.2R274 L275 R282R274-Q278 PolarHBondContact O-N 2.83Å; L275-Q278 PolarHBondContact O-N 3.06Å; L275-Q278 VanDerWaalsContact O-N 3.13Å; Q278-R282 VanDerWaalsContact O-CB 3.32Å; Q278-R282 WeakPolarHBondContact O-CB 3.18Å; Q278-R282 PolarHBondContact O-N 3.49Å
279I80.5Confident72.9Confident97 Ų97117.1 Ų117.150%0.49756%0.558SS.*Hα-helixtrans-66-46.9175.3-66.6163.4000110.5L275 Q276 L281 R282 N283L275-I279 WeakPolarHBondContact O-CG1 3.39Å; L275-I279 PolarHBondContact O-N 3.29Å; Q276-I279 PolarHBondContact O-N 2.64Å; I279-L281 PolarHBondContact O-N 3.41Å; I279-R282 WeakPolarHBondContact O-CB 3.48Å; I279-R282 PolarHBondContact O-N 3.39Å; I279-R282 VanDerWaalsContact O-N 3.14Å; I279-N283 PolarHBondContact O-N 3.24Å; I279-N283 PolarHBondContact O-OD1 3.09Å
280A74.1Confident71.1Confident47 Ų47119.8 Ų119.839%0.38858%0.575SS.*Hα-helixtrans-59.1-43.8176.900000112.6Q276 R277 N283 Q284Q276-A280 WeakPolarHBondContact O-CB 3.32Å; Q276-A280 PolarHBondContact O-N 3.3Å; R277-A280 PolarHBondContact O-N 2.93Å; A280-N283 PolarHBondContact O-N 3.21Å; A280-Q284 VanDerWaalsContact O-CG 3.31Å; A280-Q284 WeakPolarHBondContact O-CG 3.2Å; A280-Q284 PolarHBondContact O-N 3.4Å
281L77.6Confident69Low104 Ų104117.2 Ų117.255%0.54558%0.58SS.*Hα-helixtrans-68.8-30.8176.2-71168.9000112.9R277 I279 R285R277-L281 WeakPolarHBondContact O-CB 3.45Å; R277-L281 VanDerWaalsContact O-CG 3.25Å; R277-L281 WeakPolarHBondContact O-CG 3.32Å; R277-L281 PolarHBondContact O-N 3.27Å; I279-L281 PolarHBondContact O-N 3.41Å; L281-R285 WeakPolarHBondContact O-CG 3.44Å; L281-R285 PolarHBondContact O-N 3.19Å
282R75.2Confident67.5Low155 Ų155119.1 Ų119.159%0.58560%0.599SS**Hα-helixtrans-67.9-50.5172.2179.3179.5171.6-171-8.5110.8Q278 I279 Q284 R285 E286Q278-R282 VanDerWaalsContact O-CB 3.32Å; Q278-R282 WeakPolarHBondContact O-CB 3.18Å; Q278-R282 PolarHBondContact O-N 3.49Å; I279-R282 WeakPolarHBondContact O-CB 3.48Å; I279-R282 PolarHBondContact O-N 3.39Å; I279-R282 VanDerWaalsContact O-N 3.14Å; R282-Q284 VanDerWaalsContact C-N 3.26Å; R282-Q284 PolarHBondContact O-N 3.17Å; R282-R285 CarbonylContact O-C 3.6Å; R282-R285 WeakPolarHBondContact O-CA 3.31Å; R282-R285 WeakPolarHBondContact O-CB 3.31Å; R282-R285 PolarHBondContact O-N 2.98Å; R282-E286 HydrophobicContact CG-CG 4.46Å; R282-E286 IonicContact CZ-OE1 2.74Å; R282-E286 IonicContact NE-OE1 2.78Å; R282-E286 PolarHBondContact NE-OE1 3.28Å; R282-E286 IonicContact NE-OE2 2.82Å; R282-E286 IonicContact NH2-OE1 2.71Å; R282-E286 PolarHBondContact NH2-OE1 3.36Å; R282-E286 IonicContact NH2-OE2 3.16Å; R282-E286 PolarHBondContact O-N 3.39Å
283N64.7Low64.5Low84 Ų84121.6 Ų121.645%0.44962%0.62SS.*Hα-helixtrans-60.3-38.5-179.4-62.78.5000111.1I279 A280 R285 E286 T287I279-N283 PolarHBondContact O-N 3.24Å; I279-N283 PolarHBondContact O-OD1 3.09Å; A280-N283 PolarHBondContact O-N 3.21Å; N283-R285 PolarHBondContact O-N 3.09Å; N283-E286 PolarHBondContact O-N 3.03Å; N283-T287 PolarHBondContact O-N 2.66Å; N283-T287 PolarHBondContact O-OG1 3.45Å
284Q59.2Low61.5Low130 Ų130128 Ų12861%0.60764%0.637SS**Hα-helixtrans-63-37.4172.6-74172.94.700113A280 R282 T287A280-Q284 VanDerWaalsContact O-CG 3.31Å; A280-Q284 WeakPolarHBondContact O-CG 3.2Å; A280-Q284 PolarHBondContact O-N 3.4Å; R282-Q284 VanDerWaalsContact C-N 3.26Å; R282-Q284 PolarHBondContact O-N 3.17Å; Q284-T287 PolarHBondContact O-N 2.96Å
285R58.1Low59.2Low216 Ų216127.5 Ų127.582%0.81565%0.649SS**Hα-helixtrans-72.1-28.8175.3-77.8176.2169.1-176.2-4.3113.6L281 R282 N283 T287L281-R285 WeakPolarHBondContact O-CG 3.44Å; L281-R285 PolarHBondContact O-N 3.19Å; R282-R285 CarbonylContact O-C 3.6Å; R282-R285 WeakPolarHBondContact O-CA 3.31Å; R282-R285 WeakPolarHBondContact O-CB 3.31Å; R282-R285 PolarHBondContact O-N 2.98Å; N283-R285 PolarHBondContact O-N 3.09Å; R285-T287 PolarHBondContact O-N 3.35Å
286E53.5Low57.4Low118 Ų118129.5 Ų129.555%0.55167%0.667SS**THydrogen-bonded Turntrans-79.2-2.8177.2-70.7174.6165.500113.1R282 N283R282-E286 HydrophobicContact CG-CG 4.46Å; R282-E286 IonicContact CZ-OE1 2.74Å; R282-E286 IonicContact NE-OE1 2.78Å; R282-E286 PolarHBondContact NE-OE1 3.28Å; R282-E286 IonicContact NE-OE2 2.82Å; R282-E286 IonicContact NH2-OE1 2.71Å; R282-E286 PolarHBondContact NH2-OE1 3.36Å; R282-E286 IonicContact NH2-OE2 3.16Å; R282-E286 PolarHBondContact O-N 3.39Å; N283-E286 PolarHBondContact O-N 3.03Å
287T42.5Very low55.1Low110 Ų110127.6 Ų127.668%0.67568%0.677SS**THydrogen-bonded Turntrans-11214.9-175.4-42.30000114N283 Q284 R285N283-T287 PolarHBondContact O-N 2.66Å; N283-T287 PolarHBondContact O-OG1 3.45Å; Q284-T287 PolarHBondContact O-N 2.96Å; R285-T287 PolarHBondContact O-N 3.35Å
288L39.9Very low53.9Low141 Ų141124.6 Ų124.674%0.73868%0.682SS**SBendtrans-118.8136.1177.5-117.675.3000112.9
289P46.8Very low51.5Low119 Ų119123.8 Ų123.877%0.77369%0.694SS**  trans-71146.3176.6-16.731.1000113.4
290L44.8Very low49.5Very low164 Ų164126.1 Ų126.186%0.85971%0.706SS**  trans-87.8138.6179.4-133.680.8000112.7
291P42.7Very low47.7Very low114 Ų114132.3 Ų132.374%0.7473%0.727SS**  trans-118.5164.3139.4-0.321.8000112.3
292P55.5Low45.5Very low116 Ų116131.2 Ų131.275%0.75373%0.733SS**  trans-107.8157.2-158.639.1-35000116.5
293S28.9Very low43.5Very low128 Ų128135.8 Ų135.890%0.89575%0.751SS**  trans-162.8146.5145.4-7.30000114
294W24.4Very low42Very low240 Ų240136.4 Ų136.491%0.90977%0.767SS**  trans-75.6175.1160.2-136.2-96.3000109
295P44Very low40.8Very low108 Ų108133.3 Ų133.370%0.70177%0.77SS**  cis-114.3173.9-7.2-1.226.5000115.4
296P50.4Low39.6Very low121 Ų121127.9 Ų127.979%0.78677%0.771SS**  trans-78.4140.2154.533.3-32.2000112.3
297G31.1Very low39.2Very low72 Ų72128.3 Ų128.374%0.74278%0.784SS**  trans-140.8162.817600000112.1
298P56.5Low39Very low128 Ų128127.4 Ų127.483%0.83179%0.788SS**  trans-115.2-175.2-144.942.1-35.2000116
299A30.8Very low39.3Very low88 Ų88127.1 Ų127.173%0.72780%0.795SS**  trans78.3152.4158.900000116.2
300L38.2Very low38.6Very low146 Ų146125.1 Ų125.176%0.76480%0.796SS**  cis-163.6179.4-2.4-127.7174.4000111.1
301Q36.9Very low38.1Very low177 Ų177122 Ų12283%0.82779%0.794SS**  trans71.9148.5159.7-72.417184.500117.9
302A30.4Very low38.3Very low81 Ų81122.7 Ų122.767%0.66980%0.798SS**  cis-151.6143.6-9.200000108.8
303R33.6Very low37.1Very low251 Ų251120.6 Ų120.695%0.94780%0.797SS**  63.6137.879-131.4-173.3177155.2-1.2112.6
304A34.2Very low37.2Very low97 Ų97124 Ų12480%0.80280%0.799SS**  cis-145.5179.37.800000109.8
305G32.8Very low37.3Very low65 Ų65117.2 Ų117.267%0.6779%0.794SS**  cis-174147.2-1.500000109.3
306A33.2Very low37.3Very low101 Ų101118.5 Ų118.584%0.83580%0.8SS**  87.7157.495.200000113.9
307P45.2Very low36.8Very low127 Ų127118.7 Ų118.783%0.82580%0.801SS**  cis-123.51793.342.2-28.1000115.6
308A39Very low37Very low92 Ų92123.7 Ų123.776%0.7681%0.805SS**  trans-106.2176.616400000110.3
309P46.2Very low36.1Very low134 Ų134126.6 Ų126.687%0.8781%0.808SS**  -143.4179.380.537.7-20.1000113.3
310G31.4Very low36.2Very low77 Ų77129.6 Ų129.679%0.79481%0.812SS**  cis175.5154.6-5.400000110.7
311A34.6Very low36.4Very low99 Ų99126.7 Ų126.782%0.81881%0.809SS**  trans-100.8179.5174.400000110.6
312P46.3Very low36.3Very low129 Ų129125.1 Ų125.184%0.83881%0.806SS**  -153.7-166.661.443-21.1000116.3
313G30.6Very low36.4Very low71 Ų71128.3 Ų128.373%0.73281%0.812SS**  trans91.5114.7163.700000114.7
314E31.8Very low37.1Very low201 Ų201124 Ų12494%0.93981%0.807SS**  cis8410328.1-163.7174.9-132.900115.5
315A26.1Very low37.9Very low96 Ų96124.5 Ų124.579%0.79380%0.802SS**  trans171.6134.8145.300000110
316T43.3Very low38.1Very low135 Ų135127 Ų12783%0.82880%0.804SS**  trans-83.5164.1157.141.60000109.8
317P39.6Very low38.8Very low125 Ų125128.8 Ų128.881%0.81280%0.798SS**  -137.1174.5109.438.3-28.1000114
318Q36.3Very low38.7Very low177 Ų177130.4 Ų130.483%0.82780%0.799SS**  trans-94.9145.2179.3-178.7176.2-53.800109.9
319E36.9Very low38.8Very low189 Ų189127.9 Ų127.988%0.88378%0.782SS**  trans-114.3131.7168.8-70.8-171.7141.700109.7
320D33.2Very low39.1Very low152 Ų152128.4 Ų128.481%0.81377%0.773SS**  trans-154.9130.7158.2-123-28.3000109.2
321A43.1Very low40.5Very low85 Ų85128.7 Ų128.770%0.70276%0.76SS**  trans51.4127.4165.100000123
322D34.9Very low41.8Very low144 Ų144129.3 Ų129.377%0.7775%0.746SS**  90.2111129.5-77.15.8000125
323N32.3Very low43.2Very low147 Ų147128.9 Ų128.979%0.78673%0.731SS**  trans90.1145.2137.7-74.6-65.8000122.8
324L47.1Very low45.5Very low161 Ų161131.1 Ų131.184%0.84372%0.723SS**  trans-86177.5-173.3-11776.6000112
325P52.6Low47.8Very low108 Ų108127.9 Ų127.970%0.70171%0.708SS**  cis-152.7-168.340.438.1-12.4000118.5
326V37Very low50.7Low117 Ų117130.7 Ų130.771%0.70970%0.697SS**  trans68.198.9163.4-170.70000116.2
327I46.4Very low52.8Low139 Ų139127.8 Ų127.871%0.71368%0.679SS**  68.296.274.2-56.4162.9000114.4
328L43.9Very low55.1Low161 Ų161127.7 Ų127.784%0.84367%0.668SS**  trans-173150.2130.1-100.7166.1000108.5
329G41.7Very low57.7Low39 Ų39124.7 Ų124.740%0.40265%0.654SS.*  trans85.775.3177.300000115.2K333G329-K333 WeakPolarHBondContact O-CD 3.3Å; G329-K333 WeakPolarHBondContact O-CE 3.5Å
330E52.3Low60.3Low145 Ų145120.6 Ų120.668%0.67864%0.638SS**  trans-85.3-41.6173.5-64.7-179.613900114.8E332 K333 E334E330-E332 VanDerWaalsContact C-N 3.34Å; E330-E332 PolarHBondContact O-N 2.95Å; E330-K333 WeakPolarHBondContact O-CB 3.42Å; E330-K333 PolarHBondContact O-N 3.38Å; E330-E334 PolarHBondContact O-N 3.14Å
331P60.4Low63.1Low82 Ų82118.8 Ų118.853%0.53263%0.625SS.*Hα-helixtrans-68.3-28.3-173.926-34.9000114.1K333 Q335P331-K333 VanDerWaalsContact C-N 3.29Å; P331-K333 PolarHBondContact O-N 3.31Å; P331-Q335 WeakPolarHBondContact O-CG 3.31Å; P331-Q335 PolarHBondContact O-N 2.99Å; P331-Q335 VanDerWaalsContact O-N 3.13Å
332E62.5Low65.4Low112 Ų112116.6 Ų116.652%0.52360%0.604SS.*Hα-helixtrans-66.6-32172.6-78.9-164-147.200112.6E330 R336E330-E332 VanDerWaalsContact C-N 3.34Å; E330-E332 PolarHBondContact O-N 2.95Å; E332-R336 WeakPolarHBondContact O-CB 3.47Å; E332-R336 WeakPolarHBondContact O-CD 3.45Å; E332-R336 WeakPolarHBondContact O-CG 3.42Å; E332-R336 PolarHBondContact O-N 3.07Å; E332-R336 VanDerWaalsContact O-N 3.1Å; E332-R336 IonicContact OE2-CZ 2.62Å; E332-R336 IonicContact OE2-NE 2.9Å; E332-R336 IonicContact OE2-NH2 3.17Å; E332-R336 PolarHBondContact OE2-NH2 3.34Å
333K74.8Confident68.3Low121 Ų121113.6 Ų113.653%0.52659%0.585SS.*Hα-helixtrans-71.3-42.6179.3-63.7173.3-175170.70109.7G329 E330 P331 R336 V337G329-K333 WeakPolarHBondContact O-CD 3.3Å; G329-K333 WeakPolarHBondContact O-CE 3.5Å; E330-K333 WeakPolarHBondContact O-CB 3.42Å; E330-K333 PolarHBondContact O-N 3.38Å; P331-K333 VanDerWaalsContact C-N 3.29Å; P331-K333 PolarHBondContact O-N 3.31Å; K333-R336 PolarHBondContact O-N 2.86Å; K333-V337 VanDerWaalsContact O-CG2 3.32Å; K333-V337 WeakPolarHBondContact O-CG2 3.36Å; K333-V337 PolarHBondContact O-N 2.91Å
334E78.8Confident71.3Confident118 Ų118111.5 Ų111.555%0.55157%0.573SS**Hα-helixtrans-59.5-46174.7-63.8179.6155.200112.1E330 R336 V337 Q338E330-E334 PolarHBondContact O-N 3.14Å; E334-R336 PolarHBondContact O-N 2.94Å; E334-V337 PolarHBondContact O-N 2.93Å; E334-Q338 WeakPolarHBondContact O-CG 3.36Å; E334-Q338 PolarHBondContact O-N 3.27Å
335Q80.8Confident73.5Confident133 Ų133106.2 Ų106.262%0.62155%0.55SS**Hα-helixtrans-62.2-42176.5-71.1179.511.400112.4P331 Q338 Q339P331-Q335 WeakPolarHBondContact O-CG 3.31Å; P331-Q335 PolarHBondContact O-N 2.99Å; P331-Q335 VanDerWaalsContact O-N 3.13Å; Q335-Q338 PolarHBondContact O-N 2.75Å; Q335-Q339 PolarHBondContact O-N 3.45Å
336R87.8Confident75.6Confident154 Ų154106.7 Ų106.758%0.58154%0.541SS*.Hα-helixtrans-64.3-40.9175.6-69.4167.5-164.5-131.210.3111.7E332 K333 E334 Q339 L340E332-R336 WeakPolarHBondContact O-CB 3.47Å; E332-R336 WeakPolarHBondContact O-CD 3.45Å; E332-R336 WeakPolarHBondContact O-CG 3.42Å; E332-R336 PolarHBondContact O-N 3.07Å; E332-R336 VanDerWaalsContact O-N 3.1Å; E332-R336 IonicContact OE2-CZ 2.62Å; E332-R336 IonicContact OE2-NE 2.9Å; E332-R336 IonicContact OE2-NH2 3.17Å; E332-R336 PolarHBondContact OE2-NH2 3.34Å; K333-R336 PolarHBondContact O-N 2.86Å; E334-R336 PolarHBondContact O-N 2.94Å; R336-Q339 PolarHBondContact O-N 3.45Å; R336-L340 WeakPolarHBondContact O-CB 3.17Å; R336-L340 VanDerWaalsContact O-CG 3.28Å; R336-L340 WeakPolarHBondContact O-CG 3.4Å; R336-L340 PolarHBondContact O-N 2.62Å
337V85.7Confident78.5Confident74 Ų74107.5 Ų107.545%0.44854%0.535SS..Hα-helixtrans-62-50.5174.7168.60000110.7K333 E334 Q339 L340 E341K333-V337 VanDerWaalsContact O-CG2 3.32Å; K333-V337 WeakPolarHBondContact O-CG2 3.36Å; K333-V337 PolarHBondContact O-N 2.91Å; E334-V337 PolarHBondContact O-N 2.93Å; V337-Q339 VanDerWaalsContact C-N 3.3Å; V337-Q339 PolarHBondContact O-N 3.37Å; V337-L340 CarbonylContact O-C 3.58Å; V337-L340 PolarHBondContact O-N 3.28Å; V337-L340 VanDerWaalsContact O-N 3.09Å; V337-E341 HydrophobicContact CG1-CG 4.28Å; V337-E341 WeakPolarHBondContact O-CG 3.44Å; V337-E341 PolarHBondContact O-N 2.96Å
338Q88.9Confident80.9Confident123 Ų123108.9 Ų108.958%0.57553%0.531SS*.Hα-helixtrans-60.1-37.7178-70.6175.720.700112.6E334 Q335 S342E334-Q338 WeakPolarHBondContact O-CG 3.36Å; E334-Q338 PolarHBondContact O-N 3.27Å; Q335-Q338 PolarHBondContact O-N 2.75Å; Q338-S342 WeakPolarHBondContact O-CB 3.33Å; Q338-S342 PolarHBondContact O-N 2.88Å
339Q90.8Very high83.4Confident115 Ų115108 Ų10854%0.53752%0.521SS..Hα-helixtrans-62.2-49.9172.9-178.5177.9-18.400111.1Q335 R336 V337 E341 S342 E343Q335-Q339 PolarHBondContact O-N 3.45Å; R336-Q339 PolarHBondContact O-N 3.45Å; V337-Q339 VanDerWaalsContact C-N 3.3Å; V337-Q339 PolarHBondContact O-N 3.37Å; Q339-E341 VanDerWaalsContact C-N 3.33Å; Q339-E341 PolarHBondContact O-N 3Å; Q339-S342 CarbonylContact O-C 3.6Å; Q339-S342 WeakPolarHBondContact O-CA 3.46Å; Q339-S342 WeakPolarHBondContact O-CB 3.42Å; Q339-S342 PolarHBondContact O-N 3.21Å; Q339-S342 VanDerWaalsContact O-N 3.09Å; Q339-S342 PolarHBondContact O-OG 2.9Å; Q339-E343 PolarHBondContact NE2-OE1 3.5Å; Q339-E343 PolarHBondContact O-N 3.33Å
340L91.9Very high86Confident102 Ų102112.7 Ų112.753%0.53453%0.53SS..Hα-helixtrans-61.8-38.2179-71.5169.2000112.1R336 V337 E343 L344R336-L340 WeakPolarHBondContact O-CB 3.17Å; R336-L340 VanDerWaalsContact O-CG 3.28Å; R336-L340 WeakPolarHBondContact O-CG 3.4Å; R336-L340 PolarHBondContact O-N 2.62Å; V337-L340 CarbonylContact O-C 3.58Å; V337-L340 PolarHBondContact O-N 3.28Å; V337-L340 VanDerWaalsContact O-N 3.09Å; L340-E343 PolarHBondContact O-N 2.92Å; L340-L344 VanDerWaalsContact O-CB 3.32Å; L340-L344 WeakPolarHBondContact O-CB 3.21Å; L340-L344 VanDerWaalsContact O-CG 3.27Å; L340-L344 WeakPolarHBondContact O-CG 3.47Å; L340-L344 PolarHBondContact O-N 3.05Å
341E91.3Very high88Confident115 Ų115109.1 Ų109.154%0.53752%0.52SS..Hα-helixtrans-63.5-40.4171.6-71.7176.715700111.9V337 Q339 E343 S345V337-E341 HydrophobicContact CG1-CG 4.28Å; V337-E341 WeakPolarHBondContact O-CG 3.44Å; V337-E341 PolarHBondContact O-N 2.96Å; Q339-E341 VanDerWaalsContact C-N 3.33Å; Q339-E341 PolarHBondContact O-N 3Å; E341-E343 VanDerWaalsContact C-N 3.27Å; E341-E343 PolarHBondContact O-N 3.21Å; E341-S345 VanDerWaalsContact O-CB 3.29Å; E341-S345 WeakPolarHBondContact O-CB 3.36Å; E341-S345 PolarHBondContact O-N 2.83Å; E341-S345 PolarHBondContact O-OG 2.9Å
342S91.6Very high89.8Confident38 Ų38110 Ų11027%0.26652%0.518SS..Hα-helixtrans-62.7-35.8173.495.30000111.6Q338 Q339 S345 K346Q338-S342 WeakPolarHBondContact O-CB 3.33Å; Q338-S342 PolarHBondContact O-N 2.88Å; Q339-S342 CarbonylContact O-C 3.6Å; Q339-S342 WeakPolarHBondContact O-CA 3.46Å; Q339-S342 WeakPolarHBondContact O-CB 3.42Å; Q339-S342 PolarHBondContact O-N 3.21Å; Q339-S342 VanDerWaalsContact O-N 3.09Å; Q339-S342 PolarHBondContact O-OG 2.9Å; S342-S345 WeakPolarHBondContact CA-OG 3.47Å; S342-S345 PolarHBondContact O-OG 2.9Å; S342-S345 VanDerWaalsContact O-OG 3.05Å; S342-K346 WeakPolarHBondContact O-CB 3.3Å; S342-K346 WeakPolarHBondContact O-CD 3.49Å; S342-K346 WeakPolarHBondContact O-CE 3.4Å; S342-K346 WeakPolarHBondContact O-CG 3.18Å; S342-K346 PolarHBondContact O-N 2.65Å; S342-K346 VanDerWaalsContact O-N 3.11Å; S342-K346 PolarHBondContact OG-NZ 2.93Å
343E94.7Very high91.4Very high81 Ų81107.7 Ų107.738%0.37951%0.514SS..Hα-helixtrans-79.1-42.3179.7-71.6-172.4-145.100112Q339 L340 E341 S345 K346 K347Q339-E343 PolarHBondContact NE2-OE1 3.5Å; Q339-E343 PolarHBondContact O-N 3.33Å; L340-E343 PolarHBondContact O-N 2.92Å; E341-E343 VanDerWaalsContact C-N 3.27Å; E341-E343 PolarHBondContact O-N 3.21Å; E343-S345 VanDerWaalsContact C-N 3.34Å; E343-S345 PolarHBondContact O-N 3.2Å; E343-K346 CarbonylContact O-C 3.57Å; E343-K346 PolarHBondContact O-N 3Å; E343-K347 WeakPolarHBondContact O-CB 3.47Å; E343-K347 WeakPolarHBondContact O-CG 3.17Å; E343-K347 PolarHBondContact O-N 2.73Å
344L95.6Very high92.5Very high103 Ų103107 Ų10754%0.53952%0.515SS..Hα-helixtrans-61.4-40.2172.7-73.7171.2000111.5L340 K347 R348L340-L344 VanDerWaalsContact O-CB 3.32Å; L340-L344 WeakPolarHBondContact O-CB 3.21Å; L340-L344 VanDerWaalsContact O-CG 3.27Å; L340-L344 WeakPolarHBondContact O-CG 3.47Å; L340-L344 PolarHBondContact O-N 3.05Å; L344-K347 PolarHBondContact O-N 3.37Å; L344-R348 WeakPolarHBondContact O-CB 3.34Å; L344-R348 VanDerWaalsContact O-CG 3.26Å; L344-R348 WeakPolarHBondContact O-CG 3.48Å; L344-R348 PolarHBondContact O-N 3.43Å
345S94.1Very high93.3Very high51 Ų51105.9 Ų105.936%0.35751%0.51SS..Hα-helixtrans-69.9-37.1174.858.80000112.8E341 S342 E343 K347 K349E341-S345 VanDerWaalsContact O-CB 3.29Å; E341-S345 WeakPolarHBondContact O-CB 3.36Å; E341-S345 PolarHBondContact O-N 2.83Å; E341-S345 PolarHBondContact O-OG 2.9Å; S342-S345 WeakPolarHBondContact CA-OG 3.47Å; S342-S345 PolarHBondContact O-OG 2.9Å; S342-S345 VanDerWaalsContact O-OG 3.05Å; E343-S345 VanDerWaalsContact C-N 3.34Å; E343-S345 PolarHBondContact O-N 3.2Å; S345-K347 VanDerWaalsContact C-N 3.33Å; S345-K349 WeakPolarHBondContact O-CG 3.49Å; S345-K349 PolarHBondContact O-N 3.49Å; S345-K349 VanDerWaalsContact O-N 3.11Å
346K96.9Very high94.1Very high117 Ų117104.8 Ų104.851%0.50951%0.505SS..Hα-helixtrans-62.3-37.9168.6-70.5157.6-161.8154.80111.8S342 E343 K350S342-K346 WeakPolarHBondContact O-CB 3.3Å; S342-K346 WeakPolarHBondContact O-CD 3.49Å; S342-K346 WeakPolarHBondContact O-CE 3.4Å; S342-K346 WeakPolarHBondContact O-CG 3.18Å; S342-K346 PolarHBondContact O-N 2.65Å; S342-K346 VanDerWaalsContact O-N 3.11Å; S342-K346 PolarHBondContact OG-NZ 2.93Å; E343-K346 CarbonylContact O-C 3.57Å; E343-K346 PolarHBondContact O-N 3Å; K346-K350 WeakPolarHBondContact O-CG 3.47Å; K346-K350 PolarHBondContact O-N 3.29Å
347K96.9Very high94.5Very high135 Ų135101.7 Ų101.759%0.58750%0.497SS*.Hα-helixtrans-72.1-44.7178.1-66.2-95-176.2162.70111.5E343 L344 S345 K349 K350 C351E343-K347 WeakPolarHBondContact O-CB 3.47Å; E343-K347 WeakPolarHBondContact O-CG 3.17Å; E343-K347 PolarHBondContact O-N 2.73Å; L344-K347 PolarHBondContact O-N 3.37Å; S345-K347 VanDerWaalsContact C-N 3.33Å; K347-K349 PolarHBondContact O-N 3.41Å; K347-K350 CarbonylContact O-C 3.59Å; K347-K350 WeakPolarHBondContact O-CA 3.28Å; K347-K350 WeakPolarHBondContact O-CB 3.37Å; K347-K350 PolarHBondContact O-N 3.4Å; K347-K350 VanDerWaalsContact O-N 3.08Å; K347-C351 PolarHBondContact O-N 3.26Å; K347-C351 PolarHBondContact O-SG 3.16Å; K347-C351 VanDerWaalsContact O-SG 3.33Å
348R96.6Very high95.1Very high168 Ų168100.8 Ų100.863%0.63450%0.497SS*.Hα-helixtrans-54.2-51.7173.5-75.1169.1-173.8-105.35.5111.4L344 K350 C351 E352L344-R348 WeakPolarHBondContact O-CB 3.34Å; L344-R348 VanDerWaalsContact O-CG 3.26Å; L344-R348 WeakPolarHBondContact O-CG 3.48Å; L344-R348 PolarHBondContact O-N 3.43Å; R348-K350 VanDerWaalsContact C-N 3.27Å; R348-K350 PolarHBondContact O-N 3.03Å; R348-C351 WeakPolarHBondContact O-CA 3.25Å; R348-C351 WeakPolarHBondContact O-CB 3.4Å; R348-C351 PolarHBondContact O-N 2.89Å; R348-E352 WeakPolarHBondContact O-CG 3.18Å; R348-E352 PolarHBondContact O-N 3.31Å
349K97.2Very high95.5Very high143 Ų143102.1 Ų102.162%0.62250%0.497SS*.Hα-helixtrans-58.6-34.6175.5-71174.5-179.4178.90113.4S345 K347 S353S345-K349 WeakPolarHBondContact O-CG 3.49Å; S345-K349 PolarHBondContact O-N 3.49Å; S345-K349 VanDerWaalsContact O-N 3.11Å; K347-K349 PolarHBondContact O-N 3.41Å; K349-S353 WeakPolarHBondContact O-CB 3.41Å; K349-S353 PolarHBondContact O-N 3.32Å; K349-S353 VanDerWaalsContact O-N 3.08Å
350K97Very high95.9Very high136 Ų136102.4 Ų102.459%0.59150%0.496SS*.Hα-helixtrans-68.5-46.1172.6-75.3175.8178.3-174.30111.4K346 K347 R348 S353 L354K346-K350 WeakPolarHBondContact O-CG 3.47Å; K346-K350 PolarHBondContact O-N 3.29Å; K347-K350 CarbonylContact O-C 3.59Å; K347-K350 WeakPolarHBondContact O-CA 3.28Å; K347-K350 WeakPolarHBondContact O-CB 3.37Å; K347-K350 PolarHBondContact O-N 3.4Å; K347-K350 VanDerWaalsContact O-N 3.08Å; R348-K350 VanDerWaalsContact C-N 3.27Å; R348-K350 PolarHBondContact O-N 3.03Å; K350-S353 PolarHBondContact O-N 2.96Å; K350-S353 PolarHBondContact O-OG 3.4Å; K350-L354 WeakPolarHBondContact O-CG 3.35Å; K350-L354 PolarHBondContact O-N 3.26Å
351C94.8Very high96.2Very high70 Ų70103 Ų10347%0.47350%0.495SS..Hα-helixtrans-58.9-47.8174.8-62.90000111.6K347 R348 S353 L354 E355K347-C351 PolarHBondContact O-N 3.26Å; K347-C351 PolarHBondContact O-SG 3.16Å; K347-C351 VanDerWaalsContact O-SG 3.33Å; R348-C351 WeakPolarHBondContact O-CA 3.25Å; R348-C351 WeakPolarHBondContact O-CB 3.4Å; R348-C351 PolarHBondContact O-N 2.89Å; C351-S353 VanDerWaalsContact C-N 3.29Å; C351-S353 PolarHBondContact O-N 3.42Å; C351-L354 PolarHBondContact O-N 3.31Å; C351-L354 VanDerWaalsContact O-N 3.12Å; C351-E355 PolarHBondContact O-N 3.09Å
352E97Very high96.5Very high102 Ų102103.1 Ų103.148%0.47750%0.495SS..Hα-helixtrans-54.9-42.4174.4-70.4158.6-15500112.1R348 Q356R348-E352 WeakPolarHBondContact O-CG 3.18Å; R348-E352 PolarHBondContact O-N 3.31Å; E352-Q356 WeakPolarHBondContact O-CG 3.34Å; E352-Q356 PolarHBondContact O-N 3.36Å
353S96.2Very high96.8Very high63 Ų63110 Ų11044%0.44152%0.515SS..Hα-helixtrans-68.2-38.6177.775.30000112.9K349 K350 C351 Q356 E357K349-S353 WeakPolarHBondContact O-CB 3.41Å; K349-S353 PolarHBondContact O-N 3.32Å; K349-S353 VanDerWaalsContact O-N 3.08Å; K350-S353 PolarHBondContact O-N 2.96Å; K350-S353 PolarHBondContact O-OG 3.4Å; C351-S353 VanDerWaalsContact C-N 3.29Å; C351-S353 PolarHBondContact O-N 3.42Å; S353-Q356 PolarHBondContact O-N 3.26Å; S353-E357 PolarHBondContact O-N 2.88Å
354L97.2Very high97Very high106 Ų106114.2 Ų114.256%0.55553%0.528SS*.Hα-helixtrans-71.2-37176.6-70.3170.6000111.4K350 C351 E357 A358K350-L354 WeakPolarHBondContact O-CG 3.35Å; K350-L354 PolarHBondContact O-N 3.26Å; C351-L354 PolarHBondContact O-N 3.31Å; C351-L354 VanDerWaalsContact O-N 3.12Å; L354-E357 PolarHBondContact O-N 2.98Å; L354-A358 WeakPolarHBondContact O-CB 3.39Å; L354-A358 PolarHBondContact O-N 3.35Å
355E96.1Very high97.1Very high95 Ų95112.6 Ų112.644%0.44452%0.524SS..Hα-helixtrans-62.2-43.9170.8-79.9-172.1-126.600111.5C351 E357 A358 R359C351-E355 PolarHBondContact O-N 3.09Å; E355-E357 VanDerWaalsContact C-N 3.29Å; E355-E357 PolarHBondContact O-N 3.45Å; E355-A358 PolarHBondContact O-N 3.18Å; E355-R359 WeakPolarHBondContact O-CB 3.28Å; E355-R359 WeakPolarHBondContact O-CD 3.43Å; E355-R359 WeakPolarHBondContact O-CG 3.23Å; E355-R359 PolarHBondContact O-N 3.32Å; E355-R359 IonicContact OE2-CZ 3.74Å; E355-R359 IonicContact OE2-NE 2.8Å; E355-R359 IonicContact OE2-NH2 3.84Å; E355-R359 PolarHBondContact OE2-NH2 3.03Å
356Q97.6Very high97.2Very high110 Ų110114.5 Ų114.551%0.51453%0.528SS..Hα-helixtrans-62.6-36.9174.3-73.8-178.534.900112E352 S353 K360E352-Q356 WeakPolarHBondContact O-CG 3.34Å; E352-Q356 PolarHBondContact O-N 3.36Å; S353-Q356 PolarHBondContact O-N 3.26Å; Q356-K360 WeakPolarHBondContact O-CB 3.26Å; Q356-K360 VanDerWaalsContact O-CD 3.32Å; Q356-K360 WeakPolarHBondContact O-CD 3.38Å; Q356-K360 WeakPolarHBondContact O-CG 3.26Å; Q356-K360 PolarHBondContact O-N 3.32Å
357E97.4Very high97.3Very high89 Ų89114.5 Ų114.542%0.41653%0.529SS..Hα-helixtrans-69.7-42175.2-160.4-171.4144.300112.1S353 L354 E355 K360 K361S353-E357 PolarHBondContact O-N 2.88Å; L354-E357 PolarHBondContact O-N 2.98Å; E355-E357 VanDerWaalsContact C-N 3.29Å; E355-E357 PolarHBondContact O-N 3.45Å; E357-K360 WeakPolarHBondContact O-CB 3.34Å; E357-K360 PolarHBondContact O-N 3.48Å; E357-K361 WeakPolarHBondContact O-CG 3.49Å; E357-K361 PolarHBondContact O-N 3.36Å; E357-K361 WeakPolarHBondContact OE1-CE 3.26Å; E357-K361 IonicContact OE1-NZ 2.65Å; E357-K361 PolarHBondContact OE1-NZ 2.94Å
358A97.8Very high97.4Very high55 Ų55113.2 Ų113.246%0.45553%0.529SS..Hα-helixtrans-60.7-47.2174.600000111.2L354 E355 K360 K361 Q362L354-A358 WeakPolarHBondContact O-CB 3.39Å; L354-A358 PolarHBondContact O-N 3.35Å; E355-A358 PolarHBondContact O-N 3.18Å; A358-K360 VanDerWaalsContact C-N 3.31Å; A358-K360 PolarHBondContact O-N 3.29Å; A358-K361 PolarHBondContact O-N 3.11Å; A358-K361 VanDerWaalsContact O-N 3.15Å; A358-Q362 WeakPolarHBondContact O-CB 3.4Å; A358-Q362 PolarHBondContact O-N 3.46Å
359R97.8Very high97.4Very high150 Ų150109.5 Ų109.557%0.56652%0.518SS*.Hα-helixtrans-60.8-36.3174.4-66.7167.3-163.5-155.39.3112.1E355 R363E355-R359 WeakPolarHBondContact O-CB 3.28Å; E355-R359 WeakPolarHBondContact O-CD 3.43Å; E355-R359 WeakPolarHBondContact O-CG 3.23Å; E355-R359 PolarHBondContact O-N 3.32Å; E355-R359 IonicContact OE2-CZ 3.74Å; E355-R359 IonicContact OE2-NE 2.8Å; E355-R359 IonicContact OE2-NH2 3.84Å; E355-R359 PolarHBondContact OE2-NH2 3.03Å; R359-R363 WeakPolarHBondContact O-CG 3.3Å; R359-R363 PolarHBondContact O-N 2.9Å
360K98.3Very high97.5Very high122 Ų122107.2 Ų107.253%0.5351%0.512SS..Hα-helixtrans-69.2-39.5173.5-74.4162.3-172.2165.40112.3Q356 E357 A358 R364Q356-K360 WeakPolarHBondContact O-CB 3.26Å; Q356-K360 VanDerWaalsContact O-CD 3.32Å; Q356-K360 WeakPolarHBondContact O-CD 3.38Å; Q356-K360 WeakPolarHBondContact O-CG 3.26Å; Q356-K360 PolarHBondContact O-N 3.32Å; E357-K360 WeakPolarHBondContact O-CB 3.34Å; E357-K360 PolarHBondContact O-N 3.48Å; A358-K360 VanDerWaalsContact C-N 3.31Å; A358-K360 PolarHBondContact O-N 3.29Å; K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 3.41Å
361K98Very high97.6Very high115 Ų115105.2 Ų105.250%0.551%0.505SS..Hα-helixtrans-66.7-45.7175.2-75.6172.2179167.70111.2E357 A358 R363 R364 C365E357-K361 WeakPolarHBondContact O-CG 3.49Å; E357-K361 PolarHBondContact O-N 3.36Å; E357-K361 WeakPolarHBondContact OE1-CE 3.26Å; E357-K361 IonicContact OE1-NZ 2.65Å; E357-K361 PolarHBondContact OE1-NZ 2.94Å; A358-K361 PolarHBondContact O-N 3.11Å; A358-K361 VanDerWaalsContact O-N 3.15Å; K361-R363 PolarHBondContact O-N 3.33Å; K361-R364 WeakPolarHBondContact O-CB 3.48Å; K361-R364 PolarHBondContact O-N 3.43Å; K361-R364 VanDerWaalsContact O-N 3.09Å; K361-C365 PolarHBondContact O-N 2.86Å; K361-C365 PolarHBondContact O-SG 2.71Å; K361-C365 VanDerWaalsContact O-SG 3.34Å
362Q98Very high97.7Very high117 Ų117106.7 Ų106.755%0.54751%0.508SS..Hα-helixtrans-58.5-47177.4179.2172.9-21.700112A358 R364 C365 E366A358-Q362 WeakPolarHBondContact O-CB 3.4Å; A358-Q362 PolarHBondContact O-N 3.46Å; Q362-R364 PolarHBondContact O-N 3.45Å; Q362-C365 CarbonylContact O-C 3.6Å; Q362-C365 WeakPolarHBondContact O-CA 3.45Å; Q362-C365 WeakPolarHBondContact O-CB 3.35Å; Q362-C365 PolarHBondContact O-N 2.91Å; Q362-E366 HydrophobicContact CG-CG 4.37Å; Q362-E366 VanDerWaalsContact CG-OE1 3.29Å; Q362-E366 WeakPolarHBondContact CG-OE1 3.43Å; Q362-E366 PolarHBondContact NE2-OE1 3.37Å; Q362-E366 WeakPolarHBondContact O-CG 3.49Å; Q362-E366 PolarHBondContact O-N 2.9Å
363R98.3Very high97.8Very high181 Ų181108 Ų10868%0.68351%0.508SS*.Hα-helixtrans-57.9-35.3175-73176.6-176.2-166.60.2113.5R359 K361 E366 E367R359-R363 WeakPolarHBondContact O-CG 3.3Å; R359-R363 PolarHBondContact O-N 2.9Å; K361-R363 PolarHBondContact O-N 3.33Å; R363-E366 WeakPolarHBondContact CA-OE2 3.42Å; R363-E367 WeakPolarHBondContact O-CB 3.49Å; R363-E367 PolarHBondContact O-N 2.88Å
364R98.3Very high97.9Very high170 Ų170110.1 Ų110.164%0.64251%0.511SS*.Hα-helixtrans-70.1-36.3173.5-69.9171.9175.6-176.4-2.1112K360 K361 Q362 L368K360-R364 WeakPolarHBondContact O-CG 3.26Å; K360-R364 PolarHBondContact O-N 3.41Å; K361-R364 WeakPolarHBondContact O-CB 3.48Å; K361-R364 PolarHBondContact O-N 3.43Å; K361-R364 VanDerWaalsContact O-N 3.09Å; Q362-R364 PolarHBondContact O-N 3.45Å; R364-L368 WeakPolarHBondContact O-CB 3.49Å; R364-L368 WeakPolarHBondContact O-CD1 3.29Å; R364-L368 WeakPolarHBondContact O-CG 3.36Å; R364-L368 PolarHBondContact O-N 3.05Å
365C96.8Very high98Very high70 Ų70107.5 Ų107.547%0.47351%0.505SS..Hα-helixtrans-64-46.3172.1-61.30000111.1K361 Q362 E367 L368 E369K361-C365 PolarHBondContact O-N 2.86Å; K361-C365 PolarHBondContact O-SG 2.71Å; K361-C365 VanDerWaalsContact O-SG 3.34Å; Q362-C365 CarbonylContact O-C 3.6Å; Q362-C365 WeakPolarHBondContact O-CA 3.45Å; Q362-C365 WeakPolarHBondContact O-CB 3.35Å; Q362-C365 PolarHBondContact O-N 2.91Å; C365-E367 VanDerWaalsContact C-N 3.32Å; C365-E367 PolarHBondContact O-N 2.94Å; C365-L368 PolarHBondContact O-N 3.5Å; C365-E369 WeakPolarHBondContact O-CB 3.4Å; C365-E369 WeakPolarHBondContact O-CG 3.43Å; C365-E369 PolarHBondContact O-N 2.86Å
366E98.2Very high98.1Very high91 Ų91108.2 Ų108.243%0.42551%0.508SS..Hα-helixtrans-58.8-41.8176.7-68.7162.3176.800111.8Q362 R363 L370Q362-E366 HydrophobicContact CG-CG 4.37Å; Q362-E366 VanDerWaalsContact CG-OE1 3.29Å; Q362-E366 WeakPolarHBondContact CG-OE1 3.43Å; Q362-E366 PolarHBondContact NE2-OE1 3.37Å; Q362-E366 WeakPolarHBondContact O-CG 3.49Å; Q362-E366 PolarHBondContact O-N 2.9Å; R363-E366 WeakPolarHBondContact CA-OE2 3.42Å; E366-L370 WeakPolarHBondContact O-CB 3.49Å; E366-L370 PolarHBondContact O-N 2.83Å; E366-L370 VanDerWaalsContact O-N 3.1Å
367E98.3Very high98.1Very high116 Ų116108.5 Ų108.554%0.54251%0.513SS..Hα-helixtrans-66.4-44.7174.5-175.7174.2-16100112.6R363 C365 L370 Q371R363-E367 WeakPolarHBondContact O-CB 3.49Å; R363-E367 PolarHBondContact O-N 2.88Å; C365-E367 VanDerWaalsContact C-N 3.32Å; C365-E367 PolarHBondContact O-N 2.94Å; E367-L370 PolarHBondContact O-N 2.89Å; E367-Q371 WeakPolarHBondContact O-CG 3.44Å; E367-Q371 PolarHBondContact O-N 3.28Å
368L98.3Very high98.1Very high109 Ų109110.6 Ų110.657%0.57152%0.523SS*.Hα-helixtrans-67.6-35.4177.3-72.9168.9000112.7R364 C365 L370 Q371 L372R364-L368 WeakPolarHBondContact O-CB 3.49Å; R364-L368 WeakPolarHBondContact O-CD1 3.29Å; R364-L368 WeakPolarHBondContact O-CG 3.36Å; R364-L368 PolarHBondContact O-N 3.05Å; C365-L368 PolarHBondContact O-N 3.5Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L368-Q371 PolarHBondContact O-N 3.34Å; L368-L372 WeakPolarHBondContact O-CB 3.4Å; L368-L372 PolarHBondContact O-N 3.16Å
369E98.1Very high98.2Very high90 Ų90112.9 Ų112.942%0.42153%0.528SS..Hα-helixtrans-63.3-40.7171-78.3-176.1-154.300111.6C365 L372 R373C365-E369 WeakPolarHBondContact O-CB 3.4Å; C365-E369 WeakPolarHBondContact O-CG 3.43Å; C365-E369 PolarHBondContact O-N 2.86Å; E369-L372 PolarHBondContact O-N 3.45Å; E369-R373 WeakPolarHBondContact O-CB 3.26Å; E369-R373 VanDerWaalsContact O-CG 3.28Å; E369-R373 WeakPolarHBondContact O-CG 3.35Å; E369-R373 PolarHBondContact O-N 3.4Å; E369-R373 IonicContact OE2-CZ 3.62Å; E369-R373 IonicContact OE2-NH1 2.66Å; E369-R373 PolarHBondContact OE2-NH1 2.9Å; E369-R373 IonicContact OE2-NH2 3.83Å; E369-R373 PolarHBondContact OE2-NH2 3Å
370L98.3Very high98.2Very high95 Ų95108.3 Ų108.350%0.49752%0.522SS..Hα-helixtrans-67.3-40.6178-173.8141.8000111.2E366 E367 L368 R373 Q374E366-L370 WeakPolarHBondContact O-CB 3.49Å; E366-L370 PolarHBondContact O-N 2.83Å; E366-L370 VanDerWaalsContact O-N 3.1Å; E367-L370 PolarHBondContact O-N 2.89Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L370-R373 PolarHBondContact O-N 2.93Å; L370-Q374 HydrophobicContact CD2-CG 4.46Å; L370-Q374 WeakPolarHBondContact O-CG 3.36Å; L370-Q374 PolarHBondContact O-N 2.96Å
371Q98.3Very high98.2Very high93 Ų93110.6 Ų110.644%0.43553%0.527SS..Hα-helixtrans-62.7-41171.3-69.7174.41600112.1E367 L368 Q374 A375E367-Q371 WeakPolarHBondContact O-CG 3.44Å; E367-Q371 PolarHBondContact O-N 3.28Å; L368-Q371 PolarHBondContact O-N 3.34Å; Q371-Q374 PolarHBondContact O-N 3.49Å; Q371-A375 WeakPolarHBondContact O-CB 3.33Å; Q371-A375 PolarHBondContact O-N 2.83Å
372L98.4Very high98.2Very high101 Ų101110.2 Ų110.253%0.52953%0.53SS..Hα-helixtrans-63.6-43.8175.7179.561000111.7L368 E369 Q374 A375 Q376L368-L372 WeakPolarHBondContact O-CB 3.4Å; L368-L372 PolarHBondContact O-N 3.16Å; E369-L372 PolarHBondContact O-N 3.45Å; L372-Q374 VanDerWaalsContact C-N 3.35Å; L372-A375 PolarHBondContact O-N 3.19Å; L372-Q376 HydrophobicContact CD1-CG 4.49Å; L372-Q376 WeakPolarHBondContact O-CB 3.23Å; L372-Q376 VanDerWaalsContact O-CG 3.24Å; L372-Q376 WeakPolarHBondContact O-CG 3.37Å; L372-Q376 PolarHBondContact O-N 2.82Å
373R98.3Very high98.3Very high131 Ų131108.9 Ų108.949%0.49453%0.53SS..Hα-helixtrans-62.9-39.2174.8-71.8169.3-176123.110.1111.8E369 L370 Q376 N377E369-R373 WeakPolarHBondContact O-CB 3.26Å; E369-R373 VanDerWaalsContact O-CG 3.28Å; E369-R373 WeakPolarHBondContact O-CG 3.35Å; E369-R373 PolarHBondContact O-N 3.4Å; E369-R373 IonicContact OE2-CZ 3.62Å; E369-R373 IonicContact OE2-NH1 2.66Å; E369-R373 PolarHBondContact OE2-NH1 2.9Å; E369-R373 IonicContact OE2-NH2 3.83Å; E369-R373 PolarHBondContact OE2-NH2 3Å; L370-R373 PolarHBondContact O-N 2.93Å; R373-Q376 PolarHBondContact O-N 3.46Å; R373-N377 VanDerWaalsContact O-CG 3.23Å; R373-N377 PolarHBondContact O-N 3.07Å; R373-N377 PolarHBondContact O-ND2 2.83Å
374Q98.4Very high98.3Very high106 Ų106106.7 Ų106.750%0.49553%0.528SS..Hα-helixtrans-62.1-50.4173.1-75.6172.4-1700111.4L370 Q371 L372 Q376 N377 E378L370-Q374 HydrophobicContact CD2-CG 4.46Å; L370-Q374 WeakPolarHBondContact O-CG 3.36Å; L370-Q374 PolarHBondContact O-N 2.96Å; Q371-Q374 PolarHBondContact O-N 3.49Å; L372-Q374 VanDerWaalsContact C-N 3.35Å; Q374-Q376 VanDerWaalsContact C-N 3.3Å; Q374-Q376 PolarHBondContact O-N 2.65Å; Q374-N377 PolarHBondContact O-N 2.86Å; Q374-N377 VanDerWaalsContact O-N 3.14Å; Q374-E378 WeakPolarHBondContact O-CG 3.43Å; Q374-E378 PolarHBondContact O-N 3.26Å
375A98.3Very high98.3Very high52 Ų52101.6 Ų101.643%0.4351%0.511SS..Hα-helixtrans-61.6-35.2177.700000112.9Q371 L372 N379Q371-A375 WeakPolarHBondContact O-CB 3.33Å; Q371-A375 PolarHBondContact O-N 2.83Å; L372-A375 PolarHBondContact O-N 3.19Å; A375-N379 VanDerWaalsContact O-CB 3.25Å; A375-N379 WeakPolarHBondContact O-CB 3.19Å; A375-N379 PolarHBondContact O-N 3.41Å
376Q98.3Very high98.3Very high109 Ų109103.5 Ų103.551%0.50952%0.516SS..Hα-helixtrans-63.4-46172.7-75.8168.4-11.200111.8L372 R373 Q374 N379 A380L372-Q376 HydrophobicContact CD1-CG 4.49Å; L372-Q376 WeakPolarHBondContact O-CB 3.23Å; L372-Q376 VanDerWaalsContact O-CG 3.24Å; L372-Q376 WeakPolarHBondContact O-CG 3.37Å; L372-Q376 PolarHBondContact O-N 2.82Å; R373-Q376 PolarHBondContact O-N 3.46Å; Q374-Q376 VanDerWaalsContact C-N 3.3Å; Q374-Q376 PolarHBondContact O-N 2.65Å; Q376-N379 PolarHBondContact O-N 3.47Å; Q376-A380 WeakPolarHBondContact O-CB 3.39Å; Q376-A380 PolarHBondContact O-N 2.86Å
377N98.3Very high98.4Very high116 Ų116102.9 Ų102.962%0.6252%0.522SS*.Hα-helixtrans-65.5-40.2177.6-68.8-22.5000112.3R373 Q374 A380 R381R373-N377 VanDerWaalsContact O-CG 3.23Å; R373-N377 PolarHBondContact O-N 3.07Å; R373-N377 PolarHBondContact O-ND2 2.83Å; Q374-N377 PolarHBondContact O-N 2.86Å; Q374-N377 VanDerWaalsContact O-N 3.14Å; N377-A380 PolarHBondContact O-N 2.88Å; N377-R381 PolarHBondContact O-N 3.28Å; N377-R381 VanDerWaalsContact O-N 3.07Å
378E98.4Very high98.4Very high133 Ų133104.3 Ų104.362%0.62152%0.523SS*.Hα-helixtrans-64.4-42.8174.6-72-175.4166.100111.8Q374 R381 L382Q374-E378 WeakPolarHBondContact O-CG 3.43Å; Q374-E378 PolarHBondContact O-N 3.26Å; E378-R381 PolarHBondContact O-N 2.86Å; E378-L382 WeakPolarHBondContact O-CB 3.37Å; E378-L382 VanDerWaalsContact O-CG 3.29Å; E378-L382 WeakPolarHBondContact O-CG 3.29Å; E378-L382 PolarHBondContact O-N 2.85Å
379N98.2Very high98.4Very high103 Ų103103 Ų10355%0.55152%0.516SS*.Hα-helixtrans-64.4-42.8176.6-166.812.8000111.7A375 Q376 R381 L382 V383A375-N379 VanDerWaalsContact O-CB 3.25Å; A375-N379 WeakPolarHBondContact O-CB 3.19Å; A375-N379 PolarHBondContact O-N 3.41Å; Q376-N379 PolarHBondContact O-N 3.47Å; N379-R381 PolarHBondContact O-N 2.8Å; N379-L382 PolarHBondContact O-N 3Å; N379-L382 VanDerWaalsContact O-N 3.15Å; N379-V383 WeakPolarHBondContact O-CG2 3.42Å; N379-V383 PolarHBondContact O-N 3.33Å
380A98.5Very high98.4Very high54 Ų54102 Ų10245%0.44652%0.518SS..Hα-helixtrans-57.7-48.3174.500000111.8Q376 N377 L382 V383 E384Q376-A380 WeakPolarHBondContact O-CB 3.39Å; Q376-A380 PolarHBondContact O-N 2.86Å; N377-A380 PolarHBondContact O-N 2.88Å; A380-L382 VanDerWaalsContact C-N 3.32Å; A380-L382 PolarHBondContact O-N 3.38Å; A380-V383 WeakPolarHBondContact O-CB 3.43Å; A380-V383 PolarHBondContact O-N 2.9Å; A380-V383 VanDerWaalsContact O-N 3.17Å; A380-E384 PolarHBondContact O-N 2.85Å; A380-E384 VanDerWaalsContact O-N 3.08Å
381R98.6Very high98.4Very high170 Ų17098.7 Ų98.764%0.64251%0.508SS*.Hα-helixtrans-59.9-39.7174.3177.8-174.8159-158-11112.5N377 E378 N379 V383 E384 E385N377-R381 PolarHBondContact O-N 3.28Å; N377-R381 VanDerWaalsContact O-N 3.07Å; E378-R381 PolarHBondContact O-N 2.86Å; N379-R381 PolarHBondContact O-N 2.8Å; R381-V383 VanDerWaalsContact C-N 3.34Å; R381-E384 PolarHBondContact O-N 2.96Å; R381-E385 WeakPolarHBondContact O-CB 3.42Å; R381-E385 PolarHBondContact O-N 2.84Å
382L98.5Very high98.4Very high107 Ų107101.4 Ų101.456%0.5651%0.514SS*.Hα-helixtrans-67.5-33.4177.3-74.2170.4000112.1E378 N379 A380 E385 N386E378-L382 WeakPolarHBondContact O-CB 3.37Å; E378-L382 VanDerWaalsContact O-CG 3.29Å; E378-L382 WeakPolarHBondContact O-CG 3.29Å; E378-L382 PolarHBondContact O-N 2.85Å; N379-L382 PolarHBondContact O-N 3Å; N379-L382 VanDerWaalsContact O-N 3.15Å; A380-L382 VanDerWaalsContact C-N 3.32Å; A380-L382 PolarHBondContact O-N 3.38Å; L382-E385 PolarHBondContact O-N 3.2Å; L382-N386 WeakPolarHBondContact O-CB 3.27Å; L382-N386 PolarHBondContact O-N 2.8Å
383V98.6Very high98.4Very high90 Ų9098.5 Ų98.555%0.54551%0.505SS..Hα-helixtrans-66.2-42.5172.8169.90000111.3N379 A380 R381 N386 S387N379-V383 WeakPolarHBondContact O-CG2 3.42Å; N379-V383 PolarHBondContact O-N 3.33Å; A380-V383 WeakPolarHBondContact O-CB 3.43Å; A380-V383 PolarHBondContact O-N 2.9Å; A380-V383 VanDerWaalsContact O-N 3.17Å; R381-V383 VanDerWaalsContact C-N 3.34Å; V383-N386 PolarHBondContact O-N 3.3Å; V383-S387 PolarHBondContact O-N 3.18Å; V383-S387 PolarHBondContact O-OG 3.4Å
384E98.4Very high98.4Very high135 Ų13596.1 Ų96.163%0.63151%0.505SS*.Hα-helixtrans-64.3-41.2173.5-68.3178.7172.900112.8A380 R381 N386 S387 R388A380-E384 PolarHBondContact O-N 2.85Å; A380-E384 VanDerWaalsContact O-N 3.08Å; R381-E384 PolarHBondContact O-N 2.96Å; E384-N386 VanDerWaalsContact C-N 3.34Å; E384-S387 PolarHBondContact O-OG 3.45Å; E384-S387 VanDerWaalsContact O-OG 3.06Å; E384-R388 VanDerWaalsContact O-CB 3.29Å; E384-R388 WeakPolarHBondContact O-CB 3.48Å; E384-R388 PolarHBondContact O-N 2.81Å
385E98.4Very high98.4Very high62 Ų6296.7 Ų96.729%0.2951%0.508SS..Hα-helixtrans-65.2-39.2174.7177.6127.2-128.300111.1R381 L382 R388 L389R381-E385 WeakPolarHBondContact O-CB 3.42Å; R381-E385 PolarHBondContact O-N 2.84Å; L382-E385 PolarHBondContact O-N 3.2Å; E385-R388 IonicContact OE1-CZ 3.24Å; E385-R388 IonicContact OE1-NH2 2.68Å; E385-R388 PolarHBondContact OE1-NH2 2.9Å; E385-L389 HydrophobicContact CG-CD1 3.94Å; E385-L389 WeakPolarHBondContact O-CB 3.21Å; E385-L389 WeakPolarHBondContact O-CG 3.1Å; E385-L389 PolarHBondContact O-N 3.47Å
386N98.4Very high98.4Very high110 Ų11099.3 Ų99.359%0.58851%0.509SS*.Hα-helixtrans-69.3-42.7178.4-163.9-3.7000112.1L382 V383 E384 R388 L389 S390L382-N386 WeakPolarHBondContact O-CB 3.27Å; L382-N386 PolarHBondContact O-N 2.8Å; V383-N386 PolarHBondContact O-N 3.3Å; E384-N386 VanDerWaalsContact C-N 3.34Å; N386-R388 VanDerWaalsContact C-N 3.35Å; N386-R388 PolarHBondContact O-N 2.86Å; N386-L389 PolarHBondContact O-N 2.82Å; N386-S390 WeakPolarHBondContact O-CB 3.43Å; N386-S390 PolarHBondContact O-N 2.85Å
387S98.5Very high98.4Very high79 Ų7999.9 Ų99.955%0.55251%0.512SS*.Hα-helixtrans-63.4-40.7174.968.90000111.8V383 E384 S390 G391V383-S387 PolarHBondContact O-N 3.18Å; V383-S387 PolarHBondContact O-OG 3.4Å; E384-S387 PolarHBondContact O-OG 3.45Å; E384-S387 VanDerWaalsContact O-OG 3.06Å; S387-S390 WeakPolarHBondContact O-CB 3.19Å; S387-S390 PolarHBondContact O-N 2.91Å; S387-G391 PolarHBondContact O-N 2.85Å
388R98.6Very high98.5Very high145 Ų14599.9 Ų99.955%0.54751%0.508SS..Hα-helixtrans-62-40.2171.9-178.2179.670.5178.11.7112.9E384 E385 N386 R392E384-R388 VanDerWaalsContact O-CB 3.29Å; E384-R388 WeakPolarHBondContact O-CB 3.48Å; E384-R388 PolarHBondContact O-N 2.81Å; E385-R388 IonicContact OE1-CZ 3.24Å; E385-R388 IonicContact OE1-NH2 2.68Å; E385-R388 PolarHBondContact OE1-NH2 2.9Å; N386-R388 VanDerWaalsContact C-N 3.35Å; N386-R388 PolarHBondContact O-N 2.86Å; R388-R392 VanDerWaalsContact O-CG 3.31Å; R388-R392 WeakPolarHBondContact O-CG 3.35Å; R388-R392 PolarHBondContact O-N 3.35Å
389L98.5Very high98.5Very high83 Ų8397.7 Ų97.744%0.43550%0.504SS..Hα-helixtrans-71-34.2176.8-74.3168.8000112E385 N386 R392 A393E385-L389 HydrophobicContact CG-CD1 3.94Å; E385-L389 WeakPolarHBondContact O-CB 3.21Å; E385-L389 WeakPolarHBondContact O-CG 3.1Å; E385-L389 PolarHBondContact O-N 3.47Å; N386-L389 PolarHBondContact O-N 2.82Å; L389-R392 PolarHBondContact O-N 3.49Å; L389-A393 PolarHBondContact O-N 3.4Å
390S98.3Very high98.5Very high67 Ų6797.8 Ų97.847%0.46950%0.501SS..Hα-helixtrans-64.1-48.7173.9-172.10000111.7N386 S387 R392 A393 T394N386-S390 WeakPolarHBondContact O-CB 3.43Å; N386-S390 PolarHBondContact O-N 2.85Å; S387-S390 WeakPolarHBondContact O-CB 3.19Å; S387-S390 PolarHBondContact O-N 2.91Å; S390-R392 VanDerWaalsContact C-N 3.3Å; S390-R392 PolarHBondContact O-N 2.94Å; S390-A393 WeakPolarHBondContact O-CA 3.41Å; S390-A393 VanDerWaalsContact O-CB 3.31Å; S390-A393 WeakPolarHBondContact O-CB 3.31Å; S390-A393 PolarHBondContact O-N 3.38Å; S390-T394 PolarHBondContact O-N 3.23Å
391G98.5Very high98.5Very high27 Ų27103.5 Ų103.528%0.27851%0.511SS..Hα-helixtrans-57.9-41.3173.700000112.8S387 A393 T394 E395S387-G391 PolarHBondContact O-N 2.85Å; G391-A393 PolarHBondContact O-N 3.08Å; G391-T394 PolarHBondContact O-N 3.11Å; G391-T394 PolarHBondContact O-OG1 2.72Å; G391-E395 WeakPolarHBondContact O-CB 3.49Å; G391-E395 VanDerWaalsContact O-CG 3.3Å; G391-E395 WeakPolarHBondContact O-CG 3.41Å; G391-E395 PolarHBondContact O-N 2.94Å
392R98.5Very high98.5Very high149 Ų14999 Ų9956%0.56250%0.498SS*.Hα-helixtrans-69.4-17.8174.5-69.6179.866.7-140.9-4.5114.3R388 L389 S390 K396R388-R392 VanDerWaalsContact O-CG 3.31Å; R388-R392 WeakPolarHBondContact O-CG 3.35Å; R388-R392 PolarHBondContact O-N 3.35Å; L389-R392 PolarHBondContact O-N 3.49Å; S390-R392 VanDerWaalsContact C-N 3.3Å; S390-R392 PolarHBondContact O-N 2.94Å; R392-K396 WeakPolarHBondContact O-CB 3.45Å; R392-K396 PolarHBondContact O-N 3.36Å
393A98.2Very high98.5Very high41 Ų4197.3 Ų97.334%0.33949%0.489SS..Hα-helixtrans-78.1-45.8170.600000110.5L389 S390 G391 K396 E397L389-A393 PolarHBondContact O-N 3.4Å; S390-A393 WeakPolarHBondContact O-CA 3.41Å; S390-A393 VanDerWaalsContact O-CB 3.31Å; S390-A393 WeakPolarHBondContact O-CB 3.31Å; S390-A393 PolarHBondContact O-N 3.38Å; G391-A393 PolarHBondContact O-N 3.08Å; A393-K396 WeakPolarHBondContact O-CB 3.32Å; A393-K396 PolarHBondContact O-N 3.28Å; A393-K396 VanDerWaalsContact O-N 3.14Å; A393-E397 WeakPolarHBondContact O-CG 3.41Å; A393-E397 PolarHBondContact O-N 2.88Å
394T98.4Very high98.5Very high80 Ų8095.8 Ų95.849%0.49149%0.486SS..Hα-helixtrans-66.7-38.8177.6550000112.5S390 G391 K396 E397 Q398S390-T394 PolarHBondContact O-N 3.23Å; G391-T394 PolarHBondContact O-N 3.11Å; G391-T394 PolarHBondContact O-OG1 2.72Å; T394-K396 VanDerWaalsContact C-N 3.29Å; T394-K396 PolarHBondContact O-N 3.24Å; T394-E397 PolarHBondContact O-N 3.24Å; T394-Q398 PolarHBondContact O-N 3.05Å
395E98.5Very high98.5Very high118 Ų11893.3 Ų93.355%0.55147%0.474SS*.Hα-helixtrans-53.9-45.1168.7-75.3168.4-174.300111.9G391 V399G391-E395 WeakPolarHBondContact O-CB 3.49Å; G391-E395 VanDerWaalsContact O-CG 3.3Å; G391-E395 WeakPolarHBondContact O-CG 3.41Å; G391-E395 PolarHBondContact O-N 2.94Å; E395-V399 WeakPolarHBondContact O-CG2 3.39Å; E395-V399 PolarHBondContact O-N 2.95Å; E395-V399 VanDerWaalsContact O-N 3.08Å
396K98.4Very high98.5Very high108 Ų10895.2 Ų95.247%0.4749%0.486SS..Hα-helixtrans-68.3-40.5179.7177.4-169.5158.2-69.80111.5R392 A393 T394 V399 E400R392-K396 WeakPolarHBondContact O-CB 3.45Å; R392-K396 PolarHBondContact O-N 3.36Å; A393-K396 WeakPolarHBondContact O-CB 3.32Å; A393-K396 PolarHBondContact O-N 3.28Å; A393-K396 VanDerWaalsContact O-N 3.14Å; T394-K396 VanDerWaalsContact C-N 3.29Å; T394-K396 PolarHBondContact O-N 3.24Å; K396-V399 PolarHBondContact O-N 3.1Å; K396-E400 WeakPolarHBondContact CE-OE1 3.39Å; K396-E400 IonicContact NZ-OE1 3.98Å; K396-E400 PolarHBondContact NZ-OE1 3.2Å; K396-E400 IonicContact NZ-OE2 2.74Å; K396-E400 PolarHBondContact NZ-OE2 2.93Å; K396-E400 WeakPolarHBondContact O-CB 3.38Å; K396-E400 WeakPolarHBondContact O-CG 3.45Å; K396-E400 PolarHBondContact O-N 2.92Å
397E98.5Very high98.5Very high121 Ų12197.5 Ų97.557%0.56549%0.486SS*.Hα-helixtrans-65.1-41.1177.6-73.7169.8-178.600111.5A393 T394 E400 W401A393-E397 WeakPolarHBondContact O-CG 3.41Å; A393-E397 PolarHBondContact O-N 2.88Å; T394-E397 PolarHBondContact O-N 3.24Å; E397-E400 PolarHBondContact O-N 3.31Å; E397-W401 PolarHBondContact O-N 3.32Å
398Q98.7Very high98.6Very high115 Ų11595.6 Ų95.654%0.53748%0.479SS..Hα-helixtrans-58.2-51.6171.1178.9-178.5-21.400111.2T394 E400 W401 E402T394-Q398 PolarHBondContact O-N 3.05Å; Q398-E400 VanDerWaalsContact C-N 3.26Å; Q398-E400 PolarHBondContact O-N 3.25Å; Q398-W401 WeakPolarHBondContact O-CB 3.38Å; Q398-W401 PolarHBondContact O-N 2.7Å; Q398-W401 VanDerWaalsContact O-N 3.1Å; Q398-E402 HydrophobicContact CG-CG 4.45Å; Q398-E402 WeakPolarHBondContact CG-OE1 3.48Å; Q398-E402 PolarHBondContact NE2-OE1 3.13Å; Q398-E402 WeakPolarHBondContact O-CG 3.38Å; Q398-E402 PolarHBondContact O-N 2.89Å
399V98.7Very high98.6Very high87 Ų8793.6 Ų93.653%0.52748%0.476SS..Hα-helixtrans-63.5-31.3179.2171.70000111.9E395 K396 N403E395-V399 WeakPolarHBondContact O-CG2 3.39Å; E395-V399 PolarHBondContact O-N 2.95Å; E395-V399 VanDerWaalsContact O-N 3.08Å; K396-V399 PolarHBondContact O-N 3.1Å; V399-N403 WeakPolarHBondContact O-CB 3.48Å; V399-N403 PolarHBondContact O-N 3.29Å
400E98.5Very high98.6Very high106 Ų10695 Ų9550%0.49548%0.484SS..Hα-helixtrans-71.6-34173.6-78.8176164.400112.8K396 E397 Q398 A404K396-E400 WeakPolarHBondContact CE-OE1 3.39Å; K396-E400 IonicContact NZ-OE1 3.98Å; K396-E400 PolarHBondContact NZ-OE1 3.2Å; K396-E400 IonicContact NZ-OE2 2.74Å; K396-E400 PolarHBondContact NZ-OE2 2.93Å; K396-E400 WeakPolarHBondContact O-CB 3.38Å; K396-E400 WeakPolarHBondContact O-CG 3.45Å; K396-E400 PolarHBondContact O-N 2.92Å; E397-E400 PolarHBondContact O-N 3.31Å; Q398-E400 VanDerWaalsContact C-N 3.26Å; Q398-E400 PolarHBondContact O-N 3.25Å; E400-A404 WeakPolarHBondContact O-CB 3.49Å; E400-A404 PolarHBondContact O-N 2.93Å
401W98.5Very high98.6Very high173 Ų17396.9 Ų96.966%0.65549%0.488SS*.Hα-helixtrans-66.9-50.3169.9178.587.2000111.8E397 Q398 N403 A404 E405E397-W401 PolarHBondContact O-N 3.32Å; Q398-W401 WeakPolarHBondContact O-CB 3.38Å; Q398-W401 PolarHBondContact O-N 2.7Å; Q398-W401 VanDerWaalsContact O-N 3.1Å; W401-N403 PolarHBondContact O-N 3.42Å; W401-A404 WeakPolarHBondContact O-CA 3.27Å; W401-A404 WeakPolarHBondContact O-CB 3.4Å; W401-A404 PolarHBondContact O-N 3.13Å; W401-E405 PolarHBondContact O-N 2.84Å
402E98.6Very high98.6Very high77 Ų7796.9 Ų96.936%0.3649%0.488SS..Hα-helixtrans-57.3-39.5176.3-69.6174.1-171.200111.2Q398 A404 E405 L406Q398-E402 HydrophobicContact CG-CG 4.45Å; Q398-E402 WeakPolarHBondContact CG-OE1 3.48Å; Q398-E402 PolarHBondContact NE2-OE1 3.13Å; Q398-E402 WeakPolarHBondContact O-CG 3.38Å; Q398-E402 PolarHBondContact O-N 2.89Å; E402-A404 VanDerWaalsContact C-N 3.33Å; E402-A404 PolarHBondContact O-N 3.18Å; E402-E405 PolarHBondContact O-N 3.47Å; E402-L406 WeakPolarHBondContact O-CB 3.42Å; E402-L406 VanDerWaalsContact O-CG 3.31Å; E402-L406 WeakPolarHBondContact O-CG 3.4Å; E402-L406 PolarHBondContact O-N 2.87Å
403N98.6Very high98.6Very high71 Ų7194 Ų9438%0.3849%0.487SS..Hα-helixtrans-73.6-22.4176.9-153-100.3000113.4V399 W401 R407V399-N403 WeakPolarHBondContact O-CB 3.48Å; V399-N403 PolarHBondContact O-N 3.29Å; W401-N403 PolarHBondContact O-N 3.42Å; N403-R407 WeakPolarHBondContact O-CD 3.24Å; N403-R407 WeakPolarHBondContact O-CG 3.38Å; N403-R407 PolarHBondContact O-N 3.44Å; N403-R407 PolarHBondContact O-NE 3.07Å; N403-R407 PolarHBondContact OD1-NE 3.28Å; N403-R407 PolarHBondContact OD1-NH2 3.35Å
404A98.6Very high98.6Very high58 Ų5894.1 Ų94.148%0.47948%0.483SS..Hα-helixtrans-75.3-44.5170.500000111E400 W401 E402 R407 G408E400-A404 WeakPolarHBondContact O-CB 3.49Å; E400-A404 PolarHBondContact O-N 2.93Å; W401-A404 WeakPolarHBondContact O-CA 3.27Å; W401-A404 WeakPolarHBondContact O-CB 3.4Å; W401-A404 PolarHBondContact O-N 3.13Å; E402-A404 VanDerWaalsContact C-N 3.33Å; E402-A404 PolarHBondContact O-N 3.18Å; A404-R407 WeakPolarHBondContact O-CB 3.44Å; A404-R407 PolarHBondContact O-N 3.02Å; A404-G408 PolarHBondContact O-N 3.25Å
405E98.7Very high98.6Very high83 Ų8396.2 Ų96.239%0.38849%0.487SS..Hα-helixtrans-61.2-50.1177.6178.750.6-144.900111.6W401 E402 R407 G408 Q409W401-E405 PolarHBondContact O-N 2.84Å; E402-E405 PolarHBondContact O-N 3.47Å; E405-R407 PolarHBondContact O-N 2.96Å; E405-G408 WeakPolarHBondContact O-CA 3.43Å; E405-G408 PolarHBondContact O-N 3.26Å; E405-Q409 PolarHBondContact O-N 3.17Å; E405-Q409 WeakPolarHBondContact OE1-CG 3.42Å; E405-Q409 PolarHBondContact OE1-NE2 3.43Å
406L98.8Very high98.6Very high102 Ų10296.9 Ų96.953%0.53449%0.491SS..Hα-helixtrans-60.6-28.2175.5-70.9171000113.3E402 L410E402-L406 WeakPolarHBondContact O-CB 3.42Å; E402-L406 VanDerWaalsContact O-CG 3.31Å; E402-L406 WeakPolarHBondContact O-CG 3.4Å; E402-L406 PolarHBondContact O-N 2.87Å; L406-L410 VanDerWaalsContact O-CB 3.27Å; L406-L410 WeakPolarHBondContact O-CB 3.31Å; L406-L410 PolarHBondContact O-N 3.33Å
407R98.8Very high98.7Very high157 Ų15798.3 Ų98.359%0.59249%0.493SS*.Hα-helixtrans-73.3-37.6171.2-72.2166.9-161.2-172.89.2111.7N403 A404 E405 L410 L411N403-R407 WeakPolarHBondContact O-CD 3.24Å; N403-R407 WeakPolarHBondContact O-CG 3.38Å; N403-R407 PolarHBondContact O-N 3.44Å; N403-R407 PolarHBondContact O-NE 3.07Å; N403-R407 PolarHBondContact OD1-NE 3.28Å; N403-R407 PolarHBondContact OD1-NH2 3.35Å; A404-R407 WeakPolarHBondContact O-CB 3.44Å; A404-R407 PolarHBondContact O-N 3.02Å; E405-R407 PolarHBondContact O-N 2.96Å; R407-L410 PolarHBondContact O-N 3.36Å; R407-L411 WeakPolarHBondContact O-CB 3.23Å; R407-L411 VanDerWaalsContact O-CG 3.24Å; R407-L411 WeakPolarHBondContact O-CG 3.28Å; R407-L411 PolarHBondContact O-N 2.91Å
408G98.8Very high98.7Very high40 Ų4095 Ų9541%0.41248%0.479SS..Hα-helixtrans-58.8-51.7172.800000111.5A404 E405 L410 L411 G412A404-G408 PolarHBondContact O-N 3.25Å; E405-G408 WeakPolarHBondContact O-CA 3.43Å; E405-G408 PolarHBondContact O-N 3.26Å; G408-L410 PolarHBondContact O-N 3.45Å; G408-L411 WeakPolarHBondContact O-CB 3.1Å; G408-L411 PolarHBondContact O-N 3.16Å; G408-L411 VanDerWaalsContact O-N 3.14Å; G408-G412 PolarHBondContact O-N 3.4Å
409Q98.8Very high98.7Very high102 Ų10291.4 Ų91.448%0.47747%0.466SS..Hα-helixtrans-59-46176.5-64175.811.500112E405 L411 G412 V413E405-Q409 PolarHBondContact O-N 3.17Å; E405-Q409 WeakPolarHBondContact OE1-CG 3.42Å; E405-Q409 PolarHBondContact OE1-NE2 3.43Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.35Å; Q409-G412 PolarHBondContact O-N 2.91Å; Q409-G412 VanDerWaalsContact O-N 3.14Å; Q409-V413 PolarHBondContact O-N 2.92Å
410L98.8Very high98.7Very high113 Ų11390 Ų9059%0.59246%0.464SS*.Hα-helixtrans-61-36.5175.7179.561.8000112.8L406 R407 G408 T414L406-L410 VanDerWaalsContact O-CB 3.27Å; L406-L410 WeakPolarHBondContact O-CB 3.31Å; L406-L410 PolarHBondContact O-N 3.33Å; R407-L410 PolarHBondContact O-N 3.36Å; G408-L410 PolarHBondContact O-N 3.45Å; L410-T414 VanDerWaalsContact O-CB 3.28Å; L410-T414 WeakPolarHBondContact O-CB 3.46Å; L410-T414 PolarHBondContact O-N 3.17Å; L410-T414 PolarHBondContact O-OG1 2.9Å
411L98.8Very high98.7Very high107 Ų10789.1 Ų89.156%0.5646%0.462SS*.Hα-helixtrans-69.4-36.3174.7-74.9167.3000112.1R407 G408 Q409 Q415R407-L411 WeakPolarHBondContact O-CB 3.23Å; R407-L411 VanDerWaalsContact O-CG 3.24Å; R407-L411 WeakPolarHBondContact O-CG 3.28Å; R407-L411 PolarHBondContact O-N 2.91Å; G408-L411 WeakPolarHBondContact O-CB 3.1Å; G408-L411 PolarHBondContact O-N 3.16Å; G408-L411 VanDerWaalsContact O-N 3.14Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.35Å; L411-Q415 WeakPolarHBondContact O-CG 3.46Å; L411-Q415 PolarHBondContact O-N 2.83Å; L411-Q415 PolarHBondContact O-NE2 3.27Å; L411-Q415 VanDerWaalsContact O-NE2 3.14Å
412G98.7Very high98.7Very high27 Ų2787.6 Ų87.628%0.27846%0.456SS..Hα-helixtrans-60.9-58.6172.700000111.8G408 Q409 T414 Q415 E416G408-G412 PolarHBondContact O-N 3.4Å; Q409-G412 PolarHBondContact O-N 2.91Å; Q409-G412 VanDerWaalsContact O-N 3.14Å; G412-T414 PolarHBondContact O-N 2.66Å; G412-T414 VanDerWaalsContact O-N 3.17Å; G412-Q415 WeakPolarHBondContact O-CA 3.27Å; G412-Q415 WeakPolarHBondContact O-CB 3.38Å; G412-Q415 PolarHBondContact O-N 3.29Å; G412-E416 PolarHBondContact O-N 2.97Å
413V98.7Very high98.7Very high89 Ų8991.5 Ų91.554%0.53947%0.472SS..Hα-helixtrans-58.3-32.8178.3176.50000112Q409 R417Q409-V413 PolarHBondContact O-N 2.92Å; V413-R417 WeakPolarHBondContact O-CB 3.49Å; V413-R417 PolarHBondContact O-N 3.49Å
414T98.3Very high98.7Very high42 Ų4290.7 Ų90.726%0.25847%0.472SS..Hα-helixtrans-67-42.5173.4-60.80000112.1L410 G412 R417 D418L410-T414 VanDerWaalsContact O-CB 3.28Å; L410-T414 WeakPolarHBondContact O-CB 3.46Å; L410-T414 PolarHBondContact O-N 3.17Å; L410-T414 PolarHBondContact O-OG1 2.9Å; G412-T414 PolarHBondContact O-N 2.66Å; G412-T414 VanDerWaalsContact O-N 3.17Å; T414-R417 PolarHBondContact O-N 2.68Å; T414-D418 WeakPolarHBondContact O-CB 3.32Å; T414-D418 PolarHBondContact O-N 3.42Å
415Q98.8Very high98.7Very high125 Ų12593.3 Ų93.358%0.58447%0.474SS*.Hα-helixtrans-68.1-36176.8-73.8171.573.900112.5L411 G412 D418 S419L411-Q415 WeakPolarHBondContact O-CG 3.46Å; L411-Q415 PolarHBondContact O-N 2.83Å; L411-Q415 PolarHBondContact O-NE2 3.27Å; L411-Q415 VanDerWaalsContact O-NE2 3.14Å; G412-Q415 WeakPolarHBondContact O-CA 3.27Å; G412-Q415 WeakPolarHBondContact O-CB 3.38Å; G412-Q415 PolarHBondContact O-N 3.29Å; Q415-D418 PolarHBondContact O-N 3.13Å; Q415-S419 VanDerWaalsContact O-CB 3.3Å; Q415-S419 WeakPolarHBondContact O-CB 3.43Å; Q415-S419 PolarHBondContact O-N 3.22Å; Q415-S419 PolarHBondContact O-OG 2.86Å
416E98.6Very high98.7Very high132 Ų13291.1 Ų91.162%0.61747%0.474SS*.Hα-helixtrans-63.2-52172.6-70.9173.1177.900110.9G412 D418 S419 A420G412-E416 PolarHBondContact O-N 2.97Å; E416-D418 VanDerWaalsContact C-N 3.31Å; E416-D418 PolarHBondContact O-N 2.79Å; E416-S419 CarbonylContact O-C 3.51Å; E416-S419 PolarHBondContact O-N 3.44Å; E416-A420 PolarHBondContact O-N 2.96Å
417R98.7Very high98.7Very high137 Ų13791.2 Ų91.252%0.51748%0.475SS..Hα-helixtrans-52.3-49.1173.6-177.8-156.971.4-163.8-2.3111.3V413 T414 S419 A420 L421V413-R417 WeakPolarHBondContact O-CB 3.49Å; V413-R417 PolarHBondContact O-N 3.49Å; T414-R417 PolarHBondContact O-N 2.68Å; R417-S419 PolarHBondContact O-N 2.79Å; R417-A420 PolarHBondContact O-N 3.48Å; R417-L421 HydrophobicContact CG-CD1 4.1Å; R417-L421 WeakPolarHBondContact O-CB 3.45Å; R417-L421 WeakPolarHBondContact O-CG 3.25Å; R417-L421 PolarHBondContact O-N 2.93Å
418D98.6Very high98.7Very high52 Ų5288.6 Ų88.628%0.27847%0.469SS..Hα-helixtrans-69.4-25.3-177.4-69.1-10.4000112.3T414 Q415 E416 R422T414-D418 WeakPolarHBondContact O-CB 3.32Å; T414-D418 PolarHBondContact O-N 3.42Å; Q415-D418 PolarHBondContact O-N 3.13Å; E416-D418 VanDerWaalsContact C-N 3.31Å; E416-D418 PolarHBondContact O-N 2.79Å; D418-R422 VanDerWaalsContact C-NH2 3.27Å; D418-R422 WeakPolarHBondContact O-CB 3.37Å; D418-R422 WeakPolarHBondContact O-CG 3.31Å; D418-R422 VanDerWaalsContact O-CZ 3.32Å; D418-R422 PolarHBondContact O-N 3.06Å; D418-R422 VanDerWaalsContact O-N 3.07Å; D418-R422 PolarHBondContact O-NE 2.92Å; D418-R422 VanDerWaalsContact O-NE 3.07Å; D418-R422 PolarHBondContact O-NH2 2.88Å
419S98.7Very high98.7Very high39 Ų3990.1 Ų90.127%0.27347%0.473SS..Hα-helixtrans-79.2-35.4173.2-56.90000112.1Q415 E416 R417 R422 K423Q415-S419 VanDerWaalsContact O-CB 3.3Å; Q415-S419 WeakPolarHBondContact O-CB 3.43Å; Q415-S419 PolarHBondContact O-N 3.22Å; Q415-S419 PolarHBondContact O-OG 2.86Å; E416-S419 CarbonylContact O-C 3.51Å; E416-S419 PolarHBondContact O-N 3.44Å; R417-S419 PolarHBondContact O-N 2.79Å; S419-R422 PolarHBondContact OG-NH1 2.96Å; S419-R422 VanDerWaalsContact OG-NH1 3.17Å; S419-R422 PolarHBondContact OG-NH2 3.02Å; S419-K423 WeakPolarHBondContact O-CG 3.4Å; S419-K423 PolarHBondContact O-N 2.74Å
420A98.6Very high98.7Very high57 Ų5791.6 Ų91.647%0.47148%0.478SS..Hα-helixtrans-66.3-40.4169.900000111.6E416 R417 K423 S424E416-A420 PolarHBondContact O-N 2.96Å; R417-A420 PolarHBondContact O-N 3.48Å; A420-K423 PolarHBondContact O-N 2.98Å; A420-S424 WeakPolarHBondContact O-CB 3.41Å; A420-S424 PolarHBondContact O-N 3.4Å
421L98.8Very high98.7Very high88 Ų8891.1 Ų91.146%0.46148%0.476SS..Hα-helixtrans-62.4-46.2173.5-73.2170.3000111.7R417 K423 S424 Q425R417-L421 HydrophobicContact CG-CD1 4.1Å; R417-L421 WeakPolarHBondContact O-CB 3.45Å; R417-L421 WeakPolarHBondContact O-CG 3.25Å; R417-L421 PolarHBondContact O-N 2.93Å; L421-K423 VanDerWaalsContact C-N 3.34Å; L421-K423 PolarHBondContact O-N 3.18Å; L421-S424 WeakPolarHBondContact O-CB 3.4Å; L421-S424 PolarHBondContact O-N 3.45Å; L421-Q425 WeakPolarHBondContact O-CG 3.43Å; L421-Q425 PolarHBondContact O-N 3.18Å
422R98.8Very high98.7Very high142 Ų14291 Ų9154%0.53647%0.472SS..Hα-helixtrans-59.2-41.2173.4-82.6176.1-89.1115.5-0.4112.6D418 S419 G426D418-R422 VanDerWaalsContact C-NH2 3.27Å; D418-R422 WeakPolarHBondContact O-CB 3.37Å; D418-R422 WeakPolarHBondContact O-CG 3.31Å; D418-R422 VanDerWaalsContact O-CZ 3.32Å; D418-R422 PolarHBondContact O-N 3.06Å; D418-R422 VanDerWaalsContact O-N 3.07Å; D418-R422 PolarHBondContact O-NE 2.92Å; D418-R422 VanDerWaalsContact O-NE 3.07Å; D418-R422 PolarHBondContact O-NH2 2.88Å; S419-R422 PolarHBondContact OG-NH1 2.96Å; S419-R422 VanDerWaalsContact OG-NH1 3.17Å; S419-R422 PolarHBondContact OG-NH2 3.02Å; R422-G426 PolarHBondContact O-N 3.02Å; R422-G426 VanDerWaalsContact O-N 3.09Å
423K98.7Very high98.7Very high158 Ų15892.4 Ų92.469%0.68748%0.478SS*.Hα-helixtrans-63.5-44.1173.3-74.1173.4-179.4-178.40111.8S419 A420 L421 G426 L427S419-K423 WeakPolarHBondContact O-CG 3.4Å; S419-K423 PolarHBondContact O-N 2.74Å; A420-K423 PolarHBondContact O-N 2.98Å; L421-K423 VanDerWaalsContact C-N 3.34Å; L421-K423 PolarHBondContact O-N 3.18Å; K423-G426 PolarHBondContact O-N 3.14Å; K423-L427 WeakPolarHBondContact O-CG 3.33Å; K423-L427 PolarHBondContact O-N 3.39Å
424S98.6Very high98.7Very high54 Ų5493 Ų9338%0.37848%0.478SS..Hα-helixtrans-61.8-46.2178.7-174.50000112A420 L421 G426 L427 Q428A420-S424 WeakPolarHBondContact O-CB 3.41Å; A420-S424 PolarHBondContact O-N 3.4Å; L421-S424 WeakPolarHBondContact O-CB 3.4Å; L421-S424 PolarHBondContact O-N 3.45Å; S424-G426 VanDerWaalsContact C-N 3.33Å; S424-G426 PolarHBondContact O-N 2.87Å; S424-L427 CarbonylContact O-C 3.53Å; S424-L427 WeakPolarHBondContact O-CA 3.28Å; S424-L427 WeakPolarHBondContact O-CB 3.46Å; S424-L427 PolarHBondContact O-N 3.46Å; S424-Q428 WeakPolarHBondContact O-CG 3.48Å; S424-Q428 PolarHBondContact O-N 2.96Å
425Q98.7Very high98.7Very high113 Ų11397.3 Ų97.353%0.52850%0.495SS..Hα-helixtrans-58.7-43.7173.5-71167.9-24.700111.8L421 L427 Q428 S429L421-Q425 WeakPolarHBondContact O-CG 3.43Å; L421-Q425 PolarHBondContact O-N 3.18Å; Q425-L427 PolarHBondContact O-N 2.73Å; Q425-Q428 PolarHBondContact O-N 3.31Å; Q425-S429 PolarHBondContact O-N 2.96Å
426G98.6Very high98.7Very high38 Ų3897.8 Ų97.839%0.39250%0.497SS..Hα-helixtrans-66-19.8174.800000114.9R422 K423 S424 K430R422-G426 PolarHBondContact O-N 3.02Å; R422-G426 VanDerWaalsContact O-N 3.09Å; K423-G426 PolarHBondContact O-N 3.14Å; S424-G426 VanDerWaalsContact C-N 3.33Å; S424-G426 PolarHBondContact O-N 2.87Å; G426-K430 WeakPolarHBondContact O-CD 3.32Å; G426-K430 WeakPolarHBondContact O-CG 3.38Å
427L98.8Very high98.7Very high103 Ų10395.3 Ų95.354%0.53949%0.491SS..Hα-helixtrans-85.6-37.8169.8-69.1171.7000111.6K423 S424 Q425 K430 L431K423-L427 WeakPolarHBondContact O-CG 3.33Å; K423-L427 PolarHBondContact O-N 3.39Å; S424-L427 CarbonylContact O-C 3.53Å; S424-L427 WeakPolarHBondContact O-CA 3.28Å; S424-L427 WeakPolarHBondContact O-CB 3.46Å; S424-L427 PolarHBondContact O-N 3.46Å; Q425-L427 PolarHBondContact O-N 2.73Å; L427-K430 WeakPolarHBondContact O-CB 3.35Å; L427-K430 PolarHBondContact O-N 2.95Å; L427-K430 VanDerWaalsContact O-N 3.12Å; L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.05Å
428Q98.7Very high98.7Very high103 Ų10393 Ų9348%0.48149%0.488SS..Hα-helixtrans-57.9-50.3175-73.1170.3-28.600111.2S424 Q425 K430 L431 E432S424-Q428 WeakPolarHBondContact O-CG 3.48Å; S424-Q428 PolarHBondContact O-N 2.96Å; Q425-Q428 PolarHBondContact O-N 3.31Å; Q428-K430 PolarHBondContact O-N 3.09Å; Q428-L431 WeakPolarHBondContact O-CB 3.48Å; Q428-L431 PolarHBondContact O-N 3.45Å; Q428-E432 WeakPolarHBondContact O-CG 3.48Å; Q428-E432 PolarHBondContact O-N 2.89Å
429S98.6Very high98.7Very high71 Ų7196.7 Ų96.750%0.49750%0.502SS..Hα-helixtrans-67.1-18.6177-58.50000114.6Q425 E432 S433Q425-S429 PolarHBondContact O-N 2.96Å; S429-E432 WeakPolarHBondContact CA-OE2 3.42Å; S429-S433 PolarHBondContact O-N 3.48Å
430K98.7Very high98.7Very high133 Ų133100 Ų10058%0.57851%0.513SS*.Hα-helixtrans-78.1-38.1168.8-74.6175.8178.8-173.80111.9G426 L427 Q428 S433 L434G426-K430 WeakPolarHBondContact O-CD 3.32Å; G426-K430 WeakPolarHBondContact O-CG 3.38Å; L427-K430 WeakPolarHBondContact O-CB 3.35Å; L427-K430 PolarHBondContact O-N 2.95Å; L427-K430 VanDerWaalsContact O-N 3.12Å; Q428-K430 PolarHBondContact O-N 3.09Å; K430-S433 PolarHBondContact O-N 2.94Å; K430-S433 PolarHBondContact O-OG 2.68Å; K430-L434 VanDerWaalsContact O-CG 3.29Å; K430-L434 WeakPolarHBondContact O-CG 3.33Å; K430-L434 PolarHBondContact O-N 3.48Å
431L98.8Very high98.7Very high104 Ų104102.8 Ų102.855%0.54552%0.517SS..Hα-helixtrans-64.4-46.2173.3-68.6168.6000110.4L427 Q428 S433 L434 E435L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.05Å; Q428-L431 WeakPolarHBondContact O-CB 3.48Å; Q428-L431 PolarHBondContact O-N 3.45Å; L431-S433 VanDerWaalsContact C-N 3.27Å; L431-S433 PolarHBondContact O-N 3.06Å; L431-L434 PolarHBondContact O-N 2.94Å; L431-L434 VanDerWaalsContact O-N 3.12Å; L431-E435 WeakPolarHBondContact O-CG 3.3Å; L431-E435 PolarHBondContact O-N 3.02Å
432E98.6Very high98.7Very high104 Ų104106.7 Ų106.749%0.48653%0.526SS..Hα-helixtrans-55.4-39174.7-69.5167.7173.500112.6Q428 S429 Q436Q428-E432 WeakPolarHBondContact O-CG 3.48Å; Q428-E432 PolarHBondContact O-N 2.89Å; S429-E432 WeakPolarHBondContact CA-OE2 3.42Å; E432-Q436 VanDerWaalsContact O-CG 3.27Å; E432-Q436 WeakPolarHBondContact O-CG 3.38Å; E432-Q436 PolarHBondContact O-N 3.36Å; E432-Q436 PolarHBondContact O-NE2 3.22Å
433S98.7Very high98.7Very high56 Ų56102.4 Ų102.439%0.39251%0.512SS..Hα-helixtrans-74.8-36.1177.271.60000112.9S429 K430 L431 Q436 V437S429-S433 PolarHBondContact O-N 3.48Å; K430-S433 PolarHBondContact O-N 2.94Å; K430-S433 PolarHBondContact O-OG 2.68Å; L431-S433 VanDerWaalsContact C-N 3.27Å; L431-S433 PolarHBondContact O-N 3.06Å; S433-Q436 PolarHBondContact O-N 3.14Å; S433-V437 WeakPolarHBondContact O-CG2 3.48Å; S433-V437 PolarHBondContact O-N 2.94Å
434L98.7Very high98.7Very high102 Ų10298.3 Ų98.353%0.53450%0.5SS..Hα-helixtrans-67.9-37173.4-70.2170.9000112.1K430 L431 Q436 V437 L438K430-L434 VanDerWaalsContact O-CG 3.29Å; K430-L434 WeakPolarHBondContact O-CG 3.33Å; K430-L434 PolarHBondContact O-N 3.48Å; L431-L434 PolarHBondContact O-N 2.94Å; L431-L434 VanDerWaalsContact O-N 3.12Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; L434-V437 PolarHBondContact O-N 3.17Å; L434-L438 WeakPolarHBondContact O-CB 3.47Å; L434-L438 WeakPolarHBondContact O-CG 3.41Å; L434-L438 PolarHBondContact O-N 2.76Å
435E98.6Very high98.7Very high132 Ų13298.1 Ų98.162%0.61750%0.502SS*.Hα-helixtrans-62.9-39.7172.8-74.9176.9-174.900111.9L431 L438 K439L431-E435 WeakPolarHBondContact O-CG 3.3Å; L431-E435 PolarHBondContact O-N 3.02Å; E435-L438 PolarHBondContact O-N 3.14Å; E435-K439 WeakPolarHBondContact O-CB 3.46Å; E435-K439 PolarHBondContact O-N 2.96Å
436Q98.8Very high98.7Very high135 Ų13598.6 Ų98.663%0.63150%0.504SS*.Hα-helixtrans-63.8-42.9173.2-71.9167.143.900112E432 S433 L434 K439 H440E432-Q436 VanDerWaalsContact O-CG 3.27Å; E432-Q436 WeakPolarHBondContact O-CG 3.38Å; E432-Q436 PolarHBondContact O-N 3.36Å; E432-Q436 PolarHBondContact O-NE2 3.22Å; S433-Q436 PolarHBondContact O-N 3.14Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; Q436-K439 PolarHBondContact O-N 3.45Å; Q436-H440 PolarHBondContact O-N 3Å
437V98.7Very high98.7Very high81 Ų81103.2 Ų103.249%0.49151%0.51SS..Hα-helixtrans-63.3-47174.8171.30000111.1S433 L434 K439 H440 M441S433-V437 WeakPolarHBondContact O-CG2 3.48Å; S433-V437 PolarHBondContact O-N 2.94Å; L434-V437 PolarHBondContact O-N 3.17Å; V437-K439 VanDerWaalsContact C-N 3.32Å; V437-K439 PolarHBondContact O-N 3.14Å; V437-H440 PolarHBondContact O-N 3.34Å; V437-H440 VanDerWaalsContact O-N 3.13Å; V437-M441 HydrophobicContact CG1-CG 4.37Å; V437-M441 HydrophobicContact CG1-SD 4.08Å; V437-M441 WeakPolarHBondContact O-CG 3.41Å; V437-M441 PolarHBondContact O-N 3.31Å
438L98.8Very high98.7Very high88 Ų88106 Ų10646%0.46151%0.513SS..Hα-helixtrans-62.5-36.9177.3-73.1172000112.3L434 E435 M441 R442L434-L438 WeakPolarHBondContact O-CB 3.47Å; L434-L438 WeakPolarHBondContact O-CG 3.41Å; L434-L438 PolarHBondContact O-N 2.76Å; E435-L438 PolarHBondContact O-N 3.14Å; L438-M441 HydrophobicContact CD2-SD 4.49Å; L438-R442 VanDerWaalsContact O-CG 3.28Å; L438-R442 WeakPolarHBondContact O-CG 3.33Å; L438-R442 PolarHBondContact O-N 3.46Å; L438-R442 VanDerWaalsContact O-N 3.07Å
439K98.7Very high98.7Very high129 Ų129107 Ų10756%0.56152%0.518SS*.Hα-helixtrans-62.1-49.1171.4-173.3-171.9175.3-1630110.7E435 Q436 V437 M441 R442 E443E435-K439 WeakPolarHBondContact O-CB 3.46Å; E435-K439 PolarHBondContact O-N 2.96Å; Q436-K439 PolarHBondContact O-N 3.45Å; V437-K439 VanDerWaalsContact C-N 3.32Å; V437-K439 PolarHBondContact O-N 3.14Å; K439-M441 VanDerWaalsContact C-N 3.35Å; K439-M441 PolarHBondContact O-N 2.75Å; K439-R442 WeakPolarHBondContact O-CB 3.47Å; K439-R442 PolarHBondContact O-N 3.44Å; K439-E443 VanDerWaalsContact CE-OE1 3.24Å; K439-E443 WeakPolarHBondContact CE-OE1 3.39Å; K439-E443 IonicContact NZ-OE1 3.52Å; K439-E443 PolarHBondContact O-N 3.07Å
440H98.7Very high98.7Very high108 Ų108108.6 Ų108.650%0.552%0.517SS..Hα-helixtrans-60.6-42.8178.7-175.362.2000112.1Q436 V437 R442 E443 V444Q436-H440 PolarHBondContact O-N 3Å; V437-H440 PolarHBondContact O-N 3.34Å; V437-H440 VanDerWaalsContact O-N 3.13Å; H440-R442 VanDerWaalsContact C-N 3.32Å; H440-R442 PolarHBondContact O-N 3.42Å; H440-E443 PolarHBondContact O-N 3.18Å; H440-V444 WeakPolarHBondContact O-CB 3.49Å; H440-V444 WeakPolarHBondContact O-CG2 3.38Å; H440-V444 PolarHBondContact O-N 3.23Å
441M98.6Very high98.7Very high116 Ų116107.5 Ų107.557%0.57152%0.517SS*.Hα-helixtrans-59.2-40.4174.8-71.1177.973.200112.5V437 L438 K439 V444 A445V437-M441 HydrophobicContact CG1-CG 4.37Å; V437-M441 HydrophobicContact CG1-SD 4.08Å; V437-M441 WeakPolarHBondContact O-CG 3.41Å; V437-M441 PolarHBondContact O-N 3.31Å; L438-M441 HydrophobicContact CD2-SD 4.49Å; K439-M441 VanDerWaalsContact C-N 3.35Å; K439-M441 PolarHBondContact O-N 2.75Å; M441-V444 PolarHBondContact O-N 2.81Å; M441-A445 WeakPolarHBondContact O-CB 3.4Å; M441-A445 PolarHBondContact O-N 3.5Å
442R98.8Very high98.7Very high170 Ų170106.4 Ų106.464%0.64251%0.509SS*.Hα-helixtrans-63.9-46.1174.4-70.2165.8-174169.43.3111.7L438 K439 H440 V444 A445 Q446L438-R442 VanDerWaalsContact O-CG 3.28Å; L438-R442 WeakPolarHBondContact O-CG 3.33Å; L438-R442 PolarHBondContact O-N 3.46Å; L438-R442 VanDerWaalsContact O-N 3.07Å; K439-R442 WeakPolarHBondContact O-CB 3.47Å; K439-R442 PolarHBondContact O-N 3.44Å; H440-R442 VanDerWaalsContact C-N 3.32Å; H440-R442 PolarHBondContact O-N 3.42Å; R442-V444 VanDerWaalsContact C-N 3.32Å; R442-V444 PolarHBondContact O-N 3.35Å; R442-A445 PolarHBondContact O-N 3.34Å; R442-Q446 VanDerWaalsContact O-CG 3.32Å; R442-Q446 WeakPolarHBondContact O-CG 3.47Å; R442-Q446 PolarHBondContact O-N 2.96Å
443E98.8Very high98.7Very high53 Ų53104.7 Ų104.725%0.24851%0.505CS..Hα-helixtrans-64-36.6176.8-62.6178.6-161.300112.4K439 H440 R447K439-E443 VanDerWaalsContact CE-OE1 3.24Å; K439-E443 WeakPolarHBondContact CE-OE1 3.39Å; K439-E443 IonicContact NZ-OE1 3.52Å; K439-E443 PolarHBondContact O-N 3.07Å; H440-E443 PolarHBondContact O-N 3.18Å; E443-R447 WeakPolarHBondContact O-CB 3.32Å; E443-R447 VanDerWaalsContact O-CG 3.22Å; E443-R447 WeakPolarHBondContact O-CG 3.44Å; E443-R447 PolarHBondContact O-N 3.43Å; E443-R447 IonicContact OE2-CZ 3.93Å; E443-R447 IonicContact OE2-NH1 3.56Å; E443-R447 PolarHBondContact OE2-NH1 2.9Å; E443-R447 IonicContact OE2-NH2 2.82Å; E443-R447 PolarHBondContact OE2-NH2 2.83Å
444V98.8Very high98.7Very high71 Ų71106.1 Ų106.143%0.4351%0.506SS..Hα-helixtrans-68.4-41.5176.1169.10000111H440 M441 R442 R447 R448H440-V444 WeakPolarHBondContact O-CB 3.49Å; H440-V444 WeakPolarHBondContact O-CG2 3.38Å; H440-V444 PolarHBondContact O-N 3.23Å; M441-V444 PolarHBondContact O-N 2.81Å; R442-V444 VanDerWaalsContact C-N 3.32Å; R442-V444 PolarHBondContact O-N 3.35Å; V444-R447 PolarHBondContact O-N 3.39Å; V444-R448 WeakPolarHBondContact O-CB 3.24Å; V444-R448 PolarHBondContact O-N 3.07Å
445A98.6Very high98.7Very high50 Ų50106.6 Ų106.641%0.41351%0.505SS..Hα-helixtrans-62.1-4317400000112M441 R442 R448 Q449M441-A445 WeakPolarHBondContact O-CB 3.4Å; M441-A445 PolarHBondContact O-N 3.5Å; R442-A445 PolarHBondContact O-N 3.34Å; A445-R448 WeakPolarHBondContact O-CB 3.27Å; A445-R448 PolarHBondContact O-N 2.7Å; A445-Q449 WeakPolarHBondContact O-CG 3.29Å; A445-Q449 PolarHBondContact O-N 3.06Å
446Q98.7Very high98.7Very high124 Ų124105.9 Ų105.958%0.57950%0.502SS*.Hα-helixtrans-63.3-44.8175.2-73.1171.2-30.600112.2R442 R448 Q449 Q450R442-Q446 VanDerWaalsContact O-CG 3.32Å; R442-Q446 WeakPolarHBondContact O-CG 3.47Å; R442-Q446 PolarHBondContact O-N 2.96Å; Q446-R448 VanDerWaalsContact C-N 3.3Å; Q446-R448 PolarHBondContact O-N 2.94Å; Q446-Q449 PolarHBondContact O-N 2.92Å; Q446-Q450 PolarHBondContact O-N 3.03Å
447R98.8Very high98.7Very high135 Ų135105.1 Ų105.151%0.50950%0.499SS..Hα-helixtrans-61-38.1174.4-73.6168.9-173.9121.210.3111.9E443 V444 L451E443-R447 WeakPolarHBondContact O-CB 3.32Å; E443-R447 VanDerWaalsContact O-CG 3.22Å; E443-R447 WeakPolarHBondContact O-CG 3.44Å; E443-R447 PolarHBondContact O-N 3.43Å; E443-R447 IonicContact OE2-CZ 3.93Å; E443-R447 IonicContact OE2-NH1 3.56Å; E443-R447 PolarHBondContact OE2-NH1 2.9Å; E443-R447 IonicContact OE2-NH2 2.82Å; E443-R447 PolarHBondContact OE2-NH2 2.83Å; V444-R447 PolarHBondContact O-N 3.39Å; R447-L451 WeakPolarHBondContact O-CG 3.44Å; R447-L451 PolarHBondContact O-N 3.17Å
448R98.7Very high98.7Very high162 Ų162104.1 Ų104.161%0.61150%0.499SS*.Hα-helixtrans-64.1-48.4174.5176.9179.7164.3170.2-1111.7V444 A445 Q446 Q450 L451 E452V444-R448 WeakPolarHBondContact O-CB 3.24Å; V444-R448 PolarHBondContact O-N 3.07Å; A445-R448 WeakPolarHBondContact O-CB 3.27Å; A445-R448 PolarHBondContact O-N 2.7Å; Q446-R448 VanDerWaalsContact C-N 3.3Å; Q446-R448 PolarHBondContact O-N 2.94Å; R448-Q450 VanDerWaalsContact C-N 3.29Å; R448-Q450 PolarHBondContact O-N 3.19Å; R448-L451 PolarHBondContact O-N 3.3Å; R448-L451 VanDerWaalsContact O-N 3.15Å; R448-E452 HydrophobicContact CG-CG 4.39Å; R448-E452 IonicContact CZ-OE1 3.87Å; R448-E452 IonicContact NE-OE1 2.67Å; R448-E452 PolarHBondContact NE-OE1 2.96Å; R448-E452 IonicContact NE-OE2 2.7Å; R448-E452 IonicContact NH2-OE1 2.78Å; R448-E452 PolarHBondContact NH2-OE1 3.41Å; R448-E452 WeakPolarHBondContact O-CG 3.41Å; R448-E452 PolarHBondContact O-N 3.03Å
449Q98.6Very high98.7Very high124 Ų124105.7 Ų105.758%0.57950%0.498SS*.Hα-helixtrans-59.7-40.2177.8-72.8173.7-37.100112A445 Q446 E452 V453A445-Q449 WeakPolarHBondContact O-CG 3.29Å; A445-Q449 PolarHBondContact O-N 3.06Å; Q446-Q449 PolarHBondContact O-N 2.92Å; Q449-E452 PolarHBondContact O-N 3.06Å; Q449-V453 WeakPolarHBondContact O-CG2 3.48Å; Q449-V453 PolarHBondContact O-N 2.9Å
450Q98.6Very high98.7Very high104 Ų104103.9 Ų103.949%0.48649%0.494SS..Hα-helixtrans-60.6-46.9173.9-178.862.229.600111.8Q446 R448 E452 V453 E454Q446-Q450 PolarHBondContact O-N 3.03Å; R448-Q450 VanDerWaalsContact C-N 3.29Å; R448-Q450 PolarHBondContact O-N 3.19Å; Q450-E452 VanDerWaalsContact C-N 3.33Å; Q450-E452 PolarHBondContact O-N 3.19Å; Q450-V453 PolarHBondContact O-N 2.83Å; Q450-E454 WeakPolarHBondContact CG-OE1 3.49Å; Q450-E454 PolarHBondContact NE2-OE1 2.86Å; Q450-E454 WeakPolarHBondContact O-CG 3.42Å; Q450-E454 PolarHBondContact O-N 3.09Å
451L98.7Very high98.7Very high109 Ų109101.4 Ų101.457%0.57149%0.489SS*.Hα-helixtrans-65.7-33177-71.8167.6000113R447 R448 H455R447-L451 WeakPolarHBondContact O-CG 3.44Å; R447-L451 PolarHBondContact O-N 3.17Å; R448-L451 PolarHBondContact O-N 3.3Å; R448-L451 VanDerWaalsContact O-N 3.15Å; L451-H455 WeakPolarHBondContact O-CB 3.28Å; L451-H455 PolarHBondContact O-N 2.81Å
452E98.6Very high98.7Very high82 Ų82100.7 Ų100.738%0.38349%0.487SS..Hα-helixtrans-65.3-44174-74.2168.4157.700110.8R448 Q449 Q450 H455 E456R448-E452 HydrophobicContact CG-CG 4.39Å; R448-E452 IonicContact CZ-OE1 3.87Å; R448-E452 IonicContact NE-OE1 2.67Å; R448-E452 PolarHBondContact NE-OE1 2.96Å; R448-E452 IonicContact NE-OE2 2.7Å; R448-E452 IonicContact NH2-OE1 2.78Å; R448-E452 PolarHBondContact NH2-OE1 3.41Å; R448-E452 WeakPolarHBondContact O-CG 3.41Å; R448-E452 PolarHBondContact O-N 3.03Å; Q449-E452 PolarHBondContact O-N 3.06Å; Q450-E452 VanDerWaalsContact C-N 3.33Å; Q450-E452 PolarHBondContact O-N 3.19Å; E452-H455 PolarHBondContact O-N 2.92Å; E452-E456 WeakPolarHBondContact O-CG 3.43Å; E452-E456 PolarHBondContact O-N 3.4Å
453V98.8Very high98.7Very high67 Ų6798.5 Ų98.541%0.40648%0.479SS..Hα-helixtrans-65.7-44174.4171.80000112.2Q449 Q450 H455 E456 Q457Q449-V453 WeakPolarHBondContact O-CG2 3.48Å; Q449-V453 PolarHBondContact O-N 2.9Å; Q450-V453 PolarHBondContact O-N 2.83Å; V453-H455 VanDerWaalsContact C-N 3.3Å; V453-H455 PolarHBondContact O-N 3.31Å; V453-E456 PolarHBondContact O-N 3.01Å; V453-Q457 WeakPolarHBondContact O-CG 3.37Å; V453-Q457 PolarHBondContact O-N 3.25Å
454E98.4Very high98.7Very high86 Ų86101.9 Ų101.940%0.40250%0.495SS..Hα-helixtrans-61.6-38.2175.9-74.4170.3-171.100111.8Q450 Q457 A458Q450-E454 WeakPolarHBondContact CG-OE1 3.49Å; Q450-E454 PolarHBondContact NE2-OE1 2.86Å; Q450-E454 WeakPolarHBondContact O-CG 3.42Å; Q450-E454 PolarHBondContact O-N 3.09Å; E454-Q457 PolarHBondContact O-N 3Å; E454-A458 WeakPolarHBondContact O-CB 3.22Å; E454-A458 PolarHBondContact O-N 3.07Å
455H98.6Very high98.6Very high112 Ų112103.7 Ų103.752%0.51950%0.497SS..Hα-helixtrans-66.1-39.6174.7178.469.7000112.6L451 E452 V453 A458 R459L451-H455 WeakPolarHBondContact O-CB 3.28Å; L451-H455 PolarHBondContact O-N 2.81Å; E452-H455 PolarHBondContact O-N 2.92Å; V453-H455 VanDerWaalsContact C-N 3.3Å; V453-H455 PolarHBondContact O-N 3.31Å; H455-A458 PolarHBondContact O-N 2.96Å; H455-R459 VanDerWaalsContact NE2-CD 3.35Å; H455-R459 WeakPolarHBondContact NE2-CD 3.32Å; H455-R459 VanDerWaalsContact O-CG 3.3Å; H455-R459 WeakPolarHBondContact O-CG 3.33Å; H455-R459 PolarHBondContact O-N 3.37Å
456E98.7Very high98.6Very high117 Ų117105.2 Ų105.255%0.54750%0.496SS..Hα-helixtrans-66.2-41.6174.1-72.7-172.6159.400112.4E452 V453 R459 L460E452-E456 WeakPolarHBondContact O-CG 3.43Å; E452-E456 PolarHBondContact O-N 3.4Å; V453-E456 PolarHBondContact O-N 3.01Å; E456-R459 PolarHBondContact O-N 3.19Å; E456-L460 WeakPolarHBondContact O-CG 3.36Å; E456-L460 PolarHBondContact O-N 3.46Å
457Q98.7Very high98.6Very high120 Ų120103.5 Ų103.556%0.56149%0.488SS*.Hα-helixtrans-61.1-44.9173.7-70.4173.89.500111.8V453 E454 R459 L460 S461V453-Q457 WeakPolarHBondContact O-CG 3.37Å; V453-Q457 PolarHBondContact O-N 3.25Å; E454-Q457 PolarHBondContact O-N 3Å; Q457-R459 VanDerWaalsContact C-N 3.31Å; Q457-R459 PolarHBondContact O-N 2.87Å; Q457-L460 PolarHBondContact O-N 2.82Å; Q457-S461 PolarHBondContact O-N 3.12Å
458A98.6Very high98.6Very high60 Ų60101.3 Ų101.350%0.49648%0.483SS..Hα-helixtrans-61.4-37.9174.900000112.3E454 H455 L462E454-A458 WeakPolarHBondContact O-CB 3.22Å; E454-A458 PolarHBondContact O-N 3.07Å; H455-A458 PolarHBondContact O-N 2.96Å; A458-L462 WeakPolarHBondContact O-CB 3.32Å; A458-L462 PolarHBondContact O-N 3.31Å
459R98.8Very high98.6Very high120 Ų12097.2 Ų97.245%0.45348%0.476SS..Hα-helixtrans-68.6-32.8174.6-74.7172.571.1-167.98.8113.2H455 E456 Q457 R463H455-R459 VanDerWaalsContact NE2-CD 3.35Å; H455-R459 WeakPolarHBondContact NE2-CD 3.32Å; H455-R459 VanDerWaalsContact O-CG 3.3Å; H455-R459 WeakPolarHBondContact O-CG 3.33Å; H455-R459 PolarHBondContact O-N 3.37Å; E456-R459 PolarHBondContact O-N 3.19Å; Q457-R459 VanDerWaalsContact C-N 3.31Å; Q457-R459 PolarHBondContact O-N 2.87Å; R459-R463 WeakPolarHBondContact O-CD 3.35Å; R459-R463 VanDerWaalsContact O-CG 3.28Å; R459-R463 WeakPolarHBondContact O-CG 3.39Å; R459-R463 PolarHBondContact O-N 2.93Å
460L98.7Very high98.6Very high91 Ų9197.5 Ų97.548%0.47647%0.472SS..Hα-helixtrans-68.3-51.6173-72.7166.9000110.7E456 Q457 L462 R463 E464E456-L460 WeakPolarHBondContact O-CG 3.36Å; E456-L460 PolarHBondContact O-N 3.46Å; Q457-L460 PolarHBondContact O-N 2.82Å; L460-L462 VanDerWaalsContact C-N 3.27Å; L460-L462 PolarHBondContact O-N 3.21Å; L460-R463 WeakPolarHBondContact O-CA 3.33Å; L460-R463 WeakPolarHBondContact O-CB 3.5Å; L460-R463 PolarHBondContact O-N 3.12Å; L460-E464 WeakPolarHBondContact O-CG 3.45Å; L460-E464 PolarHBondContact O-N 3.03Å
461S98.6Very high98.6Very high56 Ų56100.2 Ų100.239%0.39248%0.477SS..Hα-helixtrans-60.6-35.6178.4-166.50000112.7Q457 R463 E464 K465Q457-S461 PolarHBondContact O-N 3.12Å; S461-R463 PolarHBondContact O-N 3.02Å; S461-E464 PolarHBondContact O-N 3.27Å; S461-K465 VanDerWaalsContact O-CG 3.29Å; S461-K465 WeakPolarHBondContact O-CG 3.4Å; S461-K465 PolarHBondContact O-N 3.41Å
462L98.7Very high98.6Very high102 Ų102100.3 Ų100.353%0.53448%0.478SS..Hα-helixtrans-64.5-37172.5-178.160.6000112.9A458 L460 K465 Q466A458-L462 WeakPolarHBondContact O-CB 3.32Å; A458-L462 PolarHBondContact O-N 3.31Å; L460-L462 VanDerWaalsContact C-N 3.27Å; L460-L462 PolarHBondContact O-N 3.21Å; L462-K465 PolarHBondContact O-N 2.98Å; L462-Q466 VanDerWaalsContact O-CG 3.3Å; L462-Q466 WeakPolarHBondContact O-CG 3.36Å; L462-Q466 PolarHBondContact O-N 3.42Å
463R98.6Very high98.6Very high124 Ų124101.9 Ų101.947%0.46849%0.485SS..Hα-helixtrans-66.4-45.6175.2-72.5162175.1154.6-6111.3R459 L460 S461 K465 Q466 E467R459-R463 WeakPolarHBondContact O-CD 3.35Å; R459-R463 VanDerWaalsContact O-CG 3.28Å; R459-R463 WeakPolarHBondContact O-CG 3.39Å; R459-R463 PolarHBondContact O-N 2.93Å; L460-R463 WeakPolarHBondContact O-CA 3.33Å; L460-R463 WeakPolarHBondContact O-CB 3.5Å; L460-R463 PolarHBondContact O-N 3.12Å; S461-R463 PolarHBondContact O-N 3.02Å; R463-K465 VanDerWaalsContact C-N 3.3Å; R463-K465 PolarHBondContact O-N 3.44Å; R463-Q466 WeakPolarHBondContact O-CB 3.43Å; R463-Q466 PolarHBondContact O-N 2.86Å; R463-Q466 VanDerWaalsContact O-N 3.12Å; R463-E467 PolarHBondContact O-N 3.22Å
464E98.7Very high98.6Very high124 Ų124104.2 Ų104.258%0.57949%0.492SS*.Hα-helixtrans-55.6-46.2175.1-65.9168.2169.200110.9L460 S461 Q466 E467 E468L460-E464 WeakPolarHBondContact O-CG 3.45Å; L460-E464 PolarHBondContact O-N 3.03Å; S461-E464 PolarHBondContact O-N 3.27Å; E464-Q466 PolarHBondContact O-N 2.94Å; E464-E467 PolarHBondContact O-N 3Å; E464-E468 WeakPolarHBondContact O-CB 3.21Å; E464-E468 PolarHBondContact O-N 3.39Å
465K98.5Very high98.6Very high108 Ų108102.5 Ų102.547%0.4749%0.492SS..Hα-helixtrans-66.5-34.9176.8-67.7-71.6157.6-148.80113.1S461 L462 R463 E468 V469S461-K465 VanDerWaalsContact O-CG 3.29Å; S461-K465 WeakPolarHBondContact O-CG 3.4Å; S461-K465 PolarHBondContact O-N 3.41Å; L462-K465 PolarHBondContact O-N 2.98Å; R463-K465 VanDerWaalsContact C-N 3.3Å; R463-K465 PolarHBondContact O-N 3.44Å; K465-E468 VanDerWaalsContact CD-OE2 3.27Å; K465-E468 WeakPolarHBondContact CD-OE2 3.4Å; K465-E468 WeakPolarHBondContact CE-OE2 3.45Å; K465-E468 IonicContact NZ-OE1 3.76Å; K465-E468 IonicContact NZ-OE2 2.68Å; K465-E468 PolarHBondContact NZ-OE2 2.84Å; K465-V469 VanDerWaalsContact O-CG2 3.31Å; K465-V469 WeakPolarHBondContact O-CG2 3.41Å; K465-V469 PolarHBondContact O-N 3.13Å
466Q98.6Very high98.6Very high83 Ų83103 Ų10339%0.38850%0.495SS..Hα-helixtrans-67.1-37.2171.5-73.1176.316.200112.5L462 R463 E464 R470L462-Q466 VanDerWaalsContact O-CG 3.3Å; L462-Q466 WeakPolarHBondContact O-CG 3.36Å; L462-Q466 PolarHBondContact O-N 3.42Å; R463-Q466 WeakPolarHBondContact O-CB 3.43Å; R463-Q466 PolarHBondContact O-N 2.86Å; R463-Q466 VanDerWaalsContact O-N 3.12Å; E464-Q466 PolarHBondContact O-N 2.94Å; Q466-R470 VanDerWaalsContact O-CG 3.28Å; Q466-R470 WeakPolarHBondContact O-CG 3.45Å; Q466-R470 PolarHBondContact O-N 3.4Å
467E98.6Very high98.5Very high88 Ų8899 Ų9941%0.41148%0.482SS..Hα-helixtrans-68.9-40.4174.6-74.2-176.7-145.100112.5R463 E464 R470 R471R463-E467 PolarHBondContact O-N 3.22Å; E464-E467 PolarHBondContact O-N 3Å; E467-R470 PolarHBondContact O-N 2.84Å; E467-R471 VanDerWaalsContact O-CG 3.28Å; E467-R471 WeakPolarHBondContact O-CG 3.27Å; E467-R471 PolarHBondContact O-N 2.99Å; E467-R471 IonicContact OE2-CZ 3.11Å; E467-R471 IonicContact OE2-NH2 3.71Å; E467-R471 PolarHBondContact OE2-NH2 3.3Å
468E98.4Very high98.5Very high89 Ų8997.2 Ų97.242%0.41647%0.474SS..Hα-helixtrans-58.2-47172.4-172.6176.5-157.500110.9E464 K465 R470 R471 L472E464-E468 WeakPolarHBondContact O-CB 3.21Å; E464-E468 PolarHBondContact O-N 3.39Å; K465-E468 VanDerWaalsContact CD-OE2 3.27Å; K465-E468 WeakPolarHBondContact CD-OE2 3.4Å; K465-E468 WeakPolarHBondContact CE-OE2 3.45Å; K465-E468 IonicContact NZ-OE1 3.76Å; K465-E468 IonicContact NZ-OE2 2.68Å; K465-E468 PolarHBondContact NZ-OE2 2.84Å; E468-R470 PolarHBondContact O-N 3.18Å; E468-R471 PolarHBondContact O-N 3.07Å; E468-L472 HydrophobicContact CG-CD1 4.27Å; E468-L472 VanDerWaalsContact O-CG 3.32Å; E468-L472 WeakPolarHBondContact O-CG 3.29Å; E468-L472 PolarHBondContact O-N 3.43Å
469V98.5Very high98.4Very high75 Ų7596.9 Ų96.946%0.45547%0.471SS..Hα-helixtrans-60.5-43174.61690000112K465 R471 L472 Q473K465-V469 VanDerWaalsContact O-CG2 3.31Å; K465-V469 WeakPolarHBondContact O-CG2 3.41Å; K465-V469 PolarHBondContact O-N 3.13Å; V469-R471 PolarHBondContact O-N 3.38Å; V469-L472 PolarHBondContact O-N 3.42Å; V469-Q473 HydrophobicContact CG1-CG 4.37Å; V469-Q473 WeakPolarHBondContact O-CB 3.33Å; V469-Q473 VanDerWaalsContact O-CG 3.28Å; V469-Q473 WeakPolarHBondContact O-CG 3.48Å; V469-Q473 PolarHBondContact O-N 3.28Å
470R98.7Very high98.4Very high131 Ų13196 Ų9649%0.49447%0.472SS..Hα-helixtrans-61.7-41.8176.1-72.5171.2-164.2114.26.7112.2Q466 E467 E468 Q473 Q474Q466-R470 VanDerWaalsContact O-CG 3.28Å; Q466-R470 WeakPolarHBondContact O-CG 3.45Å; Q466-R470 PolarHBondContact O-N 3.4Å; E467-R470 PolarHBondContact O-N 2.84Å; E468-R470 PolarHBondContact O-N 3.18Å; R470-Q473 PolarHBondContact O-N 3.29Å; R470-Q474 PolarHBondContact O-N 2.75Å
471R98.6Very high98.4Very high161 Ų16199.9 Ų99.961%0.60848%0.48SS*.Hα-helixtrans-65.6-40.6177-67.6169.9-158.1177.59.1111.4E467 E468 V469 Q474 A475E467-R471 VanDerWaalsContact O-CG 3.28Å; E467-R471 WeakPolarHBondContact O-CG 3.27Å; E467-R471 PolarHBondContact O-N 2.99Å; E467-R471 IonicContact OE2-CZ 3.11Å; E467-R471 IonicContact OE2-NH2 3.71Å; E467-R471 PolarHBondContact OE2-NH2 3.3Å; E468-R471 PolarHBondContact O-N 3.07Å; V469-R471 PolarHBondContact O-N 3.38Å; R471-Q474 PolarHBondContact O-N 3.06Å; R471-A475 WeakPolarHBondContact O-CB 3.3Å; R471-A475 PolarHBondContact O-N 2.95Å
472L98.6Very high98.3Very high110 Ų110104.4 Ų104.458%0.57650%0.496SS*.Hα-helixtrans-65.9-39.8174.8-69.7170.3000112.2E468 V469 A475 Q476E468-L472 HydrophobicContact CG-CD1 4.27Å; E468-L472 VanDerWaalsContact O-CG 3.32Å; E468-L472 WeakPolarHBondContact O-CG 3.29Å; E468-L472 PolarHBondContact O-N 3.43Å; V469-L472 PolarHBondContact O-N 3.42Å; L472-A475 PolarHBondContact O-N 3.33Å; L472-Q476 WeakPolarHBondContact O-CB 3.32Å; L472-Q476 PolarHBondContact O-N 3.23Å
473Q98.3Very high98.2Very high115 Ų115105.6 Ų105.654%0.53750%0.498SS..Hα-helixtrans-63.5-41.2174.1-75.1171.4-24.900112.2V469 R470 Q476 A477V469-Q473 HydrophobicContact CG1-CG 4.37Å; V469-Q473 WeakPolarHBondContact O-CB 3.33Å; V469-Q473 VanDerWaalsContact O-CG 3.28Å; V469-Q473 WeakPolarHBondContact O-CG 3.48Å; V469-Q473 PolarHBondContact O-N 3.28Å; R470-Q473 PolarHBondContact O-N 3.29Å; Q473-Q476 PolarHBondContact O-N 3.42Å; Q473-A477 PolarHBondContact O-N 2.95Å
474Q98.4Very high98.2Very high117 Ų117104.7 Ų104.755%0.54750%0.499SS..Hα-helixtrans-62.8-50.9174.3177.8175.1-9.900111.3R470 R471 Q476 A477 E478R470-Q474 PolarHBondContact O-N 2.75Å; R471-Q474 PolarHBondContact O-N 3.06Å; Q474-Q476 VanDerWaalsContact C-N 3.26Å; Q474-Q476 PolarHBondContact O-N 2.9Å; Q474-A477 PolarHBondContact O-N 3.39Å; Q474-A477 VanDerWaalsContact O-N 3.08Å; Q474-E478 HydrophobicContact CG-CG 4.45Å; Q474-E478 VanDerWaalsContact CG-OE1 3.25Å; Q474-E478 WeakPolarHBondContact CG-OE1 3.28Å; Q474-E478 PolarHBondContact NE2-OE1 2.95Å; Q474-E478 WeakPolarHBondContact O-CG 3.46Å; Q474-E478 PolarHBondContact O-N 3.34Å
475A98.2Very high98.1Very high50 Ų50100 Ų10041%0.41348%0.484SS..Hα-helixtrans-60.9-34.3178.700000112.5R471 L472 A479R471-A475 WeakPolarHBondContact O-CB 3.3Å; R471-A475 PolarHBondContact O-N 2.95Å; L472-A475 PolarHBondContact O-N 3.33Å; A475-A479 WeakPolarHBondContact O-CB 3.49Å; A475-A479 PolarHBondContact O-N 2.91Å
476Q98.1Very high98Very high121 Ų12197.1 Ų97.157%0.56548%0.48SS*.Hα-helixtrans-65.6-43.9173.2-176.31765.700112L472 Q473 Q474 E478 A479 Q480L472-Q476 WeakPolarHBondContact O-CB 3.32Å; L472-Q476 PolarHBondContact O-N 3.23Å; Q473-Q476 PolarHBondContact O-N 3.42Å; Q474-Q476 VanDerWaalsContact C-N 3.26Å; Q474-Q476 PolarHBondContact O-N 2.9Å; Q476-E478 VanDerWaalsContact C-N 3.35Å; Q476-A479 PolarHBondContact O-N 3.44Å; Q476-Q480 WeakPolarHBondContact O-CB 3.38Å; Q476-Q480 VanDerWaalsContact O-CG 3.3Å; Q476-Q480 WeakPolarHBondContact O-CG 3.5Å; Q476-Q480 PolarHBondContact O-N 2.93Å
477A98.2Very high98Very high35 Ų3595.5 Ų95.529%0.28948%0.476SS..Hα-helixtrans-69.1-31.9177.500000112.7Q473 Q474 R481Q473-A477 PolarHBondContact O-N 2.95Å; Q474-A477 PolarHBondContact O-N 3.39Å; Q474-A477 VanDerWaalsContact O-N 3.08Å; A477-R481 WeakPolarHBondContact O-CG 3.31Å; A477-R481 PolarHBondContact O-N 2.9Å; A477-R481 VanDerWaalsContact O-N 3.14Å
478E97.3Very high97.9Very high81 Ų8197.1 Ų97.138%0.37948%0.483SS..Hα-helixtrans-68.5-48.5172.9-73.4164.9178.100110.8Q474 Q476 Q480 R481 E482Q474-E478 HydrophobicContact CG-CG 4.45Å; Q474-E478 VanDerWaalsContact CG-OE1 3.25Å; Q474-E478 WeakPolarHBondContact CG-OE1 3.28Å; Q474-E478 PolarHBondContact NE2-OE1 2.95Å; Q474-E478 WeakPolarHBondContact O-CG 3.46Å; Q474-E478 PolarHBondContact O-N 3.34Å; Q476-E478 VanDerWaalsContact C-N 3.35Å; E478-Q480 VanDerWaalsContact C-N 3.28Å; E478-Q480 PolarHBondContact O-N 3.05Å; E478-R481 PolarHBondContact O-N 2.93Å; E478-R481 VanDerWaalsContact O-N 3.12Å; E478-E482 PolarHBondContact O-N 3.29Å
479A97.9Very high97.9Very high54 Ų5498.5 Ų98.545%0.44649%0.493SS..Hα-helixtrans-61.6-32.2174.100000113.4A475 Q476 H483A475-A479 WeakPolarHBondContact O-CB 3.49Å; A475-A479 PolarHBondContact O-N 2.91Å; Q476-A479 PolarHBondContact O-N 3.44Å; A479-H483 WeakPolarHBondContact O-CB 3.45Å; A479-H483 PolarHBondContact O-N 3.15Å
480Q97.7Very high97.9Very high101 Ų101100.5 Ų100.547%0.47250%0.501SS..Hα-helixtrans-65.5-45172-79.2175.6-47.100111.8Q476 E478 E482 H483 E484Q476-Q480 WeakPolarHBondContact O-CB 3.38Å; Q476-Q480 VanDerWaalsContact O-CG 3.3Å; Q476-Q480 WeakPolarHBondContact O-CG 3.5Å; Q476-Q480 PolarHBondContact O-N 2.93Å; E478-Q480 VanDerWaalsContact C-N 3.28Å; E478-Q480 PolarHBondContact O-N 3.05Å; Q480-E482 PolarHBondContact O-N 3.46Å; Q480-H483 WeakPolarHBondContact O-CB 3.35Å; Q480-H483 PolarHBondContact O-N 2.74Å; Q480-E484 WeakPolarHBondContact O-CB 3.49Å; Q480-E484 VanDerWaalsContact O-CG 3.28Å; Q480-E484 WeakPolarHBondContact O-CG 3.3Å; Q480-E484 PolarHBondContact O-N 3.39Å
481R98.2Very high97.8Very high172 Ų17299.5 Ų99.565%0.64950%0.501SS*.Hα-helixtrans-64.7-38.7176-70164.4179.6165.8-0.1112.7A477 E478 H483 E484 G485A477-R481 WeakPolarHBondContact O-CG 3.31Å; A477-R481 PolarHBondContact O-N 2.9Å; A477-R481 VanDerWaalsContact O-N 3.14Å; E478-R481 PolarHBondContact O-N 2.93Å; E478-R481 VanDerWaalsContact O-N 3.12Å; R481-H483 VanDerWaalsContact C-N 3.34Å; R481-E484 PolarHBondContact O-N 3.43Å; R481-G485 PolarHBondContact O-N 3.49Å
482E97.2Very high97.7Very high152 Ų15294.9 Ų94.971%0.7149%0.494SS*.Hα-helixtrans-63.9-40.5173.8-71.5-178167.500111.4E478 Q480 A486E478-E482 PolarHBondContact O-N 3.29Å; Q480-E482 PolarHBondContact O-N 3.46Å; E482-A486 WeakPolarHBondContact O-CB 3.46Å; E482-A486 PolarHBondContact O-N 2.88Å
483H97.6Very high97.6Very high126 Ų12693.2 Ų93.258%0.58349%0.488SS*.Hα-helixtrans-65.8-46.5174.1178.548.2000112.5A479 Q480 R481 G485 A486 V487A479-H483 WeakPolarHBondContact O-CB 3.45Å; A479-H483 PolarHBondContact O-N 3.15Å; Q480-H483 WeakPolarHBondContact O-CB 3.35Å; Q480-H483 PolarHBondContact O-N 2.74Å; R481-H483 VanDerWaalsContact C-N 3.34Å; H483-G485 PolarHBondContact O-N 2.57Å; H483-A486 PolarHBondContact O-N 3.26Å; H483-V487 WeakPolarHBondContact O-CG2 3.28Å; H483-V487 PolarHBondContact O-N 2.96Å
484E97.3Very high97.6Very high106 Ų10692.5 Ų92.550%0.49549%0.488SS..Hα-helixtrans-57.8-45.6175.4-74164.2-170.800111.4Q480 R481 V487 Q488Q480-E484 WeakPolarHBondContact O-CB 3.49Å; Q480-E484 VanDerWaalsContact O-CG 3.28Å; Q480-E484 WeakPolarHBondContact O-CG 3.3Å; Q480-E484 PolarHBondContact O-N 3.39Å; R481-E484 PolarHBondContact O-N 3.43Å; E484-V487 PolarHBondContact O-N 3Å; E484-Q488 VanDerWaalsContact O-CG 3.3Å; E484-Q488 WeakPolarHBondContact O-CG 3.33Å; E484-Q488 PolarHBondContact O-N 2.96Å
485G96.9Very high97.5Very high26 Ų2691.6 Ų91.627%0.26849%0.487SS..Hα-helixtrans-64.3-38.9175.300000113.2R481 H483 Q488 L489R481-G485 PolarHBondContact O-N 3.49Å; H483-G485 PolarHBondContact O-N 2.57Å; G485-Q488 PolarHBondContact O-N 3.18Å; G485-L489 VanDerWaalsContact O-CG 3.32Å; G485-L489 WeakPolarHBondContact O-CG 3.28Å; G485-L489 PolarHBondContact O-N 2.94Å
486A97.4Very high97.5Very high46 Ų4693.1 Ų93.138%0.3850%0.495SS..Hα-helixtrans-66.5-36.8174.200000112.5E482 H483 L490E482-A486 WeakPolarHBondContact O-CB 3.46Å; E482-A486 PolarHBondContact O-N 2.88Å; H483-A486 PolarHBondContact O-N 3.26Å; A486-L490 WeakPolarHBondContact O-CG 3.45Å; A486-L490 PolarHBondContact O-N 2.75Å
487V98Very high97.4Very high49 Ų4993.4 Ų93.430%0.29750%0.497SS..Hα-helixtrans-66.2-48174169.40000110.6H483 E484 L489 L490 E491H483-V487 WeakPolarHBondContact O-CG2 3.28Å; H483-V487 PolarHBondContact O-N 2.96Å; E484-V487 PolarHBondContact O-N 3Å; V487-L489 VanDerWaalsContact C-N 3.3Å; V487-L489 PolarHBondContact O-N 3.4Å; V487-L490 CarbonylContact O-C 3.55Å; V487-L490 WeakPolarHBondContact O-CA 3.34Å; V487-L490 WeakPolarHBondContact O-CB 3.28Å; V487-L490 PolarHBondContact O-N 3Å; V487-E491 HydrophobicContact CG1-CG 4.21Å; V487-E491 WeakPolarHBondContact O-CG 3.45Å; V487-E491 PolarHBondContact O-N 3.46Å
488Q97.3Very high97.4Very high122 Ų12294.9 Ų94.957%0.5750%0.498SS*.Hα-helixtrans-58.8-39.4176.9-71.6167.216.100112.5E484 G485 S492E484-Q488 VanDerWaalsContact O-CG 3.3Å; E484-Q488 WeakPolarHBondContact O-CG 3.33Å; E484-Q488 PolarHBondContact O-N 2.96Å; G485-Q488 PolarHBondContact O-N 3.18Å; Q488-S492 WeakPolarHBondContact O-CB 3.25Å; Q488-S492 PolarHBondContact O-N 2.93Å; Q488-S492 PolarHBondContact O-OG 3.21Å
489L97.6Very high97.3Very high118 Ų11893.6 Ų93.662%0.61850%0.501SS*.Hα-helixtrans-61.2-48.6172.1-74.2170.1000111.2G485 V487 E491 S492 T493G485-L489 VanDerWaalsContact O-CG 3.32Å; G485-L489 WeakPolarHBondContact O-CG 3.28Å; G485-L489 PolarHBondContact O-N 2.94Å; V487-L489 VanDerWaalsContact C-N 3.3Å; V487-L489 PolarHBondContact O-N 3.4Å; L489-E491 PolarHBondContact O-N 3.22Å; L489-S492 PolarHBondContact O-N 2.99Å; L489-S492 PolarHBondContact O-OG 3.48Å; L489-T493 WeakPolarHBondContact O-CG2 3.36Å; L489-T493 PolarHBondContact O-N 3.03Å
490L97.7Very high97.2Very high118 Ų11897 Ų9762%0.61850%0.503SS*.Hα-helixtrans-61.3-44.1177.5-71.3169.6000112.3A486 V487 T493 L494A486-L490 WeakPolarHBondContact O-CG 3.45Å; A486-L490 PolarHBondContact O-N 2.75Å; V487-L490 CarbonylContact O-C 3.55Å; V487-L490 WeakPolarHBondContact O-CA 3.34Å; V487-L490 WeakPolarHBondContact O-CB 3.28Å; V487-L490 PolarHBondContact O-N 3Å; L490-T493 PolarHBondContact O-N 2.89Å; L490-T493 PolarHBondContact O-OG1 3.39Å; L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 PolarHBondContact O-N 3.26Å
491E97.2Very high97.2Very high109 Ų10995.9 Ų95.951%0.50950%0.502SS..Hα-helixtrans-58-49.6175.3-71.5171.9156.100111.1V487 L489 T493 L494 D495V487-E491 HydrophobicContact CG1-CG 4.21Å; V487-E491 WeakPolarHBondContact O-CG 3.45Å; V487-E491 PolarHBondContact O-N 3.46Å; L489-E491 PolarHBondContact O-N 3.22Å; E491-T493 VanDerWaalsContact C-N 3.31Å; E491-T493 PolarHBondContact O-N 3.49Å; E491-L494 WeakPolarHBondContact O-CB 3.35Å; E491-L494 PolarHBondContact O-N 3.49Å; E491-L494 VanDerWaalsContact O-N 3.07Å; E491-D495 PolarHBondContact O-N 3.02Å
492S96.9Very high97.1Very high64 Ų6494.7 Ų94.745%0.44850%0.498SS..Hα-helixtrans-61.4-35.3176.570.80000113.5Q488 L489 S496Q488-S492 WeakPolarHBondContact O-CB 3.25Å; Q488-S492 PolarHBondContact O-N 2.93Å; Q488-S492 PolarHBondContact O-OG 3.21Å; L489-S492 PolarHBondContact O-N 2.99Å; L489-S492 PolarHBondContact O-OG 3.48Å; S492-S496 WeakPolarHBondContact O-CB 3.46Å; S492-S496 PolarHBondContact O-N 2.89Å
493T97Very high97.1Very high75 Ų7590.9 Ų90.946%0.4648%0.48SS..Hα-helixtrans-70.3-36173.362.30000112.5L489 L490 E491 S496 M497L489-T493 WeakPolarHBondContact O-CG2 3.36Å; L489-T493 PolarHBondContact O-N 3.03Å; L490-T493 PolarHBondContact O-N 2.89Å; L490-T493 PolarHBondContact O-OG1 3.39Å; E491-T493 VanDerWaalsContact C-N 3.31Å; E491-T493 PolarHBondContact O-N 3.49Å; T493-S496 PolarHBondContact O-N 3.12Å; T493-M497 WeakPolarHBondContact O-CB 3.35Å; T493-M497 VanDerWaalsContact O-CG 3.28Å; T493-M497 WeakPolarHBondContact O-CG 3.32Å; T493-M497 PolarHBondContact O-N 2.96Å
494L97.8Very high97Very high101 Ų10188.6 Ų88.653%0.52947%0.472SS..Hα-helixtrans-66.3-42.7175.8-174.770000111.2L490 E491 M497 Q498L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 PolarHBondContact O-N 3.26Å; E491-L494 WeakPolarHBondContact O-CB 3.35Å; E491-L494 PolarHBondContact O-N 3.49Å; E491-L494 VanDerWaalsContact O-N 3.07Å; L494-M497 PolarHBondContact O-N 2.94Å; L494-Q498 WeakPolarHBondContact O-CB 3.46Å; L494-Q498 WeakPolarHBondContact O-CG 3.28Å; L494-Q498 PolarHBondContact O-N 3.45Å
495D96.9Very high97Very high97 Ų9787.8 Ų87.852%0.51947%0.468SS..Hα-helixtrans-67.5-38.8176.2-77.6-19.5000112.1E491 Q498 A499E491-D495 PolarHBondContact O-N 3.02Å; D495-Q498 PolarHBondContact O-N 3.32Å; D495-Q498 PolarHBondContact OD1-NE2 2.96Å; D495-Q498 VanDerWaalsContact OD1-NE2 3.1Å; D495-A499 WeakPolarHBondContact O-CB 3.32Å; D495-A499 PolarHBondContact O-N 2.93Å
496S96.6Very high96.9Very high83 Ų8393 Ų9358%0.5849%0.485SS*.Hα-helixtrans-61.5-43.2171.7-175.70000111.7S492 T493 A499 R500S492-S496 WeakPolarHBondContact O-CB 3.46Å; S492-S496 PolarHBondContact O-N 2.89Å; T493-S496 PolarHBondContact O-N 3.12Å; S496-A499 PolarHBondContact O-N 3.22Å; S496-R500 WeakPolarHBondContact O-CB 3.45Å; S496-R500 PolarHBondContact O-N 2.82Å
497M96.9Very high96.8Very high127 Ų12794.4 Ų94.463%0.62648%0.484SS*.Hα-helixtrans-64.8-42.4173.9-74.3177.664.900112.2T493 L494 R500 V501T493-M497 WeakPolarHBondContact O-CB 3.35Å; T493-M497 VanDerWaalsContact O-CG 3.28Å; T493-M497 WeakPolarHBondContact O-CG 3.32Å; T493-M497 PolarHBondContact O-N 2.96Å; L494-M497 PolarHBondContact O-N 2.94Å; M497-R500 PolarHBondContact O-N 2.97Å; M497-V501 WeakPolarHBondContact O-CG2 3.35Å; M497-V501 PolarHBondContact O-N 3.26Å
498Q97.2Very high96.5Very high66 Ų6695.7 Ų95.731%0.30849%0.494SS..Hα-helixtrans-61.4-43.6174.7-77.5177.661.800112L494 D495 R500 V501 R502L494-Q498 WeakPolarHBondContact O-CB 3.46Å; L494-Q498 WeakPolarHBondContact O-CG 3.28Å; L494-Q498 PolarHBondContact O-N 3.45Å; D495-Q498 PolarHBondContact O-N 3.32Å; D495-Q498 PolarHBondContact OD1-NE2 2.96Å; D495-Q498 VanDerWaalsContact OD1-NE2 3.1Å; Q498-R500 VanDerWaalsContact C-N 3.34Å; Q498-V501 PolarHBondContact O-N 2.99Å; Q498-R502 WeakPolarHBondContact O-CG 3.3Å; Q498-R502 PolarHBondContact O-N 3.4Å
499A96.1Very high96.4Very high53 Ų5397 Ų9744%0.43849%0.494SS..Hα-helixtrans-61.1-44175.900000111D495 S496 V501 R502 E503D495-A499 WeakPolarHBondContact O-CB 3.32Å; D495-A499 PolarHBondContact O-N 2.93Å; S496-A499 PolarHBondContact O-N 3.22Å; A499-V501 PolarHBondContact O-N 3.46Å; A499-R502 PolarHBondContact O-N 3.47Å; A499-E503 PolarHBondContact O-N 2.9Å
500R96.5Very high96.1Very high127 Ų12793.5 Ų93.548%0.47948%0.479SS..Hα-helixtrans-66.2-34.8176.2-173.557.4177.9-1749.7113S496 M497 Q498 E503 L504S496-R500 WeakPolarHBondContact O-CB 3.45Å; S496-R500 PolarHBondContact O-N 2.82Å; M497-R500 PolarHBondContact O-N 2.97Å; Q498-R500 VanDerWaalsContact C-N 3.34Å; R500-E503 WeakPolarHBondContact CD-OE2 3.3Å; R500-E503 IonicContact CZ-OE1 3.39Å; R500-E503 IonicContact CZ-OE2 2.64Å; R500-E503 IonicContact NE-OE2 2.66Å; R500-E503 IonicContact NH1-OE1 3.36Å; R500-E503 PolarHBondContact NH1-OE1 2.97Å; R500-E503 IonicContact NH1-OE2 3.21Å; R500-E503 PolarHBondContact NH1-OE2 3.38Å; R500-L504 HydrophobicContact CG-CD1 4.23Å; R500-L504 WeakPolarHBondContact O-CB 3.47Å; R500-L504 WeakPolarHBondContact O-CD1 3.28Å; R500-L504 VanDerWaalsContact O-CG 3.24Å; R500-L504 WeakPolarHBondContact O-CG 3.38Å; R500-L504 PolarHBondContact O-N 3.5Å
501V97.1Very high95.9Very high76 Ų7692.8 Ų92.846%0.46147%0.473SS..Hα-helixtrans-65.5-44.6172.6168.40000110.8M497 Q498 A499 E503 L504 E505M497-V501 WeakPolarHBondContact O-CG2 3.35Å; M497-V501 PolarHBondContact O-N 3.26Å; Q498-V501 PolarHBondContact O-N 2.99Å; A499-V501 PolarHBondContact O-N 3.46Å; V501-E503 PolarHBondContact O-N 2.88Å; V501-L504 PolarHBondContact O-N 3.12Å; V501-E505 WeakPolarHBondContact O-CG 3.47Å; V501-E505 PolarHBondContact O-N 3.08Å
502R96.7Very high95.7Very high147 Ų14792.1 Ų92.156%0.55548%0.476SS*.Hα-helixtrans-61-42.4175.4-69.2169.8-169.9138.612112.2Q498 A499 E505 E506Q498-R502 WeakPolarHBondContact O-CG 3.3Å; Q498-R502 PolarHBondContact O-N 3.4Å; A499-R502 PolarHBondContact O-N 3.47Å; R502-E505 WeakPolarHBondContact O-CB 3.34Å; R502-E505 PolarHBondContact O-N 3.3Å; R502-E506 WeakPolarHBondContact O-CB 3.49Å; R502-E506 PolarHBondContact O-N 2.87Å
503E95.9Very high95.4Very high73 Ų7394.7 Ų94.734%0.34148%0.481SS..Hα-helixtrans-60.6-44174.9-168.6-154.5143.900111.7A499 R500 V501 E506 Q507A499-E503 PolarHBondContact O-N 2.9Å; R500-E503 WeakPolarHBondContact CD-OE2 3.3Å; R500-E503 IonicContact CZ-OE1 3.39Å; R500-E503 IonicContact CZ-OE2 2.64Å; R500-E503 IonicContact NE-OE2 2.66Å; R500-E503 IonicContact NH1-OE1 3.36Å; R500-E503 PolarHBondContact NH1-OE1 2.97Å; R500-E503 IonicContact NH1-OE2 3.21Å; R500-E503 PolarHBondContact NH1-OE2 3.38Å; V501-E503 PolarHBondContact O-N 2.88Å; E503-E506 PolarHBondContact O-N 2.77Å; E503-Q507 WeakPolarHBondContact O-CB 3.33Å; E503-Q507 VanDerWaalsContact O-CG 3.28Å; E503-Q507 WeakPolarHBondContact O-CG 3.5Å; E503-Q507 PolarHBondContact O-N 2.95Å; E503-Q507 PolarHBondContact OE1-NE2 2.96Å
504L96.4Very high95.2Very high78 Ų7896.7 Ų96.741%0.40849%0.486SS..Hα-helixtrans-68.1-36.6176.1-71.3167.3000112.3R500 V501 Q507 C508R500-L504 HydrophobicContact CG-CD1 4.23Å; R500-L504 WeakPolarHBondContact O-CB 3.47Å; R500-L504 WeakPolarHBondContact O-CD1 3.28Å; R500-L504 VanDerWaalsContact O-CG 3.24Å; R500-L504 WeakPolarHBondContact O-CG 3.38Å; R500-L504 PolarHBondContact O-N 3.5Å; V501-L504 PolarHBondContact O-N 3.12Å; L504-Q507 PolarHBondContact O-N 3.31Å; L504-C508 WeakPolarHBondContact O-CB 3.42Å; L504-C508 PolarHBondContact O-N 3.47Å; L504-C508 PolarHBondContact O-SG 2.89Å
505E96.3Very high94.9Very high89 Ų8998.5 Ų98.542%0.41649%0.489SS..Hα-helixtrans-62.9-42.3171.5-77.5-177.1-149.400112V501 R502 C508 R509V501-E505 WeakPolarHBondContact O-CG 3.47Å; V501-E505 PolarHBondContact O-N 3.08Å; R502-E505 WeakPolarHBondContact O-CB 3.34Å; R502-E505 PolarHBondContact O-N 3.3Å; E505-C508 WeakPolarHBondContact O-CB 3.48Å; E505-C508 PolarHBondContact O-N 3.23Å; E505-R509 VanDerWaalsContact O-CG 3.29Å; E505-R509 WeakPolarHBondContact O-CG 3.42Å; E505-R509 PolarHBondContact O-N 3.14Å; E505-R509 IonicContact OE2-CZ 2.96Å; E505-R509 IonicContact OE2-NH2 2.86Å; E505-R509 PolarHBondContact OE2-NH2 2.92Å
506E95.5Very high94.5Very high136 Ų13696.4 Ų96.464%0.63648%0.482SS*.Hα-helixtrans-69.2-35.5178.5-170.6163.3-140.100111.9R502 E503 R509 S510R502-E506 WeakPolarHBondContact O-CB 3.49Å; R502-E506 PolarHBondContact O-N 2.87Å; E503-E506 PolarHBondContact O-N 2.77Å; E506-R509 PolarHBondContact O-N 2.82Å; E506-S510 WeakPolarHBondContact O-CB 3.24Å; E506-S510 PolarHBondContact O-N 3.05Å; E506-S510 PolarHBondContact O-OG 2.78Å
507Q95.2Very high94.2Very high75 Ų7597 Ų9735%0.3548%0.478SS..Hα-helixtrans-62.9-41.6168.1-73.4166.916.600111.8E503 L504 S510 Q511E503-Q507 WeakPolarHBondContact O-CB 3.33Å; E503-Q507 VanDerWaalsContact O-CG 3.28Å; E503-Q507 WeakPolarHBondContact O-CG 3.5Å; E503-Q507 PolarHBondContact O-N 2.95Å; E503-Q507 PolarHBondContact OE1-NE2 2.96Å; L504-Q507 PolarHBondContact O-N 3.31Å; Q507-S510 WeakPolarHBondContact CA-OG 3.49Å; Q507-S510 PolarHBondContact O-OG 3.21Å; Q507-Q511 WeakPolarHBondContact O-CB 3.34Å; Q507-Q511 VanDerWaalsContact O-CG 3.28Å; Q507-Q511 WeakPolarHBondContact O-CG 3.45Å; Q507-Q511 PolarHBondContact O-N 3.46Å
508C92.8Very high93.7Very high75 Ų7595 Ų9551%0.50747%0.47SS..Hα-helixtrans-66-38.9174-72.40000112.7L504 E505 T512L504-C508 WeakPolarHBondContact O-CB 3.42Å; L504-C508 PolarHBondContact O-N 3.47Å; L504-C508 PolarHBondContact O-SG 2.89Å; E505-C508 WeakPolarHBondContact O-CB 3.48Å; E505-C508 PolarHBondContact O-N 3.23Å; C508-T512 WeakPolarHBondContact O-CB 3.19Å; C508-T512 PolarHBondContact O-N 2.98Å; C508-T512 PolarHBondContact O-OG1 2.8Å
509R94.6Very high93.2Very high149 Ų14994.4 Ų94.456%0.56248%0.476SS*.Hα-helixtrans-65.9-50.8176.7-70.8171.2-155.1-174.48.4111.3E505 E506 Q511 T512 E513E505-R509 VanDerWaalsContact O-CG 3.29Å; E505-R509 WeakPolarHBondContact O-CG 3.42Å; E505-R509 PolarHBondContact O-N 3.14Å; E505-R509 IonicContact OE2-CZ 2.96Å; E505-R509 IonicContact OE2-NH2 2.86Å; E505-R509 PolarHBondContact OE2-NH2 2.92Å; E506-R509 PolarHBondContact O-N 2.82Å; R509-Q511 VanDerWaalsContact C-N 3.34Å; R509-Q511 PolarHBondContact O-N 3.07Å; R509-T512 CarbonylContact O-C 3.57Å; R509-T512 WeakPolarHBondContact O-CA 3.28Å; R509-T512 WeakPolarHBondContact O-CB 3.49Å; R509-T512 PolarHBondContact O-N 3.04Å; R509-E513 WeakPolarHBondContact O-CG 3.48Å; R509-E513 PolarHBondContact O-N 3.35Å
510S91.6Very high92.6Very high45 Ų4597.6 Ų97.632%0.31548%0.482SS..Hα-helixtrans-63.8-34.8178.3520000113E506 Q507 E513 Q514E506-S510 WeakPolarHBondContact O-CB 3.24Å; E506-S510 PolarHBondContact O-N 3.05Å; E506-S510 PolarHBondContact O-OG 2.78Å; Q507-S510 WeakPolarHBondContact CA-OG 3.49Å; Q507-S510 PolarHBondContact O-OG 3.21Å; S510-E513 PolarHBondContact O-N 3.48Å; S510-Q514 VanDerWaalsContact O-CG 3.27Å; S510-Q514 WeakPolarHBondContact O-CG 3.48Å; S510-Q514 PolarHBondContact O-N 3.32Å
511Q92.8Very high92Very high103 Ų10396.7 Ų96.748%0.48148%0.483SS..Hα-helixtrans-64.3-42167.7-75.5179.119.500112.1Q507 R509 E513 Q514 F515Q507-Q511 WeakPolarHBondContact O-CB 3.34Å; Q507-Q511 VanDerWaalsContact O-CG 3.28Å; Q507-Q511 WeakPolarHBondContact O-CG 3.45Å; Q507-Q511 PolarHBondContact O-N 3.46Å; R509-Q511 VanDerWaalsContact C-N 3.34Å; R509-Q511 PolarHBondContact O-N 3.07Å; Q511-E513 VanDerWaalsContact C-N 3.31Å; Q511-E513 PolarHBondContact O-N 3.01Å; Q511-Q514 WeakPolarHBondContact O-CB 3.34Å; Q511-Q514 PolarHBondContact O-N 3.01Å; Q511-F515 HydrophobicContact CB-CE2 4.45Å; Q511-F515 WeakPolarHBondContact O-CD2 3.38Å; Q511-F515 PolarHBondContact O-N 3.29Å
512T92.3Very high91.2Very high95 Ų9598 Ų9858%0.58349%0.487SS*.Hα-helixtrans-63-38.1176.1-56.10000111.6C508 R509 F515 S516C508-T512 WeakPolarHBondContact O-CB 3.19Å; C508-T512 PolarHBondContact O-N 2.98Å; C508-T512 PolarHBondContact O-OG1 2.8Å; R509-T512 CarbonylContact O-C 3.57Å; R509-T512 WeakPolarHBondContact O-CA 3.28Å; R509-T512 WeakPolarHBondContact O-CB 3.49Å; R509-T512 PolarHBondContact O-N 3.04Å; T512-F515 PolarHBondContact O-N 2.91Å; T512-S516 WeakPolarHBondContact O-CB 3.4Å; T512-S516 PolarHBondContact O-N 2.89Å
513E92.2Very high90.4Very high119 Ų11996.8 Ų96.856%0.55649%0.487SS*.Hα-helixtrans-65.2-45.3174-72165.4-17400111.2R509 S510 Q511 F515 S516 L517R509-E513 WeakPolarHBondContact O-CG 3.48Å; R509-E513 PolarHBondContact O-N 3.35Å; S510-E513 PolarHBondContact O-N 3.48Å; Q511-E513 VanDerWaalsContact C-N 3.31Å; Q511-E513 PolarHBondContact O-N 3.01Å; E513-F515 PolarHBondContact O-N 3.48Å; E513-S516 WeakPolarHBondContact O-CA 3.06Å; E513-S516 WeakPolarHBondContact O-CB 3.47Å; E513-S516 PolarHBondContact O-N 2.82Å; E513-S516 PolarHBondContact O-OG 3.46Å; E513-L517 WeakPolarHBondContact O-CG 3.29Å; E513-L517 PolarHBondContact O-N 3.32Å
514Q91.7Very high89.2Confident117 Ų11795.7 Ų95.755%0.54749%0.491SS..Hα-helixtrans-58-45.8172.4-72.5167.99.900111.9S510 Q511 S516 L517 L518S510-Q514 VanDerWaalsContact O-CG 3.27Å; S510-Q514 WeakPolarHBondContact O-CG 3.48Å; S510-Q514 PolarHBondContact O-N 3.32Å; Q511-Q514 WeakPolarHBondContact O-CB 3.34Å; Q511-Q514 PolarHBondContact O-N 3.01Å; Q514-S516 VanDerWaalsContact C-N 3.27Å; Q514-S516 PolarHBondContact O-N 3.48Å; Q514-L517 PolarHBondContact O-N 2.92Å; Q514-L518 WeakPolarHBondContact O-CB 3.5Å; Q514-L518 WeakPolarHBondContact O-CG 3.44Å; Q514-L518 PolarHBondContact O-N 3.22Å
515F91.3Very high87.7Confident139 Ų13999.5 Ų99.561%0.6151%0.505SS*.Hα-helixtrans-62.9-32.5173.3-73.5-58.5000112.7Q511 T512 E513 L518 A519Q511-F515 HydrophobicContact CB-CE2 4.45Å; Q511-F515 WeakPolarHBondContact O-CD2 3.38Å; Q511-F515 PolarHBondContact O-N 3.29Å; T512-F515 PolarHBondContact O-N 2.91Å; E513-F515 PolarHBondContact O-N 3.48Å; F515-L518 HydrophobicContact CD1-CD1 4.44Å; F515-A519 VanDerWaalsContact O-CB 3.24Å; F515-A519 WeakPolarHBondContact O-CB 3.28Å; F515-A519 PolarHBondContact O-N 2.99Å
516S89.7Confident86.4Confident52 Ų52105.1 Ų105.136%0.36452%0.522SS..Hα-helixtrans-71.7-34.9176.285.60000112.8T512 E513 Q514 A519 Q520T512-S516 WeakPolarHBondContact O-CB 3.4Å; T512-S516 PolarHBondContact O-N 2.89Å; E513-S516 WeakPolarHBondContact O-CA 3.06Å; E513-S516 WeakPolarHBondContact O-CB 3.47Å; E513-S516 PolarHBondContact O-N 2.82Å; E513-S516 PolarHBondContact O-OG 3.46Å; Q514-S516 VanDerWaalsContact C-N 3.27Å; Q514-S516 PolarHBondContact O-N 3.48Å; S516-A519 PolarHBondContact O-N 3.33Å; S516-Q520 VanDerWaalsContact O-CG 3.3Å; S516-Q520 WeakPolarHBondContact O-CG 3.47Å; S516-Q520 PolarHBondContact O-N 2.86Å; S516-Q520 PolarHBondContact O-NE2 2.9Å
517L89.9Confident84.9Confident96 Ų96104.9 Ų104.950%0.50352%0.524SS..Hα-helixtrans-69.9-47.9173.5-68.4171.2000110.4E513 Q514 A519 Q520 E521E513-L517 WeakPolarHBondContact O-CG 3.29Å; E513-L517 PolarHBondContact O-N 3.32Å; Q514-L517 PolarHBondContact O-N 2.92Å; L517-A519 PolarHBondContact O-N 2.95Å; L517-Q520 CarbonylContact O-C 3.58Å; L517-Q520 WeakPolarHBondContact O-CA 3.46Å; L517-Q520 WeakPolarHBondContact O-CB 3.22Å; L517-Q520 PolarHBondContact O-N 3.48Å; L517-E521 WeakPolarHBondContact O-CG 3.5Å; L517-E521 PolarHBondContact O-N 3.3Å
518L86.9Confident82.5Confident86 Ų86109.1 Ų109.145%0.4554%0.544SS..Hα-helixtrans-57-37.8172.6-75.2162.9000112.1Q514 F515 L522Q514-L518 WeakPolarHBondContact O-CB 3.5Å; Q514-L518 WeakPolarHBondContact O-CG 3.44Å; Q514-L518 PolarHBondContact O-N 3.22Å; F515-L518 HydrophobicContact CD1-CD1 4.44Å; L518-L522 WeakPolarHBondContact O-CB 3.41Å; L518-L522 WeakPolarHBondContact O-CG 3.27Å; L518-L522 PolarHBondContact O-N 3.3Å
519A85.4Confident80.4Confident53 Ų53111.6 Ų111.644%0.43856%0.559SS.*Hα-helixtrans-67.5-38.6174.500000112.5F515 S516 L517 Q523F515-A519 VanDerWaalsContact O-CB 3.24Å; F515-A519 WeakPolarHBondContact O-CB 3.28Å; F515-A519 PolarHBondContact O-N 2.99Å; S516-A519 PolarHBondContact O-N 3.33Å; L517-A519 PolarHBondContact O-N 2.95Å; A519-Q523 VanDerWaalsContact O-CB 3.27Å; A519-Q523 WeakPolarHBondContact O-CB 3.37Å; A519-Q523 PolarHBondContact O-N 2.81Å
520Q84.8Confident77.6Confident119 Ų119107.6 Ų107.656%0.55656%0.564SS**Hα-helixtrans-67-41.8173.9-74.4171.15500111.9S516 L517 Q523 A524S516-Q520 VanDerWaalsContact O-CG 3.3Å; S516-Q520 WeakPolarHBondContact O-CG 3.47Å; S516-Q520 PolarHBondContact O-N 2.86Å; S516-Q520 PolarHBondContact O-NE2 2.9Å; L517-Q520 CarbonylContact O-C 3.58Å; L517-Q520 WeakPolarHBondContact O-CA 3.46Å; L517-Q520 WeakPolarHBondContact O-CB 3.22Å; L517-Q520 PolarHBondContact O-N 3.48Å; Q520-Q523 CarbonylContact O-C 3.53Å; Q520-Q523 PolarHBondContact O-N 3.32Å; Q520-A524 PolarHBondContact O-N 3.42Å
521E83.4Confident75.6Confident109 Ų109112 Ų11251%0.50959%0.591SS.*Hα-helixtrans-60.8-50.2173.4-71.9175.6175.700111L517 Q523 A524 F525L517-E521 WeakPolarHBondContact O-CG 3.5Å; L517-E521 PolarHBondContact O-N 3.3Å; E521-Q523 PolarHBondContact O-N 3.34Å; E521-A524 WeakPolarHBondContact O-CB 3.47Å; E521-A524 PolarHBondContact O-N 2.98Å; E521-F525 WeakPolarHBondContact O-CD2 3.44Å; E521-F525 PolarHBondContact O-N 3.07Å
522L80.1Confident73.9Confident102 Ų102114.7 Ų114.753%0.53461%0.608SS.*Hα-helixtrans-60.8-28.1174.9-72.6170.3000112.9L518 R526L518-L522 WeakPolarHBondContact O-CB 3.41Å; L518-L522 WeakPolarHBondContact O-CG 3.27Å; L518-L522 PolarHBondContact O-N 3.3Å; L522-R526 WeakPolarHBondContact O-CD 3.47Å; L522-R526 VanDerWaalsContact O-CG 3.3Å; L522-R526 WeakPolarHBondContact O-CG 3.34Å; L522-R526 PolarHBondContact O-N 2.7Å
523Q79.3Confident71.6Confident122 Ų122117 Ų11757%0.5762%0.617SS**Hα-helixtrans-79-33.9173.3-171.4163.3-16.800112.3A519 Q520 E521 R526 L527A519-Q523 VanDerWaalsContact O-CB 3.27Å; A519-Q523 WeakPolarHBondContact O-CB 3.37Å; A519-Q523 PolarHBondContact O-N 2.81Å; Q520-Q523 CarbonylContact O-C 3.53Å; Q520-Q523 PolarHBondContact O-N 3.32Å; E521-Q523 PolarHBondContact O-N 3.34Å; Q523-R526 WeakPolarHBondContact O-CB 3.42Å; Q523-R526 PolarHBondContact O-N 2.68Å; Q523-L527 WeakPolarHBondContact O-CG 3.33Å; Q523-L527 PolarHBondContact O-N 3.25Å
524A71.9Confident69.4Low50 Ų50120 Ų12041%0.41364%0.636SS.*Hα-helixtrans-66.6-42.2171.200000111.7Q520 E521 R526 L527 H528Q520-A524 PolarHBondContact O-N 3.42Å; E521-A524 WeakPolarHBondContact O-CB 3.47Å; E521-A524 PolarHBondContact O-N 2.98Å; A524-R526 PolarHBondContact O-N 3.48Å; A524-L527 PolarHBondContact O-N 3.1Å; A524-H528 PolarHBondContact O-N 2.88Å
525F64.6Low67.3Low159 Ų159121.7 Ų121.770%0.69765%0.648SS**Hα-helixtrans-58.4-28.7170.9-77.2-64.1000112.9E521E521-F525 WeakPolarHBondContact O-CD2 3.44Å; E521-F525 PolarHBondContact O-N 3.07Å
526R69.2Low64.8Low207 Ų207121 Ų12178%0.78166%0.655SS**THydrogen-bonded Turntrans-80.6-14.1173.9-72.6168.7178.7175.91114.1L522 Q523 A524L522-R526 WeakPolarHBondContact O-CD 3.47Å; L522-R526 VanDerWaalsContact O-CG 3.3Å; L522-R526 WeakPolarHBondContact O-CG 3.34Å; L522-R526 PolarHBondContact O-N 2.7Å; Q523-R526 WeakPolarHBondContact O-CB 3.42Å; Q523-R526 PolarHBondContact O-N 2.68Å; A524-R526 PolarHBondContact O-N 3.48Å
527L62.3Low62.2Low130 Ų130124.3 Ų124.368%0.68168%0.678SS**THydrogen-bonded Turntrans-100.6-7.2-179.9-68.6170.2000113.3Q523 A524 P529Q523-L527 WeakPolarHBondContact O-CG 3.33Å; Q523-L527 PolarHBondContact O-N 3.25Å; A524-L527 PolarHBondContact O-N 3.1Å; L527-P529 VanDerWaalsContact C-CD 3.49Å; L527-P529 VanDerWaalsContact O-CD 3.31Å; L527-P529 WeakPolarHBondContact O-CD 3.24Å
528H46.2Very low59.4Low165 Ų165124 Ų12476%0.76469%0.69SS**  trans-114.982.4173.9-84.7-69.8000113.2A524 G530A524-H528 PolarHBondContact O-N 2.88Å; H528-G530 PolarHBondContact O-N 2.93Å
529P48.3Very low57.2Low127 Ų127126.8 Ų126.883%0.82570%0.704SS**  trans-82.5109166.631.9-31000111.1L527L527-P529 VanDerWaalsContact C-CD 3.49Å; L527-P529 VanDerWaalsContact O-CD 3.31Å; L527-P529 WeakPolarHBondContact O-CD 3.24Å
530G36.2Very low54.7Low64 Ų64131.1 Ų131.166%0.6672%0.72SS**  trans-143148.5174.200000111.4H528H528-G530 PolarHBondContact O-N 2.93Å
531P49.2Very low52.1Low138 Ų138132.3 Ų132.390%0.89674%0.74SS**  trans-82.9169.8-163.133-36.5000115.8
532L57.2Low49.6Very low160 Ų160130.8 Ų130.884%0.83875%0.753SS**  trans-83.7175.1-166.6-74.2161.6000115.9
533D44.1Very low47.6Very low144 Ų144131.5 Ų131.577%0.7777%0.767SS**  trans82.9104.6157.8-61.1-24000120.2
534L45.3Very low45.6Very low180 Ų180133.3 Ų133.394%0.94278%0.779SS**  trans-156.3131.8140.1-111.7161.8000109.7
535L47.2Very low43.9Very low154 Ų154133.7 Ų133.781%0.80679%0.788SS**  trans-101.4141-169.1-75.5167.4000114.1
536T38.6Very low42.3Very low124 Ų124133.7 Ų133.776%0.76180%0.796SS**  trans38.4100.1137.2-47.30000120
537S35.6Very low41.1Very low122 Ų122129.5 Ų129.585%0.85380%0.797SS**  trans179143.8142.3-78.40000108.6
538A31.5Very low40.2Very low89 Ų89129.2 Ų129.274%0.73680%0.803SS**  cis-121.4156.6-0.200000109.1
539L40.7Very low40.4Very low145 Ų145127 Ų12776%0.75980%0.803SS**  69.194.452.1-79.4171.9000115.4
540D32.3Very low41.1Very low144 Ų144126.5 Ų126.577%0.7780%0.799SS**  trans52.9110.9134.4-56.6-7.5000122.7
541C31.1Very low41.6Very low143 Ų143129 Ų12997%0.96681%0.805SS**  trans-167.6125.3135.7-106.50000108.6
542G30.5Very low41.5Very low77 Ų77128.4 Ų128.479%0.79480%0.802SS**  cis-169.8178.4-400000111.7
543S37.6Very low40.2Very low117 Ų117126.7 Ų126.782%0.81880%0.802SS**  trans-68.7168.5178-131.80000112.5
544L38.1Very low39.9Very low160 Ų160125.6 Ų125.684%0.83880%0.804SS**  -169.9140.655.4-176.769.3000114.6
545G35.4Very low39.5Very low58 Ų58122.6 Ų122.660%0.59880%0.798SS**  trans79.2146.6146.600000119.1
546D32.3Very low39.1Very low160 Ų160123 Ų12386%0.85680%0.8SS**  cis-154.2158.3-12.9-99.5-45.6000110
547C42.8Very low39.5Very low119 Ų119122.7 Ų122.780%0.80480%0.8SS**  trans-88.2160.7-178.8-50.80000112.6
548P43.9Very low39.5Very low124 Ų124125.3 Ų125.381%0.80580%0.798SS**  -139.917282.127.2-5.9000115.4
549P50.5Low40.8Very low118 Ų118125.8 Ų125.877%0.76679%0.794SS**  trans-116.3-150.6-16045.8-32.5000114.1
550P63.6Low40.3Very low116 Ų116124 Ų12475%0.75379%0.793SS**  -112.3-170.1-120.936.1-15.1000114
551P46.9Very low40.4Very low118 Ų118129 Ų12977%0.76680%0.801SS**  -148.4172.110539.8-24.9000116
552C45.5Very low40.4Very low125 Ų125125.3 Ų125.385%0.84579%0.787SS**  trans-74.6155.6165.8-54.50000112
553C30.9Very low40.7Very low124 Ų124128 Ų12884%0.83879%0.794SS**  trans-131.5123.2165.5-78.50000111.8
554C36.9Very low40.5Very low120 Ų120125.8 Ų125.881%0.81179%0.789SS**  trans-114.2163155.5-64.50000108.7
555S37.7Very low41.1Very low117 Ų117123.7 Ų123.782%0.81879%0.785SS**  trans84.1121163.4-530000119.9
556I39.4Very low41.4Very low163 Ų163129.2 Ų129.284%0.83679%0.792SS**  trans-32137.1148.9-67.8157.5000112
557P46.1Very low41.4Very low118 Ų118126.6 Ų126.677%0.76678%0.778SS**  -155.5172.282.343.8-23.8000119.9
558Q36.9Very low41.2Very low176 Ų176127.5 Ų127.582%0.82278%0.775SS**  trans-83.5-177.4158.9-105.8-155.41900110.8
559P57.1Low40.9Very low99 Ų99127.4 Ų127.464%0.64377%0.767SS**  cis-140.2-166.59.732.4-7.4000116.4
560C30.4Very low40.4Very low108 Ų108128.8 Ų128.873%0.7377%0.768SS**  trans94130144.6-740000123.8
561R34.1Very low40.4Very low249 Ų249128.5 Ų128.594%0.9477%0.766SS**  trans61.2149.3154.5-61.4176.2-176.3-108.32.7117.6
562G32.2Very low40.7Very low66 Ų66129.2 Ų129.268%0.6877%0.77SS**  cis142.8139.5-2.500000112.5
563S37.5Very low39.9Very low134 Ų134126.9 Ų126.994%0.93777%0.768SS**  trans81.7133174.1-53.60000118.9
564G33.1Very low40.2Very low69 Ų69126.6 Ų126.671%0.71177%0.767SS**  trans-94.3-162.3166.900000112.6
565P50.8Low40.9Very low116 Ų116127 Ų12775%0.75377%0.768SS**  -158.2156.3104.840-21.6000119
566K40.9Very low40.7Very low174 Ų174124.6 Ų124.676%0.75776%0.761SS**  trans67.5163.3134.1-72.6177.9151.6-109.60120.6
567D31.5Very low40.4Very low105 Ų105127.9 Ų127.956%0.56176%0.763SS**  cis-162.1154.3-8.7-107.6-18000106.2
568L40.3Very low39.5Very low139 Ų139128 Ų12873%0.72877%0.765SS**  cis-124.8-106-11.4-82.2136.5000108
569D36.3Very low39.3Very low122 Ų122126.1 Ų126.165%0.65277%0.766SS**  cis-165.4159.3-30.1-120.8-15.2000106.8
570L40.2Very low38.5Very low147 Ų147127.2 Ų127.277%0.7777%0.773SS**  cis-140.8151.7-5.3-103.4-179.3000108.3
571P63.2Low38.9Very low110 Ų110132 Ų13271%0.71478%0.781SS**  trans-100.7161.6175.938.6-34.5000114.5
572P54.4Low39Very low132 Ų132125.1 Ų125.186%0.85777%0.772SS**  -136.6157.7123.938.7-29.8000113.7
573G27.7Very low39.2Very low77 Ų77127.3 Ų127.379%0.79478%0.777SS**  trans152.432.417300000118.4
574S38.3Very low39Very low117 Ų117129.7 Ų129.782%0.81877%0.773SS**  trans-135.2152.1-178.4-570000112
575P51.7Low39.6Very low130 Ų130132.1 Ų132.184%0.84478%0.776SS**  -141.216699.239.1-26.8000113.5
576G31.6Very low38.4Very low65 Ų65131 Ų13167%0.6778%0.776SS**  cis120.1106.4-1.100000113.9
577R33.8Very low38.8Very low233 Ų233128.2 Ų128.288%0.87978%0.777SS**  trans-179.7130.5153.5-98.1160.2-172.9-73.6-4.7107.9
578C26.9Very low38.6Very low120 Ų120127.6 Ų127.681%0.81179%0.786SS**  88.111850.6-66.20000113.9
579T33.5Very low38Very low136 Ų136127.3 Ų127.383%0.83479%0.79SS**  trans-88.4168.9161.452.30000111.2
580P40.5Very low37.6Very low123 Ų123129.3 Ų129.380%0.79980%0.8SS**  trans-110161.8152.836-28.2000112.9
581K37.7Very low36.9Very low207 Ų207129.2 Ų129.290%0.981%0.806SS**  trans-82.8173.1167.8-55.7173.7175.6177.30109.5
582S37.8Very low35.2Very low106 Ų106127.7 Ų127.774%0.74181%0.81SS**  cis-144.8179.56.356.80000108.5
583S35.3Very low34.1Very low112 Ų112128.1 Ų128.178%0.78381%0.81SS**  cis-158.7172.433.9-56.50000113.1
584E33.5Very low34.9Very low184 Ų184129.8 Ų129.886%0.8681%0.806SS**  trans-76.4179174.3-93.1-176.599.200115.2
585P45.7Very low34.5Very low119 Ų119135.9 Ų135.977%0.77381%0.811SS**  cis-128.4-172.22.219.47000116.4
586A26.2Very low33.7Very low92 Ų92140.5 Ų140.576%0.7681%0.812SS**  trans-95.9-158.5-174.400000112.8
587P48.8Very low33.6Very low117 Ų117143.9 Ų143.976%0.7682%0.82SS**  cis-144166.44.443.8-24.4000120
588A28.1Very low33.2Very low91 Ų91136.9 Ų136.975%0.75281%0.812SS**  trans56.5163.2144.500000120.8
589T26.1Very low33.4Very low134 Ų134141 Ų14182%0.82282%0.816SS**  cis-147.7159.78.1-35.40000111.1
590L28.5Very low33.1Very low163 Ų163143.2 Ų143.285%0.85381%0.814SS**  trans-97.4141.5168.9-78.6166.9000112.3
591T25Very low32.6Very low146 Ų146141.1 Ų141.190%0.89681%0.807SS**  trans-172.4147145.311.30000113.3
592G27.6Very low32.2Very low77 Ų77138.6 Ų138.679%0.79480%0.799SS**  trans85.588.5132.800000121.1
593V31.6Very low31.9Very low142 Ų142137.9 Ų137.986%0.86179%0.793SS**  trans-89.7134.3151.6170.80000106.4
594P45.4Very low31.7Very low111 Ų111141 Ų14172%0.72180%0.801SS**  -162.2168.48443.1-21.6000121.7
595R29.9Very low31.5Very low246 Ų246136.8 Ų136.893%0.92879%0.791SS**  trans83.8165.4144.4-89.4175.6177.9-175.4-1120.8
596R34.9Very low30.8Very low227 Ų227138.2 Ų138.286%0.85779%0.792SS**  trans-114.6147.4-161.4-57.5154.478.3177.36.3110.2
597T28.8Very low31.1Very low136 Ų136138.9 Ų138.983%0.83479%0.791SS**  153.2158.7116.9480000114.8
598A26Very low30.4Very low86 Ų86138.1 Ų138.171%0.71179%0.789SS**  trans81.1104.9149.100000122
599K30.9Very low30.5Very low207 Ų207142 Ų14290%0.979%0.791SS**  64.8124.6120.9-71.9-179.1174.7177.50122.8
600K27.4Very low30.9Very low181 Ų181140.3 Ų140.379%0.78779%0.785SS**  86.8111.9127.6-168.4-173.9179.8-147.10120.1
601A28.9Very low30.8Very low79 Ų79142.2 Ų142.265%0.65379%0.789SS**  trans65.6164.7141.900000118.4
602E29.4Very low31.3Very low155 Ų155140.1 Ų140.172%0.72478%0.781SS**  cis-151.2154.519.4-148.3140.8-10800114.6
603S31.4Very low31.5Very low90 Ų90144 Ų14463%0.62978%0.781SS**  trans27.1131.2156.461.60000123.4
604L30.6Very low31.5Very low179 Ų179144.7 Ų144.794%0.93778%0.775SS**  -138.8146.7114.6-83-174000110.3
605S31Very low30.7Very low95 Ų95146.7 Ų146.766%0.66478%0.78SS**  trans-109.5168.3-177.9-53.70000110.3
606N29.5Very low30.9Very low148 Ų148140.2 Ų140.279%0.79177%0.772SS**  -169.714061.1-89.3-49.6000110.9
607S32.8Very low31.1Very low106 Ų106135.3 Ų135.374%0.74177%0.77SS**  78.9144.1108.1-153.60000115.6
608S35Very low31.4Very low102 Ų102138.4 Ų138.471%0.71377%0.771SS**  cis-134.7141.813-57.70000111
609H28.8Very low32Very low172 Ų172140.3 Ų140.380%0.79678%0.777SS**  56.8106.793.3-128.2-77.8000113.7
610S34.8Very low32.1Very low99 Ų99135.6 Ų135.669%0.69277%0.77SS**  cis86.7116.841-58.30000114.5
611E28.1Very low32.8Very low203 Ų203132.9 Ų132.995%0.94977%0.771SS**  trans-156.9167.9153.4-141.7166.9-140.300111.8
612S33.6Very low33Very low102 Ų102135.3 Ų135.371%0.71378%0.778SS**  trans-148.6164.9-17465.20000111.6
613I31.8Very low33.6Very low157 Ų157133.4 Ų133.481%0.80578%0.779SS**  trans179.5158.7141.3-96.8157.2000112.3
614H32.5Very low33.3Very low157 Ų157137.5 Ų137.573%0.72779%0.785SS**  trans-68.4153.2-178.6-52.4-108.5000114.3
615N27.6Very low33.3Very low153 Ų153135.2 Ų135.282%0.81878%0.779SS**  174.3158.298.9-92.1-58.6000114.1
616S34.7Very low33.1Very low110 Ų110141.2 Ų141.277%0.76979%0.787SS**  trans-107156.8159-68.20000109.1
617P39Very low33Very low124 Ų124141.2 Ų141.281%0.80579%0.786SS**  -147.1170.6105.736.8-21.1000115.4
618K34.7Very low32.7Very low201 Ų201142.2 Ų142.287%0.87479%0.788SS**  trans-111.3148.6157.5-73.8179.2175.9173.20107.7
619P40Very low32.3Very low127 Ų127142.1 Ų142.183%0.82579%0.793SS**  -144.6-174.790.735.3-16.4000115.5
620S31.8Very low32.1Very low108 Ų108142.3 Ų142.376%0.75580%0.797SS**  trans-80.2179.3174.449.30000112.1
621P42Very low31.8Very low123 Ų123149 Ų14980%0.79981%0.807SS**  cis-141.7-167.918.443.8-22.6000118
622T34.5Very low31.8Very low131 Ų131150.3 Ų150.380%0.80480%0.803SS**  trans-78.9158.9176.748.20000113.6
623P41Very low31.4Very low115 Ų115149.8 Ų149.875%0.74780%0.799SS**  -153.3170.298.940-21.8000118.2
624F26Very low31.2Very low175 Ų175153.3 Ų153.377%0.76880%0.803SS**  trans5.8132.7155.2-85-103.1000122.8
625V29.5Very low30.9Very low132 Ų132151 Ų15180%0.880%0.804SS**  trans-140.6138.3130.7177.90000110.5L627V625-L627 HydrophobicContact CG1-CG 4.49Å
626R26.5Very low30.9Very low220 Ų220153.6 Ų153.683%0.8380%0.802SS**  trans-111.1129.4163-74.6175.6172.9163.6-4.2109.4
627L27.3Very low30.6Very low148 Ų148153.9 Ų153.978%0.77580%0.804SS**  trans-145.797.9159.2-82.2170.7000107.9V625V625-L627 HydrophobicContact CG1-CG 4.49Å
628T27.8Very low30.1Very low127 Ų127158.5 Ų158.578%0.77981%0.806SS**  74.5135.590.356.20000115.3
629A27Very low30Very low100 Ų100154.2 Ų154.283%0.82680%0.801SS**  trans-86148.6-176.200000113.2
630M24.6Very low29.4Very low177 Ų177154 Ų15487%0.87280%0.802SS**  trans-111.6110.3167.2-15469.3-179.400110.9
631R27.2Very low29.5Very low240 Ų240154.8 Ų154.891%0.90680%0.804SS**  trans-9299.4-176.3-168.6-171.4-146.3-125.811.8110.1S633R631-S633 PolarHBondContact O-N 3.24Å
632R27.7Very low29.3Very low230 Ų230154.8 Ų154.887%0.86881%0.807SS**  trans-89.2100173.1-80.1-171.3169.2178.1-2111.8
633S26.5Very low29.1Very low90 Ų90154 Ų15463%0.62981%0.806SS**  trans-72.7134.8163-175.40000109.7R631R631-S633 PolarHBondContact O-N 3.24Å
634W26.5Very low28.9Very low232 Ų232153 Ų15388%0.87980%0.803SS**  trans-125.192.4167.2-107.133.7000109
635S26.4Very low29.6Very low108 Ų108149.4 Ų149.476%0.75580%0.799SS**  trans-86.3123.1165.1-62.20000109
636R28.2Very low30.3Very low207 Ų207148 Ų14878%0.78179%0.791SS**  trans-131.7116.7157-83.2-168.1172.6-118.5-1.8109
637S29.3Very low31Very low116 Ų116140.7 Ų140.781%0.81178%0.777SS**  trans-73.3128.1168.9-174.30000108.9
638W28.5Very low31.6Very low222 Ų222143.6 Ų143.684%0.84178%0.778SS**  trans-130.8121.2168.8-89.858.8000107.8
639S31.7Very low32.4Very low111 Ų111141 Ų14178%0.77677%0.765SS**PPolyproline II helixtrans-69.6153.9-175.2-54.40000112.5P641S639-P641 WeakPolarHBondContact O-CD 3.43Å
640C27.4Very low33.2Very low123 Ų123139.1 Ų139.183%0.83175%0.746SS**PPolyproline II helixtrans-72.9137.1172.2-60.40000111.7
641P33.7Very low34.3Very low124 Ų124135.8 Ų135.881%0.80573%0.73SS**PPolyproline II helixtrans-94.3138.8140.533.1-29.4000110S639S639-P641 WeakPolarHBondContact O-CD 3.43Å
642S37.8Very low35.2Very low123 Ų123127 Ų12786%0.8671%0.709SS**PPolyproline II helixtrans-85.7118.7-179.4-64.30000112
643S31.4Very low36.1Very low113 Ų113119.1 Ų119.179%0.7969%0.689SS**  trans-165149.1149.2-1620000115.1
644S35.2Very low37Very low96 Ų96123.6 Ų123.667%0.67169%0.693SS**  trans69.6147.7162.283.10000119.5
645S41.5Very low37.9Very low99 Ų99121.9 Ų121.969%0.69269%0.686SS**SBendtrans-87.5-9.3-169.1500000115.2A647S645-A647 VanDerWaalsContact C-N 3.34Å; S645-A647 PolarHBondContact O-N 3.35Å
646V44.3Very low38.9Very low103 Ų103126.8 Ų126.862%0.62469%0.688SS**THydrogen-bonded Turntrans-68.7-25.7-165-173.10000113.8R648 S649V646-R648 PolarHBondContact O-N 3.01Å; V646-S649 PolarHBondContact O-OG 2.92Å; V646-S649 VanDerWaalsContact O-OG 3.07Å
647A40Very low39.8Very low66 Ų66126.3 Ų126.355%0.54569%0.686SS.*Hα-helixtrans-66.3-30.1-173.700000114.6S645 S650 L651S645-A647 VanDerWaalsContact C-N 3.34Å; S645-A647 PolarHBondContact O-N 3.35Å; A647-S650 PolarHBondContact O-N 2.94Å; A647-L651 PolarHBondContact O-N 3.46Å
648R41.7Very low40.5Very low209 Ų209128.7 Ų128.779%0.78968%0.682SS**Hα-helixtrans-71.4-38.7-171.1-56.6-173.5-160.4-130.42.4112.4V646 L651 A652V646-R648 PolarHBondContact O-N 3.01Å; R648-L651 PolarHBondContact O-N 3.28Å; R648-A652 WeakPolarHBondContact O-CB 3.43Å; R648-A652 PolarHBondContact O-N 2.85Å
649S44Very low41.1Very low73 Ų73127.9 Ų127.951%0.5168%0.679SS.*Hα-helixtrans-67.1-36.8177.362.10000112.3V646 S653V646-S649 PolarHBondContact O-OG 2.92Å; V646-S649 VanDerWaalsContact O-OG 3.07Å; S649-S653 VanDerWaalsContact O-CB 3.25Å; S649-S653 WeakPolarHBondContact O-CB 3.13Å; S649-S653 PolarHBondContact O-N 2.72Å; S649-S653 PolarHBondContact O-OG 3.24Å
650S44.2Very low41.8Very low60 Ų60130.4 Ų130.442%0.4268%0.676SS.*Hα-helixtrans-64-45174.1-177.40000111.9A647 S653 R654A647-S650 PolarHBondContact O-N 2.94Å; S650-S653 PolarHBondContact O-N 3.37Å; S650-R654 WeakPolarHBondContact O-CB 3.3Å; S650-R654 WeakPolarHBondContact O-CG 3.45Å; S650-R654 PolarHBondContact O-N 2.92Å
651L46.2Very low42.6Very low106 Ų106134.5 Ų134.556%0.55567%0.673SS**Hα-helixtrans-65.8-42.4175.9-87.3162.5000112.7A647 R648 S653 R654 R655A647-L651 PolarHBondContact O-N 3.46Å; R648-L651 PolarHBondContact O-N 3.28Å; L651-S653 VanDerWaalsContact C-N 3.33Å; L651-S653 PolarHBondContact O-N 2.86Å; L651-R654 PolarHBondContact O-N 3.3Å; L651-R655 WeakPolarHBondContact O-CB 3.47Å; L651-R655 WeakPolarHBondContact O-CG 3.44Å; L651-R655 PolarHBondContact O-N 2.94Å
652A47.7Very low42.8Very low55 Ų55138.5 Ų138.546%0.45567%0.673SS.*Hα-helixtrans-60.2-43.1173.100000111.6R648 R655 R656R648-A652 WeakPolarHBondContact O-CB 3.43Å; R648-A652 PolarHBondContact O-N 2.85Å; A652-R655 PolarHBondContact O-N 2.86Å; A652-R656 PolarHBondContact O-N 3.42Å
653S45.9Very low43.2Very low65 Ų65136.6 Ų136.646%0.45566%0.656SS.*Hα-helixtrans-66.4-41.8177.1-65.50000112.7S649 S650 L651 R656 R657S649-S653 VanDerWaalsContact O-CB 3.25Å; S649-S653 WeakPolarHBondContact O-CB 3.13Å; S649-S653 PolarHBondContact O-N 2.72Å; S649-S653 PolarHBondContact O-OG 3.24Å; S650-S653 PolarHBondContact O-N 3.37Å; L651-S653 VanDerWaalsContact C-N 3.33Å; L651-S653 PolarHBondContact O-N 2.86Å; S653-R656 PolarHBondContact O-N 2.88Å; S653-R657 WeakPolarHBondContact O-CB 3.41Å; S653-R657 WeakPolarHBondContact O-CG 3.27Å; S653-R657 PolarHBondContact O-N 2.95Å
654R45.8Very low43.7Very low185 Ų185140.8 Ų140.870%0.69865%0.654SS**Hα-helixtrans-64.5-39.1172.8-76.7-176.2172.8-154.4-1.7111.5S650 L651 R657 K658S650-R654 WeakPolarHBondContact O-CB 3.3Å; S650-R654 WeakPolarHBondContact O-CG 3.45Å; S650-R654 PolarHBondContact O-N 2.92Å; L651-R654 PolarHBondContact O-N 3.3Å; R654-R657 PolarHBondContact O-N 2.83Å; R654-K658 WeakPolarHBondContact O-CB 3.46Å; R654-K658 PolarHBondContact O-N 2.78Å
655R44.8Very low43.8Very low196 Ų196145 Ų14574%0.7466%0.655SS**Hα-helixtrans-65.6-47.3173.3-75.1-176178.2-155.90.8111.9L651 A652 R657 K658 R659L651-R655 WeakPolarHBondContact O-CB 3.47Å; L651-R655 WeakPolarHBondContact O-CG 3.44Å; L651-R655 PolarHBondContact O-N 2.94Å; A652-R655 PolarHBondContact O-N 2.86Å; R655-R657 PolarHBondContact O-N 3.17Å; R655-K658 PolarHBondContact O-N 2.99Å; R655-R659 PolarHBondContact O-N 3.47Å
656R46.6Very low43.8Very low210 Ų210150.2 Ų150.279%0.79266%0.66SS**Hα-helixtrans-58.7-44.4173-86.1-173.3170-169.1-2.6111.7A652 S653 R659 K660A652-R656 PolarHBondContact O-N 3.42Å; S653-R656 PolarHBondContact O-N 2.88Å; R656-R659 PolarHBondContact O-N 3.28Å; R656-K660 WeakPolarHBondContact O-CB 3.48Å; R656-K660 PolarHBondContact O-N 2.94Å
657R48.2Very low43.6Very low197 Ų197155.3 Ų155.374%0.74367%0.668SS**Hα-helixtrans-65-38.5175.7-73.9-177.5178.9-1701.1112.7S653 R654 R655 R661S653-R657 WeakPolarHBondContact O-CB 3.41Å; S653-R657 WeakPolarHBondContact O-CG 3.27Å; S653-R657 PolarHBondContact O-N 2.95Å; R654-R657 PolarHBondContact O-N 2.83Å; R655-R657 PolarHBondContact O-N 3.17Å; R657-R661 WeakPolarHBondContact O-CB 3.47Å; R657-R661 PolarHBondContact O-N 3.44Å
658K43.3Very low43.4Very low167 Ų167156 Ų15673%0.72667%0.669SS**Hα-helixtrans-65-41.9171.4-99.4-176.1174.1179.20112.2R654 R655 R661 R662R654-K658 WeakPolarHBondContact O-CB 3.46Å; R654-K658 PolarHBondContact O-N 2.78Å; R655-K658 PolarHBondContact O-N 2.99Å; K658-R661 PolarHBondContact O-N 2.99Å; K658-R662 PolarHBondContact O-N 2.91Å
659R41.1Very low43.2Very low205 Ų205153 Ų15377%0.77466%0.664SS**Hα-helixtrans-63.3-47.3175.5-132.3176.8-174.21791.3110.9R655 R656 R661 R662 T663R655-R659 PolarHBondContact O-N 3.47Å; R656-R659 PolarHBondContact O-N 3.28Å; R659-R661 PolarHBondContact O-N 3.4Å; R659-R662 PolarHBondContact O-N 3.28Å; R659-R662 VanDerWaalsContact O-N 3.15Å; R659-T663 PolarHBondContact O-N 3.44Å; R659-T663 PolarHBondContact O-OG1 2.82Å
660K47.1Very low42.8Very low164 Ų164152.9 Ų152.971%0.71367%0.674SS**Hα-helixtrans-68.2-29.2178.8-154.6166.7-173173.90113.3R656 T663 R664R656-K660 WeakPolarHBondContact O-CB 3.48Å; R656-K660 PolarHBondContact O-N 2.94Å; K660-T663 WeakPolarHBondContact CA-OG1 3.3Å; K660-T663 PolarHBondContact O-OG1 2.89Å; K660-R664 WeakPolarHBondContact O-CB 3.37Å; K660-R664 PolarHBondContact O-N 3.04Å; K660-R664 VanDerWaalsContact O-N 3.09Å
661R43.9Very low42.6Very low208 Ų208158.2 Ų158.279%0.78569%0.692SS**Hα-helixtrans-72.6-38.8167.2-82.7-169.1172.8-166.3-1.8112.8R657 K658 R659 R664 R665R657-R661 WeakPolarHBondContact O-CB 3.47Å; R657-R661 PolarHBondContact O-N 3.44Å; K658-R661 PolarHBondContact O-N 2.99Å; R659-R661 PolarHBondContact O-N 3.4Å; R661-R664 PolarHBondContact O-N 2.77Å; R661-R665 PolarHBondContact O-N 3.39Å
662R38.7Very low42.1Very low208 Ų208157.1 Ų157.179%0.78570%0.699SS**Hα-helixtrans-64.8-40.8174.1-86.2-174.1168.4-179.4-4.1112.3K658 R659 R665 R666K658-R662 PolarHBondContact O-N 2.91Å; R659-R662 PolarHBondContact O-N 3.28Å; R659-R662 VanDerWaalsContact O-N 3.15Å; R662-R665 PolarHBondContact O-N 3.22Å; R662-R666 PolarHBondContact O-N 3.49Å
663T45.9Very low41.4Very low84 Ų84160.8 Ų160.852%0.51572%0.715SS.*Hα-helixtrans-71.2-36.5175.354.20000112.7R659 K660 R666 R667R659-T663 PolarHBondContact O-N 3.44Å; R659-T663 PolarHBondContact O-OG1 2.82Å; K660-T663 WeakPolarHBondContact CA-OG1 3.3Å; K660-T663 PolarHBondContact O-OG1 2.89Å; T663-R666 PolarHBondContact O-N 2.86Å; T663-R667 PolarHBondContact O-N 3.23Å
664R42.4Very low40.7Very low200 Ų200165.9 Ų165.976%0.75574%0.736SS**Hα-helixtrans-61.9-41.8168.8-98.1-170.4170.2-179.7-2.6112.5K660 R661 R666 R667 S668K660-R664 WeakPolarHBondContact O-CB 3.37Å; K660-R664 PolarHBondContact O-N 3.04Å; K660-R664 VanDerWaalsContact O-N 3.09Å; R661-R664 PolarHBondContact O-N 2.77Å; R664-R666 PolarHBondContact O-N 2.88Å; R664-R667 PolarHBondContact O-N 2.71Å; R664-S668 PolarHBondContact O-N 2.92Å; R664-S668 PolarHBondContact O-OG 3.29Å
665R36.9Very low40.3Very low184 Ų184161.4 Ų161.469%0.69473%0.731SS**Hα-helixtrans-64-37.6175.4-118.5-170.2-175.1-162.91.6112.7R661 R662 S668 Q669R661-R665 PolarHBondContact O-N 3.39Å; R662-R665 PolarHBondContact O-N 3.22Å; R665-S668 PolarHBondContact O-N 3.22Å; R665-S668 PolarHBondContact O-OG 2.93Å; R665-Q669 WeakPolarHBondContact O-CB 3.47Å; R665-Q669 WeakPolarHBondContact O-CG 3.31Å; R665-Q669 PolarHBondContact O-N 3.36Å
666R40Very low39.9Very low209 Ų209161.6 Ų161.679%0.78974%0.741SS**Hα-helixtrans-66.6-40.8172.6-82.7-165.8169-152.9-3.3112.6R662 T663 R664 Q669 G670R662-R666 PolarHBondContact O-N 3.49Å; T663-R666 PolarHBondContact O-N 2.86Å; R664-R666 PolarHBondContact O-N 2.88Å; R666-Q669 PolarHBondContact O-N 3.05Å; R666-G670 PolarHBondContact O-N 2.81Å
667R41.6Very low39.7Very low211 Ų211157 Ų15780%0.79674%0.736SS**Hα-helixtrans-64.5-39.8172.5-79.6-166.2174.5-168.8-1.6112.5T663 R664 Q669 G670T663-R667 PolarHBondContact O-N 3.23Å; R664-R667 PolarHBondContact O-N 2.71Å; R667-Q669 VanDerWaalsContact C-N 3.26Å; R667-Q669 PolarHBondContact O-N 2.92Å; R667-G670 PolarHBondContact O-N 3.19Å
668S36.3Very low39Very low80 Ų80155 Ų15556%0.55974%0.739SS**THydrogen-bonded Turntrans-79-1.1177.475.50000114.9R664 R665R664-S668 PolarHBondContact O-N 2.92Å; R664-S668 PolarHBondContact O-OG 3.29Å; R665-S668 PolarHBondContact O-N 3.22Å; R665-S668 PolarHBondContact O-OG 2.93Å
669Q37.1Very low38.6Very low147 Ų147152.1 Ų152.169%0.68775%0.746SS**THydrogen-bonded Turntrans-108.6-13.7169.1-71.9-176-7700112R665 R666 R667 Q671R665-Q669 WeakPolarHBondContact O-CB 3.47Å; R665-Q669 WeakPolarHBondContact O-CG 3.31Å; R665-Q669 PolarHBondContact O-N 3.36Å; R666-Q669 PolarHBondContact O-N 3.05Å; R667-Q669 VanDerWaalsContact C-N 3.26Å; R667-Q669 PolarHBondContact O-N 2.92Å; Q669-Q671 VanDerWaalsContact C-N 3.28Å
670G35.2Very low38.5Very low69 Ų69153.6 Ų153.671%0.71175%0.752SS**SBendtrans-91.524.3168.800000113.3R666 R667R666-G670 PolarHBondContact O-N 2.81Å; R667-G670 PolarHBondContact O-N 3.19Å
671Q40.4Very low37.7Very low172 Ų172153.5 Ų153.580%0.80476%0.758SS**SBendtrans-146.465.5-178-146.1171.714.300110.1Q669Q669-Q671 VanDerWaalsContact C-N 3.28Å
672A34.5Very low36.9Very low84 Ų84151 Ų15169%0.69476%0.76SS**SBendtrans-150.7130.1172.700000109.9
673V33.4Very low37Very low132 Ų132148.9 Ų148.980%0.876%0.764SS**  trans59.186.4170.3-162.90000116.3
674L31.1Very low36.2Very low171 Ų171153 Ų15390%0.89578%0.777SS**  trans-91.4131.6132.6-83.5166.8000106.9
675P38.3Very low35.5Very low92 Ų92148.2 Ų148.260%0.59777%0.773SS**  trans-82.9138.8175.132.1-32.6000111.9T677P675-T677 VanDerWaalsContact C-N 3.27Å; P675-T677 PolarHBondContact O-N 2.83Å
676E35.4Very low35.1Very low200 Ų200149.1 Ų149.194%0.93578%0.776SS**SBendtrans-77.667.1177.5-67.2177.2111.700112.4
677T42.3Very low34.4Very low114 Ų114142.9 Ų142.970%0.69978%0.778SS**  trans-142.177.5172.255.90000112.1P675P675-T677 VanDerWaalsContact C-N 3.27Å; P675-T677 PolarHBondContact O-N 2.83Å
678L34.1Very low33.7Very low153 Ų153142.9 Ų142.980%0.80178%0.778SS**  trans-165.119.7154.4-111.3167.1000114.9R680L678-R680 PolarHBondContact O-N 3.02Å
679A34Very low33.3Very low107 Ų107143.3 Ų143.388%0.88479%0.786SS**SBendtrans-83.447177.400000113
680R39.2Very low32.7Very low237 Ų237142.7 Ų142.789%0.89479%0.792SS**  trans-171.586.1171.3-111.8173.8-173.2-149.40.8111.6L678L678-R680 PolarHBondContact O-N 3.02Å
681L31.4Very low32.4Very low161 Ų161144.9 Ų144.984%0.84379%0.791SS**  trans-162.4139.3148.9-106.5166000106.8
682N27.4Very low31.8Very low155 Ų155143.1 Ų143.183%0.82979%0.792SS**  trans-76.6156.4-166.4-77.9-21.1000113.3H684N682-H684 PolarHBondContact O-N 3Å
683L39.3Very low31.5Very low165 Ų165144.9 Ų144.986%0.86479%0.794SS**  trans-56.2124.4159.6-78.162.3000108.7
684H30.3Very low31.2Very low171 Ų171143.4 Ų143.479%0.79279%0.79SS**  trans-153.4125.6156.8-128.3-88.3000112.3N682N682-H684 PolarHBondContact O-N 3Å
685C27.9Very low31.3Very low98 Ų98141.5 Ų141.566%0.66279%0.787SS**SBendtrans65.6170.4168.2-59.90000118.5
686W28.1Very low31.2Very low203 Ų203145.6 Ų145.677%0.76980%0.799SS**  trans7235.7172.6-52.894000117.8W688W686-W688 VanDerWaalsContact C-N 3.31Å; W686-W688 HydrophobicContact CE3-CD2 4.48Å; W686-W688 HydrophobicContact CE3-CZ2 4.45Å; W686-W688 AromaticContact CE3-NE1 3.82Å; W686-W688 AromaticContact CZ3-CE2 3.74Å; W686-W688 AromaticContact CZ3-CZ2 3.73Å; W686-W688 HydrophobicContact CZ3-CZ2 3.73Å; W686-W688 AromaticContact CZ3-NE1 3.79Å; W686-W688 PolarHBondContact O-N 2.91Å; W686-W688 VanDerWaalsContact O-N 3.09Å
687G26Very low31.1Very low79 Ų79143.7 Ų143.781%0.81480%0.795SS**  trans-7284150.300000111.1
688W26.9Very low30.7Very low211 Ų211147 Ų14780%0.79981%0.807SS**  trans-90.595.7165.6-86.515.9000109.4W686 V690W686-W688 VanDerWaalsContact C-N 3.31Å; W686-W688 HydrophobicContact CE3-CD2 4.48Å; W686-W688 HydrophobicContact CE3-CZ2 4.45Å; W686-W688 AromaticContact CE3-NE1 3.82Å; W686-W688 AromaticContact CZ3-CE2 3.74Å; W686-W688 AromaticContact CZ3-CZ2 3.73Å; W686-W688 HydrophobicContact CZ3-CZ2 3.73Å; W686-W688 AromaticContact CZ3-NE1 3.79Å; W686-W688 PolarHBondContact O-N 2.91Å; W686-W688 VanDerWaalsContact O-N 3.09Å; W688-V690 PolarHBondContact O-N 3.38Å
689A26.7Very low30.6Very low88 Ų88144.3 Ų144.373%0.72781%0.807SS**  trans-74.2109.2172.900000109.8T691A689-T691 VanDerWaalsContact C-N 3.28Å; A689-T691 PolarHBondContact O-N 3.48Å; A689-T691 VanDerWaalsContact O-N 3.07Å
690V25.1Very low30.6Very low134 Ų134145.3 Ų145.381%0.81281%0.808SS**  trans-80.981168.1-177.60000108.1W688 V692W688-V690 PolarHBondContact O-N 3.38Å; V690-V692 PolarHBondContact O-N 3.25Å
691T28.2Very low30.1Very low115 Ų115140.6 Ų140.671%0.70681%0.805SS**  trans-70.4114.9168.75.80000109.1A689 V693A689-T691 VanDerWaalsContact C-N 3.28Å; A689-T691 PolarHBondContact O-N 3.48Å; A689-T691 VanDerWaalsContact O-N 3.07Å; T691-V693 PolarHBondContact O-N 3.24Å
692V27.8Very low30.6Very low135 Ų135138.5 Ų138.582%0.81880%0.801SS**  trans-73.3110.7170.4178.10000108V690V690-V692 PolarHBondContact O-N 3.25Å
693V28.8Very low30.7Very low122 Ų122137 Ų13774%0.73980%0.801SS**  trans-112.2126.4174.6-1790000108.2T691T691-V693 PolarHBondContact O-N 3.24Å
694S26.2Very low30.2Very low100 Ų100136.6 Ų136.670%0.69980%0.799SS**  trans-76.7145.2176.6-64.90000111.1E696S694-E696 PolarHBondContact O-N 2.95Å
695P34.2Very low30.2Very low131 Ų131136 Ų13685%0.85180%0.801SS**SBendtrans-96.961.6-165.539.2-38.2000114.3
696E36.1Very low30.3Very low179 Ų179136.4 Ų136.484%0.83681%0.805SS**  trans-130.6169.8161.7-66.5-169.5167.800109.2S694S694-E696 PolarHBondContact O-N 2.95Å
697D33.7Very low31.2Very low160 Ų160132.4 Ų132.486%0.85681%0.805SS**  trans68.358.4-174.8-61.2-22.8000118
698L33.3Very low32.1Very low183 Ų183134.7 Ų134.796%0.95881%0.805SS**  trans-13078.2156.3-85.3-179.5000111.9
699A32.8Very low32.2Very low97 Ų97128.2 Ų128.280%0.80281%0.805SS**  trans-15053.9-179.500000114.4
700S33.1Very low32.5Very low128 Ų128130.8 Ų130.890%0.89581%0.805SS**  trans-150.6107.7162.2-91.50000113.4
701V29Very low32.8Very low138 Ų138132.3 Ų132.384%0.83680%0.803SS**  trans-52.9158.2162.31600000111.7
702P41.2Very low33.1Very low117 Ų117132.7 Ų132.776%0.7681%0.806SS**  cis-131.7172.42020.75000118.3
703C29.9Very low33.3Very low122 Ų122130.4 Ų130.482%0.82480%0.801SS**  trans-74.5157.8160.8-430000112.2
704L29.7Very low33.3Very low157 Ų157136.4 Ų136.482%0.82281%0.811SS**  trans-163.9139.2145.3-105.7168.5000111.7
705L30.6Very low33.5Very low158 Ų158141.2 Ų141.283%0.82782%0.819SS**  trans63.8122.2159.6-64.4160.8000121
706S29.2Very low33.3Very low108 Ų108141 Ų14176%0.75582%0.815SS**  trans-110.4-161155.9-38.30000107.9
707P46.3Very low33Very low119 Ų119139 Ų13977%0.77382%0.82SS**  cis-104.1-144.3-48.142.9-29.4000107.2
708P45.3Very low33Very low126 Ų126139.1 Ų139.182%0.81882%0.819SS**  cis-121.6-165.5-2341.3-25.2000112.4
709G29.5Very low33.3Very low76 Ų76142 Ų14278%0.78484%0.836SS**  trans171.860.9176.300000113
710L33.6Very low33.3Very low141 Ų141144.3 Ų144.374%0.73884%0.838SS**  trans-6121.7168.1-67.8169.3000116.6
711E29.7Very low33.3Very low166 Ų166145.2 Ų145.278%0.77684%0.835SS**  66.7139.789-72-176.6-168.100114.1
712T34.8Very low33.5Very low124 Ų124145.6 Ų145.676%0.76184%0.835SS**  cis-153.2174.614.7-3.30000111.4
713A32.6Very low33.1Very low86 Ų86147.2 Ų147.271%0.71184%0.839SS**  trans51.5120.2156.600000118.8
714W28.7Very low33.3Very low248 Ų248148.8 Ų148.894%0.93984%0.84SS**  cis60.4121.818.9-8177.1000116.7
715K29.7Very low33.5Very low201 Ų201148.3 Ų148.387%0.87484%0.841SS**  trans73.6139.2-169.4-50.8173.2-176.9175.30112.6
716T31.5Very low33.7Very low127 Ų127147.6 Ų147.678%0.77984%0.842SS**  cis-126.21518.8430000112.8
717C28.1Very low34.1Very low137 Ų137150.6 Ų150.693%0.92685%0.849SS**  trans-147.281.7160.6-87.60000107.4
718L35Very low33Very low162 Ų162153.3 Ų153.385%0.84886%0.855SS**  trans-159.870.6176.1-134175.1000110.3
719D38.1Very low31.9Very low245 Ų245155.7 Ų155.7100%1.3186%0.859SS**  trans-147.30160.1-83.4-50.8000106.7

Retrieved 719 of 719 residues in 103.2 ms (Link to these results)