A0A077ZGM6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZGM6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,689 aa.

>A0A077ZGM6_TRITR|A0A077ZGM6
MNGSVQMSASFPCSTTNCKQGDNKSLSLPRKGILKQSASANQLETSRELSRDRSRSLSPNRDVISSDHTVVPKPSVRQSKKSKIPKLSVTWGETSPDQQDEDENEELLERDRETAIISTTDYSNEDDNEYPKEEATKGEENESMDGTEETHSQTSASGSTISQWWQGRSTRYVLHCDKRSCNGHSHLHDEDYMTPTQRKNREMTQLRMRLRQKETELEDREAHLQQLRDRLTELETIMDRGGLLTENYRLASKLAQLQEAHKKEKRLMCDRFEQQFNQLRDYYESESIELKDTHEFELHELRTMAEDSNESTGTTASSGAKPSGIPKRKAANLFDDWEATTPPRKDVSVMTEEWEPSLIEELKAYHSECVFLQNYVMELQRQLASNEQGSRVDKTEPLTVDVGTLPTEVGAGSAGGAGGGGYSAMEAQIEAYKTECVIWRLKSSELEIALKEQIAARGKIEEQMEIIERDNEGLEKLVNQLRSQMAATTNTRDEHHFDNTVETTSSDMAIASSPTVQPPDEPADLTSDQAKDAMTIEEPKKESTFQFDPTAWVAREKYEELRDQKHSLNAALVLLRGQLAELEKNQSDKEEKLRLKEDMNRLLEKQLLAKQGEYETFQLSFMDLRQQNEKLAGTVETLENKIRRQQELLDQCGVTVTPLTNGEPTSSRAKIASEKAEIISRAREVQTDFAYVDHQTTMSQLLALKEEYDKLKALHDSESSQSNLKLTELGETLKAKNDLVANLTSQIQTLCDEFQALQEGFERERSCYAQQANQLGAMVQRIPYLEKELLKTRVDMRNAEELAGSERINFQRTMEQSLTENLRVQNETASFWRLKLSKMEQQLEKYKKRLDEKENELSEANIRFGLEKANLAQQVRLSMTEVAEFQKRFNRPTANQKIMVQPPMRDQETNCFVKRSNVATEVQRDEFCADASTETVRYEEDHQVRLLKGELTTTRAQINILQNKLINEDKKRVEADELGDLYKKAMEQAEDLQQELSISKAETKIAQENLFQRDQAWQAEKDQLLRAEKDRFLRLEKEFEMVRQELKAMMIKHEKEKAELIARLDKGNVVASASRTMERSTSVPPEPTANEGPSNSATTSATSQDYFEWIKDVISGEAKSPITSEASKRKLEQTTTELEKCVEEKRKLMDQLDEQKALVQSLTGELILYRAEEGRVVRRLEEQLSATKHLSFTDLLSVTNVGPDGRPAKSSRNSLLLRHTLNDTCRQLVLLRQKFDQLEADRAKIRYELDVLKGDYEMTTLKSEDDSRSTKASTIPTEPSTPQVGRRSFKRLNIPIVSRKKRSSSCSSSMEKASQTETDRFLQKNHLNSTDWKTVSTTISQSAQEVAKLYAQIQAYYEEQNAHFKRPSKHRLSHLLQQLMEALRTANSRIASAVSVEKSVEMSYQMQMDSLRQQLQMAEYNAAQLGREIEEFRIQQQRYFSARFDRLHNIPSSSSSDVPLENIPAEGFNDASPSSNRSNRPSAKTDQLEREKSESSGTLTLQQSNDDHGDPTTVSANLNDADERMTKSLCENAQSDPFEPIPSPSMANLSTAGESIAFYSCDSLNLSCEDVDYLHQLLQLERERFKIVEEKAAQLEKETSMLNFELGMLYRRQSRERELLKTENERLHKQVNELIDRLEKAATHRSPTCICGRRRRISARSLSASARHSSSERASISPMSKSEYAHRVH
Structure Viewer
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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
1M40.1Very low39.5Very low227 Ų227144.2 Ų144.2100%1.11885%0.849SS**  0940-65.4170.3176.800105
2N34.7Very low39.6Very low167 Ų167143 Ų14389%0.89385%0.848SS**  cis72.9122.241.3-51.343.5000111
3G45.5Very low39.1Very low83 Ų83140.5 Ų140.586%0.85684%0.841SS**  cis-167.5-162.93.800000115.6
4S35.9Very low38.9Very low107 Ų107137.7 Ų137.775%0.74883%0.831SS**  trans-129.9149.3-170.4152.10000110.5
5V48.1Very low38.6Very low141 Ų141136.4 Ų136.486%0.85582%0.824SS**  trans-139.6131.1166.3-179.30000110.2
6Q36.4Very low38.6Very low164 Ų164136.4 Ų136.477%0.76683%0.825SS**  trans-108161164.5-56.1170.9-77.200109.1
7M44.4Very low38.4Very low184 Ų184136.8 Ų136.891%0.90682%0.821SS**  trans-151.3159.9147.8-93.5-52.216700111.2
8S35.3Very low38.3Very low105 Ų105133.8 Ų133.873%0.73481%0.807SS**  trans-150.9-177-170-54.80000112
9A38.5Very low38.4Very low96 Ų96136.1 Ų136.179%0.79381%0.805SS**  trans91.5156.4167.100000117.6
10S37.6Very low38.4Very low114 Ų114138.1 Ų138.180%0.79781%0.806SS**  cis-170.9161.5-30.655.40000112.4
11F37.7Very low38.5Very low198 Ų198135.3 Ų135.387%0.86881%0.806SS**  trans-57.4159.6173-90-81.4000115.5
12P41.4Very low38.5Very low130 Ų130131.1 Ų131.184%0.84479%0.789SS**  -153.2-169.176.441.9-19.6000118.6
13C32.3Very low38.9Very low111 Ų111128.9 Ų128.975%0.7578%0.777SS**  trans-106.7159-166.3168.80000114.6
14S36.6Very low38.8Very low101 Ų101133.3 Ų133.371%0.70677%0.772SS**  trans171.6116133.2-78.20000119.1
15T33.8Very low38.9Very low118 Ų118133 Ų13372%0.72477%0.771SS**  trans65.7146.6130.667.40000126.6
16T38.7Very low38.6Very low137 Ų137134 Ų13484%0.8477%0.77SS**  trans92.6157.2152.873.90000121
17N36.6Very low39Very low142 Ų142132 Ų13276%0.75977%0.774SS**  -167.3156.3-51.1-159.6-7.7000111.7
18C36.1Very low38.7Very low84 Ų84131.1 Ų131.157%0.56877%0.772SS**  trans81.5127.7147.1-90.40000124.3
19K40.5Very low39.3Very low177 Ų177131.3 Ų131.377%0.7777%0.771SS**  trans78158.1135.7-69.3173.8-176.7177.30120
20Q38.8Very low39.6Very low176 Ų176139 Ų13982%0.82278%0.78SS**  cis175.8143.6-34.1-131.8176.4-19.500107
21G39Very low39.7Very low79 Ų79143.8 Ų143.881%0.81479%0.786SS**  trans166.5119169.100000117.1
22D40.1Very low39.9Very low140 Ų140137.6 Ų137.675%0.74978%0.778SS**  trans-96.8152.9-179-53.5-95.1000114.1
23N44.5Very low39.7Very low119 Ų119139.2 Ų139.264%0.63678%0.778SS**  161.6124.9106.7-86.5-71000115.5
24K42Very low39.9Very low176 Ų176140.8 Ų140.877%0.76578%0.778SS**  29.8130.1127.8-48.1171.3-171.5121.60117.9
25S39Very low40Very low102 Ų102144.8 Ų144.871%0.71378%0.783SS**  173.3162.160.747.50000114.6
26L41.8Very low40Very low162 Ų162148.3 Ų148.385%0.84879%0.791SS**  trans58.2104.9149-69.5161000122
27S43.4Very low39.8Very low122 Ų122147.3 Ų147.385%0.85379%0.79SS**  168168.7111.650.90000113.5
28L38.8Very low39.8Very low165 Ų165145.7 Ų145.786%0.86480%0.796SS**  trans-124.8176.9-170.5-71.3165.5000110.5
29P47.8Very low39.9Very low109 Ų109147.3 Ų147.371%0.70881%0.808SS**  -133.9165-50.838.4-24.1000112.8
30R44.6Very low39.9Very low257 Ų257143.2 Ų143.297%0.9781%0.807SS**  trans-159.7171.9160.8-115.1164.5-167.7-150.41.2114.4
31K41.3Very low39.7Very low214 Ų214142 Ų14293%0.9381%0.807SS**  trans-88149.4-162.3-53.9176.8179.8-177.90114.5
32G39.9Very low39.5Very low68 Ų68146.5 Ų146.570%0.70181%0.806SS**  trans155.2109.3170.900000109.1
33I39.3Very low39.4Very low165 Ų165146 Ų14685%0.84680%0.803SS**  79.393.365.1-60.4174000113.7
34L34.8Very low39.1Very low144 Ų144147.8 Ų147.875%0.75481%0.807SS**  trans65.3127.6134-159.371.4000122.8
35K38.5Very low38.8Very low185 Ų185145.2 Ų145.280%0.80481%0.806SS**  trans63.9147.3165.9-74.7168.5178.6-1770115.1
36Q35.3Very low38.6Very low192 Ų192145 Ų14590%0.89781%0.805SS**  cis-138.2-175.835.3-72.2174-46.100114.4
37S34.1Very low38.3Very low116 Ų116147.4 Ų147.481%0.81180%0.803SS**  trans-109.9173.4177.2-45.70000111.8
38A37.1Very low37.9Very low107 Ų107148.6 Ų148.688%0.88480%0.795SS**  trans67.4159.4-176.200000113.8
39S38.5Very low37.9Very low119 Ų119148.3 Ų148.383%0.83279%0.794SS**  cis-130.5-167.81.459.20000109.3
40A39.2Very low37.2Very low90 Ų90147.7 Ų147.774%0.74479%0.792SS**  cis-153.7-173.26.800000111.3
41N35.3Very low36.9Very low152 Ų152146 Ų14681%0.81379%0.786SS**  trans-71.3152.9168.8-55.3-58.5000112.8
42Q34.6Very low36.5Very low173 Ų173142.5 Ų142.581%0.80878%0.777SS**  177.4144.4118.3-98.8177.132.300116.2
43L38.3Very low36.4Very low130 Ų130150.5 Ų150.568%0.68179%0.786SS**  trans67.6109.6144.7-63.6168.9000123.3
44E37.2Very low36.2Very low156 Ų156147.5 Ų147.573%0.72978%0.78SS**  63.9100.2120.3-66.5-171145.200124.2
45T36.5Very low36.3Very low121 Ų121151.3 Ų151.374%0.74278%0.784SS**  63.6149.6123.981.40000123.7
46S34.6Very low35.9Very low99 Ų99147.3 Ų147.369%0.69278%0.779SS**  trans92.6106.5143.7-59.30000120.6
47R35.9Very low36.1Very low212 Ų212145.8 Ų145.880%0.878%0.777SS**  trans75.6118.2135.4-71.1-171.1141.4115.13.5121.5
48E34.6Very low36.5Very low147 Ų147145.8 Ų145.869%0.68778%0.777SS**  47.7105119.9-54.3171116.500118.3
49L39.2Very low37.1Very low159 Ų159146.4 Ų146.483%0.83277%0.772SS**  172.3125105.9-90.4167.5000114.9
50S33Very low37Very low96 Ų96147.3 Ų147.367%0.67177%0.767SS**  trans51.7134.9134.7-64.50000124.3
51R37Very low36.8Very low222 Ų222153.1 Ų153.184%0.83877%0.77SS**  trans84.2112.1139.9-82.1178.4167.31470121.7
52D33.7Very low37.2Very low139 Ų139153.5 Ų153.574%0.74377%0.772SS**  37.3114.7115.8-63.8-53.4000119.9
53R37.9Very low37.4Very low237 Ų237150.2 Ų150.289%0.89476%0.763SS**  -171.3107.2114.8-104162.7176.5-170.7-1.6115.4
54S34.3Very low37.5Very low102 Ų102152.1 Ų152.171%0.71377%0.772SS**  45.6126.4118.7-78.90000122.4
55R37.1Very low37.5Very low223 Ų223149.2 Ų149.284%0.84277%0.769SS**  trans82.8115130.6-70.7174.6171.7-119.4-0.8122.1
56S31.5Very low37.8Very low101 Ų101148.9 Ų148.971%0.70677%0.772SS**  trans65.2155.4132.666.50000118.8
57L39.4Very low38Very low161 Ų161150.2 Ų150.284%0.84377%0.771SS**  cis-151.3173.738.6-76.5161.4000112.8
58S41Very low38.4Very low116 Ų116147.5 Ų147.581%0.81177%0.767SS**  trans-117.5150.5164.4-47.60000111.4
59P49.9Very low38.7Very low120 Ų120146.2 Ų146.278%0.77977%0.77SS**  trans-116.5133.615213.57.2000110.4
60N36.1Very low38.8Very low138 Ų138145 Ų14574%0.73877%0.769SS**  64.2102.263.9-149.961.3000110.7
61R36.8Very low39.2Very low212 Ų212146 Ų14680%0.877%0.77SS**  72109.955.4-165-169.8-166.2-171.96.4112.7
62D41.9Very low39.6Very low160 Ų160141.4 Ų141.486%0.85677%0.769SS**  trans-139.4158169.3-101.3-47.9000111.5
63V38.7Very low40.1Very low103 Ų103143.6 Ų143.662%0.62477%0.772SS**  trans-146.4126.1-171.3174.30000110.4
64I41.8Very low40.3Very low171 Ų171138 Ų13888%0.87777%0.767SS**  trans-134.9146163.9-60-176.2000108.7
65S37.4Very low40.4Very low95 Ų95137.5 Ų137.566%0.66476%0.763SS**  trans-118.3-163.7-168.6-540000112.4
66S42.2Very low40.4Very low114 Ų114132.2 Ų132.280%0.79776%0.755SS**  trans88.8144.3173.577.90000116.9
67D37.9Very low40.9Very low127 Ų127136.6 Ų136.668%0.67976%0.756SS**  cis-165.1170.4-35.7-142.4-50.7000109.5
68H44.2Very low40.9Very low155 Ų155135.4 Ų135.472%0.71875%0.746SS**  trans69.3152.5160.9-58.3-4.9000116.2
69T41.9Very low40.7Very low120 Ų120134.8 Ų134.874%0.73674%0.742SS**  cis-158.8156.8-2.33.70000112.6
70V41.9Very low40.1Very low134 Ų134137.7 Ų137.781%0.81274%0.742SS**  trans73.3140.5152173.20000119.6
71V40.8Very low40.3Very low116 Ų116140.3 Ų140.370%0.70375%0.747SS**  trans-117.9165.8177.8-152.10000108.5
72P45.6Very low40.3Very low125 Ų125134.7 Ų134.781%0.81274%0.74SS**  -143.4139.1106.835.9-21.4000116.3
73K42.8Very low40.1Very low186 Ų186136 Ų13681%0.80974%0.738SS**  trans-64.8165.1153.3-75.7178179.6176.30109.3
74P42.7Very low39.9Very low120 Ų120138.6 Ų138.678%0.77975%0.747SS**  cis-143.2-150.237.435.3-8000112.2
75S37.7Very low39.8Very low91 Ų91136.4 Ų136.464%0.63674%0.744SS**  cis-172.5161.813.8-147.90000112.4
76V35.7Very low39.6Very low112 Ų112140.7 Ų140.768%0.67975%0.751SS**  trans56.4130.9134.6148.60000118.9
77R41.6Very low39.3Very low192 Ų192143.4 Ų143.473%0.72576%0.756SS**  cis-166.7162.721.4-125.5171.4-156.7-173.44.9111.9
78Q40.6Very low39.1Very low137 Ų137141.5 Ų141.564%0.6475%0.752SS**  trans42.4118.3143.8-69.2156.76.900118.9
79S36.2Very low38.9Very low103 Ų103140.9 Ų140.972%0.7276%0.759SS**  cis59.810642.892.20000116.1
80K36.8Very low38.7Very low180 Ų180140 Ų14078%0.78375%0.753SS**  trans161.7149.9141.9-91.1157.8-174.6178.40113.3
81K42Very low38.4Very low194 Ų194146.5 Ų146.584%0.84376%0.763SS**  trans69.9142.4170-58.7164.6-176.7179.10115.5
82S35.6Very low38.1Very low94 Ų94144.5 Ų144.566%0.65777%0.766SS**  cis131.4136.5-17.467.60000112.1
83K38.7Very low37.7Very low187 Ų187147.9 Ų147.981%0.81377%0.771SS**  trans74.3120.5176.4-54.1-177.8176.5-174.30113.2
84I34.2Very low37.5Very low158 Ų158145.9 Ų145.981%0.8178%0.775SS**  62.4110.562.1-58.2168.7000108.9
85P40.2Very low37.3Very low125 Ų125145.3 Ų145.381%0.81277%0.774SS**  -141178.877.340.9-25.3000117.3
86K31.4Very low37.6Very low184 Ų184146.6 Ų146.680%0.878%0.78SS**  trans-73.9143.8179.7-54.3173178-177.80112.9
87L36.6Very low37.9Very low172 Ų172147.8 Ų147.890%0.90178%0.783SS**  trans-147.7114.3149.8-72.5174.8000105.3
88S33.2Very low37.8Very low87 Ų87145.7 Ų145.761%0.60878%0.781SS**  cis88.358.510.192.70000118.3
89V40.2Very low37.8Very low141 Ų141146.1 Ų146.186%0.85578%0.783SS**  trans-144.8147.8154.6-172.50000107.9
90T37.5Very low38Very low102 Ų102147 Ų14763%0.62678%0.78SS**  -165.8122-89.533.70000111
91W35.7Very low38.4Very low270 Ų270147 Ų147100%1.02378%0.782SS**  trans-172.5113.3151.7-65.6116.1000107.7
92G34.4Very low38.4Very low74 Ų74144.5 Ų144.576%0.76378%0.779SS**  cis-175.792.8-12.300000111.4
93E38.2Very low38.8Very low196 Ų196148 Ų14892%0.91678%0.784SS**  trans-97.5106.9170.2-74.4-173.6136.400110.6S95E93-S95 PolarHBondContact O-N 3.1Å
94T38.8Very low39.1Very low144 Ų144145.4 Ų145.488%0.88378%0.78SS**  trans-89.193169.146.20000110.3
95S37.1Very low39.4Very low109 Ų109146.5 Ų146.576%0.76278%0.781SS**  trans-71.7156.4162.7-84.70000111.2E93E93-S95 PolarHBondContact O-N 3.1Å
96P45.6Very low39.4Very low118 Ų118149 Ų14977%0.76678%0.782SS**  trans-89.1156.5-155.934.7-37.4000114.1
97D40.9Very low40.1Very low137 Ų137147.4 Ų147.473%0.73378%0.782SS**  trans-155.5139.6137.3-129.5-18.4000113.6
98Q39.8Very low40.3Very low147 Ų147146.9 Ų146.969%0.68778%0.779SS**  trans45.5123.3149.5-79.9161.47500123.8
99Q40.3Very low41Very low147 Ų147149.8 Ų149.869%0.68778%0.783SS**  trans92.1104.2137-69.7-168.9-9900121.9
100D40.9Very low41.1Very low122 Ų122153 Ų15365%0.65278%0.78SS**  81.5139.5122.1-50.7-16.2000121.2
101E44.5Very low41.2Very low178 Ų178155.6 Ų155.683%0.83279%0.79SS**  trans66.3137169.4-59.4173.7-158.200118
102D43.2Very low41.5Very low143 Ų143153.5 Ų153.577%0.76578%0.781SS**  cis-163.8150.8-35.3-114.2-18.5000109.3
103E43.9Very low41.9Very low166 Ų166157.2 Ų157.278%0.77678%0.779SS**  trans40145.9160.3-54.4-166.6147.400123.8
104N45.4Very low41.9Very low134 Ų134153.6 Ų153.672%0.71777%0.77SS**  trans78113.6155.6-60-29.2000122.6
105E40.3Very low41.6Very low181 Ų181151.7 Ų151.785%0.84677%0.769SS**  83.1157.7120.3-149.2149.4-136.700120.7
106E39.1Very low41.8Very low178 Ų178153.5 Ų153.583%0.83277%0.769SS**  trans49119.6-176.3-68.1-174.7109.200118.4
107L46.2Very low41.5Very low150 Ų150155 Ų15579%0.78577%0.769SS**  cis77.5120.748.3-155.288.5000114.4
108L41.3Very low41.2Very low160 Ų160153.2 Ų153.284%0.83877%0.767SS**  trans72.3111.7177.6-57174.5000118.7
109E46.5Very low41Very low149 Ų149152.2 Ų152.270%0.69677%0.771SS**  trans175.5111.7131.5-106.5-158.2169.800113.9
110R42.4Very low40.9Very low209 Ų209150.6 Ų150.679%0.78977%0.772SS**  162.8118.6120.4-93.1172.5-177.467.218.2114.3
111D39.7Very low41Very low156 Ų156150.1 Ų150.183%0.83477%0.769SS**  trans-100.8156.5175.9-55.5-79.9000114
112R42.2Very low40.9Very low226 Ų226151.6 Ų151.685%0.85377%0.768SS**  trans170.1146.3140.2-91.6158.5-167.3-1744.9108.6
113E42.7Very low40.8Very low151 Ų151148.8 Ų148.871%0.70676%0.76SS**  cis-150.5122.815.9-138.2144.5-123.900112.8
114T39.5Very low40.8Very low121 Ų121146.7 Ų146.774%0.74275%0.754SS**  trans40.5121.5151540000123
115A31.4Very low40.6Very low104 Ų104147.4 Ų147.486%0.8675%0.753SS**  trans-122.8140.3145.700000110.1
116I42.4Very low40.9Very low147 Ų147145.2 Ų145.275%0.75475%0.747SS**  trans-152.9134.5-168.4-84.6177.8000107
117I39.3Very low41.3Very low149 Ų149143.4 Ų143.476%0.76474%0.743SS**  cis-154.3167.1-8.2-148.3169.8000109.9
118S34.3Very low41.2Very low100 Ų100142.6 Ų142.670%0.69974%0.74SS**  trans-147.3180169.1-77.30000109.8
119T36Very low41Very low126 Ų126143.7 Ų143.777%0.77374%0.741SS**  trans69.9151.2-163.472.90000111.4
120T37.4Very low40.5Very low113 Ų113147 Ų14769%0.69375%0.748SS**  cis-150.6163.635.844.30000110.4
121D43.3Very low40.6Very low111 Ų111141.7 Ų141.759%0.59474%0.741SS**  cis-167.6154.8-6.8-100.7-8.5000111.7
122Y43.3Very low40.4Very low210 Ų210141.5 Ų141.582%0.82473%0.733SS**  trans47.1158.4133.3-69.2-121.8000121.1
123S41.2Very low40.1Very low84 Ų84137.4 Ų137.459%0.58772%0.723SS**  cis-176.8-172.8-15.5173.70000107.3
124N44.1Very low39.7Very low122 Ų122138.3 Ų138.365%0.65273%0.728SS**  trans75.5149.4162.2-63.854.6000116.6
125E40.5Very low39.4Very low149 Ų149136.4 Ų136.470%0.69672%0.724SS**  cis-167.5172.5-32.1-124.4160.7-167.300108.8
126D46.8Very low39.6Very low135 Ų135137.4 Ų137.472%0.72272%0.719SS**  trans29.3121.7148.7-71.111.2000122.3
127D47Very low39.3Very low140 Ų140139.1 Ų139.175%0.74972%0.722SS**  58.6145.9124.2-80.99.4000124.8
128N43.6Very low39.2Very low132 Ų132134.7 Ų134.771%0.70671%0.712SS**  trans70.3111.4147.7-70.9-40.3000121.8
129E38.7Very low39.3Very low184 Ų184137.6 Ų137.686%0.8672%0.715SS**  85117.3118.3-155.1159.5-143.300119.5
130Y35.5Very low39.2Very low217 Ų217138.7 Ų138.785%0.85171%0.711SS**  trans-55.1165.5163.1-101.2-137.1000112.7
131P44.1Very low39.3Very low99 Ų99138.4 Ų138.464%0.64371%0.705SS**  cis-144-160-13.535.9-13.4000114.1
132K36.4Very low39.2Very low151 Ų151141.5 Ų141.566%0.65772%0.716SS**  trans86.7107.5140.5-94.2-170.8175.9-74.50119.9
133E34.8Very low38.8Very low140 Ų140136.3 Ų136.365%0.65471%0.71SS**  77.4157115.7-86.3165.5-15000122.6
134E33.9Very low38.9Very low171 Ų171139.9 Ų139.980%0.79972%0.72SS**  trans67.764.1155.3-71.6-175.6-178.600120.8
135A34.4Very low38.6Very low81 Ų81141.4 Ų141.467%0.66973%0.728SS**  70174.9103.200000121
136T35.7Very low38.6Very low124 Ų124137 Ų13776%0.76172%0.722SS**  trans72.6149.4170.375.80000116.1
137K35.8Very low38.1Very low184 Ų184135.5 Ų135.580%0.872%0.719SS**  cis-162.6170.5-21.1-113.7176.3-176.2-177.10107
138G36.2Very low37.8Very low55 Ų55134.1 Ų134.157%0.56771%0.707SS**  trans117.3132.216500000111.7
139E35.9Very low37.7Very low161 Ų161132.3 Ų132.375%0.75270%0.695SS**  cis65.8123.833.3-46.2149.7176.700109.3
140E35.8Very low37.8Very low150 Ų150126.2 Ų126.270%0.70167%0.67SS**  cis-167.2173.314-133.6172.7-136.100113.4
141N38.9Very low38.1Very low106 Ų106122.6 Ų122.657%0.56766%0.661SS**  trans70.6125.1149.6-61.4-27.7000122.3
142E41.4Very low37.8Very low177 Ų177121.4 Ų121.483%0.82766%0.655SS**  trans70.7161.2130.6-67.3173.4-169.600119.8
143S35.2Very low38Very low100 Ų100122.1 Ų122.170%0.69966%0.661SS**  cis-179.5159.7-29.7-176.60000107
144M41.8Very low38.1Very low159 Ų159121.3 Ų121.378%0.78367%0.665SS**  trans77.5133.3-175-50.8-165.174.100114.8
145D38.8Very low38.3Very low154 Ų154118.3 Ų118.382%0.82466%0.663SS**  cis86.4139.632.5-166.728.7000113.6
146G39.3Very low38.5Very low56 Ų56118.2 Ų118.258%0.57766%0.663SS**  trans113.369.5176.500000118.7
147T37.9Very low38.7Very low105 Ų105118.6 Ų118.664%0.64467%0.67SS**  28.2131.6128.749.10000124.1
148E39.9Very low38.8Very low110 Ų110113.2 Ų113.251%0.51467%0.667SS.*  72.6163.1128.8-67156.917100120.7Q1487 L1488E148-Q1487 HydrophobicContact CB-CG 4.27Å; E148-Q1487 VanDerWaalsContact CB-NE2 3.27Å; E148-Q1487 VanDerWaalsContact OE2-CD 3.27Å; E148-Q1487 PolarHBondContact OE2-NE2 3.15Å; E148-Q1487 PolarHBondContact OE2-OE1 2.89Å; E148-L1488 HydrophobicContact CG-CD1 4.17Å; E148-L1488 VanDerWaalsContact OE1-CD1 3.31Å; E148-L1488 WeakPolarHBondContact OE1-CD1 3.41Å
149E41Very low38.9Very low95 Ų95116 Ų11644%0.44468%0.678SS.*  cis-170.8162.7-35.2-167.8-167.3-13600108.2D1486 Q1487 L1488E149-D1486 PolarHBondContact N-OD1 3.15Å; E149-D1486 VanDerWaalsContact N-OD1 3.16Å; E149-D1486 PolarHBondContact O-N 3.12Å; E149-Q1487 HydrophobicContact CB-CG 4.26Å; E149-L1488 WeakPolarHBondContact OE2-CG 3.34Å; E149-L1488 PolarHBondContact OE2-N 2.9Å
150T41.3Very low39.1Very low56 Ų56113.4 Ų113.434%0.34467%0.673SS.*  trans100.8151146.176.20000125.1D1486 Q1487T150-D1486 VanDerWaalsContact OG1-CA 3.3Å; T150-D1486 WeakPolarHBondContact OG1-CA 3.3Å; T150-D1486 PolarHBondContact OG1-N 3.08Å; T150-Q1487 VanDerWaalsContact CG2-CA 3.49Å
151H41.2Very low39.3Very low140 Ų140113.5 Ų113.565%0.64868%0.677SS**  trans84.9140.5135.2-77-11.6000120.7
152S39.3Very low39.2Very low74 Ų74111.8 Ų111.852%0.51767%0.673SS.*  cis-170.6167.9-6.5-124.70000115.9
153Q40.1Very low39.4Very low167 Ų167109.4 Ų109.478%0.7866%0.662SS**  trans68152145.1-70.516318.200118.6
154T36.2Very low39.8Very low123 Ų123112.3 Ų112.376%0.75566%0.658SS**  cis-156.1-177.51.53.20000107.7
155S39.4Very low39.8Very low108 Ų108113.1 Ų113.176%0.75565%0.652SS**  cis-168.5175.13.7-113.70000107.8
156A38.6Very low40.1Very low79 Ų79113.9 Ų113.965%0.65365%0.651SS**  cis-177.5150-38.200000110.6
157S39.2Very low40Very low131 Ų131114.3 Ų114.392%0.91666%0.655SS**  trans71.2138.7161.2-56.30000120.6
158G37Very low40Very low71 Ų71120.1 Ų120.173%0.73267%0.665SS**  cis160.4177.3-11.800000116.4
159S39.8Very low40Very low115 Ų115118.4 Ų118.480%0.80467%0.665SS**  trans75.4140.9164-1190000118.4
160T38.6Very low39.8Very low106 Ų106117.1 Ų117.165%0.6566%0.664SS**  cis-167.8164-7.9-0.60000112.1
161I41.1Very low39.6Very low151 Ų151123.4 Ų123.477%0.77468%0.682SS**  trans71.2132.9148.1-74.9165.2000116.7
162S36.9Very low39.7Very low71 Ų71125.4 Ų125.450%0.49769%0.685SS.*  cis-174.3149.4-1.2-109.50000114.3
163Q45.8Very low39.8Very low126 Ų126127.3 Ų127.359%0.58969%0.693SS**  trans74.6144.8133.8-65.3168.3-6.600119.9
164W42.6Very low39.7Very low161 Ų161126.2 Ų126.261%0.6169%0.692SS**  cis-173.3159.64.3-112.3-28.8000114.2
165W41.6Very low39.7Very low177 Ų177127.9 Ų127.967%0.6769%0.691SS**  trans58.1162.2162.93.995.1000122.2
166Q45.9Very low39.9Very low170 Ų170128.3 Ų128.379%0.79469%0.692SS**  cis-179.6143-30.5-102.3162.218.800107.2
167G37.1Very low39.8Very low65 Ų65130.7 Ų130.767%0.6769%0.694SS**  cis157.1175.9-9.200000112.5
168R37.6Very low39.7Very low227 Ų227132.6 Ų132.686%0.85769%0.686SS**  trans80.6153.6160.4-63.4178.3174.2161.7-1.5120.3
169S39.7Very low39.6Very low73 Ų73140.2 Ų140.251%0.5169%0.693SS.*  cis-178.6135.8-23.5-171.20000113
170T36.2Very low39.3Very low69 Ų69139.9 Ų139.942%0.42369%0.69SS.*  trans57.2130.6140.555.80000126.6E1494T170-E1494 PolarHBondContact N-OE2 3.24Å
171R38.8Very low39.4Very low187 Ų187141.3 Ų141.371%0.70670%0.703SS**  trans70.3159.8140.2-57.6162-165.2-172.33118.1
172Y42.5Very low39.2Very low183 Ų183142 Ų14272%0.71871%0.708SS**  cis-133.914413.4-75.2-86.5000109.7
173V41.5Very low39.3Very low114 Ų114142 Ų14269%0.69172%0.719SS**  80.2100.263.7179.10000115.9
174L37.8Very low38.9Very low144 Ų144145.2 Ų145.275%0.75473%0.734SS**  trans55.2154.5142.1-59.1175.6000124.7
175H35.8Very low38.7Very low157 Ų157142 Ų14273%0.72774%0.736SS**  trans79.7108.4158.9-65.1-72.9000122.1
176C43.3Very low38.7Very low117 Ų117140.1 Ų140.179%0.79173%0.734SS**  -163.8118.5129.1-165.60000107.1
177D36.6Very low38.7Very low130 Ų130139.8 Ų139.870%0.69574%0.737SS**  cis69.547.410.1-158.125.5000117.3
178K38.4Very low39.1Very low170 Ų170142.3 Ų142.374%0.73973%0.731SS**  trans-166.7111.8140.7-105.1144.3-169.3160.60114.1
179R34.5Very low39.8Very low232 Ų232137.2 Ų137.288%0.87572%0.721SS**  trans59.3130.8144.6-59.4-177.6176.1-127.7-5.3119.9
180S32.4Very low40.6Very low108 Ų108136.4 Ų136.476%0.75571%0.709SS**  trans59.880.3153.555.50000119.2
181C42.2Very low41.8Very low135 Ų135137.7 Ų137.791%0.91271%0.714SS**  trans-134.975.5149.6-76.30000109.7
182N35.5Very low42.7Very low166 Ų166137.3 Ų137.389%0.88871%0.713SS**  trans-83.7133.7175.2-76.4-0.8000110.5
183G39.3Very low43.4Very low70 Ų70131.1 Ų131.172%0.72269%0.691SS**  trans113.733.4152.900000119.5
184H38.4Very low44.6Very low195 Ų195128.9 Ų128.990%0.90368%0.678SS**  trans-130.9158.2166.9-81.2-73.5000113.7
185S36.6Very low46Very low94 Ų94127.3 Ų127.366%0.65768%0.676SS**  trans-80.8131-173.7121.90000112
186H41.7Very low47.8Very low136 Ų136124.3 Ų124.363%0.6367%0.669SS**  trans-106.181.9158-94.4-85.3000110.2H188H186-H188 VanDerWaalsContact C-N 3.31Å; H186-H188 PolarHBondContact ND1-O 2.95Å
187L46.5Very low49.3Very low164 Ų164122.6 Ų122.686%0.85965%0.65SS**  trans-84-10.2157.6-100.6164.3000112.1
188H46.3Very low51Low117 Ų117121 Ų12154%0.54263%0.634SS.*  trans-98.6109.4168.6-83-78000111.1H186 E190H186-H188 VanDerWaalsContact C-N 3.31Å; H186-H188 PolarHBondContact ND1-O 2.95Å; H188-E190 VanDerWaalsContact C-N 3.27Å; H188-E190 HydrophobicContact CB-CB 4.45Å; H188-E190 WeakPolarHBondContact ND1-CG 3.26Å
189D51.7Low52.7Low121 Ų121119.5 Ų119.565%0.64763%0.628SS**  trans-88-1158.1-128.2-8.1000111.1D191 Y192 M193D189-D191 PolarHBondContact O-N 2.74Å; D189-Y192 PolarHBondContact O-N 3.31Å; D189-M193 WeakPolarHBondContact O-CG 3.24Å; D189-M193 PolarHBondContact O-N 3.21Å
190E56.5Low54.8Low55 Ų55112 Ų11226%0.25761%0.605SS.*THydrogen-bonded Turntrans-60-25.9175.5-69.9-68.8162.400113.2H188 M193 R198 R201H188-E190 VanDerWaalsContact C-N 3.27Å; H188-E190 HydrophobicContact CB-CB 4.45Å; H188-E190 WeakPolarHBondContact ND1-CG 3.26Å; E190-M193 WeakPolarHBondContact O-CB 3.47Å; E190-R198 PolarHBondContact O-NE 3.41Å; E190-R198 PolarHBondContact O-NH2 2.9Å; E190-R201 VanDerWaalsContact OE1-CD 3.28Å; E190-R201 WeakPolarHBondContact OE1-CD 3.41Å; E190-R201 IonicContact OE1-CZ 3.93Å; E190-R201 IonicContact OE1-NE 2.88Å; E190-R201 IonicContact OE1-NH1 3.76Å; E190-R201 PolarHBondContact OE1-NH1 2.8Å; E190-R201 IonicContact OE2-NH1 3.66Å
191D60.7Low56.9Low97 Ų97112.4 Ų112.452%0.51959%0.59SS.*THydrogen-bonded Turntrans-91.1-13.8-176.7-67.1-57.1000114.5D189 R198D189-D191 PolarHBondContact O-N 2.74Å; D191-R198 IonicContact OD1-CZ 2.74Å; D191-R198 IonicContact OD1-NH1 3.92Å; D191-R198 IonicContact OD1-NH2 3.83Å; D191-R198 PolarHBondContact OD1-NH2 3.44Å
192Y59.3Low58.5Low179 Ų179111.9 Ų111.970%0.70257%0.574SS**THydrogen-bonded Turntrans-97-2.5165.3-74.6-80000112.8D189 T194D189-Y192 PolarHBondContact O-N 3.31Å; Y192-T194 PolarHBondContact O-N 2.71Å
193M56.8Low60.4Low52 Ų52106.9 Ų106.926%0.25655%0.546SS..SBendtrans-65116.5158.5-60.3-86.282.900108.8D189 E190 Q197 R198D189-M193 WeakPolarHBondContact O-CG 3.24Å; D189-M193 PolarHBondContact O-N 3.21Å; E190-M193 WeakPolarHBondContact O-CB 3.47Å; M193-Q197 HydrophobicContact CB-CB 3.77Å; M193-Q197 HydrophobicContact CE-CB 4.11Å; M193-Q197 HydrophobicContact CE-CG 4.36Å; M193-Q197 HydrophobicContact CG-CB 4.34Å; M193-Q197 HydrophobicContact SD-CB 3.75Å; M193-R198 HydrophobicContact CB-CB 4.4Å
194T66.9Low62.2Low68 Ų68107 Ų10742%0.41753%0.533SS..  trans-51.8157.9168.357.20000111Y192 T196 Q197 R198Y192-T194 PolarHBondContact O-N 2.71Å; T194-T196 CarbonylContact O-C 3.56Å; T194-T196 PolarHBondContact O-N 2.84Å; T194-Q197 WeakPolarHBondContact O-CA 3.45Å; T194-Q197 PolarHBondContact O-N 3.37Å; T194-Q197 WeakPolarHBondContact OG1-CG 3.14Å; T194-Q197 PolarHBondContact OG1-N 2.9Å; T194-Q197 PolarHBondContact OG1-OE1 2.77Å; T194-R198 PolarHBondContact O-N 2.73Å
195P66.6Low64.1Low110 Ų110103.7 Ų103.771%0.71452%0.518SS*.Hα-helixtrans-52-33.9177.8-29.236.3000113.4K199P195-K199 VanDerWaalsContact O-CB 3.25Å; P195-K199 WeakPolarHBondContact O-CB 3.44Å; P195-K199 PolarHBondContact O-N 3.16Å
196T72.9Confident66.3Low94 Ų94105 Ų10558%0.57752%0.517SS*.Hα-helixtrans-58.8-52169.7-48.60000112.3T194 N200T194-T196 CarbonylContact O-C 3.56Å; T194-T196 PolarHBondContact O-N 2.84Å; T196-N200 WeakPolarHBondContact O-CB 3.4Å; T196-N200 PolarHBondContact O-N 3.21Å; T196-N200 PolarHBondContact O-ND2 2.77Å; T196-N200 PolarHBondContact O-OD1 3.44Å
197Q75.3Confident67.8Low81 Ų81104.6 Ų104.638%0.37951%0.51SS..Hα-helixtrans-67.7-39.1-179-71.8162-55.600112.8M193 T194 N200 R201M193-Q197 HydrophobicContact CB-CB 3.77Å; M193-Q197 HydrophobicContact CE-CB 4.11Å; M193-Q197 HydrophobicContact CE-CG 4.36Å; M193-Q197 HydrophobicContact CG-CB 4.34Å; M193-Q197 HydrophobicContact SD-CB 3.75Å; T194-Q197 WeakPolarHBondContact O-CA 3.45Å; T194-Q197 PolarHBondContact O-N 3.37Å; T194-Q197 WeakPolarHBondContact OG1-CG 3.14Å; T194-Q197 PolarHBondContact OG1-N 2.9Å; T194-Q197 PolarHBondContact OG1-OE1 2.77Å; Q197-N200 WeakPolarHBondContact O-CB 3.49Å; Q197-N200 PolarHBondContact O-N 3.46Å; Q197-R201 PolarHBondContact O-N 3.43Å
198R72.4Confident69.4Low96 Ų96102.8 Ų102.836%0.36250%0.499SS..Hα-helixtrans-64.7-49175-173177.8-63.2-171.8-0.2111.4E190 D191 M193 T194 N200 R201 E202E190-R198 PolarHBondContact O-NE 3.41Å; E190-R198 PolarHBondContact O-NH2 2.9Å; D191-R198 IonicContact OD1-CZ 2.74Å; D191-R198 IonicContact OD1-NH1 3.92Å; D191-R198 IonicContact OD1-NH2 3.83Å; D191-R198 PolarHBondContact OD1-NH2 3.44Å; M193-R198 HydrophobicContact CB-CB 4.4Å; T194-R198 PolarHBondContact O-N 2.73Å; R198-N200 VanDerWaalsContact C-N 3.26Å; R198-N200 PolarHBondContact O-N 3.44Å; R198-R201 WeakPolarHBondContact O-CB 3.48Å; R198-R201 PolarHBondContact O-N 2.77Å; R198-E202 PolarHBondContact O-N 3.41Å
199K75.1Confident71.1Confident140 Ų140105.6 Ų105.661%0.60950%0.504SS*.Hα-helixtrans-58.5-38.7175.1-172.4176.2-179176.40111.5P195 R201 M203P195-K199 VanDerWaalsContact O-CB 3.25Å; P195-K199 WeakPolarHBondContact O-CB 3.44Å; P195-K199 PolarHBondContact O-N 3.16Å; K199-R201 VanDerWaalsContact C-N 3.29Å; K199-R201 PolarHBondContact O-N 3.03Å; K199-M203 HydrophobicContact CD-CE 4.41Å; K199-M203 HydrophobicContact CG-CE 3.94Å; K199-M203 WeakPolarHBondContact O-CB 3.33Å; K199-M203 PolarHBondContact O-N 2.73Å
200N76.8Confident72.7Confident75 Ų75105 Ų10540%0.40150%0.501SS..Hα-helixtrans-62.3-33.7173.4-73.1-13.1000112.6T196 Q197 R198 T204T196-N200 WeakPolarHBondContact O-CB 3.4Å; T196-N200 PolarHBondContact O-N 3.21Å; T196-N200 PolarHBondContact O-ND2 2.77Å; T196-N200 PolarHBondContact O-OD1 3.44Å; Q197-N200 WeakPolarHBondContact O-CB 3.49Å; Q197-N200 PolarHBondContact O-N 3.46Å; R198-N200 VanDerWaalsContact C-N 3.26Å; R198-N200 PolarHBondContact O-N 3.44Å; N200-T204 VanDerWaalsContact O-CB 3.3Å; N200-T204 WeakPolarHBondContact O-CB 3.23Å; N200-T204 PolarHBondContact O-N 2.91Å; N200-T204 PolarHBondContact O-OG1 3.14Å
201R77.6Confident73.4Confident115 Ų115110 Ų11043%0.43452%0.517SS..Hα-helixtrans-72.5-48.7-178.7-145.2178.2-155.115911.8112.5E190 Q197 R198 K199 T204 Q205E190-R201 VanDerWaalsContact OE1-CD 3.28Å; E190-R201 WeakPolarHBondContact OE1-CD 3.41Å; E190-R201 IonicContact OE1-CZ 3.93Å; E190-R201 IonicContact OE1-NE 2.88Å; E190-R201 IonicContact OE1-NH1 3.76Å; E190-R201 PolarHBondContact OE1-NH1 2.8Å; E190-R201 IonicContact OE2-NH1 3.66Å; Q197-R201 PolarHBondContact O-N 3.43Å; R198-R201 WeakPolarHBondContact O-CB 3.48Å; R198-R201 PolarHBondContact O-N 2.77Å; K199-R201 VanDerWaalsContact C-N 3.29Å; K199-R201 PolarHBondContact O-N 3.03Å; R201-T204 WeakPolarHBondContact O-CB 3.39Å; R201-T204 PolarHBondContact O-N 3.39Å; R201-T204 VanDerWaalsContact O-N 3.15Å; R201-Q205 PolarHBondContact O-N 2.8Å; R201-Q205 VanDerWaalsContact O-N 3.08Å
202E75.3Confident74.5Confident124 Ų124111 Ų11158%0.57952%0.519SS*.Hα-helixtrans-62.9-45174.8-66.9175.5155.100111.4R198 T204 Q205 L206R198-E202 PolarHBondContact O-N 3.41Å; E202-T204 PolarHBondContact O-N 3.17Å; E202-Q205 PolarHBondContact O-N 2.84Å; E202-Q205 VanDerWaalsContact O-N 3.07Å; E202-L206 PolarHBondContact O-N 3.5Å
203M76.5Confident75.6Confident61 Ų61108.1 Ų108.130%0.351%0.51SS..Hα-helixtrans-59.8-32.7174.5-167.9-169.5-45.800111.7K199 R207K199-M203 HydrophobicContact CD-CE 4.41Å; K199-M203 HydrophobicContact CG-CE 3.94Å; K199-M203 WeakPolarHBondContact O-CB 3.33Å; K199-M203 PolarHBondContact O-N 2.73Å; M203-R207 WeakPolarHBondContact O-CB 3.39Å; M203-R207 VanDerWaalsContact O-CD 3.3Å; M203-R207 WeakPolarHBondContact O-CD 3.21Å; M203-R207 WeakPolarHBondContact O-CG 3.32Å; M203-R207 PolarHBondContact O-N 3.23Å; M203-R207 PolarHBondContact SD-NH1 3.42Å; M203-R207 PolarHBondContact SD-NH2 2.8Å; M203-R207 VanDerWaalsContact SD-NH2 3.35Å
204T76.2Confident76.9Confident74 Ų74109.7 Ų109.745%0.45452%0.516SS..Hα-helixtrans-70.2-38.9173.9-61.70000112.3N200 R201 E202 R207 M208N200-T204 VanDerWaalsContact O-CB 3.3Å; N200-T204 WeakPolarHBondContact O-CB 3.23Å; N200-T204 PolarHBondContact O-N 2.91Å; N200-T204 PolarHBondContact O-OG1 3.14Å; R201-T204 WeakPolarHBondContact O-CB 3.39Å; R201-T204 PolarHBondContact O-N 3.39Å; R201-T204 VanDerWaalsContact O-N 3.15Å; E202-T204 PolarHBondContact O-N 3.17Å; T204-R207 PolarHBondContact O-N 2.81Å; T204-M208 WeakPolarHBondContact O-CG 3.12Å; T204-M208 PolarHBondContact O-N 3.29Å
205Q79Confident77.4Confident125 Ų125109.5 Ų109.558%0.58452%0.515SS*.Hα-helixtrans-70.1-40.6176.7-68.3-170.81100112.8R201 E202 M208 R209R201-Q205 PolarHBondContact O-N 2.8Å; R201-Q205 VanDerWaalsContact O-N 3.08Å; E202-Q205 PolarHBondContact O-N 2.84Å; E202-Q205 VanDerWaalsContact O-N 3.07Å; Q205-M208 WeakPolarHBondContact O-CB 3.29Å; Q205-M208 PolarHBondContact O-N 2.75Å; Q205-R209 PolarHBondContact O-N 3.28Å; Q205-R209 VanDerWaalsContact O-N 3.16Å
206L83.1Confident78Confident121 Ų121107.8 Ų107.863%0.63450%0.498SS*.Hα-helixtrans-66.9-40.3173.5-70.8176000111.2E202 M208 R209 L210E202-L206 PolarHBondContact O-N 3.5Å; L206-M208 VanDerWaalsContact C-N 3.27Å; L206-M208 PolarHBondContact O-N 3.38Å; L206-R209 PolarHBondContact O-N 3.02Å; L206-L210 WeakPolarHBondContact O-CB 3.34Å; L206-L210 PolarHBondContact O-N 2.89Å
207R73.2Confident78.5Confident128 Ų128109.2 Ų109.248%0.48350%0.501SS..Hα-helixtrans-57.5-36.1169.6-78.8166.8173.5165.8-3.8112.8M203 T204 R211M203-R207 WeakPolarHBondContact O-CB 3.39Å; M203-R207 VanDerWaalsContact O-CD 3.3Å; M203-R207 WeakPolarHBondContact O-CD 3.21Å; M203-R207 WeakPolarHBondContact O-CG 3.32Å; M203-R207 PolarHBondContact O-N 3.23Å; M203-R207 PolarHBondContact SD-NH1 3.42Å; M203-R207 PolarHBondContact SD-NH2 2.8Å; M203-R207 VanDerWaalsContact SD-NH2 3.35Å; T204-R207 PolarHBondContact O-N 2.81Å; R207-R211 VanDerWaalsContact O-CB 3.24Å; R207-R211 WeakPolarHBondContact O-CB 3.5Å; R207-R211 VanDerWaalsContact O-CD 3.3Å; R207-R211 WeakPolarHBondContact O-CD 3.38Å; R207-R211 WeakPolarHBondContact O-CG 3.48Å; R207-R211 PolarHBondContact O-N 2.84Å
208M79.6Confident78.6Confident126 Ų126111.2 Ų111.262%0.62151%0.51SS*.Hα-helixtrans-66.3-45.1176-68-109.3-63.700112.4T204 Q205 L206 Q212T204-M208 WeakPolarHBondContact O-CG 3.12Å; T204-M208 PolarHBondContact O-N 3.29Å; Q205-M208 WeakPolarHBondContact O-CB 3.29Å; Q205-M208 PolarHBondContact O-N 2.75Å; L206-M208 VanDerWaalsContact C-N 3.27Å; L206-M208 PolarHBondContact O-N 3.38Å; M208-Q212 PolarHBondContact O-N 2.84Å
209R82.3Confident79.1Confident176 Ų176112.1 Ų112.166%0.66452%0.522SS*.Hα-helixtrans-73.2-34.9179.9-74.4-174.8178.4146.40.5113.4Q205 L206 Q212 K213Q205-R209 PolarHBondContact O-N 3.28Å; Q205-R209 VanDerWaalsContact O-N 3.16Å; L206-R209 PolarHBondContact O-N 3.02Å; R209-Q212 PolarHBondContact O-N 2.78Å; R209-K213 PolarHBondContact O-N 3.42Å
210L83.9Confident79Confident108 Ų108114 Ų11457%0.56553%0.526SS*.Hα-helixtrans-60.8-54.9172.1-158.781000108.9L206 Q212 K213 E214L206-L210 WeakPolarHBondContact O-CB 3.34Å; L206-L210 PolarHBondContact O-N 2.89Å; L210-Q212 VanDerWaalsContact C-N 3.26Å; L210-Q212 PolarHBondContact O-N 2.85Å; L210-Q212 VanDerWaalsContact O-N 3.16Å; L210-K213 CarbonylContact O-C 3.48Å; L210-K213 PolarHBondContact O-N 2.82Å; L210-E214 VanDerWaalsContact CD2-OE1 3.28Å; L210-E214 WeakPolarHBondContact CD2-OE1 3.29Å; L210-E214 HydrophobicContact CG-CG 4.31Å; L210-E214 WeakPolarHBondContact O-CG 3.46Å; L210-E214 PolarHBondContact O-N 3.27Å
211R72.4Confident79.4Confident159 Ų159115.2 Ų115.260%0.653%0.529SS*.Hα-helixtrans-51.5-42176.2-77169.4179.5-177.6-5113.1R207 K213 E214 T215R207-R211 VanDerWaalsContact O-CB 3.24Å; R207-R211 WeakPolarHBondContact O-CB 3.5Å; R207-R211 VanDerWaalsContact O-CD 3.3Å; R207-R211 WeakPolarHBondContact O-CD 3.38Å; R207-R211 WeakPolarHBondContact O-CG 3.48Å; R207-R211 PolarHBondContact O-N 2.84Å; R211-K213 VanDerWaalsContact C-N 3.31Å; R211-K213 PolarHBondContact O-N 3.21Å; R211-E214 WeakPolarHBondContact CA-OE2 3.24Å; R211-E214 PolarHBondContact N-OE2 2.84Å; R211-E214 VanDerWaalsContact N-OE2 3.1Å; R211-E214 PolarHBondContact O-N 2.9Å; R211-T215 WeakPolarHBondContact O-CG2 3.5Å; R211-T215 PolarHBondContact O-N 3.41Å; R211-T215 PolarHBondContact O-OG1 3.27Å
212Q84.2Confident79.1Confident119 Ų119112.5 Ų112.556%0.55653%0.531SS*.Hα-helixtrans-64-33.5179.7-171.8176.42.600113.3M208 R209 L210 T215 E216M208-Q212 PolarHBondContact O-N 2.84Å; R209-Q212 PolarHBondContact O-N 2.78Å; L210-Q212 VanDerWaalsContact C-N 3.26Å; L210-Q212 PolarHBondContact O-N 2.85Å; L210-Q212 VanDerWaalsContact O-N 3.16Å; Q212-T215 WeakPolarHBondContact CA-OG1 3.4Å; Q212-T215 PolarHBondContact O-OG1 3.47Å; Q212-E216 WeakPolarHBondContact O-CG 3.4Å; Q212-E216 PolarHBondContact O-N 2.87Å
213K80.7Confident79.6Confident118 Ų118111.7 Ų111.751%0.51353%0.527SS..Hα-helixtrans-90.5-23.8176.1-69.2-50.8-169-165.90113.8R209 L210 R211 E216 L217R209-K213 PolarHBondContact O-N 3.42Å; L210-K213 CarbonylContact O-C 3.48Å; L210-K213 PolarHBondContact O-N 2.82Å; R211-K213 VanDerWaalsContact C-N 3.31Å; R211-K213 PolarHBondContact O-N 3.21Å; K213-E216 HydrophobicContact CD-CB 4.49Å; K213-E216 IonicContact NZ-OE1 2.69Å; K213-E216 PolarHBondContact NZ-OE1 3.26Å; K213-E216 IonicContact NZ-OE2 3.72Å; K213-E216 PolarHBondContact NZ-OE2 3.42Å; K213-L217 WeakPolarHBondContact O-CG 3.19Å; K213-L217 PolarHBondContact O-N 2.81Å
214E84.8Confident79.6Confident85 Ų85112.8 Ų112.840%0.39753%0.534SS..Hα-helixtrans-60.5-53.2163.3-68.3165.2143.800108.7L210 R211 E216 L217 E218L210-E214 VanDerWaalsContact CD2-OE1 3.28Å; L210-E214 WeakPolarHBondContact CD2-OE1 3.29Å; L210-E214 HydrophobicContact CG-CG 4.31Å; L210-E214 WeakPolarHBondContact O-CG 3.46Å; L210-E214 PolarHBondContact O-N 3.27Å; R211-E214 WeakPolarHBondContact CA-OE2 3.24Å; R211-E214 PolarHBondContact N-OE2 2.84Å; R211-E214 VanDerWaalsContact N-OE2 3.1Å; R211-E214 PolarHBondContact O-N 2.9Å; E214-E216 PolarHBondContact O-N 3.22Å; E214-L217 PolarHBondContact O-N 2.83Å; E214-L217 VanDerWaalsContact O-N 3.08Å; E214-E218 WeakPolarHBondContact O-CB 3.39Å; E214-E218 VanDerWaalsContact O-CG 3.3Å; E214-E218 WeakPolarHBondContact O-CG 3.15Å; E214-E218 PolarHBondContact O-N 3.43Å
215T77.2Confident79.9Confident64 Ų64112.9 Ų112.939%0.39353%0.529SS..Hα-helixtrans-61.1-40.4178.752.80000113.9R211 Q212 L217 E218 D219R211-T215 WeakPolarHBondContact O-CG2 3.5Å; R211-T215 PolarHBondContact O-N 3.41Å; R211-T215 PolarHBondContact O-OG1 3.27Å; Q212-T215 WeakPolarHBondContact CA-OG1 3.4Å; Q212-T215 PolarHBondContact O-OG1 3.47Å; T215-L217 PolarHBondContact O-N 3.44Å; T215-E218 PolarHBondContact O-N 2.88Å; T215-D219 WeakPolarHBondContact O-CB 3.43Å; T215-D219 VanDerWaalsContact O-CG 3.27Å; T215-D219 PolarHBondContact O-N 3.43Å
216E78.9Confident79.8Confident75 Ų75112.4 Ų112.435%0.3553%0.527SS..Hα-helixtrans-66.4-23177.3-80.4179.2-137.100113.8Q212 K213 E214 R220Q212-E216 WeakPolarHBondContact O-CG 3.4Å; Q212-E216 PolarHBondContact O-N 2.87Å; K213-E216 HydrophobicContact CD-CB 4.49Å; K213-E216 IonicContact NZ-OE1 2.69Å; K213-E216 PolarHBondContact NZ-OE1 3.26Å; K213-E216 IonicContact NZ-OE2 3.72Å; K213-E216 PolarHBondContact NZ-OE2 3.42Å; E214-E216 PolarHBondContact O-N 3.22Å; E216-R220 WeakPolarHBondContact O-CG 3.36Å
217L85.1Confident79.5Confident123 Ų123110.8 Ų110.864%0.64452%0.518SS*.Hα-helixtrans-89.5-40.2174-72.1173000111.3K213 E214 T215 D219 R220 E221K213-L217 WeakPolarHBondContact O-CG 3.19Å; K213-L217 PolarHBondContact O-N 2.81Å; E214-L217 PolarHBondContact O-N 2.83Å; E214-L217 VanDerWaalsContact O-N 3.08Å; T215-L217 PolarHBondContact O-N 3.44Å; L217-D219 PolarHBondContact O-N 2.88Å; L217-R220 PolarHBondContact O-N 3.1Å; L217-R220 VanDerWaalsContact O-N 3.14Å; L217-E221 PolarHBondContact O-N 3.43Å
218E77.3Confident80Confident123 Ų123110.2 Ų110.258%0.57552%0.516SS*.Hα-helixtrans-57-46.1172.1-72.2170.3167.600110.9E214 T215 R220 A222E214-E218 WeakPolarHBondContact O-CB 3.39Å; E214-E218 VanDerWaalsContact O-CG 3.3Å; E214-E218 WeakPolarHBondContact O-CG 3.15Å; E214-E218 PolarHBondContact O-N 3.43Å; T215-E218 PolarHBondContact O-N 2.88Å; E218-R220 VanDerWaalsContact C-N 3.26Å; E218-R220 PolarHBondContact O-N 3.34Å; E218-A222 WeakPolarHBondContact O-CB 3.29Å; E218-A222 PolarHBondContact O-N 2.92Å
219D81.4Confident79.8Confident115 Ų115107 Ų10762%0.61550%0.501SS*.Hα-helixtrans-57.4-37.1175.4-78.2-23.8000112.6T215 L217 H223T215-D219 WeakPolarHBondContact O-CB 3.43Å; T215-D219 VanDerWaalsContact O-CG 3.27Å; T215-D219 PolarHBondContact O-N 3.43Å; L217-D219 PolarHBondContact O-N 2.88Å; D219-H223 WeakPolarHBondContact O-CB 3.47Å; D219-H223 PolarHBondContact O-N 3.45Å
220R72.9Confident79.5Confident181 Ų181105.8 Ų105.868%0.68350%0.497SS*.Hα-helixtrans-82.5-41.7-176.7-74-179.8174.1-169.9-1.3113E216 L217 E218 A222 H223 L224E216-R220 WeakPolarHBondContact O-CG 3.36Å; L217-R220 PolarHBondContact O-N 3.1Å; L217-R220 VanDerWaalsContact O-N 3.14Å; E218-R220 VanDerWaalsContact C-N 3.26Å; E218-R220 PolarHBondContact O-N 3.34Å; R220-A222 VanDerWaalsContact C-N 3.32Å; R220-H223 PolarHBondContact O-N 2.67Å; R220-L224 PolarHBondContact O-N 2.88Å
221E86.2Confident79Confident100 Ų100105.8 Ų105.847%0.46750%0.497SS..Hα-helixtrans-68.7-35.2172.5-163.665.3-132.800110.2L217 L224 Q225 R228L217-E221 PolarHBondContact O-N 3.43Å; E221-L224 PolarHBondContact O-N 3.44Å; E221-Q225 WeakPolarHBondContact O-CB 3.25Å; E221-Q225 PolarHBondContact O-N 2.91Å; E221-R228 IonicContact OE1-CZ 3.28Å; E221-R228 IonicContact OE1-NH1 3.93Å; E221-R228 PolarHBondContact OE1-NH1 3.25Å; E221-R228 IonicContact OE1-NH2 2.65Å; E221-R228 PolarHBondContact OE1-NH2 3.09Å
222A71.8Confident79.4Confident58 Ų58101.6 Ų101.648%0.47949%0.489SS..Hα-helixtrans-62.2-42.1171.400000112.2E218 R220 Q225 Q226E218-A222 WeakPolarHBondContact O-CB 3.29Å; E218-A222 PolarHBondContact O-N 2.92Å; R220-A222 VanDerWaalsContact C-N 3.32Å; A222-Q225 PolarHBondContact O-N 3.15Å; A222-Q226 WeakPolarHBondContact O-CB 3.11Å; A222-Q226 PolarHBondContact O-N 2.93Å
223H84.2Confident78.8Confident106 Ų10698.3 Ų98.349%0.49147%0.474SS..Hα-helixtrans-66.3-40.7175-177.5-108.3000112.5D219 R220 Q226 L227D219-H223 WeakPolarHBondContact O-CB 3.47Å; D219-H223 PolarHBondContact O-N 3.45Å; R220-H223 PolarHBondContact O-N 2.67Å; H223-Q226 PolarHBondContact O-N 3.39Å; H223-L227 WeakPolarHBondContact O-CG 3.31Å; H223-L227 PolarHBondContact O-N 2.79Å
224L78.2Confident78.3Confident84 Ų8497.8 Ų97.844%0.4448%0.476SS..Hα-helixtrans-66.2-40.8174.1-74.2174.5000112.1R220 E221 L227 R228R220-L224 PolarHBondContact O-N 2.88Å; E221-L224 PolarHBondContact O-N 3.44Å; L224-L227 PolarHBondContact O-N 3.43Å; L224-R228 WeakPolarHBondContact O-CG 3.35Å; L224-R228 PolarHBondContact O-N 3.14Å
225Q81.7Confident77.8Confident76 Ų7698.6 Ų98.636%0.35548%0.48SS..Hα-helixtrans-66.3-41.8176.4-168.35933.400111E221 A222 L227 R228 D229E221-Q225 WeakPolarHBondContact O-CB 3.25Å; E221-Q225 PolarHBondContact O-N 2.91Å; A222-Q225 PolarHBondContact O-N 3.15Å; Q225-L227 PolarHBondContact O-N 3.36Å; Q225-R228 CarbonylContact O-C 3.58Å; Q225-R228 PolarHBondContact O-N 2.84Å; Q225-D229 PolarHBondContact NE2-OD1 3.36Å; Q225-D229 VanDerWaalsContact O-CB 3.29Å; Q225-D229 WeakPolarHBondContact O-CB 3.5Å; Q225-D229 PolarHBondContact O-N 3.37Å
226Q76.2Confident77.4Confident115 Ų11597.2 Ų97.254%0.53747%0.472SS..Hα-helixtrans-59.8-28.4174.4-174.8176.386.300113A222 H223 R230A222-Q226 WeakPolarHBondContact O-CB 3.11Å; A222-Q226 PolarHBondContact O-N 2.93Å; H223-Q226 PolarHBondContact O-N 3.39Å; Q226-R230 WeakPolarHBondContact O-CB 3.37Å; Q226-R230 WeakPolarHBondContact O-CG 3.31Å; Q226-R230 PolarHBondContact O-N 3.18Å
227L76.8Confident76.7Confident87 Ų8797.6 Ų97.646%0.45548%0.475SS..Hα-helixtrans-78.9-37.6171.8-69.8172.5000113H223 L224 Q225 L231H223-L227 WeakPolarHBondContact O-CG 3.31Å; H223-L227 PolarHBondContact O-N 2.79Å; L224-L227 PolarHBondContact O-N 3.43Å; Q225-L227 PolarHBondContact O-N 3.36Å; L227-L231 PolarHBondContact O-N 3.11Å
228R84.5Confident75.5Confident116 Ų11697.7 Ų97.744%0.43847%0.474SS..Hα-helixtrans-64.3-49.3172.3-65.8172.7-165.5135.42.7110.8E221 L224 Q225 R230 L231 T232E221-R228 IonicContact OE1-CZ 3.28Å; E221-R228 IonicContact OE1-NH1 3.93Å; E221-R228 PolarHBondContact OE1-NH1 3.25Å; E221-R228 IonicContact OE1-NH2 2.65Å; E221-R228 PolarHBondContact OE1-NH2 3.09Å; L224-R228 WeakPolarHBondContact O-CG 3.35Å; L224-R228 PolarHBondContact O-N 3.14Å; Q225-R228 CarbonylContact O-C 3.58Å; Q225-R228 PolarHBondContact O-N 2.84Å; R228-R230 VanDerWaalsContact C-N 3.29Å; R228-R230 PolarHBondContact O-N 3.26Å; R228-L231 WeakPolarHBondContact O-CB 3.39Å; R228-L231 PolarHBondContact O-N 2.8Å; R228-T232 PolarHBondContact O-N 2.76Å; R228-T232 PolarHBondContact O-OG1 2.84Å
229D75Confident75.1Confident58 Ų5897.8 Ų97.831%0.3148%0.478SS..Hα-helixtrans-56.1-42.3177.8-70.5-8.5000111.4Q225 E233 Q770Q225-D229 PolarHBondContact NE2-OD1 3.36Å; Q225-D229 VanDerWaalsContact O-CB 3.29Å; Q225-D229 WeakPolarHBondContact O-CB 3.5Å; Q225-D229 PolarHBondContact O-N 3.37Å; D229-E233 WeakPolarHBondContact O-CB 3.42Å; D229-E233 PolarHBondContact O-N 3.45Å; D229-Q770 PolarHBondContact O-NE2 3.16Å
230R76Confident74.1Confident151 Ų15199.2 Ų99.257%0.5748%0.475SS*.Hα-helixtrans-64.6-34.6173.5-92.4-179.5157179.1-4.8113.8Q226 R228 L234Q226-R230 WeakPolarHBondContact O-CB 3.37Å; Q226-R230 WeakPolarHBondContact O-CG 3.31Å; Q226-R230 PolarHBondContact O-N 3.18Å; R228-R230 VanDerWaalsContact C-N 3.29Å; R228-R230 PolarHBondContact O-N 3.26Å; R230-L234 WeakPolarHBondContact O-CG 3.26Å; R230-L234 PolarHBondContact O-N 3.42Å; R230-L234 VanDerWaalsContact O-N 3.07Å
231L73.1Confident73.1Confident108 Ų10892.5 Ų92.557%0.56546%0.462SS*.Hα-helixtrans-69.9-49.7178.1-15291.5000110.1L227 R228 E233 L234 E235L227-L231 PolarHBondContact O-N 3.11Å; R228-L231 WeakPolarHBondContact O-CB 3.39Å; R228-L231 PolarHBondContact O-N 2.8Å; L231-E233 VanDerWaalsContact C-N 3.29Å; L231-E233 PolarHBondContact O-N 2.91Å; L231-L234 PolarHBondContact O-N 2.65Å; L231-L234 VanDerWaalsContact O-N 3.14Å; L231-E235 WeakPolarHBondContact O-CG 3.48Å; L231-E235 PolarHBondContact O-N 3.48Å
232T81.1Confident71.6Confident72 Ų7289.7 Ų89.744%0.44246%0.46SS..Hα-helixtrans-68.5-27.3177.2-55.10000112.4R228 T236R228-T232 PolarHBondContact O-N 2.76Å; R228-T232 PolarHBondContact O-OG1 2.84Å; T232-T236 HydrophobicContact CG2-CG2 4.41Å; T232-T236 WeakPolarHBondContact O-CB 3.21Å; T232-T236 VanDerWaalsContact O-CG2 3.31Å; T232-T236 WeakPolarHBondContact O-CG2 3.4Å; T232-T236 PolarHBondContact O-N 2.78Å; T232-T236 PolarHBondContact O-OG1 3.1Å
233E72.8Confident70.9Confident49 Ų4992.3 Ų92.323%0.22947%0.465CS..Hα-helixtrans-62.7-49167.1170.8172.3-146.600111.4D229 L231 E235 T236 I237 Q774D229-E233 WeakPolarHBondContact O-CB 3.42Å; D229-E233 PolarHBondContact O-N 3.45Å; L231-E233 VanDerWaalsContact C-N 3.29Å; L231-E233 PolarHBondContact O-N 2.91Å; E233-E235 PolarHBondContact O-N 3.4Å; E233-T236 PolarHBondContact O-N 3.08Å; E233-T236 PolarHBondContact O-OG1 2.68Å; E233-I237 HydrophobicContact CG-CD1 3.67Å; E233-I237 HydrophobicContact CG-CG1 4.36Å; E233-I237 WeakPolarHBondContact O-CB 3.29Å; E233-I237 VanDerWaalsContact O-CG1 3.22Å; E233-I237 WeakPolarHBondContact O-CG1 3.38Å; E233-I237 PolarHBondContact O-N 3.22Å; E233-Q774 PolarHBondContact OE1-NE2 3.26Å; E233-Q774 PolarHBondContact OE2-NE2 3.31Å; E233-Q774 VanDerWaalsContact OE2-NE2 3.07Å
234L69.8Low69.6Low107 Ų10793.6 Ų93.656%0.5648%0.475SS*.Hα-helixtrans-63-42.2177.6-73.8168.1000112.1R230 L231 I237 M238R230-L234 WeakPolarHBondContact O-CG 3.26Å; R230-L234 PolarHBondContact O-N 3.42Å; R230-L234 VanDerWaalsContact O-N 3.07Å; L231-L234 PolarHBondContact O-N 2.65Å; L231-L234 VanDerWaalsContact O-N 3.14Å; L234-I237 PolarHBondContact O-N 2.92Å; L234-M238 WeakPolarHBondContact O-CG 3.36Å; L234-M238 PolarHBondContact O-N 3.17Å; L234-M238 VanDerWaalsContact O-N 3.07Å
235E73.5Confident68.8Low102 Ų10294.6 Ų94.648%0.47749%0.485SS..Hα-helixtrans-60.4-47.3173.8-69173.8147.400111.2L231 E233 I237 M238 D239L231-E235 WeakPolarHBondContact O-CG 3.48Å; L231-E235 PolarHBondContact O-N 3.48Å; E233-E235 PolarHBondContact O-N 3.4Å; E235-I237 PolarHBondContact O-N 2.78Å; E235-M238 PolarHBondContact O-N 3.12Å; E235-D239 PolarHBondContact O-N 2.99Å
236T69.1Low67.8Low36 Ų3694.2 Ų94.222%0.22148%0.483CS..Hα-helixtrans-73.5-25.5179.156.30000114T232 E233 M238 R240T232-T236 HydrophobicContact CG2-CG2 4.41Å; T232-T236 WeakPolarHBondContact O-CB 3.21Å; T232-T236 VanDerWaalsContact O-CG2 3.31Å; T232-T236 WeakPolarHBondContact O-CG2 3.4Å; T232-T236 PolarHBondContact O-N 2.78Å; T232-T236 PolarHBondContact O-OG1 3.1Å; E233-T236 PolarHBondContact O-N 3.08Å; E233-T236 PolarHBondContact O-OG1 2.68Å; T236-M238 VanDerWaalsContact C-N 3.34Å; T236-R240 WeakPolarHBondContact O-CB 3.26Å; T236-R240 WeakPolarHBondContact O-CD 3.45Å; T236-R240 WeakPolarHBondContact O-CG 3.35Å; T236-R240 PolarHBondContact O-N 3.2Å; T236-R240 PolarHBondContact OG1-NH1 3.3Å; T236-R240 VanDerWaalsContact OG1-NH1 3.12Å
237I64.6Low67.1Low83 Ų8393.3 Ų93.343%0.42648%0.482SS..Hα-helixtrans-65.1-40.1168.2-74.8166.9000110.3E233 L234 E235E233-I237 HydrophobicContact CG-CD1 3.67Å; E233-I237 HydrophobicContact CG-CG1 4.36Å; E233-I237 WeakPolarHBondContact O-CB 3.29Å; E233-I237 VanDerWaalsContact O-CG1 3.22Å; E233-I237 WeakPolarHBondContact O-CG1 3.38Å; E233-I237 PolarHBondContact O-N 3.22Å; L234-I237 PolarHBondContact O-N 2.92Å; E235-I237 PolarHBondContact O-N 2.78Å
238M60.4Low66.8Low125 Ų12598.4 Ų98.462%0.61650%0.496SS*.Hα-helixtrans-70.6-33.9176.7-74.8174.647.400113.3L234 E235 T236L234-M238 WeakPolarHBondContact O-CG 3.36Å; L234-M238 PolarHBondContact O-N 3.17Å; L234-M238 VanDerWaalsContact O-N 3.07Å; E235-M238 PolarHBondContact O-N 3.12Å; T236-M238 VanDerWaalsContact C-N 3.34Å
239D68.9Low66Low125 Ų12598.4 Ų98.467%0.66850%0.496SS*.Hα-helixtrans-91.6-19.4-176.7-76.7-14000114.7E235 G241E235-D239 PolarHBondContact O-N 2.99Å; D239-G241 VanDerWaalsContact C-N 3.33Å; D239-G241 PolarHBondContact O-N 2.89Å
240R59.8Low66Low145 Ų14599.7 Ų99.755%0.54750%0.503SS..SBendtrans-78.2-3.4-177.8-79.8171.9172.4142.8-2.3116.1T236 G242 C767T236-R240 WeakPolarHBondContact O-CB 3.26Å; T236-R240 WeakPolarHBondContact O-CD 3.45Å; T236-R240 WeakPolarHBondContact O-CG 3.35Å; T236-R240 PolarHBondContact O-N 3.2Å; T236-R240 PolarHBondContact OG1-NH1 3.3Å; T236-R240 VanDerWaalsContact OG1-NH1 3.12Å; R240-G242 PolarHBondContact O-N 3.49Å; R240-C767 PolarHBondContact NH1-SG 3.29Å; R240-C767 VanDerWaalsContact NH1-SG 3.38Å; R240-C767 PolarHBondContact NH2-SG 3.13Å
241G52.6Low65.7Low40 Ų4095 Ų9541%0.41250%0.497SS..  trans67.2-12.8166.800000118.4D239 L243 L244D239-G241 VanDerWaalsContact C-N 3.33Å; D239-G241 PolarHBondContact O-N 2.89Å; G241-L243 PolarHBondContact O-N 3.17Å; G241-L244 PolarHBondContact O-N 2.96Å
242G54.5Low65.8Low40 Ų4092.9 Ų92.941%0.41249%0.491SS..THydrogen-bonded Turntrans-65.2-9.1-176.600000116.1R240 L244 T245 E246R240-G242 PolarHBondContact O-N 3.49Å; G242-L244 PolarHBondContact O-N 2.81Å; G242-L244 VanDerWaalsContact O-N 3.16Å; G242-T245 PolarHBondContact O-N 2.83Å; G242-T245 PolarHBondContact O-OG1 3.36Å; G242-E246 PolarHBondContact O-N 3.25Å; G242-E246 VanDerWaalsContact O-N 3.15Å
243L57.1Low65.3Low114 Ų11494.1 Ų94.160%0.59749%0.49SS*.Hα-helixtrans-58.5-24.3172.8-74163.7000112.6G241 N247G241-L243 PolarHBondContact O-N 3.17Å; L243-N247 WeakPolarHBondContact O-CB 3.44Å; L243-N247 PolarHBondContact O-N 3.02Å
244L56.3Low65.6Low132 Ų13295.9 Ų95.969%0.69150%0.5SS*.Hα-helixtrans-71.6-41.5175.7-82.8155.3000113.5G241 G242 N247 Y248G241-L244 PolarHBondContact O-N 2.96Å; G242-L244 PolarHBondContact O-N 2.81Å; G242-L244 VanDerWaalsContact O-N 3.16Å; L244-N247 WeakPolarHBondContact O-CB 3.44Å; L244-N247 PolarHBondContact O-N 3.28Å; L244-Y248 PolarHBondContact O-N 3.06Å
245T62Low66Low106 Ų10693.5 Ų93.565%0.6550%0.496SS*.Hα-helixtrans-70.3-36.8174.322.90000111.4G242 N247 Y248 R249G242-T245 PolarHBondContact O-N 2.83Å; G242-T245 PolarHBondContact O-OG1 3.36Å; T245-N247 VanDerWaalsContact C-N 3.3Å; T245-N247 PolarHBondContact O-N 3.35Å; T245-Y248 PolarHBondContact O-N 3.06Å; T245-R249 PolarHBondContact O-N 3.09Å; T245-R249 VanDerWaalsContact O-N 3.08Å
246E60.1Low66.2Low67 Ų6794.8 Ų94.831%0.31350%0.502SS..Hα-helixtrans-64.6-34.9170.7-175.657.8-166.600111.6G242 Y248 R249 L250G242-E246 PolarHBondContact O-N 3.25Å; G242-E246 VanDerWaalsContact O-N 3.15Å; E246-Y248 VanDerWaalsContact C-N 3.3Å; E246-Y248 PolarHBondContact O-N 3.09Å; E246-R249 VanDerWaalsContact CD-NE 3.31Å; E246-R249 CarbonylContact O-C 3.57Å; E246-R249 WeakPolarHBondContact O-CA 3.37Å; E246-R249 WeakPolarHBondContact O-CB 3.47Å; E246-R249 PolarHBondContact O-N 3.15Å; E246-R249 VanDerWaalsContact O-N 3.1Å; E246-R249 IonicContact OE1-CZ 3.18Å; E246-R249 VanDerWaalsContact OE1-CZ 3.3Å; E246-R249 IonicContact OE1-NE 2.73Å; E246-R249 PolarHBondContact OE1-NE 3.21Å; E246-R249 VanDerWaalsContact OE1-NE 3.07Å; E246-R249 IonicContact OE1-NH2 3.75Å; E246-R249 PolarHBondContact OE1-NH2 2.95Å; E246-R249 WeakPolarHBondContact OE2-CD 3.4Å; E246-R249 IonicContact OE2-CZ 2.75Å; E246-R249 IonicContact OE2-NE 3.71Å; E246-R249 PolarHBondContact OE2-NE 3.06Å; E246-R249 IonicContact OE2-NH2 2.73Å; E246-L250 HydrophobicContact CG-CD1 4.26Å; E246-L250 HydrophobicContact CG-CG 4.42Å; E246-L250 WeakPolarHBondContact O-CB 3.46Å; E246-L250 WeakPolarHBondContact O-CG 3.44Å; E246-L250 PolarHBondContact O-N 3.34Å
247N61.7Low66.7Low96 Ų9698.6 Ų98.651%0.51352%0.52SS..Hα-helixtrans-62.8-35.5173.3-133.3-22.6000112.3L243 L244 T245 L250 A251L243-N247 WeakPolarHBondContact O-CB 3.44Å; L243-N247 PolarHBondContact O-N 3.02Å; L244-N247 WeakPolarHBondContact O-CB 3.44Å; L244-N247 PolarHBondContact O-N 3.28Å; T245-N247 VanDerWaalsContact C-N 3.3Å; T245-N247 PolarHBondContact O-N 3.35Å; N247-L250 PolarHBondContact O-N 3.47Å; N247-A251 WeakPolarHBondContact O-CB 3.32Å; N247-A251 PolarHBondContact O-N 3.09Å
248Y69.2Low67.3Low194 Ų19499.8 Ų99.876%0.76152%0.524SS*.Hα-helixtrans-67.9-36.9172.1-161.3-93.2000112.1L244 T245 E246 A251 S252L244-Y248 PolarHBondContact O-N 3.06Å; T245-Y248 PolarHBondContact O-N 3.06Å; E246-Y248 VanDerWaalsContact C-N 3.3Å; E246-Y248 PolarHBondContact O-N 3.09Å; Y248-A251 PolarHBondContact O-N 2.92Å; Y248-S252 PolarHBondContact O-N 2.65Å
249R68.5Low68.4Low116 Ų11697.7 Ų97.744%0.43851%0.513SS..Hα-helixtrans-65.3-41.2172.9-162.1-179.675.7125.8-1.5111.8T245 E246 S252 K253T245-R249 PolarHBondContact O-N 3.09Å; T245-R249 VanDerWaalsContact O-N 3.08Å; E246-R249 VanDerWaalsContact CD-NE 3.31Å; E246-R249 CarbonylContact O-C 3.57Å; E246-R249 WeakPolarHBondContact O-CA 3.37Å; E246-R249 WeakPolarHBondContact O-CB 3.47Å; E246-R249 PolarHBondContact O-N 3.15Å; E246-R249 VanDerWaalsContact O-N 3.1Å; E246-R249 IonicContact OE1-CZ 3.18Å; E246-R249 VanDerWaalsContact OE1-CZ 3.3Å; E246-R249 IonicContact OE1-NE 2.73Å; E246-R249 PolarHBondContact OE1-NE 3.21Å; E246-R249 VanDerWaalsContact OE1-NE 3.07Å; E246-R249 IonicContact OE1-NH2 3.75Å; E246-R249 PolarHBondContact OE1-NH2 2.95Å; E246-R249 WeakPolarHBondContact OE2-CD 3.4Å; E246-R249 IonicContact OE2-CZ 2.75Å; E246-R249 IonicContact OE2-NE 3.71Å; E246-R249 PolarHBondContact OE2-NE 3.06Å; E246-R249 IonicContact OE2-NH2 2.73Å; R249-S252 WeakPolarHBondContact O-CB 3.29Å; R249-S252 PolarHBondContact O-N 2.84Å; R249-K253 PolarHBondContact O-N 2.81Å
250L74.7Confident68.7Low86 Ų8694.3 Ų94.345%0.4550%0.502SS..Hα-helixtrans-66.2-39.1174.5-70.6170.8000111.8E246 N247 S252 K253 L254E246-L250 HydrophobicContact CG-CD1 4.26Å; E246-L250 HydrophobicContact CG-CG 4.42Å; E246-L250 WeakPolarHBondContact O-CB 3.46Å; E246-L250 WeakPolarHBondContact O-CG 3.44Å; E246-L250 PolarHBondContact O-N 3.34Å; N247-L250 PolarHBondContact O-N 3.47Å; L250-S252 VanDerWaalsContact C-N 3.34Å; L250-S252 PolarHBondContact O-N 3.41Å; L250-K253 CarbonylContact O-C 3.55Å; L250-K253 PolarHBondContact O-N 3.46Å; L250-L254 WeakPolarHBondContact O-CB 3.45Å; L250-L254 PolarHBondContact O-N 3.01Å
251A69.4Low69.7Low53 Ų5393.1 Ų93.144%0.43850%0.502SS..Hα-helixtrans-63.5-37.9172.700000112.3N247 Y248 L254 A255N247-A251 WeakPolarHBondContact O-CB 3.32Å; N247-A251 PolarHBondContact O-N 3.09Å; Y248-A251 PolarHBondContact O-N 2.92Å; A251-L254 WeakPolarHBondContact O-CB 3.13Å; A251-L254 PolarHBondContact O-N 2.84Å; A251-A255 PolarHBondContact O-N 2.83Å
252S75.3Confident71.1Confident63 Ų6395.8 Ų95.844%0.44150%0.503SS..Hα-helixtrans-65.6-45172.8-169.40000112Y248 R249 L250 L254 A255 Q256Y248-S252 PolarHBondContact O-N 2.65Å; R249-S252 WeakPolarHBondContact O-CB 3.29Å; R249-S252 PolarHBondContact O-N 2.84Å; L250-S252 VanDerWaalsContact C-N 3.34Å; L250-S252 PolarHBondContact O-N 3.41Å; S252-L254 VanDerWaalsContact C-N 3.3Å; S252-L254 PolarHBondContact O-N 3.06Å; S252-A255 PolarHBondContact O-N 3.08Å; S252-Q256 WeakPolarHBondContact O-CG 3.29Å; S252-Q256 PolarHBondContact O-N 3.2Å
253K72.3Confident72.5Confident98 Ų98100.4 Ų100.443%0.42651%0.512SS..Hα-helixtrans-60.8-36.3170.7-82.3-169.1171-172.40112.5R249 L250 Q256 L257R249-K253 PolarHBondContact O-N 2.81Å; L250-K253 CarbonylContact O-C 3.55Å; L250-K253 PolarHBondContact O-N 3.46Å; K253-Q256 PolarHBondContact O-N 2.9Å; K253-L257 WeakPolarHBondContact O-CB 3.35Å; K253-L257 WeakPolarHBondContact O-CG 3.4Å; K253-L257 PolarHBondContact O-N 2.99Å
254L77.9Confident73.4Confident86 Ų86100.5 Ų100.545%0.4551%0.509SS..Hα-helixtrans-64.9-41.3175.4-166.280.9000111.1L250 A251 S252 L257 Q258L250-L254 WeakPolarHBondContact O-CB 3.45Å; L250-L254 PolarHBondContact O-N 3.01Å; A251-L254 WeakPolarHBondContact O-CB 3.13Å; A251-L254 PolarHBondContact O-N 2.84Å; S252-L254 VanDerWaalsContact C-N 3.3Å; S252-L254 PolarHBondContact O-N 3.06Å; L254-L257 PolarHBondContact O-N 3.42Å; L254-Q258 WeakPolarHBondContact O-CB 3.3Å; L254-Q258 VanDerWaalsContact O-CG 3.31Å; L254-Q258 WeakPolarHBondContact O-CG 3.34Å; L254-Q258 PolarHBondContact O-N 3.17Å
255A78.1Confident74.5Confident56 Ų56100.3 Ų100.346%0.46350%0.503SS..Hα-helixtrans-64.3-40.3174.600000112.1A251 S252 Q258 E259A251-A255 PolarHBondContact O-N 2.83Å; S252-A255 PolarHBondContact O-N 3.08Å; A255-Q258 PolarHBondContact O-N 3.37Å; A255-E259 PolarHBondContact O-N 2.81Å
256Q77.6Confident75.4Confident130 Ų130101.8 Ų101.861%0.60750%0.496SS*.Hα-helixtrans-63.5-44.5173-70.5177.7-9.500111.9S252 K253 Q258 E259 A260S252-Q256 WeakPolarHBondContact O-CG 3.29Å; S252-Q256 PolarHBondContact O-N 3.2Å; K253-Q256 PolarHBondContact O-N 2.9Å; Q256-Q258 VanDerWaalsContact C-N 3.32Å; Q256-Q258 PolarHBondContact O-N 3.25Å; Q256-E259 PolarHBondContact O-N 2.9Å; Q256-A260 WeakPolarHBondContact O-CB 3.48Å; Q256-A260 PolarHBondContact O-N 2.91Å
257L79.1Confident76.2Confident116 Ų116103 Ų10361%0.60751%0.505SS*.Hα-helixtrans-63.2-35.4174-75169.4000112.3K253 L254 A260 H261K253-L257 WeakPolarHBondContact O-CB 3.35Å; K253-L257 WeakPolarHBondContact O-CG 3.4Å; K253-L257 PolarHBondContact O-N 2.99Å; L254-L257 PolarHBondContact O-N 3.42Å; L257-A260 PolarHBondContact O-N 3.22Å; L257-H261 VanDerWaalsContact O-CB 3.25Å; L257-H261 WeakPolarHBondContact O-CB 3.33Å; L257-H261 PolarHBondContact O-N 3.35Å
258Q78.8Confident77Confident107 Ų107103.2 Ų103.250%0.550%0.503SS..Hα-helixtrans-68.4-37.5174.5-76.9179.313.100112.8L254 A255 Q256 K262L254-Q258 WeakPolarHBondContact O-CB 3.3Å; L254-Q258 VanDerWaalsContact O-CG 3.31Å; L254-Q258 WeakPolarHBondContact O-CG 3.34Å; L254-Q258 PolarHBondContact O-N 3.17Å; A255-Q258 PolarHBondContact O-N 3.37Å; Q256-Q258 VanDerWaalsContact C-N 3.32Å; Q256-Q258 PolarHBondContact O-N 3.25Å; Q258-K262 WeakPolarHBondContact O-CB 3.45Å; Q258-K262 VanDerWaalsContact O-CE 3.3Å; Q258-K262 WeakPolarHBondContact O-CE 3.35Å; Q258-K262 WeakPolarHBondContact O-CG 3.42Å; Q258-K262 PolarHBondContact O-N 2.77Å
259E82.5Confident77.3Confident82 Ų8297.1 Ų97.138%0.38349%0.488SS..Hα-helixtrans-76.5-32.8174.1-162.559.7-14200112A255 Q256 K262 K263 R266A255-E259 PolarHBondContact O-N 2.81Å; Q256-E259 PolarHBondContact O-N 2.9Å; E259-K262 CarbonylContact O-C 3.55Å; E259-K262 PolarHBondContact O-N 3.49Å; E259-K262 WeakPolarHBondContact OE2-CD 3.39Å; E259-K262 VanDerWaalsContact OE2-CE 3.22Å; E259-K262 WeakPolarHBondContact OE2-CE 3.46Å; E259-K262 IonicContact OE2-NZ 2.71Å; E259-K262 PolarHBondContact OE2-NZ 3.37Å; E259-K263 WeakPolarHBondContact O-CB 3.49Å; E259-K263 PolarHBondContact O-N 3.43Å; E259-R266 IonicContact OE1-CZ 3.7Å; E259-R266 IonicContact OE1-NH1 2.96Å; E259-R266 PolarHBondContact OE1-NH1 2.91Å; E259-R266 IonicContact OE1-NH2 3.25Å
260A74.6Confident77.7Confident54 Ų5495.1 Ų95.145%0.44649%0.486SS..Hα-helixtrans-61.1-47.5169.700000111.3Q256 L257 K262 K263 E264Q256-A260 WeakPolarHBondContact O-CB 3.48Å; Q256-A260 PolarHBondContact O-N 2.91Å; L257-A260 PolarHBondContact O-N 3.22Å; A260-K262 VanDerWaalsContact C-N 3.33Å; A260-K262 PolarHBondContact O-N 3.47Å; A260-K263 CarbonylContact O-C 3.56Å; A260-K263 WeakPolarHBondContact O-CA 3.3Å; A260-K263 WeakPolarHBondContact O-CB 3.23Å; A260-K263 PolarHBondContact O-N 3.26Å; A260-K263 VanDerWaalsContact O-N 3.07Å; A260-E264 WeakPolarHBondContact O-CB 3.21Å; A260-E264 PolarHBondContact O-N 3.06Å
261H82.4Confident77.8Confident119 Ų11999.2 Ų99.255%0.55150%0.496SS*.Hα-helixtrans-66.8-30.3174.6179.5-110.6000112.7L257 E264 K265L257-H261 VanDerWaalsContact O-CB 3.25Å; L257-H261 WeakPolarHBondContact O-CB 3.33Å; L257-H261 PolarHBondContact O-N 3.35Å; H261-E264 IonicContact CD2-OE2 3.52Å; H261-K265 VanDerWaalsContact O-CB 3.24Å; H261-K265 WeakPolarHBondContact O-CB 3.31Å; H261-K265 PolarHBondContact O-N 3.02Å
262K80.6Confident78.2Confident97 Ų97102.7 Ų102.742%0.42250%0.501SS..Hα-helixtrans-66.9-38.4167.5-83176.8-104163.10112Q258 E259 A260 R266Q258-K262 WeakPolarHBondContact O-CB 3.45Å; Q258-K262 VanDerWaalsContact O-CE 3.3Å; Q258-K262 WeakPolarHBondContact O-CE 3.35Å; Q258-K262 WeakPolarHBondContact O-CG 3.42Å; Q258-K262 PolarHBondContact O-N 2.77Å; E259-K262 CarbonylContact O-C 3.55Å; E259-K262 PolarHBondContact O-N 3.49Å; E259-K262 WeakPolarHBondContact OE2-CD 3.39Å; E259-K262 VanDerWaalsContact OE2-CE 3.22Å; E259-K262 WeakPolarHBondContact OE2-CE 3.46Å; E259-K262 IonicContact OE2-NZ 2.71Å; E259-K262 PolarHBondContact OE2-NZ 3.37Å; A260-K262 VanDerWaalsContact C-N 3.33Å; A260-K262 PolarHBondContact O-N 3.47Å; K262-R266 WeakPolarHBondContact O-CG 3.41Å; K262-R266 PolarHBondContact O-N 3.49Å
263K84.2Confident78.3Confident137 Ų137105.6 Ų105.660%0.59651%0.508SS*.Hα-helixtrans-68.5-42.2175.3-170.9-177.2178.4-173.40111.4E259 A260 R266 L267E259-K263 WeakPolarHBondContact O-CB 3.49Å; E259-K263 PolarHBondContact O-N 3.43Å; A260-K263 CarbonylContact O-C 3.56Å; A260-K263 WeakPolarHBondContact O-CA 3.3Å; A260-K263 WeakPolarHBondContact O-CB 3.23Å; A260-K263 PolarHBondContact O-N 3.26Å; A260-K263 VanDerWaalsContact O-N 3.07Å; K263-R266 WeakPolarHBondContact O-CB 3.41Å; K263-R266 PolarHBondContact O-N 2.92Å; K263-L267 HydrophobicContact CG-CD1 4.36Å; K263-L267 WeakPolarHBondContact O-CB 3.46Å; K263-L267 WeakPolarHBondContact O-CG 3.33Å; K263-L267 PolarHBondContact O-N 3.41Å
264E75.5Confident78.2Confident116 Ų116105.6 Ų105.654%0.54251%0.509SS..Hα-helixtrans-62.9-43.7172.8-175.8177.9-155.100111.4A260 H261 R266 L267 M268A260-E264 WeakPolarHBondContact O-CB 3.21Å; A260-E264 PolarHBondContact O-N 3.06Å; H261-E264 IonicContact CD2-OE2 3.52Å; E264-R266 PolarHBondContact O-N 3.21Å; E264-L267 CarbonylContact O-C 3.54Å; E264-L267 PolarHBondContact O-N 3.33Å; E264-M268 WeakPolarHBondContact O-CB 3.25Å; E264-M268 PolarHBondContact O-N 2.95Å
265K79.3Confident78.1Confident128 Ų128105 Ų10556%0.55750%0.504SS*.Hα-helixtrans-65.4-36.4174.1-176.5168.8-179.1172.60112.8H261 M268 C269H261-K265 VanDerWaalsContact O-CB 3.24Å; H261-K265 WeakPolarHBondContact O-CB 3.31Å; H261-K265 PolarHBondContact O-N 3.02Å; K265-M268 PolarHBondContact O-N 3.38Å; K265-C269 WeakPolarHBondContact O-CB 3.23Å; K265-C269 PolarHBondContact O-N 3.4Å; K265-C269 PolarHBondContact O-SG 3.45Å; K265-C269 VanDerWaalsContact O-SG 3.38Å
266R82.3Confident78Confident136 Ų136109 Ų10951%0.51351%0.512SS..Hα-helixtrans-59.6-56.7169-74.6174.5-169.3121.8-0.1109.3E259 K262 K263 E264 M268 C269 D270E259-R266 IonicContact OE1-CZ 3.7Å; E259-R266 IonicContact OE1-NH1 2.96Å; E259-R266 PolarHBondContact OE1-NH1 2.91Å; E259-R266 IonicContact OE1-NH2 3.25Å; K262-R266 WeakPolarHBondContact O-CG 3.41Å; K262-R266 PolarHBondContact O-N 3.49Å; K263-R266 WeakPolarHBondContact O-CB 3.41Å; K263-R266 PolarHBondContact O-N 2.92Å; E264-R266 PolarHBondContact O-N 3.21Å; R266-M268 PolarHBondContact O-N 3.13Å; R266-M268 VanDerWaalsContact O-N 3.1Å; R266-C269 CarbonylContact O-C 3.57Å; R266-C269 WeakPolarHBondContact O-CA 3.36Å; R266-C269 WeakPolarHBondContact O-CB 3.22Å; R266-C269 PolarHBondContact O-N 2.84Å; R266-D270 PolarHBondContact O-N 3.29Å; R266-D270 VanDerWaalsContact O-OD2 3.09Å
267L76.5Confident77.8Confident94 Ų94105.1 Ų105.149%0.49250%0.495SS..Hα-helixtrans-55.5-32.2177.6-71.4166.6000113.9K263 E264 D270 R271K263-L267 HydrophobicContact CG-CD1 4.36Å; K263-L267 WeakPolarHBondContact O-CB 3.46Å; K263-L267 WeakPolarHBondContact O-CG 3.33Å; K263-L267 PolarHBondContact O-N 3.41Å; E264-L267 CarbonylContact O-C 3.54Å; E264-L267 PolarHBondContact O-N 3.33Å; L267-D270 WeakPolarHBondContact CA-OD2 3.39Å; L267-D270 PolarHBondContact N-OD2 2.83Å; L267-R271 WeakPolarHBondContact O-CB 3.44Å; L267-R271 WeakPolarHBondContact O-CG 3.49Å; L267-R271 PolarHBondContact O-N 3.1Å
268M79.4Confident77.3Confident99 Ų99101 Ų10149%0.48847%0.473SS..Hα-helixtrans-73.1-41.8173.8-170.6-168.6-66.100111.8E264 K265 R266 D270 R271 F272E264-M268 WeakPolarHBondContact O-CB 3.25Å; E264-M268 PolarHBondContact O-N 2.95Å; K265-M268 PolarHBondContact O-N 3.38Å; R266-M268 PolarHBondContact O-N 3.13Å; R266-M268 VanDerWaalsContact O-N 3.1Å; M268-D270 VanDerWaalsContact C-N 3.34Å; M268-R271 PolarHBondContact O-N 3.2Å; M268-F272 HydrophobicContact CG-CD2 4Å; M268-F272 HydrophobicContact CG-CE2 3.7Å; M268-F272 WeakPolarHBondContact O-CD2 3.46Å; M268-F272 PolarHBondContact O-N 2.67Å; M268-F272 HydrophobicContact SD-CE2 4.05Å
269C75Confident77.2Confident66 Ų6698.8 Ų98.845%0.44646%0.464SS..Hα-helixtrans-64.2-39.2170.1-72.20000111.8K265 R266 F272 E273K265-C269 WeakPolarHBondContact O-CB 3.23Å; K265-C269 PolarHBondContact O-N 3.4Å; K265-C269 PolarHBondContact O-SG 3.45Å; K265-C269 VanDerWaalsContact O-SG 3.38Å; R266-C269 CarbonylContact O-C 3.57Å; R266-C269 WeakPolarHBondContact O-CA 3.36Å; R266-C269 WeakPolarHBondContact O-CB 3.22Å; R266-C269 PolarHBondContact O-N 2.84Å; C269-F272 PolarHBondContact O-N 3.22Å; C269-E273 WeakPolarHBondContact O-CB 3.45Å; C269-E273 PolarHBondContact O-N 2.59Å
270D76.3Confident76.8Confident74 Ų7499.6 Ų99.640%0.39646%0.464SS..Hα-helixtrans-66.1-38.7177.3-54.6-31.9000110.2R266 L267 M268 E273 Q274R266-D270 PolarHBondContact O-N 3.29Å; R266-D270 VanDerWaalsContact O-OD2 3.09Å; L267-D270 WeakPolarHBondContact CA-OD2 3.39Å; L267-D270 PolarHBondContact N-OD2 2.83Å; M268-D270 VanDerWaalsContact C-N 3.34Å; D270-E273 PolarHBondContact O-N 2.81Å; D270-Q274 WeakPolarHBondContact O-CB 3.19Å; D270-Q274 WeakPolarHBondContact O-CG 3.39Å; D270-Q274 PolarHBondContact O-N 3.46Å
271R75.9Confident76.8Confident173 Ų173100.6 Ų100.665%0.65346%0.461SS*.Hα-helixtrans-63.1-47.7169.1-80.9-177.9-174.7-166.11.7112.4L267 M268 E273 Q274 Q275L267-R271 WeakPolarHBondContact O-CB 3.44Å; L267-R271 WeakPolarHBondContact O-CG 3.49Å; L267-R271 PolarHBondContact O-N 3.1Å; M268-R271 PolarHBondContact O-N 3.2Å; R271-E273 VanDerWaalsContact C-N 3.29Å; R271-E273 PolarHBondContact O-N 2.84Å; R271-Q274 WeakPolarHBondContact O-CB 3.44Å; R271-Q274 PolarHBondContact O-N 2.98Å; R271-Q275 WeakPolarHBondContact O-CG 3.43Å; R271-Q275 PolarHBondContact O-N 2.94Å
272F78.7Confident76.6Confident125 Ų12598.1 Ų98.155%0.54845%0.448SS..Hα-helixtrans-65.4-33.2177.5-77.5-54.8000112.3M268 C269 F276M268-F272 HydrophobicContact CG-CD2 4Å; M268-F272 HydrophobicContact CG-CE2 3.7Å; M268-F272 WeakPolarHBondContact O-CD2 3.46Å; M268-F272 PolarHBondContact O-N 2.67Å; M268-F272 HydrophobicContact SD-CE2 4.05Å; C269-F272 PolarHBondContact O-N 3.22Å; F272-F276 WeakPolarHBondContact O-CB 3.09Å; F272-F276 PolarHBondContact O-N 2.88Å
273E76.9Confident76.6Confident124 Ų12498.8 Ų98.858%0.57945%0.448SS*.Hα-helixtrans-72-36.9173-177.3161.8-177.400111.1C269 D270 R271 F276 N277C269-E273 WeakPolarHBondContact O-CB 3.45Å; C269-E273 PolarHBondContact O-N 2.59Å; D270-E273 PolarHBondContact O-N 2.81Å; R271-E273 VanDerWaalsContact C-N 3.29Å; R271-E273 PolarHBondContact O-N 2.84Å; E273-F276 PolarHBondContact O-N 3.38Å; E273-N277 VanDerWaalsContact CG-ND2 3.33Å; E273-N277 WeakPolarHBondContact CG-ND2 3.31Å; E273-N277 VanDerWaalsContact O-CB 3.31Å; E273-N277 WeakPolarHBondContact O-CB 3.47Å; E273-N277 PolarHBondContact O-N 2.97Å; E273-N277 PolarHBondContact O-ND2 3.29Å
274Q70.4Confident76.3Confident98 Ų9898 Ų9846%0.45845%0.447SS..Hα-helixtrans-60.7-54.3170.1-76.3167.76.200111.1D270 R271 F276 N277 Q278D270-Q274 WeakPolarHBondContact O-CB 3.19Å; D270-Q274 WeakPolarHBondContact O-CG 3.39Å; D270-Q274 PolarHBondContact O-N 3.46Å; R271-Q274 WeakPolarHBondContact O-CB 3.44Å; R271-Q274 PolarHBondContact O-N 2.98Å; Q274-F276 VanDerWaalsContact C-N 3.32Å; Q274-F276 PolarHBondContact O-N 3.41Å; Q274-N277 CarbonylContact O-C 3.59Å; Q274-N277 PolarHBondContact O-N 2.82Å; Q274-N277 VanDerWaalsContact O-N 3.12Å; Q274-Q278 WeakPolarHBondContact O-CB 3.23Å; Q274-Q278 WeakPolarHBondContact O-CG 3.41Å; Q274-Q278 PolarHBondContact O-N 3.43Å; Q274-Q278 PolarHBondContact O-OE1 2.9Å; Q274-Q278 VanDerWaalsContact O-OE1 3.12Å
275Q76.9Confident76.3Confident73 Ų7395.1 Ų95.134%0.34144%0.439SS..Hα-helixtrans-56.1-42.9175.5-69.7179.8-47.500112R271 Q278 L279 E360R271-Q275 WeakPolarHBondContact O-CG 3.43Å; R271-Q275 PolarHBondContact O-N 2.94Å; Q275-Q278 PolarHBondContact O-N 3.48Å; Q275-L279 WeakPolarHBondContact O-CB 3.46Å; Q275-L279 PolarHBondContact O-N 3.36Å; Q275-E360 WeakPolarHBondContact CA-OE2 3.4Å; Q275-E360 WeakPolarHBondContact CG-OE2 3.23Å
276F74.4Confident76.4Confident141 Ų14192.2 Ų92.262%0.61843%0.428SS*.Hα-helixtrans-66.5-39.5176.8-177.3-94.9000113F272 E273 Q274 R280F272-F276 WeakPolarHBondContact O-CB 3.09Å; F272-F276 PolarHBondContact O-N 2.88Å; E273-F276 PolarHBondContact O-N 3.38Å; Q274-F276 VanDerWaalsContact C-N 3.32Å; Q274-F276 PolarHBondContact O-N 3.41Å; F276-R280 WeakPolarHBondContact O-CB 3.33Å; F276-R280 PolarHBondContact O-N 3.32Å; F276-R280 VanDerWaalsContact O-N 3.09Å
277N73.8Confident76.2Confident48 Ų4888.4 Ų88.426%0.25742%0.422SS..Hα-helixtrans-65.5-40.4173.4-83.4-74.9000111.2E273 Q274 R280 D281E273-N277 VanDerWaalsContact CG-ND2 3.33Å; E273-N277 WeakPolarHBondContact CG-ND2 3.31Å; E273-N277 VanDerWaalsContact O-CB 3.31Å; E273-N277 WeakPolarHBondContact O-CB 3.47Å; E273-N277 PolarHBondContact O-N 2.97Å; E273-N277 PolarHBondContact O-ND2 3.29Å; Q274-N277 CarbonylContact O-C 3.59Å; Q274-N277 PolarHBondContact O-N 2.82Å; Q274-N277 VanDerWaalsContact O-N 3.12Å; N277-R280 WeakPolarHBondContact O-CB 3.49Å; N277-R280 PolarHBondContact O-N 2.93Å; N277-R280 PolarHBondContact O-NH2 3.36Å; N277-R280 VanDerWaalsContact OD1-CZ 3.26Å; N277-R280 PolarHBondContact OD1-NH1 3.48Å; N277-R280 PolarHBondContact OD1-NH2 2.93Å; N277-D281 WeakPolarHBondContact O-CB 3.15Å; N277-D281 PolarHBondContact O-N 3.24Å; N277-D281 VanDerWaalsContact O-OD1 3.11Å
278Q69.6Low76.5Confident31 Ų3188.4 Ų88.415%0.14542%0.421CS..Hα-helixtrans-76.8-33.6-176.8-67.5166.6-67.200112.4Q274 Q275 D281 Y282 E360Q274-Q278 WeakPolarHBondContact O-CB 3.23Å; Q274-Q278 WeakPolarHBondContact O-CG 3.41Å; Q274-Q278 PolarHBondContact O-N 3.43Å; Q274-Q278 PolarHBondContact O-OE1 2.9Å; Q274-Q278 VanDerWaalsContact O-OE1 3.12Å; Q275-Q278 PolarHBondContact O-N 3.48Å; Q278-D281 CarbonylContact O-C 3.56Å; Q278-D281 PolarHBondContact O-N 3.29Å; Q278-Y282 PolarHBondContact O-N 3.12Å; Q278-E360 HydrophobicContact CB-CB 4.38Å; Q278-E360 VanDerWaalsContact CB-CD 3.42Å; Q278-E360 HydrophobicContact CB-CG 3.56Å; Q278-E360 WeakPolarHBondContact CB-OE1 3.15Å; Q278-E360 HydrophobicContact CG-CG 4.27Å; Q278-E360 PolarHBondContact NE2-O 2.62Å
279L77Confident76.6Confident60 Ų6090.2 Ų90.231%0.31443%0.428SS..Hα-helixtrans-63.9-42.1168.1177.770.4000111.3Q275 D281 Y282 Y283 P356 E360Q275-L279 WeakPolarHBondContact O-CB 3.46Å; Q275-L279 PolarHBondContact O-N 3.36Å; L279-D281 VanDerWaalsContact C-N 3.34Å; L279-Y282 WeakPolarHBondContact O-CB 3.34Å; L279-Y282 PolarHBondContact O-N 2.93Å; L279-Y283 HydrophobicContact CD1-CD2 4.21Å; L279-Y283 HydrophobicContact CD1-CE2 3.7Å; L279-Y283 HydrophobicContact CD2-CE2 4.34Å; L279-Y283 HydrophobicContact CG-CD2 4.09Å; L279-Y283 HydrophobicContact CG-CE2 3.81Å; L279-Y283 VanDerWaalsContact O-CD2 3.25Å; L279-Y283 WeakPolarHBondContact O-CD2 3.26Å; L279-Y283 PolarHBondContact O-N 3.41Å; L279-P356 HydrophobicContact CD1-CG 3.84Å; L279-E360 PolarHBondContact N-OE1 3.39Å
280R74.2Confident77Confident99 Ų9992.5 Ų92.537%0.37444%0.436SS..Hα-helixtrans-59.4-47.3170.5178-156.861.5-131.6-9.3110.5F276 N277 Y282 Y283 E284F276-R280 WeakPolarHBondContact O-CB 3.33Å; F276-R280 PolarHBondContact O-N 3.32Å; F276-R280 VanDerWaalsContact O-N 3.09Å; N277-R280 WeakPolarHBondContact O-CB 3.49Å; N277-R280 PolarHBondContact O-N 2.93Å; N277-R280 PolarHBondContact O-NH2 3.36Å; N277-R280 VanDerWaalsContact OD1-CZ 3.26Å; N277-R280 PolarHBondContact OD1-NH1 3.48Å; N277-R280 PolarHBondContact OD1-NH2 2.93Å; R280-Y282 VanDerWaalsContact C-N 3.28Å; R280-Y282 PolarHBondContact O-N 3.49Å; R280-Y283 PolarHBondContact O-N 2.88Å; R280-E284 PolarHBondContact O-N 3.32Å
281D74.7Confident77.4Confident74 Ų7494.2 Ų94.240%0.39644%0.44SS..Hα-helixtrans-68.5-28.9-178.3-64.6-3.1000111.6N277 Q278 L279 S285N277-D281 WeakPolarHBondContact O-CB 3.15Å; N277-D281 PolarHBondContact O-N 3.24Å; N277-D281 VanDerWaalsContact O-OD1 3.11Å; Q278-D281 CarbonylContact O-C 3.56Å; Q278-D281 PolarHBondContact O-N 3.29Å; L279-D281 VanDerWaalsContact C-N 3.34Å; D281-S285 WeakPolarHBondContact O-CB 3.49Å; D281-S285 PolarHBondContact O-N 2.69Å; D281-S285 PolarHBondContact O-OG 2.98Å
282Y77.7Confident77.7Confident68 Ų6891.1 Ų91.127%0.26744%0.436SS..Hα-helixtrans-60.8-56.3166.7175.3-86.5000110.1Q278 L279 R280 E284 S285 E286Q278-Y282 PolarHBondContact O-N 3.12Å; L279-Y282 WeakPolarHBondContact O-CB 3.34Å; L279-Y282 PolarHBondContact O-N 2.93Å; R280-Y282 VanDerWaalsContact C-N 3.28Å; R280-Y282 PolarHBondContact O-N 3.49Å; Y282-E284 VanDerWaalsContact C-N 3.29Å; Y282-E284 PolarHBondContact O-N 2.7Å; Y282-S285 WeakPolarHBondContact CA-OG 3.46Å; Y282-S285 CarbonylContact O-C 3.6Å; Y282-S285 WeakPolarHBondContact O-CA 3.31Å; Y282-S285 PolarHBondContact O-N 2.92Å; Y282-S285 PolarHBondContact O-OG 2.97Å; Y282-E286 HydrophobicContact CE1-CB 4.1Å; Y282-E286 HydrophobicContact CE1-CG 4.4Å; Y282-E286 WeakPolarHBondContact CE1-OE1 3.27Å; Y282-E286 WeakPolarHBondContact O-CB 3.41Å; Y282-E286 PolarHBondContact O-N 2.96Å; Y282-E286 PolarHBondContact OH-OE1 3.06Å
283Y79.1Confident77.8Confident110 Ų11088.6 Ų88.643%0.43143%0.431SS..Hα-helixtrans-61.4-33.2178.8-75.9-58.5000113.2L279 R280 S287 E353L279-Y283 HydrophobicContact CD1-CD2 4.21Å; L279-Y283 HydrophobicContact CD1-CE2 3.7Å; L279-Y283 HydrophobicContact CD2-CE2 4.34Å; L279-Y283 HydrophobicContact CG-CD2 4.09Å; L279-Y283 HydrophobicContact CG-CE2 3.81Å; L279-Y283 VanDerWaalsContact O-CD2 3.25Å; L279-Y283 WeakPolarHBondContact O-CD2 3.26Å; L279-Y283 PolarHBondContact O-N 3.41Å; R280-Y283 PolarHBondContact O-N 2.88Å; Y283-S287 WeakPolarHBondContact O-CB 3.39Å; Y283-S287 PolarHBondContact O-N 3.39Å; Y283-E353 PolarHBondContact OH-OE1 2.86Å
284E79Confident78.2Confident122 Ų12287.8 Ų87.857%0.5743%0.427SS*.Hα-helixtrans-68-38.3171.6-73.2-163.5175.900111.8R280 Y282 I288R280-E284 PolarHBondContact O-N 3.32Å; Y282-E284 VanDerWaalsContact C-N 3.29Å; Y282-E284 PolarHBondContact O-N 2.7Å; E284-I288 WeakPolarHBondContact O-CD1 3.45Å; E284-I288 VanDerWaalsContact O-CG1 3.27Å; E284-I288 WeakPolarHBondContact O-CG1 3.36Å; E284-I288 PolarHBondContact O-N 3.37Å
285S75.9Confident78.8Confident54 Ų5489.8 Ų89.838%0.37844%0.436SS..Hα-helixtrans-69.6-46.1175.468.40000113.4D281 Y282 S287 I288 E289D281-S285 WeakPolarHBondContact O-CB 3.49Å; D281-S285 PolarHBondContact O-N 2.69Å; D281-S285 PolarHBondContact O-OG 2.98Å; Y282-S285 WeakPolarHBondContact CA-OG 3.46Å; Y282-S285 CarbonylContact O-C 3.6Å; Y282-S285 WeakPolarHBondContact O-CA 3.31Å; Y282-S285 PolarHBondContact O-N 2.92Å; Y282-S285 PolarHBondContact O-OG 2.97Å; S285-S287 VanDerWaalsContact C-N 3.3Å; S285-S287 PolarHBondContact O-N 3.06Å; S285-I288 CarbonylContact O-C 3.59Å; S285-I288 WeakPolarHBondContact O-CA 3.42Å; S285-I288 WeakPolarHBondContact O-CB 3.44Å; S285-I288 PolarHBondContact O-N 3.2Å; S285-E289 PolarHBondContact O-N 3.42Å
286E80.3Confident79.1Confident68 Ų6892.7 Ų92.732%0.31845%0.448SS..Hα-helixtrans-62.5-38.5174.8-176.7179.2-111.700110.7Y282 I288 E289 L290Y282-E286 HydrophobicContact CE1-CB 4.1Å; Y282-E286 HydrophobicContact CE1-CG 4.4Å; Y282-E286 WeakPolarHBondContact CE1-OE1 3.27Å; Y282-E286 WeakPolarHBondContact O-CB 3.41Å; Y282-E286 PolarHBondContact O-N 2.96Å; Y282-E286 PolarHBondContact OH-OE1 3.06Å; E286-I288 VanDerWaalsContact C-N 3.27Å; E286-I288 PolarHBondContact O-N 2.93Å; E286-E289 PolarHBondContact O-N 2.86Å; E286-L290 HydrophobicContact CG-CD1 4.1Å; E286-L290 WeakPolarHBondContact O-CB 3.32Å; E286-L290 PolarHBondContact O-N 3.47Å
287S78.3Confident79.7Confident56 Ų5691.5 Ų91.539%0.39244%0.444SS..Hα-helixtrans-67-24.6172-163.80000113Y283 S285 K291Y283-S287 WeakPolarHBondContact O-CB 3.39Å; Y283-S287 PolarHBondContact O-N 3.39Å; S285-S287 VanDerWaalsContact C-N 3.3Å; S285-S287 PolarHBondContact O-N 3.06Å; S287-K291 VanDerWaalsContact O-CG 3.31Å; S287-K291 WeakPolarHBondContact O-CG 3.06Å; S287-K291 PolarHBondContact O-NZ 3.15Å; S287-K291 PolarHBondContact OG-NZ 3.12Å
288I83.4Confident80.2Confident94 Ų9493 Ų9348%0.48245%0.452SS..Hα-helixtrans-76.8-47.5171-71.7161.9000109.7E284 S285 E286 L290 K291 D292E284-I288 WeakPolarHBondContact O-CD1 3.45Å; E284-I288 VanDerWaalsContact O-CG1 3.27Å; E284-I288 WeakPolarHBondContact O-CG1 3.36Å; E284-I288 PolarHBondContact O-N 3.37Å; S285-I288 CarbonylContact O-C 3.59Å; S285-I288 WeakPolarHBondContact O-CA 3.42Å; S285-I288 WeakPolarHBondContact O-CB 3.44Å; S285-I288 PolarHBondContact O-N 3.2Å; E286-I288 VanDerWaalsContact C-N 3.27Å; E286-I288 PolarHBondContact O-N 2.93Å; I288-L290 VanDerWaalsContact C-N 3.35Å; I288-L290 PolarHBondContact O-N 3.47Å; I288-K291 WeakPolarHBondContact O-CA 3.44Å; I288-K291 WeakPolarHBondContact O-CB 3.42Å; I288-K291 PolarHBondContact O-N 3.27Å; I288-D292 PolarHBondContact O-N 3.38Å
289E81.4Confident80.8Confident136 Ų13696.4 Ų96.464%0.63647%0.468SS*.Hα-helixtrans-62.4-38.9179.4-67.5-171.4-179.300112.3S285 E286 K291 D292 T293S285-E289 PolarHBondContact O-N 3.42Å; E286-E289 PolarHBondContact O-N 2.86Å; E289-K291 VanDerWaalsContact C-N 3.26Å; E289-K291 PolarHBondContact O-N 2.88Å; E289-D292 PolarHBondContact O-N 3.07Å; E289-T293 WeakPolarHBondContact O-CG2 3.43Å; E289-T293 PolarHBondContact O-N 3.48Å; E289-T293 PolarHBondContact O-OG1 2.85Å; E289-T293 VanDerWaalsContact O-OG1 3.13Å
290L83.6Confident81.1Confident114 Ų11498 Ų9860%0.59747%0.473SS*.Hα-helixtrans-65.2-22.4171-96.1146.9000114.4E286 I288 T293 H294E286-L290 HydrophobicContact CG-CD1 4.1Å; E286-L290 WeakPolarHBondContact O-CB 3.32Å; E286-L290 PolarHBondContact O-N 3.47Å; I288-L290 VanDerWaalsContact C-N 3.35Å; I288-L290 PolarHBondContact O-N 3.47Å; L290-T293 WeakPolarHBondContact CA-OG1 3.15Å; L290-T293 PolarHBondContact O-OG1 3.05Å; L290-H294 VanDerWaalsContact O-CB 3.25Å; L290-H294 WeakPolarHBondContact O-CB 3.48Å; L290-H294 PolarHBondContact O-N 3.45Å
291K84Confident81.5Confident111 Ų11198.7 Ų98.748%0.48348%0.484SS..Hα-helixtrans-81.5-41170.5-72.3178.8-159.177.90110.8S287 I288 E289 H294 E295S287-K291 VanDerWaalsContact O-CG 3.31Å; S287-K291 WeakPolarHBondContact O-CG 3.06Å; S287-K291 PolarHBondContact O-NZ 3.15Å; S287-K291 PolarHBondContact OG-NZ 3.12Å; I288-K291 WeakPolarHBondContact O-CA 3.44Å; I288-K291 WeakPolarHBondContact O-CB 3.42Å; I288-K291 PolarHBondContact O-N 3.27Å; E289-K291 VanDerWaalsContact C-N 3.26Å; E289-K291 PolarHBondContact O-N 2.88Å; K291-H294 PolarHBondContact O-N 3.21Å; K291-E295 WeakPolarHBondContact O-CB 3.39Å; K291-E295 PolarHBondContact O-N 3Å
292D82.8Confident82Confident107 Ų107102.5 Ų102.557%0.57249%0.493SS*.Hα-helixtrans-67.4-36.7178.8-79.315.4000111.8I288 E289 F296I288-D292 PolarHBondContact O-N 3.38Å; E289-D292 PolarHBondContact O-N 3.07Å; D292-F296 WeakPolarHBondContact O-CB 3.37Å; D292-F296 PolarHBondContact O-N 3.3Å
293T81.1Confident82Confident73 Ų73102 Ų10245%0.44850%0.497SS..Hα-helixtrans-69.6-43.817255.30000112.1E289 L290 E295 F296 E297E289-T293 WeakPolarHBondContact O-CG2 3.43Å; E289-T293 PolarHBondContact O-N 3.48Å; E289-T293 PolarHBondContact O-OG1 2.85Å; E289-T293 VanDerWaalsContact O-OG1 3.13Å; L290-T293 WeakPolarHBondContact CA-OG1 3.15Å; L290-T293 PolarHBondContact O-OG1 3.05Å; T293-E295 PolarHBondContact O-N 3.37Å; T293-F296 CarbonylContact O-C 3.54Å; T293-F296 WeakPolarHBondContact O-CA 3.3Å; T293-F296 WeakPolarHBondContact O-CB 3.41Å; T293-F296 PolarHBondContact O-N 3.32Å; T293-F296 VanDerWaalsContact O-N 3.09Å; T293-E297 PolarHBondContact O-N 2.99Å
294H84Confident82Confident106 Ų106102.2 Ų102.249%0.49150%0.503SS..Hα-helixtrans-65.7-34.7175.8178.7-99000112.5L290 K291 L298L290-H294 VanDerWaalsContact O-CB 3.25Å; L290-H294 WeakPolarHBondContact O-CB 3.48Å; L290-H294 PolarHBondContact O-N 3.45Å; K291-H294 PolarHBondContact O-N 3.21Å; H294-L298 VanDerWaalsContact CE1-CD1 3.45Å; H294-L298 WeakPolarHBondContact CE1-CD1 3.46Å; H294-L298 WeakPolarHBondContact O-CB 3.44Å; H294-L298 VanDerWaalsContact O-CG 3.29Å; H294-L298 WeakPolarHBondContact O-CG 3.43Å; H294-L298 PolarHBondContact O-N 3.47Å
295E84.2Confident82Confident140 Ų14099.1 Ų99.165%0.65450%0.499SS*.Hα-helixtrans-69.2-33.2169.3-77.2-160.1-17200112.5K291 T293 H299K291-E295 WeakPolarHBondContact O-CB 3.39Å; K291-E295 PolarHBondContact O-N 3Å; T293-E295 PolarHBondContact O-N 3.37Å; E295-H299 WeakPolarHBondContact O-CB 3.29Å; E295-H299 PolarHBondContact O-N 3.05Å
296F83.2Confident82Confident135 Ų135102.9 Ų102.959%0.59251%0.51SS*.Hα-helixtrans-65.5-48.2172.4-178.3-87.3000111.9D292 T293 L298 H299 E300D292-F296 WeakPolarHBondContact O-CB 3.37Å; D292-F296 PolarHBondContact O-N 3.3Å; T293-F296 CarbonylContact O-C 3.54Å; T293-F296 WeakPolarHBondContact O-CA 3.3Å; T293-F296 WeakPolarHBondContact O-CB 3.41Å; T293-F296 PolarHBondContact O-N 3.32Å; T293-F296 VanDerWaalsContact O-N 3.09Å; F296-L298 PolarHBondContact O-N 3.19Å; F296-H299 CarbonylContact O-C 3.57Å; F296-H299 WeakPolarHBondContact O-CA 3.46Å; F296-H299 WeakPolarHBondContact O-CB 3.37Å; F296-H299 PolarHBondContact O-N 2.99Å; F296-E300 PolarHBondContact O-N 3.48Å
297E85.9Confident81.3Confident115 Ų115106.7 Ų106.754%0.53753%0.533SS..Hα-helixtrans-60-44.7175.3-72.1-179.1178.500111.7T293 H299 E300 L301T293-E297 PolarHBondContact O-N 2.99Å; E297-H299 PolarHBondContact O-N 3.48Å; E297-E300 PolarHBondContact O-N 3.47Å; E297-L301 WeakPolarHBondContact O-CB 3.41Å; E297-L301 WeakPolarHBondContact O-CG 3.37Å; E297-L301 PolarHBondContact O-N 3.41Å
298L84.5Confident80.7Confident79 Ų79108.6 Ų108.641%0.41455%0.546SS..Hα-helixtrans-65.1-26.3174.4-75.2177000113.2H294 F296 R302H294-L298 VanDerWaalsContact CE1-CD1 3.45Å; H294-L298 WeakPolarHBondContact CE1-CD1 3.46Å; H294-L298 WeakPolarHBondContact O-CB 3.44Å; H294-L298 VanDerWaalsContact O-CG 3.29Å; H294-L298 WeakPolarHBondContact O-CG 3.43Å; H294-L298 PolarHBondContact O-N 3.47Å; F296-L298 PolarHBondContact O-N 3.19Å; L298-R302 WeakPolarHBondContact O-CB 3.41Å; L298-R302 PolarHBondContact O-N 3.19Å
299H83.1Confident79.6Confident103 Ų103110.8 Ų110.848%0.47756%0.559SS.*Hα-helixtrans-75.6-43.1171.2-172.2-53.4000111.2E295 F296 E297 R302 T303E295-H299 WeakPolarHBondContact O-CB 3.29Å; E295-H299 PolarHBondContact O-N 3.05Å; F296-H299 CarbonylContact O-C 3.57Å; F296-H299 WeakPolarHBondContact O-CA 3.46Å; F296-H299 WeakPolarHBondContact O-CB 3.37Å; F296-H299 PolarHBondContact O-N 2.99Å; E297-H299 PolarHBondContact O-N 3.48Å; H299-R302 WeakPolarHBondContact O-CB 3.46Å; H299-R302 PolarHBondContact O-N 2.89Å; H299-T303 PolarHBondContact O-N 3.12Å; H299-T303 PolarHBondContact O-OG1 3.45Å
300E81.9Confident78.5Confident93 Ų93113 Ų11344%0.43557%0.569SS.*Hα-helixtrans-63.9-46.5178.7-176.7160.4-159.700111.3F296 E297 R302 T303 M304F296-E300 PolarHBondContact O-N 3.48Å; E297-E300 PolarHBondContact O-N 3.47Å; E300-R302 PolarHBondContact O-N 3.34Å; E300-T303 WeakPolarHBondContact CA-OG1 3.3Å; E300-T303 PolarHBondContact O-N 3.36Å; E300-T303 VanDerWaalsContact O-N 3.12Å; E300-T303 PolarHBondContact O-OG1 2.92Å; E300-M304 HydrophobicContact CG-CE 4.34Å; E300-M304 WeakPolarHBondContact O-CG 3.25Å; E300-M304 PolarHBondContact O-N 3.36Å
301L82.8Confident76.9Confident115 Ų115113.2 Ų113.260%0.60258%0.58SS**Hα-helixtrans-58.1-35.3172.7-71.5172.1000112.5E297 A305E297-L301 WeakPolarHBondContact O-CB 3.41Å; E297-L301 WeakPolarHBondContact O-CG 3.37Å; E297-L301 PolarHBondContact O-N 3.41Å; L301-A305 WeakPolarHBondContact O-CB 3.36Å; L301-A305 PolarHBondContact O-N 3.46Å; L301-A305 VanDerWaalsContact O-N 3.11Å
302R84.9Confident75.3Confident153 Ų153115.5 Ų115.558%0.57760%0.604SS**Hα-helixtrans-68.5-42.7174.9-169175.4-57.5157.110.5111.9L298 H299 E300 A305 E306L298-R302 WeakPolarHBondContact O-CB 3.41Å; L298-R302 PolarHBondContact O-N 3.19Å; H299-R302 WeakPolarHBondContact O-CB 3.46Å; H299-R302 PolarHBondContact O-N 2.89Å; E300-R302 PolarHBondContact O-N 3.34Å; R302-A305 PolarHBondContact O-N 2.93Å; R302-E306 PolarHBondContact O-N 3.36Å; R302-E306 VanDerWaalsContact O-N 3.09Å
303T79.5Confident73.7Confident58 Ų58113.5 Ų113.536%0.35661%0.609SS.*Hα-helixtrans-64.8-39.8175.539.70000112.6H299 E300 A305 E306 D307H299-T303 PolarHBondContact O-N 3.12Å; H299-T303 PolarHBondContact O-OG1 3.45Å; E300-T303 WeakPolarHBondContact CA-OG1 3.3Å; E300-T303 PolarHBondContact O-N 3.36Å; E300-T303 VanDerWaalsContact O-N 3.12Å; E300-T303 PolarHBondContact O-OG1 2.92Å; T303-A305 VanDerWaalsContact C-N 3.28Å; T303-A305 PolarHBondContact O-N 3Å; T303-E306 PolarHBondContact O-N 2.86Å; T303-D307 PolarHBondContact O-N 3.26Å; T303-D307 VanDerWaalsContact O-N 3.14Å
304M77.7Confident72Confident114 Ų114116.1 Ų116.156%0.56263%0.625SS**Hα-helixtrans-60.9-36173.8-67-75.3179.400112.3E300 S308E300-M304 HydrophobicContact CG-CE 4.34Å; E300-M304 WeakPolarHBondContact O-CG 3.25Å; E300-M304 PolarHBondContact O-N 3.36Å; M304-S308 PolarHBondContact O-OG 3.44Å
305A78.9Confident70.2Confident57 Ų57117.5 Ų117.547%0.47164%0.641SS.*Hα-helixtrans-74.1-30.8177.800000113.8L301 R302 T303L301-A305 WeakPolarHBondContact O-CB 3.36Å; L301-A305 PolarHBondContact O-N 3.46Å; L301-A305 VanDerWaalsContact O-N 3.11Å; R302-A305 PolarHBondContact O-N 2.93Å; T303-A305 VanDerWaalsContact C-N 3.28Å; T303-A305 PolarHBondContact O-N 3Å
306E76.9Confident68.3Low134 Ų134115.3 Ų115.363%0.62665%0.647SS**Hα-helixtrans-76.2-45.3178.7-73.9177.5-164.500111.8R302 T303 S308 N309R302-E306 PolarHBondContact O-N 3.36Å; R302-E306 VanDerWaalsContact O-N 3.09Å; T303-E306 PolarHBondContact O-N 2.86Å; E306-S308 PolarHBondContact O-N 3.48Å; E306-S308 VanDerWaalsContact O-N 3.1Å; E306-N309 PolarHBondContact O-N 2.81Å
307D66Low66.4Low148 Ų148114.3 Ų114.379%0.79166%0.656SS**Hα-helixtrans-64.5-15177.7-81.9-14.8000113.6T303 N309T303-D307 PolarHBondContact O-N 3.26Å; T303-D307 VanDerWaalsContact O-N 3.14Å; D307-N309 PolarHBondContact O-N 2.86Å
308S64.6Low64.4Low96 Ų96114 Ų11467%0.67167%0.667SS**THydrogen-bonded Turntrans-77.6-10.4-177.9-68.10000115.4M304 E306M304-S308 PolarHBondContact O-OG 3.44Å; E306-S308 PolarHBondContact O-N 3.48Å; E306-S308 VanDerWaalsContact O-N 3.1Å
309N61.3Low62.2Low140 Ų140113.8 Ų113.875%0.74968%0.684SS**SBendtrans-111.4-11.8-167.3-86-65.3000117.2E306 D307E306-N309 PolarHBondContact O-N 2.81Å; D307-N309 PolarHBondContact O-N 2.86Å
310E57.4Low60.3Low181 Ų181113.3 Ų113.385%0.84670%0.698SS**SBendtrans-117.392.2-179-71.4-157.1132.600113.6
311S50.9Low58.6Low119 Ų119118.3 Ų118.383%0.83272%0.718SS**  trans162.163.1138.351.30000116.1
312T49.9Very low57.1Low159 Ų159118 Ų11898%0.97572%0.723SS**  trans-120.280.8164.740.50000113.8
313G49.5Very low55.1Low66 Ų66116.5 Ų116.568%0.6874%0.736SS**  trans-172.9145.2168.100000109.7
314T45.8Very low53.2Low128 Ų128117.2 Ų117.279%0.78576%0.755SS**  cis-154.9153.41744.70000111.9
315T45.8Very low51.6Low134 Ų134119.8 Ų119.882%0.82277%0.769SS**  trans41.4128.5148.655.90000120.5
316A44.5Very low49.8Very low95 Ų95122.4 Ų122.479%0.78578%0.782SS**  cis-159.1-1537.200000109.1
317S43Very low48.3Very low113 Ų113125.5 Ų125.579%0.7979%0.793SS**  cis-164.2-159.114.1-155.90000113.5
318S43.4Very low47.2Very low110 Ų110130 Ų13077%0.76980%0.799SS**  trans-52.9140.1177.651.90000116.9
319G39.4Very low45.7Very low74 Ų74135.4 Ų135.476%0.76381%0.81SS**  cis101.1151.63.100000114.5
320A42.7Very low44.7Very low93 Ų93133.7 Ų133.777%0.76982%0.815SS**  cis-176-175.2-4.600000111.1
321K45.4Very low43.8Very low198 Ų198129.5 Ų129.586%0.86181%0.811SS**  trans83.7161.4160-65.2-178.9176.81780119.8
322P50.9Low43.1Very low107 Ų107131.1 Ų131.170%0.69581%0.811SS**  cis-148.7178.2-43.343.2-26.2000117.7
323S43.2Very low42.6Very low122 Ų122131.3 Ų131.385%0.85381%0.805SS**  trans97.1141.3135.677.60000123.8
324G39.5Very low42Very low73 Ų73135.8 Ų135.875%0.75381%0.806SS**  trans97.3143.3169.400000115.3
325I44.4Very low41.6Very low168 Ų168135.6 Ų135.686%0.86280%0.8SS**  cis-147.2152.3-5-87.5174.8000107.7
326P41.6Very low41.1Very low113 Ų113136.3 Ų136.373%0.73480%0.799SS**  trans-113.5167.7-15541-34.2000117.4
327K44.9Very low40.8Very low198 Ų198143 Ų14386%0.86180%0.804SS**  trans-161.1136.7154-110.8154.8-171.7173.70115.9
328R42.2Very low40.5Very low244 Ų244146.5 Ų146.592%0.92181%0.808SS**  trans60.6106.3156.8-67.5-175.9172.5176.1-3.4120.9
329K34.8Very low40.3Very low209 Ų209145 Ų14591%0.90980%0.802SS**  trans-85.1147.4148.9-63.1177.4174-175.80110.5
330A39.7Very low40.3Very low103 Ų103147.8 Ų147.885%0.85180%0.804SS**  trans167.5147.7145.600000108.2
331A38Very low40.4Very low93 Ų93149.9 Ų149.977%0.76981%0.808SS**  cis-160.7168.4-21.600000107.5
332N35.8Very low40.5Very low153 Ų153145.8 Ų145.882%0.81880%0.802SS**  trans-72.3135.6175.1-64.77.9000111.3
333L40.1Very low40.1Very low163 Ų163146.6 Ų146.685%0.85381%0.807SS**  trans-145129.5152.6-128.569.4000104.3
334F37.9Very low40Very low161 Ų161152.4 Ų152.471%0.70681%0.81SS**  53126.154.2-76.8-101.3000112.4
335D35.9Very low40.4Very low124 Ų124158 Ų15866%0.66381%0.813SS**  cis-162.2-165.3-18.2-112.71.4000106
336D35.9Very low40.1Very low148 Ų148157.4 Ų157.479%0.79181%0.812SS**  trans55.191.8164-65.1-22.3000118.9
337W37.5Very low40.1Very low237 Ų237158.1 Ų158.190%0.89881%0.814SS**  -148.464.7129.7-155.2-83.1000112.1A339W337-A339 PolarHBondContact NE1-O 2.73Å
338E38Very low39.9Very low185 Ų185154.4 Ų154.486%0.86481%0.813SS**  trans-72.2164.1152.1-73.8-163.1143.700110.3
339A39Very low39.8Very low78 Ų78148 Ų14865%0.64580%0.801SS**  trans81.4139.3177.100000118.9W337W337-A339 PolarHBondContact NE1-O 2.73Å
340T39.2Very low39.8Very low133 Ų133146 Ų14682%0.81680%0.797SS**  trans80.656.2162.7-23.80000118.5
341T43.8Very low40.1Very low137 Ų137147.6 Ų147.684%0.8480%0.796SS**  trans-107.8131.6145.643.90000110.2
342P47.8Very low40.4Very low113 Ų113150.8 Ų150.873%0.73480%0.795SS**PPolyproline II helixtrans-74.7160.5-176.531.7-36.2000112.5R344P342-R344 PolarHBondContact O-N 2.98Å
343P43Very low40.9Very low123 Ų123151.1 Ų151.180%0.79979%0.792SS**PPolyproline II helixtrans-64.8128.5-179.326.6-34.7000111.6K345P343-K345 PolarHBondContact O-N 3.25Å
344R41.5Very low41.3Very low245 Ų245148.4 Ų148.493%0.92577%0.77SS**PPolyproline II helixtrans-66.5124.7158.5-74.9-176.7168.9-163.3-5.5107.4P342P342-R344 PolarHBondContact O-N 2.98Å
345K47.2Very low41.9Very low189 Ų189148.4 Ų148.482%0.82277%0.772SS**PPolyproline II helixtrans-75148.1168.6-74.3-173173-172.80109.7P343P343-K345 PolarHBondContact O-N 3.25Å
346D37.4Very low43Very low157 Ų157144 Ų14484%0.8475%0.75SS**PPolyproline II helixtrans-60.9135173.5-51.2-78.6000111.2
347V42Very low44.7Very low127 Ų127138.7 Ų138.777%0.7773%0.725SS**  trans-114.775.9171175.30000106.1V349V347-V349 HydrophobicContact CG1-CG2 3.81Å; V347-V349 PolarHBondContact O-N 2.96Å
348S40.8Very low46.5Very low120 Ų120129.6 Ų129.684%0.83969%0.694SS**  trans-73.890176.9-177.10000109.1
349V40.6Very low48.4Very low111 Ų111123.7 Ų123.767%0.67367%0.668SS**  trans-84.3131.9178.5169.20000110.5V347 T351V347-V349 HydrophobicContact CG1-CG2 3.81Å; V347-V349 PolarHBondContact O-N 2.96Å; V349-T351 PolarHBondContact O-N 3.29Å; V349-T351 VanDerWaalsContact O-N 3.08Å
350M34.9Very low50.4Low167 Ų167120.4 Ų120.482%0.82364%0.639SS**  trans-2299.2171.4-54.3-54.6-160.700115.2
351T46.4Very low52.4Low135 Ų135117.3 Ų117.383%0.82862%0.615SS**  trans-94.2100.9146.438.40000105.9V349 E353V349-T351 PolarHBondContact O-N 3.29Å; V349-T351 VanDerWaalsContact O-N 3.08Å; T351-E353 PolarHBondContact O-N 2.85Å
352E44.6Very low54.6Low160 Ų160112.1 Ų112.175%0.74858%0.582SS**PPolyproline II helixtrans-64.3127.7175.9-69.3-178.3133.300109.3W354E352-W354 PolarHBondContact O-N 2.99Å
353E45.8Very low56.5Low161 Ų161111.9 Ų111.975%0.75257%0.57SS**PPolyproline II helixtrans-60.3126.2174-66.6-179.8117.600108.7Y283 T351 E355Y283-E353 PolarHBondContact OH-OE1 2.86Å; T351-E353 PolarHBondContact O-N 2.85Å; E353-E355 PolarHBondContact O-N 3.2Å
354W47.5Very low58.7Low105 Ų105107.1 Ų107.140%0.39854%0.541SS..PPolyproline II helixtrans-58.5131.6171.4-65.680.2000108.6E352 P356 I454 R457E352-W354 PolarHBondContact O-N 2.99Å; W354-P356 WeakPolarHBondContact O-CD 3.31Å; W354-P356 VanDerWaalsContact O-N 3.13Å; W354-I454 HydrophobicContact CZ3-CG1 4.43Å; W354-R457 VanDerWaalsContact CE2-CZ 3.4Å; W354-R457 VanDerWaalsContact CZ2-CD 3.4Å
355E52.2Low60.9Low161 Ų16197.2 Ų97.275%0.75250%0.503SS*.  trans-64.9110.2162.5-71.3-163.6146.200108.5E353 S357E353-E355 PolarHBondContact O-N 3.2Å; E355-S357 PolarHBondContact O-N 2.92Å
356P58.2Low63Low31 Ų3193.7 Ų93.720%0.20149%0.49CS..THydrogen-bonded Turntrans-71.4-19.8-178.3-13.331.2000111L279 W354 L358 I359 E360L279-P356 HydrophobicContact CD1-CG 3.84Å; W354-P356 WeakPolarHBondContact O-CD 3.31Å; W354-P356 VanDerWaalsContact O-N 3.13Å; P356-L358 PolarHBondContact O-N 2.8Å; P356-I359 WeakPolarHBondContact O-CA 3.24Å; P356-I359 WeakPolarHBondContact O-CB 3.49Å; P356-I359 PolarHBondContact O-N 2.65Å; P356-E360 HydrophobicContact CB-CG 4.01Å; P356-E360 WeakPolarHBondContact CB-OE1 3.4Å; P356-E360 WeakPolarHBondContact O-CG 3.49Å; P356-E360 PolarHBondContact O-N 3.43Å
357S71.3Confident65.6Low37 Ų3789.4 Ų89.426%0.25947%0.472SS..Hα-helixtrans-26.4-50.2178-165.40000115.2E355 E360 E361E355-S357 PolarHBondContact O-N 2.92Å; S357-E360 PolarHBondContact O-N 3.12Å; S357-E361 VanDerWaalsContact O-CB 3.23Å; S357-E361 WeakPolarHBondContact O-CB 3.48Å; S357-E361 PolarHBondContact O-N 2.95Å
358L75.5Confident67.9Low47 Ų4786.4 Ų86.425%0.24645%0.45CS..Hα-helixtrans-72.6-35.2-177.3-67.8168.2000113.6P356 E360 L362 L446 L450P356-L358 PolarHBondContact O-N 2.8Å; L358-E360 VanDerWaalsContact C-N 3.32Å; L358-L362 WeakPolarHBondContact O-CB 3.25Å; L358-L362 PolarHBondContact O-N 2.96Å; L358-L362 VanDerWaalsContact O-N 3.1Å; L358-L446 HydrophobicContact CD2-CD2 3.78Å; L358-L450 HydrophobicContact CB-CD1 3.89Å
359I78Confident70.3Confident61 Ų6180.9 Ų80.931%0.31341%0.411SS..Hα-helixtrans-71.5-34.2171.8-56.3-177.5000109.9P356 K363 L450P356-I359 WeakPolarHBondContact O-CA 3.24Å; P356-I359 WeakPolarHBondContact O-CB 3.49Å; P356-I359 PolarHBondContact O-N 2.65Å; I359-K363 HydrophobicContact CG2-CD 4.26Å; I359-K363 WeakPolarHBondContact O-CB 3.42Å; I359-K363 VanDerWaalsContact O-CG 3.25Å; I359-K363 WeakPolarHBondContact O-CG 3.29Å; I359-K363 PolarHBondContact O-N 3.26Å; I359-L450 HydrophobicContact CD1-CD1 4.33Å; I359-L450 HydrophobicContact CD1-CD2 4.44Å; I359-L450 HydrophobicContact CG1-CD1 3.54Å; I359-L450 HydrophobicContact CG1-CD2 3.82Å; I359-L450 HydrophobicContact CG1-CG 4.32Å
360E81.4Confident72.8Confident9 Ų978.7 Ų78.74%0.04240%0.398CS..Hα-helixtrans-72.3-45.9-178.7-66.7-173.6160.600112.7Q275 Q278 L279 P356 S357 L358 K363 A364Q275-E360 WeakPolarHBondContact CA-OE2 3.4Å; Q275-E360 WeakPolarHBondContact CG-OE2 3.23Å; Q278-E360 HydrophobicContact CB-CB 4.38Å; Q278-E360 VanDerWaalsContact CB-CD 3.42Å; Q278-E360 HydrophobicContact CB-CG 3.56Å; Q278-E360 WeakPolarHBondContact CB-OE1 3.15Å; Q278-E360 HydrophobicContact CG-CG 4.27Å; Q278-E360 PolarHBondContact NE2-O 2.62Å; L279-E360 PolarHBondContact N-OE1 3.39Å; P356-E360 HydrophobicContact CB-CG 4.01Å; P356-E360 WeakPolarHBondContact CB-OE1 3.4Å; P356-E360 WeakPolarHBondContact O-CG 3.49Å; P356-E360 PolarHBondContact O-N 3.43Å; S357-E360 PolarHBondContact O-N 3.12Å; L358-E360 VanDerWaalsContact C-N 3.32Å; E360-K363 PolarHBondContact O-N 3.36Å; E360-A364 WeakPolarHBondContact O-CB 3.28Å; E360-A364 PolarHBondContact O-N 3.41Å
361E81.1Confident75.6Confident68 Ų6876.2 Ų76.232%0.31838%0.383SS..Hα-helixtrans-67.5-37.4174.8-164.5-177-172.900110.6S357 A364 Y365 L446S357-E361 VanDerWaalsContact O-CB 3.23Å; S357-E361 WeakPolarHBondContact O-CB 3.48Å; S357-E361 PolarHBondContact O-N 2.95Å; E361-A364 PolarHBondContact O-N 3.09Å; E361-Y365 HydrophobicContact CG-CD1 4.35Å; E361-Y365 HydrophobicContact CG-CD2 4.29Å; E361-Y365 HydrophobicContact CG-CE1 3.88Å; E361-Y365 HydrophobicContact CG-CE2 3.79Å; E361-Y365 WeakPolarHBondContact O-CB 3.47Å; E361-Y365 VanDerWaalsContact O-CG 3.28Å; E361-Y365 PolarHBondContact O-N 3.04Å; E361-Y365 PolarHBondContact OE1-OH 3.17Å; E361-L446 HydrophobicContact CB-CD1 3.68Å; E361-L446 HydrophobicContact CG-CD1 3.62Å
362L88.9Confident77.9Confident27 Ų2770 Ų7014%0.14135%0.345CS..Hα-helixtrans-60-47.4170.117559.9000111.9L358 A364 H366 S443 L446 E447 L450L358-L362 WeakPolarHBondContact O-CB 3.25Å; L358-L362 PolarHBondContact O-N 2.96Å; L358-L362 VanDerWaalsContact O-N 3.1Å; L362-A364 VanDerWaalsContact C-N 3.34Å; L362-H366 VanDerWaalsContact O-CB 3.29Å; L362-H366 WeakPolarHBondContact O-CB 3.36Å; L362-H366 PolarHBondContact O-N 2.81Å; L362-S443 WeakPolarHBondContact CD1-O 3.25Å; L362-S443 WeakPolarHBondContact CD1-OG 3.42Å; L362-L446 HydrophobicContact CB-CB 4.2Å; L362-L446 HydrophobicContact CB-CD1 4.32Å; L362-L446 HydrophobicContact CD1-CB 4.23Å; L362-E447 HydrophobicContact CD1-CB 4.04Å; L362-E447 HydrophobicContact CD2-CB 4.31Å; L362-E447 HydrophobicContact CD2-CG 4.29Å; L362-L450 HydrophobicContact CD2-CD2 4.31Å
363K89Confident80.3Confident109 Ų10966.1 Ų66.147%0.47433%0.326SS..Hα-helixtrans-62.2-40.7174.2-77.1168-178.9171.70111.5I359 E360 H366 S367I359-K363 HydrophobicContact CG2-CD 4.26Å; I359-K363 WeakPolarHBondContact O-CB 3.42Å; I359-K363 VanDerWaalsContact O-CG 3.25Å; I359-K363 WeakPolarHBondContact O-CG 3.29Å; I359-K363 PolarHBondContact O-N 3.26Å; E360-K363 PolarHBondContact O-N 3.36Å; K363-H366 PolarHBondContact O-N 3.11Å; K363-S367 WeakPolarHBondContact O-CB 3.32Å; K363-S367 PolarHBondContact O-N 3.08Å; K363-S367 PolarHBondContact O-OG 3.41Å
364A88.5Confident82.6Confident23 Ų2362.4 Ų62.419%0.1931%0.311CS..Hα-helixtrans-64.6-52.317900000111.3E360 E361 L362 H366 S367 E368E360-A364 WeakPolarHBondContact O-CB 3.28Å; E360-A364 PolarHBondContact O-N 3.41Å; E361-A364 PolarHBondContact O-N 3.09Å; L362-A364 VanDerWaalsContact C-N 3.34Å; A364-H366 VanDerWaalsContact C-N 3.31Å; A364-H366 PolarHBondContact O-N 2.86Å; A364-S367 PolarHBondContact O-N 3.41Å; A364-S367 PolarHBondContact O-OG 3.13Å; A364-E368 PolarHBondContact O-N 3.29Å
365Y88.7Confident84.9Confident36 Ų3661.8 Ų61.814%0.14131%0.31CS..Hα-helixtrans-58.2-41.9175.7-68.1-9.9000111.6E361 S367 E368 C369 W439 K442 L446E361-Y365 HydrophobicContact CG-CD1 4.35Å; E361-Y365 HydrophobicContact CG-CD2 4.29Å; E361-Y365 HydrophobicContact CG-CE1 3.88Å; E361-Y365 HydrophobicContact CG-CE2 3.79Å; E361-Y365 WeakPolarHBondContact O-CB 3.47Å; E361-Y365 VanDerWaalsContact O-CG 3.28Å; E361-Y365 PolarHBondContact O-N 3.04Å; E361-Y365 PolarHBondContact OE1-OH 3.17Å; Y365-S367 PolarHBondContact O-N 3.15Å; Y365-E368 PolarHBondContact O-N 2.92Å; Y365-C369 PolarHBondContact O-N 3.31Å; Y365-C369 PolarHBondContact O-SG 2.99Å; Y365-W439 AromaticContact CD1-CE3 3.49Å; Y365-W439 HydrophobicContact CD1-CE3 3.49Å; Y365-W439 VanDerWaalsContact CD1-CE3 3.49Å; Y365-W439 AromaticContact CD1-CZ3 3.45Å; Y365-W439 HydrophobicContact CD1-CZ3 3.45Å; Y365-W439 VanDerWaalsContact CD1-CZ3 3.45Å; Y365-W439 AromaticContact CE1-CE3 3.91Å; Y365-W439 HydrophobicContact CE1-CE3 3.91Å; Y365-W439 AromaticContact CE1-CZ3 3.5Å; Y365-W439 HydrophobicContact CE1-CZ3 3.5Å; Y365-W439 VanDerWaalsContact CE1-CZ3 3.5Å; Y365-W439 HydrophobicContact CG-CE3 4.17Å; Y365-K442 HydrophobicContact CD2-CB 3.56Å; Y365-K442 HydrophobicContact CE2-CB 3.61Å; Y365-K442 HydrophobicContact CE2-CD 4.11Å; Y365-K442 HydrophobicContact CE2-CG 4.4Å; Y365-K442 HydrophobicContact CG-CB 4.33Å; Y365-L446 HydrophobicContact CD2-CD1 3.5Å; Y365-L446 HydrophobicContact CD2-CG 4.26Å; Y365-L446 HydrophobicContact CE2-CD1 3.51Å; Y365-L446 HydrophobicContact CE2-CG 4.17Å
366H90.8Very high86.9Confident115 Ų11554.7 Ų54.753%0.53228%0.277SS..Hα-helixtrans-64.6-37.6174.3-164.389000112.7L362 K363 A364 C369 V370L362-H366 VanDerWaalsContact O-CB 3.29Å; L362-H366 WeakPolarHBondContact O-CB 3.36Å; L362-H366 PolarHBondContact O-N 2.81Å; K363-H366 PolarHBondContact O-N 3.11Å; A364-H366 VanDerWaalsContact C-N 3.31Å; A364-H366 PolarHBondContact O-N 2.86Å; H366-C369 WeakPolarHBondContact O-CB 3.43Å; H366-V370 WeakPolarHBondContact O-CG2 3.45Å; H366-V370 PolarHBondContact O-N 3.37Å; H366-V370 VanDerWaalsContact O-N 3.15Å
367S90.8Very high88.7Confident68 Ų6857.3 Ų57.348%0.47629%0.288SS..Hα-helixtrans-68.9-38.9176.774.10000112.7K363 A364 Y365 V370 F371K363-S367 WeakPolarHBondContact O-CB 3.32Å; K363-S367 PolarHBondContact O-N 3.08Å; K363-S367 PolarHBondContact O-OG 3.41Å; A364-S367 PolarHBondContact O-N 3.41Å; A364-S367 PolarHBondContact O-OG 3.13Å; Y365-S367 PolarHBondContact O-N 3.15Å; S367-V370 PolarHBondContact O-N 2.99Å; S367-F371 PolarHBondContact O-N 3.12Å
368E91.9Very high89.8Confident63 Ų6358.8 Ų58.829%0.29429%0.291SS..Hα-helixtrans-69.2-38.2176.8-159.361.3-149.500111A364 Y365 V370 F371 L372 W439A364-E368 PolarHBondContact O-N 3.29Å; Y365-E368 PolarHBondContact O-N 2.92Å; E368-V370 VanDerWaalsContact C-N 3.29Å; E368-V370 PolarHBondContact O-N 2.86Å; E368-F371 PolarHBondContact O-N 2.78Å; E368-L372 HydrophobicContact CG-CD1 4.06Å; E368-L372 HydrophobicContact CG-CG 4.41Å; E368-L372 WeakPolarHBondContact O-CB 3.48Å; E368-L372 WeakPolarHBondContact O-CG 3.41Å; E368-L372 PolarHBondContact O-N 2.67Å; E368-W439 HydrophobicContact CB-CD2 4.15Å; E368-W439 HydrophobicContact CB-CE3 4.27Å; E368-W439 HydrophobicContact CB-CG 4.43Å; E368-W439 HydrophobicContact CG-CD2 3.92Å; E368-W439 HydrophobicContact CG-CE3 4.34Å; E368-W439 HydrophobicContact CG-CG 4.3Å; E368-W439 HydrophobicContact CG-CH2 4.42Å; E368-W439 HydrophobicContact CG-CZ2 4.02Å
369C90.4Very high90.7Very high5 Ų556.9 Ų56.93%0.03428%0.281CS..Hα-helixtrans-53.6-46.2168.4-69.20000112.2Y365 H366 Q373 W439 R440Y365-C369 PolarHBondContact O-N 3.31Å; Y365-C369 PolarHBondContact O-SG 2.99Å; H366-C369 WeakPolarHBondContact O-CB 3.43Å; C369-Q373 WeakPolarHBondContact O-CB 3.35Å; C369-Q373 PolarHBondContact O-N 2.98Å; C369-W439 WeakPolarHBondContact SG-CB 3.28Å; C369-R440 HydrophobicContact CB-CG 4.17Å; C369-R440 VanDerWaalsContact SG-CA 3.54Å; C369-R440 VanDerWaalsContact SG-CG 3.51Å; C369-R440 PolarHBondContact SG-N 3.37Å
370V92.4Very high91.5Very high65 Ų6557.9 Ų57.939%0.39428%0.284SS..Hα-helixtrans-71.9-38.7-178.8170.50000110.9H366 S367 E368 N374H366-V370 WeakPolarHBondContact O-CG2 3.45Å; H366-V370 PolarHBondContact O-N 3.37Å; H366-V370 VanDerWaalsContact O-N 3.15Å; S367-V370 PolarHBondContact O-N 2.99Å; E368-V370 VanDerWaalsContact C-N 3.29Å; E368-V370 PolarHBondContact O-N 2.86Å; V370-N374 WeakPolarHBondContact O-CB 3.47Å; V370-N374 PolarHBondContact O-N 3.44Å; V370-N374 PolarHBondContact O-ND2 3Å
371F94.7Very high92.1Very high115 Ų11564.1 Ų64.150%0.50431%0.307SS..Hα-helixtrans-61.7-55175.1175.6-106.8000111.6S367 E368 Q373 N374 Y375S367-F371 PolarHBondContact O-N 3.12Å; E368-F371 PolarHBondContact O-N 2.78Å; F371-Q373 VanDerWaalsContact C-N 3.34Å; F371-Q373 PolarHBondContact O-N 2.97Å; F371-N374 WeakPolarHBondContact O-CB 3.32Å; F371-N374 PolarHBondContact O-N 3.2Å; F371-N374 VanDerWaalsContact O-N 3.15Å; F371-Y375 PolarHBondContact O-N 3.05Å
372L93.9Very high92.6Very high5 Ų564.8 Ų64.83%0.02631%0.31CS..Hα-helixtrans-64-37.8179.6-65.7170.6000111.8E368 N374 Y375 V376 Y432 E435 C436 W439E368-L372 HydrophobicContact CG-CD1 4.06Å; E368-L372 HydrophobicContact CG-CG 4.41Å; E368-L372 WeakPolarHBondContact O-CB 3.48Å; E368-L372 WeakPolarHBondContact O-CG 3.41Å; E368-L372 PolarHBondContact O-N 2.67Å; L372-N374 VanDerWaalsContact C-N 3.34Å; L372-N374 PolarHBondContact O-N 3.4Å; L372-Y375 PolarHBondContact O-N 2.92Å; L372-V376 WeakPolarHBondContact O-CG2 3.41Å; L372-V376 PolarHBondContact O-N 3.24Å; L372-Y432 HydrophobicContact CD2-CD1 3.86Å; L372-Y432 HydrophobicContact CD2-CE1 4.29Å; L372-E435 HydrophobicContact CD1-CB 4.2Å; L372-E435 HydrophobicContact CD1-CG 3.98Å; L372-C436 WeakPolarHBondContact CB-SG 3.46Å; L372-W439 HydrophobicContact CD1-CG 4.31Å
373Q94.5Very high92.8Very high78 Ų7864.6 Ų64.636%0.36431%0.309SS..Hα-helixtrans-63.7-39.5174.4179.4175.5-14.500111.9C369 F371 M377 C436C369-Q373 WeakPolarHBondContact O-CB 3.35Å; C369-Q373 PolarHBondContact O-N 2.98Å; F371-Q373 VanDerWaalsContact C-N 3.34Å; F371-Q373 PolarHBondContact O-N 2.97Å; Q373-M377 WeakPolarHBondContact O-CG 3.15Å; Q373-M377 PolarHBondContact O-N 3.32Å; Q373-C436 PolarHBondContact N-SG 3.22Å; Q373-C436 VanDerWaalsContact N-SG 3.4Å
374N95.4Very high92.8Very high82 Ų8260.9 Ų60.944%0.43930%0.299SS..Hα-helixtrans-66.6-37.9173.1-72.8-35.8000111.6V370 F371 L372 M377 E378V370-N374 WeakPolarHBondContact O-CB 3.47Å; V370-N374 PolarHBondContact O-N 3.44Å; V370-N374 PolarHBondContact O-ND2 3Å; F371-N374 WeakPolarHBondContact O-CB 3.32Å; F371-N374 PolarHBondContact O-N 3.2Å; F371-N374 VanDerWaalsContact O-N 3.15Å; L372-N374 VanDerWaalsContact C-N 3.34Å; L372-N374 PolarHBondContact O-N 3.4Å; N374-M377 PolarHBondContact O-N 2.98Å; N374-M377 WeakPolarHBondContact OD1-CE 3.18Å; N374-E378 PolarHBondContact O-N 2.9Å
375Y94.9Very high92.8Very high93 Ų9362.8 Ų62.837%0.36531%0.311SS..Hα-helixtrans-67.1-40.7177-158.4-103.4000112.4F371 L372 E378 L379 Y432F371-Y375 PolarHBondContact O-N 3.05Å; L372-Y375 PolarHBondContact O-N 2.92Å; Y375-E378 PolarHBondContact O-N 3.33Å; Y375-L379 HydrophobicContact CD1-CD1 3.83Å; Y375-L379 HydrophobicContact CD1-CG 4.19Å; Y375-L379 HydrophobicContact CE1-CD1 3.71Å; Y375-L379 HydrophobicContact CE1-CD2 4.34Å; Y375-L379 HydrophobicContact CE1-CG 4.02Å; Y375-L379 WeakPolarHBondContact O-CG 3.43Å; Y375-L379 PolarHBondContact O-N 3.06Å; Y375-Y432 AromaticContact CD1-CD2 3.8Å; Y375-Y432 HydrophobicContact CD1-CD2 3.8Å; Y375-Y432 HydrophobicContact CD1-CE1 4.5Å; Y375-Y432 AromaticContact CD1-CE2 3.6Å; Y375-Y432 HydrophobicContact CD1-CE2 3.6Å; Y375-Y432 HydrophobicContact CD1-CG 4.33Å; Y375-Y432 AromaticContact CD1-CZ 3.98Å; Y375-Y432 HydrophobicContact CE1-CD2 4.06Å; Y375-Y432 AromaticContact CE1-CE2 3.41Å; Y375-Y432 HydrophobicContact CE1-CE2 3.41Å; Y375-Y432 VanDerWaalsContact CE1-CE2 3.41Å; Y375-Y432 AromaticContact CE1-CZ 3.76Å
376V95.6Very high92.7Very high12 Ų1265.1 Ų65.17%0.07333%0.326CS..Hα-helixtrans-58-47.3169.7168.70000110.8L372 E378 L379 Q380 Y432 K433L372-V376 WeakPolarHBondContact O-CG2 3.41Å; L372-V376 PolarHBondContact O-N 3.24Å; V376-E378 VanDerWaalsContact C-N 3.28Å; V376-E378 PolarHBondContact O-N 3.4Å; V376-L379 PolarHBondContact O-N 3.2Å; V376-Q380 HydrophobicContact CG1-CG 4.37Å; V376-Q380 VanDerWaalsContact O-CB 3.32Å; V376-Q380 WeakPolarHBondContact O-CB 3.46Å; V376-Q380 VanDerWaalsContact O-CG 3.24Å; V376-Q380 WeakPolarHBondContact O-CG 3.48Å; V376-Q380 PolarHBondContact O-N 3.21Å; V376-Y432 VanDerWaalsContact CG2-CB 3.49Å; V376-K433 HydrophobicContact CG1-CG 4.01Å; V376-K433 HydrophobicContact CG2-CG 4.32Å
377M94.8Very high92.3Very high85 Ų8564.5 Ų64.542%0.41932%0.323SS..Hα-helixtrans-64.7-30.3177-72.6-167.9-5800113.1Q373 N374 R381Q373-M377 WeakPolarHBondContact O-CG 3.15Å; Q373-M377 PolarHBondContact O-N 3.32Å; N374-M377 PolarHBondContact O-N 2.98Å; N374-M377 WeakPolarHBondContact OD1-CE 3.18Å; M377-R381 WeakPolarHBondContact O-CB 3.46Å; M377-R381 PolarHBondContact O-N 3.29Å
378E95.5Very high91.8Very high69 Ų6967.9 Ų67.932%0.32233%0.332SS..Hα-helixtrans-74.7-45.3176.6-161.161.4-132.700111.5N374 Y375 V376 Q380 R381 Q382N374-E378 PolarHBondContact O-N 2.9Å; Y375-E378 PolarHBondContact O-N 3.33Å; V376-E378 VanDerWaalsContact C-N 3.28Å; V376-E378 PolarHBondContact O-N 3.4Å; E378-Q380 VanDerWaalsContact C-N 3.35Å; E378-Q380 PolarHBondContact O-N 3.19Å; E378-R381 WeakPolarHBondContact O-CB 3.45Å; E378-R381 PolarHBondContact O-N 2.86Å; E378-R381 VanDerWaalsContact O-N 3.13Å; E378-R381 IonicContact OE1-CZ 2.97Å; E378-R381 IonicContact OE1-NH1 2.69Å; E378-R381 PolarHBondContact OE1-NH1 3.43Å; E378-R381 IonicContact OE1-NH2 3.54Å; E378-R381 IonicContact OE2-CZ 3.34Å; E378-R381 IonicContact OE2-NH1 2.69Å; E378-R381 PolarHBondContact OE2-NH1 3.48Å; E378-R381 IonicContact OE2-NH2 3.05Å; E378-R381 PolarHBondContact OE2-NH2 3.24Å; E378-Q382 WeakPolarHBondContact O-CG 3.26Å; E378-Q382 PolarHBondContact O-N 2.68Å
379L94.3Very high91.1Very high6 Ų667.3 Ų67.33%0.03134%0.343CS..Hα-helixtrans-61.7-41.5173.2-70.2175.3000111.7Y375 V376 R381 Q382 L383 M425 Q428 I429 Y432Y375-L379 HydrophobicContact CD1-CD1 3.83Å; Y375-L379 HydrophobicContact CD1-CG 4.19Å; Y375-L379 HydrophobicContact CE1-CD1 3.71Å; Y375-L379 HydrophobicContact CE1-CD2 4.34Å; Y375-L379 HydrophobicContact CE1-CG 4.02Å; Y375-L379 WeakPolarHBondContact O-CG 3.43Å; Y375-L379 PolarHBondContact O-N 3.06Å; V376-L379 PolarHBondContact O-N 3.2Å; L379-R381 VanDerWaalsContact C-N 3.3Å; L379-R381 PolarHBondContact O-N 3.02Å; L379-Q382 PolarHBondContact O-N 3.04Å; L379-L383 WeakPolarHBondContact O-CB 3.35Å; L379-L383 PolarHBondContact O-N 2.84Å; L379-M425 HydrophobicContact CB-CE 4.39Å; L379-M425 HydrophobicContact CD2-CE 3.71Å; L379-Q428 HydrophobicContact CD1-CG 4.1Å; L379-I429 HydrophobicContact CB-CD1 3.96Å; L379-I429 HydrophobicContact CB-CG1 3.55Å; L379-I429 HydrophobicContact CD1-CG1 4.07Å; L379-I429 HydrophobicContact CG-CG1 4.47Å; L379-Y432 HydrophobicContact CD1-CD2 3.64Å; L379-Y432 HydrophobicContact CD1-CE2 3.82Å
380Q94.4Very high90Very high83 Ų8371.6 Ų71.639%0.38837%0.372SS..Hα-helixtrans-62.8-35.8173.5-75.2178.4-35.900112.2V376 E378 A384 I429V376-Q380 HydrophobicContact CG1-CG 4.37Å; V376-Q380 VanDerWaalsContact O-CB 3.32Å; V376-Q380 WeakPolarHBondContact O-CB 3.46Å; V376-Q380 VanDerWaalsContact O-CG 3.24Å; V376-Q380 WeakPolarHBondContact O-CG 3.48Å; V376-Q380 PolarHBondContact O-N 3.21Å; E378-Q380 VanDerWaalsContact C-N 3.35Å; E378-Q380 PolarHBondContact O-N 3.19Å; Q380-A384 WeakPolarHBondContact O-CB 3.4Å; Q380-A384 PolarHBondContact O-N 2.84Å; Q380-I429 HydrophobicContact CG-CD1 4.09Å; Q380-I429 HydrophobicContact CG-CG2 4.16Å
381R94.1Very high88.7Confident139 Ų13979 Ų7953%0.52539%0.393SS..Hα-helixtrans-68-40.6173.4-164.6-171.6-50.9132.521.7111.7M377 E378 L379 A384 S385M377-R381 WeakPolarHBondContact O-CB 3.46Å; M377-R381 PolarHBondContact O-N 3.29Å; E378-R381 WeakPolarHBondContact O-CB 3.45Å; E378-R381 PolarHBondContact O-N 2.86Å; E378-R381 VanDerWaalsContact O-N 3.13Å; E378-R381 IonicContact OE1-CZ 2.97Å; E378-R381 IonicContact OE1-NH1 2.69Å; E378-R381 PolarHBondContact OE1-NH1 3.43Å; E378-R381 IonicContact OE1-NH2 3.54Å; E378-R381 IonicContact OE2-CZ 3.34Å; E378-R381 IonicContact OE2-NH1 2.69Å; E378-R381 PolarHBondContact OE2-NH1 3.48Å; E378-R381 IonicContact OE2-NH2 3.05Å; E378-R381 PolarHBondContact OE2-NH2 3.24Å; L379-R381 VanDerWaalsContact C-N 3.3Å; L379-R381 PolarHBondContact O-N 3.02Å; R381-A384 PolarHBondContact O-N 3.07Å; R381-S385 PolarHBondContact O-N 3.26Å; R381-S385 PolarHBondContact O-OG 3.27Å
382Q92.1Very high87Confident83 Ų8378.4 Ų78.439%0.38840%0.399SS..Hα-helixtrans-64.5-43.4176.8-71172.720.100111.6E378 L379 S385 N386 M425E378-Q382 WeakPolarHBondContact O-CG 3.26Å; E378-Q382 PolarHBondContact O-N 2.68Å; L379-Q382 PolarHBondContact O-N 3.04Å; Q382-S385 VanDerWaalsContact CA-OG 3.31Å; Q382-S385 WeakPolarHBondContact CA-OG 3.45Å; Q382-S385 PolarHBondContact O-N 2.84Å; Q382-S385 PolarHBondContact O-OG 3.02Å; Q382-N386 VanDerWaalsContact O-CG 3.26Å; Q382-N386 PolarHBondContact O-N 3.03Å; Q382-M425 HydrophobicContact CB-CE 3.55Å
383L91.7Very high85.3Confident22 Ų2284.8 Ų84.812%0.11543%0.433CS..Hα-helixtrans-56-52.9172.1-16392.1000110.5L379 S385 N386 E387 Y422 M425 E426 I429L379-L383 WeakPolarHBondContact O-CB 3.35Å; L379-L383 PolarHBondContact O-N 2.84Å; L383-S385 VanDerWaalsContact C-N 3.31Å; L383-S385 PolarHBondContact O-N 3.42Å; L383-N386 WeakPolarHBondContact O-CB 3.46Å; L383-N386 PolarHBondContact O-N 3.41Å; L383-N386 VanDerWaalsContact O-N 3.09Å; L383-E387 WeakPolarHBondContact O-CG 3.42Å; L383-E387 PolarHBondContact O-N 2.93Å; L383-Y422 HydrophobicContact CD1-CD1 3.9Å; L383-Y422 HydrophobicContact CG-CD1 4.37Å; L383-M425 HydrophobicContact CB-SD 4.26Å; L383-M425 HydrophobicContact CD1-CB 3.95Å; L383-M425 HydrophobicContact CD1-CG 3.93Å; L383-M425 HydrophobicContact CD1-SD 3.82Å; L383-E426 HydrophobicContact CD1-CG 4.31Å; L383-E426 HydrophobicContact CD2-CG 4.49Å; L383-I429 HydrophobicContact CB-CD1 4.49Å
384A90.5Very high83.3Confident32 Ų3290.8 Ų90.826%0.26446%0.458SS..Hα-helixtrans-64.6-29.117900000113.9Q380 R381 Q388Q380-A384 WeakPolarHBondContact O-CB 3.4Å; Q380-A384 PolarHBondContact O-N 2.84Å; R381-A384 PolarHBondContact O-N 3.07Å; A384-Q388 VanDerWaalsContact O-CG 3.3Å; A384-Q388 WeakPolarHBondContact O-CG 3.14Å; A384-Q388 PolarHBondContact O-N 2.89Å; A384-Q388 VanDerWaalsContact O-N 3.15Å
385S88.1Confident81.2Confident62 Ų6293.2 Ų93.243%0.43448%0.476SS..Hα-helixtrans-74.7-32.5172.256.90000112.6R381 Q382 L383 Q388 G389R381-S385 PolarHBondContact O-N 3.26Å; R381-S385 PolarHBondContact O-OG 3.27Å; Q382-S385 VanDerWaalsContact CA-OG 3.31Å; Q382-S385 WeakPolarHBondContact CA-OG 3.45Å; Q382-S385 PolarHBondContact O-N 2.84Å; Q382-S385 PolarHBondContact O-OG 3.02Å; L383-S385 VanDerWaalsContact C-N 3.31Å; L383-S385 PolarHBondContact O-N 3.42Å; S385-Q388 PolarHBondContact O-N 3.25Å; S385-G389 PolarHBondContact O-N 3.35Å
386N85.4Confident78.8Confident85 Ų8597.7 Ų97.746%0.45550%0.5SS..Hα-helixtrans-69.5-41.2173.7-68.7-13.1000110.9Q382 L383 Q388 G389 S390Q382-N386 VanDerWaalsContact O-CG 3.26Å; Q382-N386 PolarHBondContact O-N 3.03Å; L383-N386 WeakPolarHBondContact O-CB 3.46Å; L383-N386 PolarHBondContact O-N 3.41Å; L383-N386 VanDerWaalsContact O-N 3.09Å; N386-Q388 VanDerWaalsContact C-N 3.3Å; N386-Q388 PolarHBondContact O-N 2.76Å; N386-G389 PolarHBondContact O-N 3.43Å; N386-S390 WeakPolarHBondContact O-CB 3.42Å; N386-S390 PolarHBondContact O-N 2.83Å
387E82.8Confident76.3Confident102 Ų102103.1 Ų103.148%0.47754%0.536SS..Hα-helixtrans-58.9-39.2171.6-70.8-177.7154.800112.7L383 R391 Y422L383-E387 WeakPolarHBondContact O-CG 3.42Å; L383-E387 PolarHBondContact O-N 2.93Å; E387-R391 WeakPolarHBondContact O-CG 3.26Å; E387-Y422 HydrophobicContact CG-CE1 4.11Å
388Q80.7Confident74Confident140 Ų140107.5 Ų107.565%0.65456%0.56SS**Hα-helixtrans-73.4-43.3177.3-75174.844.400112.2A384 S385 N386 S390 R391A384-Q388 VanDerWaalsContact O-CG 3.3Å; A384-Q388 WeakPolarHBondContact O-CG 3.14Å; A384-Q388 PolarHBondContact O-N 2.89Å; A384-Q388 VanDerWaalsContact O-N 3.15Å; S385-Q388 PolarHBondContact O-N 3.25Å; N386-Q388 VanDerWaalsContact C-N 3.3Å; N386-Q388 PolarHBondContact O-N 2.76Å; Q388-S390 VanDerWaalsContact C-N 3.3Å; Q388-S390 PolarHBondContact O-N 2.96Å; Q388-R391 PolarHBondContact O-N 2.8Å; Q388-R391 VanDerWaalsContact O-N 3.11Å
389G76.8Confident71.7Confident51 Ų51110.2 Ų110.253%0.52658%0.581SS.*Hα-helixtrans-58.7-41.917500000112.1S385 N386 R391 V392S385-G389 PolarHBondContact O-N 3.35Å; N386-G389 PolarHBondContact O-N 3.43Å; G389-R391 PolarHBondContact O-N 2.69Å; G389-V392 PolarHBondContact O-N 3.3Å
390S68Low69.5Low94 Ų94116.7 Ų116.766%0.65762%0.621SS**THydrogen-bonded Turntrans-65.2-8.1177.5-168.80000114.8N386 Q388N386-S390 WeakPolarHBondContact O-CB 3.42Å; N386-S390 PolarHBondContact O-N 2.83Å; Q388-S390 VanDerWaalsContact C-N 3.3Å; Q388-S390 PolarHBondContact O-N 2.96Å
391R64.5Low67.1Low220 Ų220119.4 Ų119.483%0.8364%0.638SS**THydrogen-bonded Turntrans-106.4-1.8-175.6-82.5-173.5173.8-156.20.4115.5E387 Q388 G389E387-R391 WeakPolarHBondContact O-CG 3.26Å; Q388-R391 PolarHBondContact O-N 2.8Å; Q388-R391 VanDerWaalsContact O-N 3.11Å; G389-R391 PolarHBondContact O-N 2.69Å
392V59.6Low64.8Low103 Ų103119.3 Ų119.362%0.62465%0.653SS**SBendtrans-75.9-44.6-172.4-179.20000112.4G389 K394G389-V392 PolarHBondContact O-N 3.3Å; V392-K394 PolarHBondContact O-N 3.03Å
393D56.9Low62.3Low139 Ų139118.3 Ų118.374%0.74366%0.664SS**SBendtrans-99.574.3-171.1-75.4-67.3000115.5
394K53.9Low60.1Low204 Ų204123.5 Ų123.589%0.88770%0.697SS**  trans-174.1103.3133.6-98142.8-161.8128.70112.4V392V392-K394 PolarHBondContact O-N 3.03Å
395T50.5Low57.8Low134 Ų134129.9 Ų129.982%0.82273%0.726SS**  trans-81.3114.9169.450.70000111.7
396E45.4Very low55.6Low187 Ų187132.1 Ų132.187%0.87474%0.739SS**  -175.6124.1125.5-104.7-176.7175.500110.9
397P42Very low53.6Low125 Ų125134.4 Ų134.481%0.81276%0.756SS**  trans-97.9131.5-179.335-30.8000112.7
398L47.5Very low51.8Low177 Ų177138 Ų13893%0.92777%0.773SS**  trans-129.8124.1164.9-99.4168.1000111.4
399T46.7Very low50.5Low126 Ų126138.1 Ų138.177%0.77378%0.783SS**  trans-83.6148.2-178.950.90000112.6
400V48Very low48.8Very low143 Ų143139.4 Ų139.487%0.86780%0.796SS**  trans-170.5158.5133135.90000111.2
401D43.6Very low47.8Very low140 Ų140140.3 Ų140.375%0.74981%0.81SS**  trans-67.2144.8-167.3-76.3-70.8000118.9
402V45.3Very low46.8Very low137 Ų137133.4 Ų133.483%0.8381%0.806SS**  31.2125.2125.6-171.70000119.6
403G41.2Very low45.9Very low61 Ų61134.5 Ų134.563%0.62982%0.819SS**  trans156.493.514200000120.6
404T43.7Very low45.2Very low132 Ų132132.9 Ų132.981%0.8182%0.824SS**  trans73.4100.2131-420000121.8
405L43.5Very low44.5Very low165 Ų165127 Ų12786%0.86482%0.822SS**  trans69.8152.9149.7-88.583.6000122.3
406P41.4Very low44.1Very low110 Ų110124.6 Ų124.671%0.71482%0.824SS**  trans-118.3165.5-170.442.7-31.1000115.6
407T43.5Very low44Very low133 Ų133120.5 Ų120.582%0.81682%0.822SS**  trans-154.2109152.9-43.80000112
408E45.5Very low44.5Very low176 Ų176118.7 Ų118.782%0.82283%0.826SS**  trans39161.5147.7-52.8-165.5149.400125.3
409V51.9Low44.8Very low144 Ų144113 Ų11387%0.87381%0.81SS**  trans75.5112.6161.3-162.90000118.4
410G41.8Very low45.2Very low77 Ų77110 Ų11079%0.79480%0.804SS**  trans154.977.8160.400000115.9
411A48.2Very low45.7Very low114 Ų114105.9 Ų105.994%0.94279%0.79SS**  trans-75.5140.5177.500000113.1
412G41.6Very low47Very low74 Ų74103.3 Ų103.376%0.76377%0.771SS**  trans174.8112170.200000118
413S41.9Very low48.5Very low127 Ų127100.6 Ų100.689%0.88876%0.758SS**  trans73.6113.6152.2-154.80000120.4
414A41.6Very low50.6Low104 Ų104101 Ų10186%0.8676%0.755SS**  trans-54.2156.3173.800000117.6
415G39Very low52.7Low81 Ų8196.2 Ų96.284%0.83572%0.724SS**  trans165.4101.7159.600000115.5
416G43.2Very low54.9Low83 Ų8393.2 Ų93.286%0.85671%0.706SS**  trans88.3164.5172.500000115.8
417A42.3Very low57.1Low102 Ų10290.9 Ų90.984%0.84370%0.696SS**  cis-161.2149.4-10.400000112.7G419A417-G419 VanDerWaalsContact C-N 3.33Å; A417-G419 PolarHBondContact O-N 2.8Å
418G52Low59.4Low87 Ų8788.4 Ų88.490%0.89768%0.675SS**  trans60.6-14.614100000123.5G420G418-G420 PolarHBondContact O-N 2.7Å; G418-G420 VanDerWaalsContact O-N 3.16Å
419G54.9Low61.7Low57 Ų5780.3 Ų80.359%0.58864%0.637SS**THydrogen-bonded Turntrans-70.1-14.5-160.300000118.8A417 G421A417-G419 VanDerWaalsContact C-N 3.33Å; A417-G419 PolarHBondContact O-N 2.8Å; G419-G421 VanDerWaalsContact C-N 3.33Å; G419-G421 PolarHBondContact O-N 3.31Å; G419-G421 VanDerWaalsContact O-N 3.14Å
420G54.9Low63.6Low62 Ų6278 Ų7864%0.63962%0.617SS**THydrogen-bonded Turntrans-66.9-18.7-161.300000117.7G418 Y422G418-G420 PolarHBondContact O-N 2.7Å; G418-G420 VanDerWaalsContact O-N 3.16Å; G420-Y422 PolarHBondContact O-N 3.45Å
421G59.1Low66Low57 Ų5776.7 Ų76.759%0.58860%0.599SS**Hα-helixtrans-67.1-34.4-172.300000115G419G419-G421 VanDerWaalsContact C-N 3.33Å; G419-G421 PolarHBondContact O-N 3.31Å; G419-G421 VanDerWaalsContact O-N 3.14Å
422Y69.5Low68.2Low86 Ų8674.1 Ų74.134%0.33757%0.565SS.*Hα-helixtrans-68.5-42.7-175.3-72.6-90.6000112.2L383 E387 G420 A424 M425 E426L383-Y422 HydrophobicContact CD1-CD1 3.9Å; L383-Y422 HydrophobicContact CG-CD1 4.37Å; E387-Y422 HydrophobicContact CG-CE1 4.11Å; G420-Y422 PolarHBondContact O-N 3.45Å; Y422-A424 VanDerWaalsContact C-N 3.29Å; Y422-A424 PolarHBondContact O-N 2.87Å; Y422-M425 PolarHBondContact O-N 3.01Å; Y422-E426 WeakPolarHBondContact O-CG 3.31Å; Y422-E426 PolarHBondContact O-N 3.35Å
423S78.5Confident70.7Confident81 Ų8174.1 Ų74.157%0.56654%0.544SS*.Hα-helixtrans-58.6-36.1-177.31800000113.4A427S423-A427 VanDerWaalsContact O-CB 3.26Å; S423-A427 WeakPolarHBondContact O-CB 3.46Å; S423-A427 PolarHBondContact O-N 3.12Å
424A85Confident73.1Confident68 Ų6871.6 Ų71.656%0.56252%0.524SS*.Hα-helixtrans-67.3-38.9176.200000112.3Y422 Q428Y422-A424 VanDerWaalsContact C-N 3.29Å; Y422-A424 PolarHBondContact O-N 2.87Å; A424-Q428 WeakPolarHBondContact O-CB 3.22Å; A424-Q428 PolarHBondContact O-N 3.09Å
425M88Confident75.5Confident32 Ų3269.8 Ų69.816%0.15850%0.497CS..Hα-helixtrans-73.8-37.9178.4-164.9169.4-153.700111.8L379 Q382 L383 Y422 Q428 I429L379-M425 HydrophobicContact CB-CE 4.39Å; L379-M425 HydrophobicContact CD2-CE 3.71Å; Q382-M425 HydrophobicContact CB-CE 3.55Å; L383-M425 HydrophobicContact CB-SD 4.26Å; L383-M425 HydrophobicContact CD1-CB 3.95Å; L383-M425 HydrophobicContact CD1-CG 3.93Å; L383-M425 HydrophobicContact CD1-SD 3.82Å; Y422-M425 PolarHBondContact O-N 3.01Å; M425-Q428 PolarHBondContact O-N 2.81Å; M425-I429 HydrophobicContact CG-CD1 4.27Å; M425-I429 WeakPolarHBondContact O-CB 3.25Å; M425-I429 WeakPolarHBondContact O-CD1 3.3Å; M425-I429 VanDerWaalsContact O-CG1 3.26Å; M425-I429 WeakPolarHBondContact O-CG1 3.48Å; M425-I429 PolarHBondContact O-N 3.33Å
426E88.9Confident78Confident103 Ų10366.3 Ų66.348%0.48146%0.46SS..Hα-helixtrans-64.5-44.5173.2-69.8177.8136.200111.9L383 Y422 Q428 I429 E430L383-E426 HydrophobicContact CD1-CG 4.31Å; L383-E426 HydrophobicContact CD2-CG 4.49Å; Y422-E426 WeakPolarHBondContact O-CG 3.31Å; Y422-E426 PolarHBondContact O-N 3.35Å; E426-Q428 VanDerWaalsContact C-N 3.31Å; E426-Q428 PolarHBondContact O-N 3.23Å; E426-I429 WeakPolarHBondContact O-CB 3.48Å; E426-I429 PolarHBondContact O-N 3.41Å; E426-E430 PolarHBondContact O-N 3.22Å
427A88.3Confident80.3Confident61 Ų6166.8 Ų66.850%0.50445%0.446SS..Hα-helixtrans-61.6-39.2174.600000112.1S423 E430 A431S423-A427 VanDerWaalsContact O-CB 3.26Å; S423-A427 WeakPolarHBondContact O-CB 3.46Å; S423-A427 PolarHBondContact O-N 3.12Å; A427-E430 PolarHBondContact O-N 2.89Å; A427-A431 WeakPolarHBondContact O-CB 3.45Å; A427-A431 PolarHBondContact O-N 2.88Å
428Q91.9Very high82.6Confident80 Ų8066.2 Ų66.237%0.37443%0.428SS..Hα-helixtrans-66.5-40.7173.8-175.7173.225.300112.1L379 A424 M425 E426 E430 A431 Y432L379-Q428 HydrophobicContact CD1-CG 4.1Å; A424-Q428 WeakPolarHBondContact O-CB 3.22Å; A424-Q428 PolarHBondContact O-N 3.09Å; M425-Q428 PolarHBondContact O-N 2.81Å; E426-Q428 VanDerWaalsContact C-N 3.31Å; E426-Q428 PolarHBondContact O-N 3.23Å; Q428-E430 VanDerWaalsContact C-N 3.35Å; Q428-A431 PolarHBondContact O-N 2.94Å; Q428-Y432 HydrophobicContact CG-CD2 3.88Å; Q428-Y432 HydrophobicContact CG-CE2 3.43Å; Q428-Y432 VanDerWaalsContact CG-CE2 3.43Å; Q428-Y432 WeakPolarHBondContact O-CD2 3.34Å; Q428-Y432 PolarHBondContact O-N 2.9Å; Q428-Y432 VanDerWaalsContact O-N 3.09Å
429I92.7Very high84.5Confident7 Ų765.1 Ų65.14%0.03640%0.397CS..Hα-helixtrans-60.2-43.9173.5-77163.8000110.8L379 Q380 L383 M425 E426 Y432 K433L379-I429 HydrophobicContact CB-CD1 3.96Å; L379-I429 HydrophobicContact CB-CG1 3.55Å; L379-I429 HydrophobicContact CD1-CG1 4.07Å; L379-I429 HydrophobicContact CG-CG1 4.47Å; Q380-I429 HydrophobicContact CG-CD1 4.09Å; Q380-I429 HydrophobicContact CG-CG2 4.16Å; L383-I429 HydrophobicContact CB-CD1 4.49Å; M425-I429 HydrophobicContact CG-CD1 4.27Å; M425-I429 WeakPolarHBondContact O-CB 3.25Å; M425-I429 WeakPolarHBondContact O-CD1 3.3Å; M425-I429 VanDerWaalsContact O-CG1 3.26Å; M425-I429 WeakPolarHBondContact O-CG1 3.48Å; M425-I429 PolarHBondContact O-N 3.33Å; E426-I429 WeakPolarHBondContact O-CB 3.48Å; E426-I429 PolarHBondContact O-N 3.41Å; I429-Y432 PolarHBondContact O-N 3.03Å; I429-K433 WeakPolarHBondContact O-CG 3.34Å; I429-K433 PolarHBondContact O-N 3.44Å
430E92.6Very high86.2Confident94 Ų9468.2 Ų68.244%0.43939%0.391SS..Hα-helixtrans-71-35.2-179.9-154.160.7-13600112.7E426 A427 Q428 K433 T434E426-E430 PolarHBondContact O-N 3.22Å; A427-E430 PolarHBondContact O-N 2.89Å; Q428-E430 VanDerWaalsContact C-N 3.35Å; E430-K433 PolarHBondContact O-N 2.96Å; E430-K433 WeakPolarHBondContact OE1-CD 3.46Å; E430-K433 IonicContact OE1-NZ 2.75Å; E430-K433 WeakPolarHBondContact OE2-CD 3.35Å; E430-K433 IonicContact OE2-NZ 2.8Å; E430-K433 PolarHBondContact OE2-NZ 3.13Å; E430-T434 PolarHBondContact O-N 3.24Å; E430-T434 PolarHBondContact O-OG1 3.44Å
431A91.6Very high87.9Confident51 Ų5170 Ų7042%0.42139%0.385SS..Hα-helixtrans-58.3-49.1170.300000111.1A427 Q428 K433 T434 E435A427-A431 WeakPolarHBondContact O-CB 3.45Å; A427-A431 PolarHBondContact O-N 2.88Å; Q428-A431 PolarHBondContact O-N 2.94Å; A431-K433 PolarHBondContact O-N 3.12Å; A431-T434 PolarHBondContact O-N 3.24Å; A431-T434 PolarHBondContact O-OG1 3.3Å; A431-E435 WeakPolarHBondContact O-CB 3.48Å; A431-E435 PolarHBondContact O-N 2.87Å
432Y94.7Very high89.4Confident60 Ų6071 Ų7124%0.23537%0.373CS..Hα-helixtrans-70.5-29177.3-66.7-56.9000113.8L372 Y375 V376 L379 Q428 I429 C436L372-Y432 HydrophobicContact CD2-CD1 3.86Å; L372-Y432 HydrophobicContact CD2-CE1 4.29Å; Y375-Y432 AromaticContact CD1-CD2 3.8Å; Y375-Y432 HydrophobicContact CD1-CD2 3.8Å; Y375-Y432 HydrophobicContact CD1-CE1 4.5Å; Y375-Y432 AromaticContact CD1-CE2 3.6Å; Y375-Y432 HydrophobicContact CD1-CE2 3.6Å; Y375-Y432 HydrophobicContact CD1-CG 4.33Å; Y375-Y432 AromaticContact CD1-CZ 3.98Å; Y375-Y432 HydrophobicContact CE1-CD2 4.06Å; Y375-Y432 AromaticContact CE1-CE2 3.41Å; Y375-Y432 HydrophobicContact CE1-CE2 3.41Å; Y375-Y432 VanDerWaalsContact CE1-CE2 3.41Å; Y375-Y432 AromaticContact CE1-CZ 3.76Å; V376-Y432 VanDerWaalsContact CG2-CB 3.49Å; L379-Y432 HydrophobicContact CD1-CD2 3.64Å; L379-Y432 HydrophobicContact CD1-CE2 3.82Å; Q428-Y432 HydrophobicContact CG-CD2 3.88Å; Q428-Y432 HydrophobicContact CG-CE2 3.43Å; Q428-Y432 VanDerWaalsContact CG-CE2 3.43Å; Q428-Y432 WeakPolarHBondContact O-CD2 3.34Å; Q428-Y432 PolarHBondContact O-N 2.9Å; Q428-Y432 VanDerWaalsContact O-N 3.09Å; I429-Y432 PolarHBondContact O-N 3.03Å; Y432-C436 WeakPolarHBondContact O-CB 3.46Å; Y432-C436 PolarHBondContact O-N 3.31Å; Y432-C436 PolarHBondContact O-SG 3.36Å
433K93.8Very high90.2Very high73 Ų7367.3 Ų67.332%0.31736%0.36SS..Hα-helixtrans-64.4-47.4170.7-76179.8-158155.80111.8V376 I429 E430 A431 E435 C436 V437V376-K433 HydrophobicContact CG1-CG 4.01Å; V376-K433 HydrophobicContact CG2-CG 4.32Å; I429-K433 WeakPolarHBondContact O-CG 3.34Å; I429-K433 PolarHBondContact O-N 3.44Å; E430-K433 PolarHBondContact O-N 2.96Å; E430-K433 WeakPolarHBondContact OE1-CD 3.46Å; E430-K433 IonicContact OE1-NZ 2.75Å; E430-K433 WeakPolarHBondContact OE2-CD 3.35Å; E430-K433 IonicContact OE2-NZ 2.8Å; E430-K433 PolarHBondContact OE2-NZ 3.13Å; A431-K433 PolarHBondContact O-N 3.12Å; K433-E435 VanDerWaalsContact C-N 3.3Å; K433-E435 PolarHBondContact O-N 2.95Å; K433-C436 WeakPolarHBondContact O-CB 3.43Å; K433-C436 PolarHBondContact O-N 3.36Å; K433-V437 WeakPolarHBondContact O-CG2 3.02Å; K433-V437 PolarHBondContact O-N 3.18Å; K433-V437 VanDerWaalsContact O-N 3.1Å
434T91.9Very high90.6Very high75 Ų7565.7 Ų65.746%0.4635%0.349SS..Hα-helixtrans-64.8-37.8178.348.70000110.8E430 A431 V437 I438E430-T434 PolarHBondContact O-N 3.24Å; E430-T434 PolarHBondContact O-OG1 3.44Å; A431-T434 PolarHBondContact O-N 3.24Å; A431-T434 PolarHBondContact O-OG1 3.3Å; T434-V437 PolarHBondContact O-N 3.3Å; T434-I438 WeakPolarHBondContact O-CG1 3.27Å; T434-I438 PolarHBondContact O-N 2.93Å; T434-I438 VanDerWaalsContact O-N 3.13Å
435E92.3Very high90.7Very high65 Ų6567.5 Ų67.530%0.30435%0.345SS..Hα-helixtrans-60.9-46.6170.9-149.1-168.1155.900112.3L372 A431 K433 V437 I438 W439L372-E435 HydrophobicContact CD1-CB 4.2Å; L372-E435 HydrophobicContact CD1-CG 3.98Å; A431-E435 WeakPolarHBondContact O-CB 3.48Å; A431-E435 PolarHBondContact O-N 2.87Å; K433-E435 VanDerWaalsContact C-N 3.3Å; K433-E435 PolarHBondContact O-N 2.95Å; E435-V437 PolarHBondContact O-N 3.32Å; E435-I438 PolarHBondContact O-N 2.96Å; E435-W439 PolarHBondContact O-N 3.28Å; E435-W439 PolarHBondContact OE1-NE1 2.71Å
436C91Very high90.6Very high9 Ų967.1 Ų67.16%0.06134%0.344CS..Hα-helixtrans-53.9-38.7173.9-71.60000112.7L372 Q373 Y432 K433 R440L372-C436 WeakPolarHBondContact CB-SG 3.46Å; Q373-C436 PolarHBondContact N-SG 3.22Å; Q373-C436 VanDerWaalsContact N-SG 3.4Å; Y432-C436 WeakPolarHBondContact O-CB 3.46Å; Y432-C436 PolarHBondContact O-N 3.31Å; Y432-C436 PolarHBondContact O-SG 3.36Å; K433-C436 WeakPolarHBondContact O-CB 3.43Å; K433-C436 PolarHBondContact O-N 3.36Å; C436-R440 WeakPolarHBondContact O-CB 3.49Å; C436-R440 VanDerWaalsContact O-CG 3.24Å; C436-R440 WeakPolarHBondContact O-CG 3.37Å; C436-R440 PolarHBondContact O-N 3.47Å; C436-R440 VanDerWaalsContact O-N 3.08Å
437V91.6Very high90.6Very high92 Ų9266.3 Ų66.356%0.55834%0.34SS*.Hα-helixtrans-68.6-40.2178.3173.30000111K433 T434 E435 R440 L441K433-V437 WeakPolarHBondContact O-CG2 3.02Å; K433-V437 PolarHBondContact O-N 3.18Å; K433-V437 VanDerWaalsContact O-N 3.1Å; T434-V437 PolarHBondContact O-N 3.3Å; E435-V437 PolarHBondContact O-N 3.32Å; V437-R440 PolarHBondContact O-N 2.99Å; V437-L441 PolarHBondContact O-N 2.87Å
438I90.6Very high90.4Very high91 Ų9168 Ų6847%0.46734%0.34SS..Hα-helixtrans-63.6-49177.4-66.4164.6000111.1T434 E435 R440 L441 K442T434-I438 WeakPolarHBondContact O-CG1 3.27Å; T434-I438 PolarHBondContact O-N 2.93Å; T434-I438 VanDerWaalsContact O-N 3.13Å; E435-I438 PolarHBondContact O-N 2.96Å; I438-R440 VanDerWaalsContact C-N 3.3Å; I438-R440 PolarHBondContact O-N 3.5Å; I438-L441 PolarHBondContact O-N 3.18Å; I438-K442 WeakPolarHBondContact O-CG 3.32Å; I438-K442 PolarHBondContact O-N 2.8Å; I438-K442 VanDerWaalsContact O-N 3.1Å
439W91.9Very high90Very high63 Ų6366.3 Ų66.324%0.23934%0.339CS..Hα-helixtrans-64.2-34.7177.8-66.1105.4000112Y365 E368 C369 L372 E435 S443Y365-W439 AromaticContact CD1-CE3 3.49Å; Y365-W439 HydrophobicContact CD1-CE3 3.49Å; Y365-W439 VanDerWaalsContact CD1-CE3 3.49Å; Y365-W439 AromaticContact CD1-CZ3 3.45Å; Y365-W439 HydrophobicContact CD1-CZ3 3.45Å; Y365-W439 VanDerWaalsContact CD1-CZ3 3.45Å; Y365-W439 AromaticContact CE1-CE3 3.91Å; Y365-W439 HydrophobicContact CE1-CE3 3.91Å; Y365-W439 AromaticContact CE1-CZ3 3.5Å; Y365-W439 HydrophobicContact CE1-CZ3 3.5Å; Y365-W439 VanDerWaalsContact CE1-CZ3 3.5Å; Y365-W439 HydrophobicContact CG-CE3 4.17Å; E368-W439 HydrophobicContact CB-CD2 4.15Å; E368-W439 HydrophobicContact CB-CE3 4.27Å; E368-W439 HydrophobicContact CB-CG 4.43Å; E368-W439 HydrophobicContact CG-CD2 3.92Å; E368-W439 HydrophobicContact CG-CE3 4.34Å; E368-W439 HydrophobicContact CG-CG 4.3Å; E368-W439 HydrophobicContact CG-CH2 4.42Å; E368-W439 HydrophobicContact CG-CZ2 4.02Å; C369-W439 WeakPolarHBondContact SG-CB 3.28Å; L372-W439 HydrophobicContact CD1-CG 4.31Å; E435-W439 PolarHBondContact O-N 3.28Å; E435-W439 PolarHBondContact OE1-NE1 2.71Å; W439-S443 WeakPolarHBondContact O-CB 3.42Å; W439-S443 PolarHBondContact O-N 2.94Å
440R91.6Very high89.7Confident123 Ų12367.2 Ų67.246%0.46434%0.344SS..Hα-helixtrans-66.8-40.9175.3-79.8178.4-177.4174.52112.4C369 C436 V437 I438 S443 S444C369-R440 HydrophobicContact CB-CG 4.17Å; C369-R440 VanDerWaalsContact SG-CA 3.54Å; C369-R440 VanDerWaalsContact SG-CG 3.51Å; C369-R440 PolarHBondContact SG-N 3.37Å; C436-R440 WeakPolarHBondContact O-CB 3.49Å; C436-R440 VanDerWaalsContact O-CG 3.24Å; C436-R440 WeakPolarHBondContact O-CG 3.37Å; C436-R440 PolarHBondContact O-N 3.47Å; C436-R440 VanDerWaalsContact O-N 3.08Å; V437-R440 PolarHBondContact O-N 2.99Å; I438-R440 VanDerWaalsContact C-N 3.3Å; I438-R440 PolarHBondContact O-N 3.5Å; R440-S443 WeakPolarHBondContact O-CB 3.46Å; R440-S443 PolarHBondContact O-N 2.84Å; R440-S444 PolarHBondContact O-N 3.28Å
441L89.4Confident89.4Confident98 Ų9868.1 Ų68.151%0.51335%0.347SS..Hα-helixtrans-61.7-51.4177.5-172.466.9000110V437 I438 S443 S444 E445V437-L441 PolarHBondContact O-N 2.87Å; I438-L441 PolarHBondContact O-N 3.18Å; L441-S443 VanDerWaalsContact C-N 3.31Å; L441-S443 PolarHBondContact O-N 3.46Å; L441-S444 WeakPolarHBondContact O-CA 3.26Å; L441-S444 PolarHBondContact O-N 3.39Å; L441-S444 PolarHBondContact O-OG 2.99Å; L441-E445 WeakPolarHBondContact O-CG 3.5Å; L441-E445 PolarHBondContact O-N 3.34Å
442K91.4Very high89Confident79 Ų7972.2 Ų72.234%0.34336%0.357SS..Hα-helixtrans-57.3-40.9175.1-68.2-177.9175-1720113.3Y365 I438 S444 E445 L446Y365-K442 HydrophobicContact CD2-CB 3.56Å; Y365-K442 HydrophobicContact CE2-CB 3.61Å; Y365-K442 HydrophobicContact CE2-CD 4.11Å; Y365-K442 HydrophobicContact CE2-CG 4.4Å; Y365-K442 HydrophobicContact CG-CB 4.33Å; I438-K442 WeakPolarHBondContact O-CG 3.32Å; I438-K442 PolarHBondContact O-N 2.8Å; I438-K442 VanDerWaalsContact O-N 3.1Å; K442-S444 VanDerWaalsContact C-N 3.32Å; K442-S444 PolarHBondContact O-N 2.92Å; K442-E445 WeakPolarHBondContact CA-OE2 3.38Å; K442-E445 PolarHBondContact O-N 3.04Å; K442-L446 PolarHBondContact O-N 3.38Å
443S87.2Confident88.4Confident9 Ų973.8 Ų73.86%0.06337%0.367CS..Hα-helixtrans-60.1-41.5173.2-177.10000111.3L362 W439 R440 L441 E447L362-S443 WeakPolarHBondContact CD1-O 3.25Å; L362-S443 WeakPolarHBondContact CD1-OG 3.42Å; W439-S443 WeakPolarHBondContact O-CB 3.42Å; W439-S443 PolarHBondContact O-N 2.94Å; R440-S443 WeakPolarHBondContact O-CB 3.46Å; R440-S443 PolarHBondContact O-N 2.84Å; L441-S443 VanDerWaalsContact C-N 3.31Å; L441-S443 PolarHBondContact O-N 3.46Å; S443-E447 WeakPolarHBondContact O-CB 3.26Å; S443-E447 PolarHBondContact O-N 3.06Å
444S87Confident87.8Confident46 Ų4674.3 Ų74.332%0.32237%0.372SS..Hα-helixtrans-71.9-33177.868.10000113.5R440 L441 K442 E447 I448R440-S444 PolarHBondContact O-N 3.28Å; L441-S444 WeakPolarHBondContact O-CA 3.26Å; L441-S444 PolarHBondContact O-N 3.39Å; L441-S444 PolarHBondContact O-OG 2.99Å; K442-S444 VanDerWaalsContact C-N 3.32Å; K442-S444 PolarHBondContact O-N 2.92Å; S444-E447 PolarHBondContact O-N 2.96Å; S444-I448 WeakPolarHBondContact O-CG1 3.47Å; S444-I448 PolarHBondContact O-N 3.35Å
445E85.8Confident87.3Confident106 Ų10673.4 Ų73.450%0.49537%0.372SS..Hα-helixtrans-64.9-46.5175.4-70.3166.7162.400111.1L441 K442 I448 A449L441-E445 WeakPolarHBondContact O-CG 3.5Å; L441-E445 PolarHBondContact O-N 3.34Å; K442-E445 WeakPolarHBondContact CA-OE2 3.38Å; K442-E445 PolarHBondContact O-N 3.04Å; E445-I448 PolarHBondContact O-N 2.88Å; E445-A449 PolarHBondContact O-N 3.48Å
446L87Confident86.8Confident24 Ų2472.5 Ų72.513%0.12638%0.376CS..Hα-helixtrans-64.2-38.3172.6-71.2-175.4000112.8L358 E361 L362 Y365 K442 I448 A449 L450L358-L446 HydrophobicContact CD2-CD2 3.78Å; E361-L446 HydrophobicContact CB-CD1 3.68Å; E361-L446 HydrophobicContact CG-CD1 3.62Å; L362-L446 HydrophobicContact CB-CB 4.2Å; L362-L446 HydrophobicContact CB-CD1 4.32Å; L362-L446 HydrophobicContact CD1-CB 4.23Å; Y365-L446 HydrophobicContact CD2-CD1 3.5Å; Y365-L446 HydrophobicContact CD2-CG 4.26Å; Y365-L446 HydrophobicContact CE2-CD1 3.51Å; Y365-L446 HydrophobicContact CE2-CG 4.17Å; K442-L446 PolarHBondContact O-N 3.38Å; L446-I448 VanDerWaalsContact C-N 3.25Å; L446-I448 PolarHBondContact O-N 3.22Å; L446-A449 PolarHBondContact O-N 2.92Å; L446-L450 VanDerWaalsContact O-CB 3.28Å; L446-L450 WeakPolarHBondContact O-CB 3.44Å; L446-L450 PolarHBondContact O-N 3.12Å
447E88.2Confident86.2Confident87 Ų8776.1 Ų76.141%0.40739%0.388SS..Hα-helixtrans-64.6-30.6177.6-158.1-164.814900112.2L362 S443 S444 K451L362-E447 HydrophobicContact CD1-CB 4.04Å; L362-E447 HydrophobicContact CD2-CB 4.31Å; L362-E447 HydrophobicContact CD2-CG 4.29Å; S443-E447 WeakPolarHBondContact O-CB 3.26Å; S443-E447 PolarHBondContact O-N 3.06Å; S444-E447 PolarHBondContact O-N 2.96Å; E447-K451 VanDerWaalsContact CD-NZ 3.33Å; E447-K451 VanDerWaalsContact O-CD 3.25Å; E447-K451 WeakPolarHBondContact O-CD 3.34Å; E447-K451 VanDerWaalsContact O-CG 3.22Å; E447-K451 WeakPolarHBondContact O-CG 3.39Å; E447-K451 PolarHBondContact O-N 3.21Å; E447-K451 WeakPolarHBondContact OE1-CE 3.47Å; E447-K451 IonicContact OE1-NZ 3.07Å; E447-K451 PolarHBondContact OE1-NZ 3.41Å
448I83.7Confident85.8Confident95 Ų9573.3 Ų73.349%0.48738%0.378SS..Hα-helixtrans-74.5-52.3173.3-68.7164.3000110.2S444 E445 L446 L450 K451 E452S444-I448 WeakPolarHBondContact O-CG1 3.47Å; S444-I448 PolarHBondContact O-N 3.35Å; E445-I448 PolarHBondContact O-N 2.88Å; L446-I448 VanDerWaalsContact C-N 3.25Å; L446-I448 PolarHBondContact O-N 3.22Å; I448-L450 VanDerWaalsContact C-N 3.3Å; I448-L450 PolarHBondContact O-N 2.78Å; I448-K451 PolarHBondContact O-N 3.47Å; I448-E452 PolarHBondContact O-N 2.93Å
449A84.3Confident85.5Confident45 Ų4575.2 Ų75.237%0.37238%0.383SS..Hα-helixtrans-56.4-43-179.200000112.4E445 L446 K451 E452 Q453E445-A449 PolarHBondContact O-N 3.48Å; L446-A449 PolarHBondContact O-N 2.92Å; A449-K451 PolarHBondContact O-N 3.12Å; A449-E452 PolarHBondContact O-N 2.87Å; A449-Q453 WeakPolarHBondContact O-CB 3.24Å; A449-Q453 PolarHBondContact O-N 3.24Å
450L87Confident84.9Confident26 Ų2677 Ų7714%0.13640%0.396CS..Hα-helixtrans-62.6-41.1176.8-168.783.6000112.2L358 I359 L362 L446 I448 Q453 I454L358-L450 HydrophobicContact CB-CD1 3.89Å; I359-L450 HydrophobicContact CD1-CD1 4.33Å; I359-L450 HydrophobicContact CD1-CD2 4.44Å; I359-L450 HydrophobicContact CG1-CD1 3.54Å; I359-L450 HydrophobicContact CG1-CD2 3.82Å; I359-L450 HydrophobicContact CG1-CG 4.32Å; L362-L450 HydrophobicContact CD2-CD2 4.31Å; L446-L450 VanDerWaalsContact O-CB 3.28Å; L446-L450 WeakPolarHBondContact O-CB 3.44Å; L446-L450 PolarHBondContact O-N 3.12Å; I448-L450 VanDerWaalsContact C-N 3.3Å; I448-L450 PolarHBondContact O-N 2.78Å; L450-Q453 PolarHBondContact O-N 2.87Å; L450-I454 HydrophobicContact CD2-CD1 4.16Å; L450-I454 HydrophobicContact CG-CD1 3.93Å; L450-I454 WeakPolarHBondContact O-CB 3.4Å; L450-I454 VanDerWaalsContact O-CG1 3.26Å; L450-I454 WeakPolarHBondContact O-CG1 3.42Å; L450-I454 PolarHBondContact O-N 3.27Å
451K85.8Confident84.5Confident114 Ų11475.5 Ų75.550%0.49639%0.394SS..Hα-helixtrans-66.3-39.5177.7-74.9167.5-170.41610112E447 I448 A449 A455E447-K451 VanDerWaalsContact CD-NZ 3.33Å; E447-K451 VanDerWaalsContact O-CD 3.25Å; E447-K451 WeakPolarHBondContact O-CD 3.34Å; E447-K451 VanDerWaalsContact O-CG 3.22Å; E447-K451 WeakPolarHBondContact O-CG 3.39Å; E447-K451 PolarHBondContact O-N 3.21Å; E447-K451 WeakPolarHBondContact OE1-CE 3.47Å; E447-K451 IonicContact OE1-NZ 3.07Å; E447-K451 PolarHBondContact OE1-NZ 3.41Å; I448-K451 PolarHBondContact O-N 3.47Å; A449-K451 PolarHBondContact O-N 3.12Å; K451-A455 VanDerWaalsContact O-CB 3.26Å; K451-A455 WeakPolarHBondContact O-CB 3.45Å; K451-A455 PolarHBondContact O-N 2.86Å
452E83.4Confident84.4Confident136 Ų13676.7 Ų76.764%0.63640%0.397SS*.Hα-helixtrans-66.5-42.1175.8-68.4-175.6165.700111.2I448 A449 A455 A456I448-E452 PolarHBondContact O-N 2.93Å; A449-E452 PolarHBondContact O-N 2.87Å; E452-A455 PolarHBondContact O-N 3.16Å; E452-A456 WeakPolarHBondContact O-CB 3.35Å; E452-A456 PolarHBondContact O-N 2.84Å
453Q81.7Confident84.1Confident94 Ų9477.4 Ų77.444%0.43940%0.402SS..Hα-helixtrans-63.4-44.7175.7-168.5-177.118.100112.6A449 L450 A456 R457A449-Q453 WeakPolarHBondContact O-CB 3.24Å; A449-Q453 PolarHBondContact O-N 3.24Å; L450-Q453 PolarHBondContact O-N 2.87Å; Q453-A456 PolarHBondContact O-N 2.8Å; Q453-R457 PolarHBondContact O-N 3Å
454I81.1Confident84Confident84 Ų8482.1 Ų82.143%0.43142%0.424SS..Hα-helixtrans-62.6-43.6175.5-69.5165.8000110.7W354 L450 A456 R457 G458W354-I454 HydrophobicContact CZ3-CG1 4.43Å; L450-I454 HydrophobicContact CD2-CD1 4.16Å; L450-I454 HydrophobicContact CG-CD1 3.93Å; L450-I454 WeakPolarHBondContact O-CB 3.4Å; L450-I454 VanDerWaalsContact O-CG1 3.26Å; L450-I454 WeakPolarHBondContact O-CG1 3.42Å; L450-I454 PolarHBondContact O-N 3.27Å; I454-A456 VanDerWaalsContact C-N 3.27Å; I454-A456 PolarHBondContact O-N 3.04Å; I454-R457 PolarHBondContact O-N 2.84Å; I454-G458 PolarHBondContact O-N 2.95Å
455A82.5Confident84.1Confident56 Ų5685 Ų8546%0.46343%0.432SS..Hα-helixtrans-69-22.3177.200000113.6K451 E452 K459K451-A455 VanDerWaalsContact O-CB 3.26Å; K451-A455 WeakPolarHBondContact O-CB 3.45Å; K451-A455 PolarHBondContact O-N 2.86Å; E452-A455 PolarHBondContact O-N 3.16Å; A455-K459 WeakPolarHBondContact O-CG 3.22Å
456A81.5Confident84.2Confident45 Ų4583.5 Ų83.537%0.37243%0.427SS..Hα-helixtrans-78.7-47.4169.900000111.4E452 Q453 I454 G458 K459 I460E452-A456 WeakPolarHBondContact O-CB 3.35Å; E452-A456 PolarHBondContact O-N 2.84Å; Q453-A456 PolarHBondContact O-N 2.8Å; I454-A456 VanDerWaalsContact C-N 3.27Å; I454-A456 PolarHBondContact O-N 3.04Å; A456-G458 PolarHBondContact O-N 3.33Å; A456-K459 WeakPolarHBondContact O-CB 3.49Å; A456-K459 PolarHBondContact O-N 2.87Å; A456-K459 VanDerWaalsContact O-N 3.12Å; A456-I460 PolarHBondContact O-N 3.21Å; A456-I460 VanDerWaalsContact O-N 3.16Å
457R77.7Confident84.1Confident85 Ų8587 Ų8732%0.32145%0.445SS..Hα-helixtrans-59.4-44.5-179.9-156.8-169.5-160.4-114.814.1111.8W354 Q453 I454 K459 I460 E461W354-R457 VanDerWaalsContact CE2-CZ 3.4Å; W354-R457 VanDerWaalsContact CZ2-CD 3.4Å; Q453-R457 PolarHBondContact O-N 3Å; I454-R457 PolarHBondContact O-N 2.84Å; R457-K459 PolarHBondContact O-N 2.83Å; R457-I460 CarbonylContact O-C 3.55Å; R457-I460 WeakPolarHBondContact O-CA 3.36Å; R457-I460 WeakPolarHBondContact O-CB 3.03Å; R457-I460 PolarHBondContact O-N 2.73Å; R457-E461 VanDerWaalsContact CD-OE1 3.26Å; R457-E461 WeakPolarHBondContact CD-OE1 3.49Å; R457-E461 HydrophobicContact CG-CG 4.5Å; R457-E461 WeakPolarHBondContact CG-OE1 3.33Å; R457-E461 IonicContact CZ-OE1 2.67Å; R457-E461 IonicContact NE-OE1 3.91Å; R457-E461 IonicContact NH1-OE1 3.33Å; R457-E461 PolarHBondContact NH1-OE1 2.77Å; R457-E461 WeakPolarHBondContact O-CG 3.44Å; R457-E461 PolarHBondContact O-N 2.83Å
458G83.6Confident84.1Confident34 Ų3488.5 Ų88.535%0.35145%0.452SS..Hα-helixtrans-59.8-30.2177.100000114.3I454 A456 E462I454-G458 PolarHBondContact O-N 2.95Å; A456-G458 PolarHBondContact O-N 3.33Å; G458-E462 WeakPolarHBondContact O-CB 3.39Å; G458-E462 PolarHBondContact O-N 3.47Å
459K84Confident84.4Confident130 Ų13089.9 Ų89.957%0.56545%0.451SS*.Hα-helixtrans-74.8-34.1172.8-66.7171-175.3171.90112.4A455 A456 R457 Q463A455-K459 WeakPolarHBondContact O-CG 3.22Å; A456-K459 WeakPolarHBondContact O-CB 3.49Å; A456-K459 PolarHBondContact O-N 2.87Å; A456-K459 VanDerWaalsContact O-N 3.12Å; R457-K459 PolarHBondContact O-N 2.83Å; K459-Q463 WeakPolarHBondContact O-CB 3.47Å; K459-Q463 VanDerWaalsContact O-CG 3.26Å; K459-Q463 WeakPolarHBondContact O-CG 3.49Å; K459-Q463 PolarHBondContact O-N 3.02Å
460I79.8Confident84.6Confident101 Ų10192.8 Ų92.852%0.51846%0.461SS..Hα-helixtrans-70-41.2175.7-64.5167.7000109.6A456 R457 Q463 M464A456-I460 PolarHBondContact O-N 3.21Å; A456-I460 VanDerWaalsContact O-N 3.16Å; R457-I460 CarbonylContact O-C 3.55Å; R457-I460 WeakPolarHBondContact O-CA 3.36Å; R457-I460 WeakPolarHBondContact O-CB 3.03Å; R457-I460 PolarHBondContact O-N 2.73Å; I460-Q463 PolarHBondContact O-N 3.48Å; I460-M464 HydrophobicContact CG2-CG 4.35Å; I460-M464 WeakPolarHBondContact O-CB 3.28Å; I460-M464 WeakPolarHBondContact O-CG 3.4Å; I460-M464 PolarHBondContact O-N 3.17Å
461E82.7Confident84.6Confident91 Ų9195.8 Ų95.843%0.42548%0.476SS..Hα-helixtrans-62.1-46.2173.8-70.7164.7-170.700111.8R457 Q463 M464 E465R457-E461 VanDerWaalsContact CD-OE1 3.26Å; R457-E461 WeakPolarHBondContact CD-OE1 3.49Å; R457-E461 HydrophobicContact CG-CG 4.5Å; R457-E461 WeakPolarHBondContact CG-OE1 3.33Å; R457-E461 IonicContact CZ-OE1 2.67Å; R457-E461 IonicContact NE-OE1 3.91Å; R457-E461 IonicContact NH1-OE1 3.33Å; R457-E461 PolarHBondContact NH1-OE1 2.77Å; R457-E461 WeakPolarHBondContact O-CG 3.44Å; R457-E461 PolarHBondContact O-N 2.83Å; E461-Q463 VanDerWaalsContact C-N 3.33Å; E461-Q463 PolarHBondContact O-N 3.24Å; E461-M464 PolarHBondContact O-N 3.36Å; E461-E465 PolarHBondContact O-N 2.9Å
462E87.2Confident84.8Confident124 Ų12495.7 Ų95.758%0.57948%0.478SS*.Hα-helixtrans-60.1-41.2173.8-175177.9-160.900111.8G458 I466G458-E462 WeakPolarHBondContact O-CB 3.39Å; G458-E462 PolarHBondContact O-N 3.47Å; E462-I466 HydrophobicContact CG-CD1 4.2Å; E462-I466 WeakPolarHBondContact O-CD1 3.35Å; E462-I466 VanDerWaalsContact O-CG1 3.23Å; E462-I466 WeakPolarHBondContact O-CG1 3.2Å; E462-I466 PolarHBondContact O-N 3.4Å; E462-I466 VanDerWaalsContact O-N 3.09Å
463Q85.6Confident85.2Confident94 Ų9491 Ų9144%0.43947%0.466SS..Hα-helixtrans-68-39.1175.6-75177.59.800112.9K459 I460 E461 I466 I467K459-Q463 WeakPolarHBondContact O-CB 3.47Å; K459-Q463 VanDerWaalsContact O-CG 3.26Å; K459-Q463 WeakPolarHBondContact O-CG 3.49Å; K459-Q463 PolarHBondContact O-N 3.02Å; I460-Q463 PolarHBondContact O-N 3.48Å; E461-Q463 VanDerWaalsContact C-N 3.33Å; E461-Q463 PolarHBondContact O-N 3.24Å; Q463-I466 PolarHBondContact O-N 3.38Å; Q463-I467 WeakPolarHBondContact O-CB 3.45Å; Q463-I467 WeakPolarHBondContact O-CD1 3.34Å; Q463-I467 VanDerWaalsContact O-CG1 3.25Å; Q463-I467 WeakPolarHBondContact O-CG1 3.04Å; Q463-I467 PolarHBondContact O-N 3.22Å
464M84Confident85.4Confident107 Ų10791.6 Ų91.653%0.52747%0.471SS..Hα-helixtrans-60.5-50.3173.7-72.6-99.5-65.700110.7I460 E461 I466 I467 E468I460-M464 HydrophobicContact CG2-CG 4.35Å; I460-M464 WeakPolarHBondContact O-CB 3.28Å; I460-M464 WeakPolarHBondContact O-CG 3.4Å; I460-M464 PolarHBondContact O-N 3.17Å; E461-M464 PolarHBondContact O-N 3.36Å; M464-I466 VanDerWaalsContact C-N 3.26Å; M464-I466 PolarHBondContact O-N 3.46Å; M464-I467 CarbonylContact O-C 3.51Å; M464-I467 PolarHBondContact O-N 2.84Å; M464-E468 WeakPolarHBondContact O-CG 3.35Å; M464-E468 PolarHBondContact O-N 3.01Å
465E89Confident85.8Confident106 Ų10694 Ų9450%0.49548%0.481SS..Hα-helixtrans-64.3-31-179.1-156.1-139.3170.300112E461 R469E461-E465 PolarHBondContact O-N 2.9Å; E465-R469 WeakPolarHBondContact O-CB 3.48Å; E465-R469 PolarHBondContact O-N 3.41Å; E465-R469 PolarHBondContact O-NH1 2.83Å; E465-R469 VanDerWaalsContact O-NH1 3.12Å; E465-R469 IonicContact OE1-CZ 2.57Å; E465-R469 IonicContact OE1-NH2 2.67Å; E465-R469 PolarHBondContact OE1-NH2 3.08Å; E465-R469 IonicContact OE2-CZ 2.61Å; E465-R469 IonicContact OE2-NH1 3.78Å; E465-R469 IonicContact OE2-NH2 3.44Å; E465-R469 PolarHBondContact OE2-NH2 3.39Å
466I88.3Confident86.3Confident76 Ų7697.4 Ų97.439%0.3949%0.485SS..Hα-helixtrans-66.5-48.5169.6-69.8165.2000111E462 Q463 M464 R469 D470E462-I466 HydrophobicContact CG-CD1 4.2Å; E462-I466 WeakPolarHBondContact O-CD1 3.35Å; E462-I466 VanDerWaalsContact O-CG1 3.23Å; E462-I466 WeakPolarHBondContact O-CG1 3.2Å; E462-I466 PolarHBondContact O-N 3.4Å; E462-I466 VanDerWaalsContact O-N 3.09Å; Q463-I466 PolarHBondContact O-N 3.38Å; M464-I466 VanDerWaalsContact C-N 3.26Å; M464-I466 PolarHBondContact O-N 3.46Å; I466-R469 PolarHBondContact O-N 3.42Å; I466-D470 PolarHBondContact O-N 2.9Å
467I85.8Confident86.7Confident98 Ų9899.7 Ų99.750%0.50349%0.491SS..Hα-helixtrans-64.6-40.8-179.3-71.3164.7000111.8Q463 M464 D470 N471Q463-I467 WeakPolarHBondContact O-CB 3.45Å; Q463-I467 WeakPolarHBondContact O-CD1 3.34Å; Q463-I467 VanDerWaalsContact O-CG1 3.25Å; Q463-I467 WeakPolarHBondContact O-CG1 3.04Å; Q463-I467 PolarHBondContact O-N 3.22Å; M464-I467 CarbonylContact O-C 3.51Å; M464-I467 PolarHBondContact O-N 2.84Å; I467-D470 PolarHBondContact O-N 3.31Å; I467-N471 WeakPolarHBondContact CG2-ND2 3.41Å; I467-N471 VanDerWaalsContact O-CB 3.29Å; I467-N471 WeakPolarHBondContact O-CB 3.29Å; I467-N471 VanDerWaalsContact O-CG 3.23Å; I467-N471 PolarHBondContact O-N 2.92Å; I467-N471 PolarHBondContact O-ND2 2.86Å; I467-N471 VanDerWaalsContact O-ND2 3.11Å
468E88.5Confident87.2Confident117 Ų11799 Ų9955%0.54750%0.496SS..Hα-helixtrans-64.6-44.1176.1-72.1-177.8161.300111.6M464 D470 N471 E472M464-E468 WeakPolarHBondContact O-CG 3.35Å; M464-E468 PolarHBondContact O-N 3.01Å; E468-D470 PolarHBondContact O-N 3.13Å; E468-N471 PolarHBondContact O-N 3.06Å; E468-E472 PolarHBondContact O-N 3.15Å
469R89.7Confident87.5Confident124 Ų124100.9 Ų100.947%0.46850%0.498SS..Hα-helixtrans-63.7-39177.1-168.8-174.2-64.1116.2-20112.4E465 I466 G473E465-R469 WeakPolarHBondContact O-CB 3.48Å; E465-R469 PolarHBondContact O-N 3.41Å; E465-R469 PolarHBondContact O-NH1 2.83Å; E465-R469 VanDerWaalsContact O-NH1 3.12Å; E465-R469 IonicContact OE1-CZ 2.57Å; E465-R469 IonicContact OE1-NH2 2.67Å; E465-R469 PolarHBondContact OE1-NH2 3.08Å; E465-R469 IonicContact OE2-CZ 2.61Å; E465-R469 IonicContact OE2-NH1 3.78Å; E465-R469 IonicContact OE2-NH2 3.44Å; E465-R469 PolarHBondContact OE2-NH2 3.39Å; I466-R469 PolarHBondContact O-N 3.42Å; R469-G473 PolarHBondContact O-N 2.8Å; R469-G473 VanDerWaalsContact O-N 3.12Å
470D87.8Confident87.8Confident107 Ų107100.4 Ų100.457%0.57250%0.498SS*.Hα-helixtrans-71.3-38.9173.9-84.5-3.9000112.1I466 I467 E468 G473 L474I466-D470 PolarHBondContact O-N 2.9Å; I467-D470 PolarHBondContact O-N 3.31Å; E468-D470 PolarHBondContact O-N 3.13Å; D470-G473 WeakPolarHBondContact O-CA 3.39Å; D470-G473 PolarHBondContact O-N 2.04Å; D470-G473 VanDerWaalsContact O-N 3.15Å; D470-L474 WeakPolarHBondContact O-CG 3.36Å; D470-L474 PolarHBondContact O-N 2.79Å
471N86.6Confident88.2Confident88 Ų8899.4 Ų99.447%0.47149%0.493SS..Hα-helixtrans-61.8-44.9173.5-80.2-35.7000111.8I467 E468 G473 L474 E475I467-N471 WeakPolarHBondContact CG2-ND2 3.41Å; I467-N471 VanDerWaalsContact O-CB 3.29Å; I467-N471 WeakPolarHBondContact O-CB 3.29Å; I467-N471 VanDerWaalsContact O-CG 3.23Å; I467-N471 PolarHBondContact O-N 2.92Å; I467-N471 PolarHBondContact O-ND2 2.86Å; I467-N471 VanDerWaalsContact O-ND2 3.11Å; E468-N471 PolarHBondContact O-N 3.06Å; N471-G473 VanDerWaalsContact C-N 3.28Å; N471-G473 PolarHBondContact O-N 3.43Å; N471-L474 PolarHBondContact O-N 2.98Å; N471-E475 PolarHBondContact O-N 2.7Å
472E90.5Very high88.5Confident112 Ų112102.8 Ų102.852%0.52350%0.502SS..Hα-helixtrans-57.6-41.3171.5-83.5-156.4177.400111.9E468 E475 K476E468-E472 PolarHBondContact O-N 3.15Å; E472-E475 PolarHBondContact O-N 2.63Å; E472-K476 WeakPolarHBondContact O-CB 3.27Å; E472-K476 VanDerWaalsContact O-CD 3.23Å; E472-K476 WeakPolarHBondContact O-CD 3.36Å; E472-K476 WeakPolarHBondContact O-CG 3.46Å; E472-K476 PolarHBondContact O-N 3.34Å; E472-K476 IonicContact OE2-NZ 3.21Å; E472-K476 PolarHBondContact OE2-NZ 2.85Å
473G91.8Very high88.4Confident37 Ų37100.8 Ų100.838%0.38150%0.501SS..Hα-helixtrans-61-44.6175.900000112.4R469 D470 N471 K476 L477R469-G473 PolarHBondContact O-N 2.8Å; R469-G473 VanDerWaalsContact O-N 3.12Å; D470-G473 WeakPolarHBondContact O-CA 3.39Å; D470-G473 PolarHBondContact O-N 2.04Å; D470-G473 VanDerWaalsContact O-N 3.15Å; N471-G473 VanDerWaalsContact C-N 3.28Å; N471-G473 PolarHBondContact O-N 3.43Å; G473-K476 PolarHBondContact O-N 3.13Å; G473-L477 WeakPolarHBondContact O-CB 3.11Å; G473-L477 PolarHBondContact O-N 3.07Å; G473-L477 VanDerWaalsContact O-N 3.07Å
474L86.8Confident88.5Confident107 Ų107101.5 Ų101.556%0.5651%0.505SS*.Hα-helixtrans-66.1-42.7176.1-70.9171000112.2D470 N471 L477 V478D470-L474 WeakPolarHBondContact O-CG 3.36Å; D470-L474 PolarHBondContact O-N 2.79Å; N471-L474 PolarHBondContact O-N 2.98Å; L474-L477 PolarHBondContact O-N 2.84Å; L474-V478 WeakPolarHBondContact O-CB 3.45Å; L474-V478 VanDerWaalsContact O-CG2 3.3Å; L474-V478 WeakPolarHBondContact O-CG2 3.19Å; L474-V478 PolarHBondContact O-N 3.15Å
475E89.2Confident88.4Confident134 Ų134102.3 Ų102.363%0.62651%0.509SS*.Hα-helixtrans-61.6-44175-74.8-142.9143.800112N471 E472 L477 V478 N479N471-E475 PolarHBondContact O-N 2.7Å; E472-E475 PolarHBondContact O-N 2.63Å; E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 3.22Å; E475-V478 PolarHBondContact O-N 2.99Å; E475-N479 WeakPolarHBondContact O-CB 3.44Å; E475-N479 PolarHBondContact O-N 3.49Å; E475-N479 PolarHBondContact O-ND2 3.03Å
476K91.9Very high88.1Confident128 Ų12899.8 Ų99.856%0.55751%0.506SS*.Hα-helixtrans-59.8-42.2176.7-71.1159.8-164.8168.60110.8E472 G473 Q480E472-K476 WeakPolarHBondContact O-CB 3.27Å; E472-K476 VanDerWaalsContact O-CD 3.23Å; E472-K476 WeakPolarHBondContact O-CD 3.36Å; E472-K476 WeakPolarHBondContact O-CG 3.46Å; E472-K476 PolarHBondContact O-N 3.34Å; E472-K476 IonicContact OE2-NZ 3.21Å; E472-K476 PolarHBondContact OE2-NZ 2.85Å; G473-K476 PolarHBondContact O-N 3.13Å; K476-Q480 WeakPolarHBondContact O-CB 3.4Å; K476-Q480 PolarHBondContact O-N 2.95Å
477L89.3Confident87.7Confident93 Ų9399.1 Ų99.149%0.48751%0.512SS..Hα-helixtrans-71.7-40.5178.5-166.8150.4000112.8G473 L474 E475 Q480 L481G473-L477 WeakPolarHBondContact O-CB 3.11Å; G473-L477 PolarHBondContact O-N 3.07Å; G473-L477 VanDerWaalsContact O-N 3.07Å; L474-L477 PolarHBondContact O-N 2.84Å; E475-L477 VanDerWaalsContact C-N 3.3Å; E475-L477 PolarHBondContact O-N 3.22Å; L477-Q480 PolarHBondContact O-N 3.47Å; L477-L481 HydrophobicContact CD2-CD1 3.71Å; L477-L481 HydrophobicContact CD2-CG 4.25Å; L477-L481 WeakPolarHBondContact O-CG 2.99Å; L477-L481 PolarHBondContact O-N 3.19Å
478V88.7Confident87.3Confident70 Ų7098.9 Ų98.942%0.42452%0.515SS..Hα-helixtrans-63.7-42174.7166.70000111.1L474 E475 L481 R482L474-V478 WeakPolarHBondContact O-CB 3.45Å; L474-V478 VanDerWaalsContact O-CG2 3.3Å; L474-V478 WeakPolarHBondContact O-CG2 3.19Å; L474-V478 PolarHBondContact O-N 3.15Å; E475-V478 PolarHBondContact O-N 2.99Å; V478-L481 PolarHBondContact O-N 3.24Å; V478-R482 WeakPolarHBondContact O-CB 3.2Å; V478-R482 PolarHBondContact O-N 2.62Å
479N90Very high86.4Confident74 Ų7497.4 Ų97.440%0.39651%0.514SS..Hα-helixtrans-66.4-40.3175.3-74.3-48.2000111.5E475 L481 R482 S483E475-N479 WeakPolarHBondContact O-CB 3.44Å; E475-N479 PolarHBondContact O-N 3.49Å; E475-N479 PolarHBondContact O-ND2 3.03Å; N479-L481 PolarHBondContact O-N 2.73Å; N479-R482 PolarHBondContact O-N 3.48Å; N479-S483 PolarHBondContact O-N 2.68Å; N479-S483 PolarHBondContact O-OG 2.73Å
480Q90.7Very high85.2Confident121 Ų12198.4 Ų98.457%0.56553%0.529SS*.Hα-helixtrans-60.7-44173.9-168.5178.33100112.4K476 L477 S483 Q484K476-Q480 WeakPolarHBondContact O-CB 3.4Å; K476-Q480 PolarHBondContact O-N 2.95Å; L477-Q480 PolarHBondContact O-N 3.47Å; Q480-S483 PolarHBondContact O-N 3.27Å; Q480-Q484 WeakPolarHBondContact O-CG 3.4Å; Q480-Q484 PolarHBondContact O-N 3.43Å
481L87.2Confident83.8Confident79 Ų7998.9 Ų98.941%0.41454%0.536SS..Hα-helixtrans-63.7-42.1174.1-75.6174000112.2L477 V478 N479 S483 Q484 M485L477-L481 HydrophobicContact CD2-CD1 3.71Å; L477-L481 HydrophobicContact CD2-CG 4.25Å; L477-L481 WeakPolarHBondContact O-CG 2.99Å; L477-L481 PolarHBondContact O-N 3.19Å; V478-L481 PolarHBondContact O-N 3.24Å; N479-L481 PolarHBondContact O-N 2.73Å; L481-S483 VanDerWaalsContact C-N 3.34Å; L481-S483 PolarHBondContact O-N 3.07Å; L481-Q484 PolarHBondContact O-N 3.44Å; L481-M485 WeakPolarHBondContact O-CG 3.29Å; L481-M485 PolarHBondContact O-N 2.87Å
482R88.9Confident82.1Confident162 Ų162105 Ų10561%0.61155%0.553SS**Hα-helixtrans-62.2-40.9177.1-172.5-179-74.1159.4-6.3111.4V478 N479 M485 A486V478-R482 WeakPolarHBondContact O-CB 3.2Å; V478-R482 PolarHBondContact O-N 2.62Å; N479-R482 PolarHBondContact O-N 3.48Å; R482-M485 PolarHBondContact O-N 3.49Å; R482-A486 WeakPolarHBondContact O-CB 3.38Å; R482-A486 PolarHBondContact O-N 2.92Å
483S87.2Confident80.2Confident82 Ų82106.8 Ų106.857%0.57357%0.566SS**Hα-helixtrans-64.9-40172.9-63.80000112.8N479 Q480 L481 A487N479-S483 PolarHBondContact O-N 2.68Å; N479-S483 PolarHBondContact O-OG 2.73Å; Q480-S483 PolarHBondContact O-N 3.27Å; L481-S483 VanDerWaalsContact C-N 3.34Å; L481-S483 PolarHBondContact O-N 3.07Å; S483-A487 WeakPolarHBondContact O-CB 3.39Å; S483-A487 PolarHBondContact O-N 3.48Å
484Q86.2Confident78Confident110 Ų110113.9 Ų113.951%0.51459%0.589SS.*Hα-helixtrans-64.3-44.9175.2-74.5177.47.500111.8Q480 L481 A486 A487 T488Q480-Q484 WeakPolarHBondContact O-CG 3.4Å; Q480-Q484 PolarHBondContact O-N 3.43Å; L481-Q484 PolarHBondContact O-N 3.44Å; Q484-A486 PolarHBondContact O-N 3.04Å; Q484-A487 PolarHBondContact O-N 2.96Å; Q484-T488 WeakPolarHBondContact O-CG2 3.41Å; Q484-T488 PolarHBondContact O-N 2.82Å; Q484-T488 PolarHBondContact O-OG1 3.1Å
485M82.2Confident76.3Confident124 Ų124117.5 Ų117.561%0.61160%0.603SS**Hα-helixtrans-59.1-48.8176.2-70.1-178.4-170.500111.3L481 R482 A487 T488 T489L481-M485 WeakPolarHBondContact O-CG 3.29Å; L481-M485 PolarHBondContact O-N 2.87Å; R482-M485 PolarHBondContact O-N 3.49Å; M485-A487 VanDerWaalsContact C-N 3.3Å; M485-A487 PolarHBondContact O-N 2.89Å; M485-T488 PolarHBondContact O-N 3.26Å; M485-T488 PolarHBondContact O-OG1 2.82Å; M485-T489 PolarHBondContact O-N 3.38Å; M485-T489 PolarHBondContact O-OG1 2.92Å
486A82.1Confident74Confident52 Ų52118.1 Ų118.143%0.4361%0.605SS.*Hα-helixtrans-59.5-38.417800000113R482 Q484 T489R482-A486 WeakPolarHBondContact O-CB 3.38Å; R482-A486 PolarHBondContact O-N 2.92Å; Q484-A486 PolarHBondContact O-N 3.04Å; A486-T489 PolarHBondContact O-OG1 3.36Å; A486-T489 VanDerWaalsContact O-OG1 3.09Å
487A80.5Confident71.7Confident63 Ų63122.1 Ų122.152%0.52162%0.623SS.*Hα-helixtrans-64.9-37.9174.300000112.4S483 Q484 M485S483-A487 WeakPolarHBondContact O-CB 3.39Å; S483-A487 PolarHBondContact O-N 3.48Å; Q484-A487 PolarHBondContact O-N 2.96Å; M485-A487 VanDerWaalsContact C-N 3.3Å; M485-A487 PolarHBondContact O-N 2.89Å
488T77.1Confident69.4Low93 Ų93123 Ų12357%0.57163%0.628SS**Hα-helixtrans-77.1-27179.556.60000114.9Q484 M485 T491Q484-T488 WeakPolarHBondContact O-CG2 3.41Å; Q484-T488 PolarHBondContact O-N 2.82Å; Q484-T488 PolarHBondContact O-OG1 3.1Å; M485-T488 PolarHBondContact O-N 3.26Å; M485-T488 PolarHBondContact O-OG1 2.82Å; T488-T491 PolarHBondContact O-OG1 3.31Å
489T69.9Low67.3Low86 Ų86126.6 Ų126.653%0.52865%0.645SS.*Hα-helixtrans-74.3-36.9178.543.30000112.6M485 A486 T491M485-T489 PolarHBondContact O-N 3.38Å; M485-T489 PolarHBondContact O-OG1 2.92Å; A486-T489 PolarHBondContact O-OG1 3.36Å; A486-T489 VanDerWaalsContact O-OG1 3.09Å; T489-T491 PolarHBondContact O-N 3.47Å; T489-T491 VanDerWaalsContact O-N 3.09Å
490N63.9Low64.9Low144 Ų144128.7 Ų128.777%0.7766%0.661SS**THydrogen-bonded Turntrans-71.6-3.4-176.9-73.27.2000114.4
491T58.3Low62.8Low118 Ų118128.8 Ų128.872%0.72467%0.669SS**THydrogen-bonded Turntrans-110.916.1-17552.60000114.5T488 T489T488-T491 PolarHBondContact O-OG1 3.31Å; T489-T491 PolarHBondContact O-N 3.47Å; T489-T491 VanDerWaalsContact O-N 3.09Å
492R52.1Low60.6Low217 Ų217132.9 Ų132.982%0.81969%0.686SS**SBendtrans-120.7-23.4-172.4-164.3163.7-176.8130.74.4117.2
493D51Low58.3Low149 Ų149131.1 Ų131.180%0.79769%0.694SS**SBendtrans-99.5-0.8-166.3-65.7-18.2000115.4H495D493-H495 PolarHBondContact O-N 3.07Å
494E45.6Very low56Low186 Ų186133.3 Ų133.387%0.86970%0.703SS**  trans-87.769.6173.4-68.8-162.2150.500113
495H49.9Very low53.6Low183 Ų183133 Ų13385%0.84771%0.714SS**  trans-161.878154-103.9-57.8000114.9D493D493-H495 PolarHBondContact O-N 3.07Å
496H41.3Very low51.5Low147 Ų147131.8 Ų131.868%0.68172%0.717SS**  45107.5127.1-165.427.3000119.7D498H496-D498 IonicContact CE1-OD2 2.76Å; H496-D498 PolarHBondContact CE1-OD2 3.3Å; H496-D498 IonicContact ND1-OD2 3.53Å; H496-D498 PolarHBondContact ND1-OD2 3.4Å
497F43.7Very low49.3Very low212 Ų212136.3 Ų136.393%0.9373%0.734SS**  trans-154124.5137.4-119.8-73.6000111.5
498D41.6Very low47.5Very low111 Ų111142 Ų14259%0.59475%0.752SS**  trans-82.3148.1176.9-67.4-84.3000112.7H496H496-D498 IonicContact CE1-OD2 2.76Å; H496-D498 PolarHBondContact CE1-OD2 3.3Å; H496-D498 IonicContact ND1-OD2 3.53Å; H496-D498 PolarHBondContact ND1-OD2 3.4Å
499N44.7Very low45.6Very low145 Ų145141.4 Ų141.478%0.77576%0.757SS**  171.7126.6116.4-90.6-68.5000112.7
500T38.8Very low44.3Very low119 Ų119144.5 Ų144.573%0.7377%0.768SS**  28.4139.6129.617.10000120.6
501V46.6Very low43Very low123 Ų123141.7 Ų141.775%0.74577%0.766SS**  cis-145.2164.428.1-175.80000112
502E41.1Very low42.1Very low165 Ų165141 Ų14177%0.77177%0.766SS**  trans-52.4161.7168.3-55.9147.912500113.5
503T41.4Very low41.5Very low125 Ų125136.1 Ų136.177%0.76777%0.765SS**  -168.7155.161.325.80000115.4
504T38.2Very low41.4Very low127 Ų127134.1 Ų134.178%0.77976%0.76SS**  trans-9157.9144.956.70000119.9
505S35.7Very low40.9Very low104 Ų104131.2 Ų131.273%0.72776%0.755SS**  cis-173.1156.112.3133.50000113
506S38.4Very low40.4Very low98 Ų98129.3 Ų129.369%0.68576%0.756SS**  trans41.9131.1143.6-155.80000123.9
507D36.7Very low40.2Very low147 Ų147130.9 Ų130.979%0.78676%0.763SS**  trans7.9134.7146-53.4-13.3000121.8
508M42.8Very low40.9Very low182 Ų182125.9 Ų125.990%0.89775%0.752SS**  -173.1169.8103.2-95-153.879.900112.9
509A36.5Very low41.3Very low81 Ų81125.5 Ų125.567%0.66976%0.756SS**  trans-102.5-172.8-165.100000115.5
510I41.7Very low41.2Very low151 Ų151125.1 Ų125.177%0.77475%0.754SS**  trans94112.9158.4-59.6161.1000118.2
511A38.1Very low41.3Very low86 Ų86127.9 Ų127.971%0.71176%0.758SS**  trans58.5162.7143.800000121.2
512S37.6Very low41.7Very low104 Ų104127.1 Ų127.173%0.72776%0.756SS**  cis-171.7153-31.2-900000109.7
513S40.9Very low41.7Very low114 Ų114124.3 Ų124.380%0.79776%0.761SS**  trans75.5169154.388.60000117.2
514P48.9Very low41.4Very low107 Ų107125.4 Ų125.470%0.69576%0.762SS**  -145.2-168.9-105.935.8-10.6000117.2
515T34.9Very low41.4Very low125 Ų125125.5 Ų125.577%0.76776%0.757SS**  trans82124.3149.8-47.50000119.7
516V38.8Very low41.4Very low142 Ų142126.9 Ų126.986%0.86176%0.761SS**  179.4161.1122.6152.20000109.3
517Q37.9Very low41.1Very low180 Ų180126.6 Ų126.684%0.84176%0.759SS**  trans-109.7175.6-163.5-106.8-174.8-3900114.5
518P57.2Low41Very low107 Ų107125.2 Ų125.270%0.69575%0.752SS**  trans-86.5-166.3-169.639.6-39.9000113.6
519P50.4Low40.6Very low103 Ų103124.5 Ų124.567%0.66975%0.746SS**  -156.5-174.291.845.6-26.5000118.1
520D42.4Very low40.5Very low138 Ų138124.8 Ų124.874%0.73875%0.749SS**  trans69.9108.8150.4-53.4-26.8000125.2
521E42.1Very low40.3Very low176 Ų176126.2 Ų126.282%0.82275%0.75SS**  31.9168.3105.2-74.7-150.214200123.5
522P53.6Low40.3Very low107 Ų107128.3 Ų128.370%0.69575%0.749SS**  cis-141-179.5-44.141-24.4000113.5
523A40.7Very low40.2Very low106 Ų106127.8 Ų127.888%0.87675%0.751SS**  trans-175.5160.3147.200000112.6
524D36.9Very low40Very low148 Ų148130 Ų13079%0.79175%0.751SS**  trans-137.4-178-172.5-176.228000111.7
525L37.8Very low39.4Very low130 Ų130131 Ų13168%0.68176%0.755SS**  trans108.4112.4155.6-57.4173.8000119.2
526T35.2Very low39.9Very low132 Ų132131.1 Ų131.181%0.8175%0.75SS**  trans65.6157.5133.960.30000120.6
527S33.2Very low40Very low92 Ų92132.8 Ų132.864%0.64375%0.748SS**  cis-166.1170.4-27.3-169.70000109
528D34Very low40.1Very low119 Ų119132.5 Ų132.564%0.63675%0.747SS**  trans71.1130.1152.2-77-72.6000123.7
529Q34.4Very low39.4Very low166 Ų166132.3 Ų132.378%0.77675%0.745SS**  trans71.797.8133.4-68.3171.555.200122.7
530A34.7Very low38.9Very low88 Ų88137.4 Ų137.473%0.72776%0.757SS**  70.9123107.500000122.7
531K37Very low38.9Very low181 Ų181140.9 Ų140.979%0.78777%0.765SS**  trans86.1136.2135.4-81.8-174.9166.5-154.10122.7
532D36.8Very low38.8Very low129 Ų129141.7 Ų141.769%0.6977%0.769SS**  trans68.3102.1140.1-56.1-20.3000122.1
533A35.8Very low38.2Very low93 Ų93141.6 Ų141.677%0.76977%0.771SS**  92.2144.712100000122.6
534M38Very low38.1Very low162 Ų162143.2 Ų143.280%0.79877%0.77SS**  trans64.1118.4168.5-58.4-17473.200116.9
535T36.3Very low38.8Very low127 Ų127145.5 Ų145.578%0.77977%0.773SS**  cis86.2148.249.8-56.20000112.8
536I44.7Very low39.3Very low128 Ų128147.9 Ų147.966%0.65678%0.781SS**  trans89.689.7-178-53.6178.2000112.8
537E40.7Very low40.2Very low177 Ų177149.4 Ų149.483%0.82778%0.777SS**  84.6158.3101-73.6174.8178.600113.3
538E40.3Very low41.6Very low174 Ų174149.2 Ų149.281%0.81377%0.768SS**  cis-138.3179.216-118.4-139.1116.300111.5
539P43Very low43.4Very low102 Ų102147.6 Ų147.666%0.66277%0.765SS**  trans-107.4168.4-151.140.9-38.6000117.9
540K39.6Very low45.2Very low211 Ų211144.4 Ų144.492%0.91776%0.757SS**  trans-149143.4153-113.6157.7-169.7166.30113.3
541K41.6Very low47Very low211 Ų211143.1 Ų143.192%0.91775%0.746SS**  trans-61.8135.6-169.6-57.3167.8-179.9176.80113.5
542E40.1Very low48.6Very low193 Ų193141.7 Ų141.790%0.90274%0.735SS**  trans-140.4160.1157.5-120165.2-157.200110.4
543S41.8Very low50.6Low105 Ų105139.8 Ų139.873%0.73473%0.728SS**  trans-82128.5-160.753.80000114.3F545S543-F545 PolarHBondContact O-N 2.93Å
544T39.1Very low52.6Low140 Ų140138.5 Ų138.586%0.85972%0.718SS**  trans-66.591.7174.3-47.20000111.9Q546T544-Q546 PolarHBondContact O-N 3.34Å
545F50.7Low54.6Low195 Ų195138.4 Ų138.486%0.85571%0.709SS**  trans-76.1117.5166.7-139.5-90.3000108.7S543 F547S543-F545 PolarHBondContact O-N 2.93Å; F545-F547 PolarHBondContact O-N 3.02Å; F545-F547 VanDerWaalsContact O-N 3.12Å
546Q48.9Very low56.8Low181 Ų181136.9 Ų136.985%0.84669%0.693SS**  trans-78.3102-173.7-153.2170.415.100109.7T544 D548T544-Q546 PolarHBondContact O-N 3.34Å; Q546-D548 PolarHBondContact O-N 2.68Å
547F53.9Low58.7Low163 Ų163136.9 Ų136.972%0.71569%0.688SS**  trans-70.6114.3-179.7-167.1-86000109.9F545 P549F545-F547 PolarHBondContact O-N 3.02Å; F545-F547 VanDerWaalsContact O-N 3.12Å; F547-P549 VanDerWaalsContact O-CD 3.26Å; F547-P549 WeakPolarHBondContact O-CD 3.25Å
548D62.9Low60.7Low88 Ų88135.6 Ų135.647%0.47168%0.677SS.*  trans-86.7107.7176.8177.117.9000110.6Q546 T550 A551Q546-D548 PolarHBondContact O-N 2.68Å; D548-T550 PolarHBondContact O-N 2.88Å; D548-T550 WeakPolarHBondContact OD1-CB 3.22Å; D548-T550 PolarHBondContact OD1-N 3.34Å; D548-T550 PolarHBondContact OD1-OG1 3.23Å; D548-A551 PolarHBondContact O-N 2.87Å
549P70.4Confident62.9Low86 Ų86131 Ų13156%0.55866%0.655SS**Hα-helixtrans-65.7-20.9178.329.2-35.8000112.7F547 A551 W552 V553F547-P549 VanDerWaalsContact O-CD 3.26Å; F547-P549 WeakPolarHBondContact O-CD 3.25Å; P549-A551 VanDerWaalsContact C-N 3.28Å; P549-A551 PolarHBondContact O-N 2.88Å; P549-W552 PolarHBondContact O-N 3.46Å; P549-V553 PolarHBondContact O-N 2.91Å
550T73.3Confident65.1Low99 Ų99131.3 Ų131.361%0.60765%0.648SS**Hα-helixtrans-64.7-34.4-179.7-32.10000111.6D548 W552 A554D548-T550 PolarHBondContact O-N 2.88Å; D548-T550 WeakPolarHBondContact OD1-CB 3.22Å; D548-T550 PolarHBondContact OD1-N 3.34Å; D548-T550 PolarHBondContact OD1-OG1 3.23Å; T550-W552 VanDerWaalsContact C-N 3.33Å; T550-W552 PolarHBondContact O-N 2.89Å; T550-A554 PolarHBondContact O-N 3.41Å
551A71.3Confident67.3Low60 Ų60125.8 Ų125.850%0.49663%0.628SS.*Hα-helixtrans-69.5-27.417700000113.3D548 P549 R555D548-A551 PolarHBondContact O-N 2.87Å; P549-A551 VanDerWaalsContact C-N 3.28Å; P549-A551 PolarHBondContact O-N 2.88Å; A551-R555 PolarHBondContact O-N 2.8Å
552W71.6Confident69.5Low151 Ų151122.1 Ų122.157%0.57261%0.608SS**Hα-helixtrans-74.3-47-179.4-160.283.5000111.4P549 T550 A554 R555 E556P549-W552 PolarHBondContact O-N 3.46Å; T550-W552 VanDerWaalsContact C-N 3.33Å; T550-W552 PolarHBondContact O-N 2.89Å; W552-A554 VanDerWaalsContact C-N 3.27Å; W552-A554 PolarHBondContact O-N 3.33Å; W552-R555 WeakPolarHBondContact O-CB 3.42Å; W552-R555 PolarHBondContact O-N 2.75Å; W552-E556 WeakPolarHBondContact CZ3-OE2 3.41Å; W552-E556 PolarHBondContact O-N 3.42Å
553V77.9Confident71.9Confident89 Ų89117.9 Ų117.954%0.53959%0.592SS.*Hα-helixtrans-60.7-35.7176-179.40000111.9P549 R555 K557P549-V553 PolarHBondContact O-N 2.91Å; V553-R555 VanDerWaalsContact C-N 3.29Å; V553-R555 PolarHBondContact O-N 2.9Å; V553-K557 WeakPolarHBondContact O-CB 3.38Å; V553-K557 PolarHBondContact O-N 3.26Å
554A77.5Confident74.1Confident67 Ų67118.2 Ų118.255%0.55458%0.582SS**Hα-helixtrans-65.8-31.5175.100000112.9T550 W552 Y558T550-A554 PolarHBondContact O-N 3.41Å; W552-A554 VanDerWaalsContact C-N 3.27Å; W552-A554 PolarHBondContact O-N 3.33Å; A554-Y558 PolarHBondContact O-N 2.69Å
555R80.5Confident76.5Confident159 Ų159118 Ų11860%0.657%0.569SS**Hα-helixtrans-78.7-47.4178.2-179.2177.5176.1160.82.7112.2A551 W552 V553 K557 Y558 E559A551-R555 PolarHBondContact O-N 2.8Å; W552-R555 WeakPolarHBondContact O-CB 3.42Å; W552-R555 PolarHBondContact O-N 2.75Å; V553-R555 VanDerWaalsContact C-N 3.29Å; V553-R555 PolarHBondContact O-N 2.9Å; R555-K557 VanDerWaalsContact C-N 3.29Å; R555-K557 PolarHBondContact O-N 2.77Å; R555-Y558 WeakPolarHBondContact O-CA 3.28Å; R555-Y558 WeakPolarHBondContact O-CB 3.3Å; R555-Y558 PolarHBondContact O-N 2.87Å; R555-E559 IonicContact CZ-OE1 3.2Å; R555-E559 IonicContact NE-OE1 2.94Å; R555-E559 PolarHBondContact NE-OE1 3.43Å; R555-E559 IonicContact NH2-OE1 2.66Å; R555-E559 PolarHBondContact NH2-OE1 2.73Å; R555-E559 PolarHBondContact O-N 3.44Å
556E82.2Confident78.3Confident95 Ų95114.1 Ų114.144%0.44455%0.553SS.*Hα-helixtrans-53.1-49.2176.2-174.5171.9-135.300110.3W552 Y558 E559 E560W552-E556 WeakPolarHBondContact CZ3-OE2 3.41Å; W552-E556 PolarHBondContact O-N 3.42Å; E556-Y558 VanDerWaalsContact C-N 3.31Å; E556-Y558 PolarHBondContact O-N 2.89Å; E556-E559 PolarHBondContact O-N 3.48Å; E556-E559 VanDerWaalsContact O-N 3.13Å; E556-E560 PolarHBondContact O-N 3.29Å
557K84.5Confident80.2Confident129 Ų129109.3 Ų109.356%0.56154%0.539SS*.Hα-helixtrans-65.1-26.9175.7-169.9172.6-177.4178.30114.8V553 R555 L561V553-K557 WeakPolarHBondContact O-CB 3.38Å; V553-K557 PolarHBondContact O-N 3.26Å; R555-K557 VanDerWaalsContact C-N 3.29Å; R555-K557 PolarHBondContact O-N 2.77Å; K557-L561 WeakPolarHBondContact O-CB 3.37Å; K557-L561 VanDerWaalsContact O-CG 3.28Å; K557-L561 WeakPolarHBondContact O-CG 3.13Å; K557-L561 PolarHBondContact O-N 3.27Å; K557-L561 VanDerWaalsContact O-N 3.12Å
558Y83.6Confident81.9Confident150 Ų150107 Ų10759%0.58853%0.534SS*.Hα-helixtrans-75.5-36.3173.4-177.8-93.3000111.4A554 R555 E556 R562A554-Y558 PolarHBondContact O-N 2.69Å; R555-Y558 WeakPolarHBondContact O-CA 3.28Å; R555-Y558 WeakPolarHBondContact O-CB 3.3Å; R555-Y558 PolarHBondContact O-N 2.87Å; E556-Y558 VanDerWaalsContact C-N 3.31Å; E556-Y558 PolarHBondContact O-N 2.89Å; Y558-R562 VanDerWaalsContact O-CB 3.32Å; Y558-R562 WeakPolarHBondContact O-CB 3.36Å; Y558-R562 PolarHBondContact O-N 2.94Å
559E87.4Confident83.1Confident78 Ų78106.6 Ų106.636%0.36453%0.532SS..Hα-helixtrans-69.6-42174.3-69.7171.6-175.900110R555 E556 L561 R562 D563R555-E559 IonicContact CZ-OE1 3.2Å; R555-E559 IonicContact NE-OE1 2.94Å; R555-E559 PolarHBondContact NE-OE1 3.43Å; R555-E559 IonicContact NH2-OE1 2.66Å; R555-E559 PolarHBondContact NH2-OE1 2.73Å; R555-E559 PolarHBondContact O-N 3.44Å; E556-E559 PolarHBondContact O-N 3.48Å; E556-E559 VanDerWaalsContact O-N 3.13Å; E559-L561 PolarHBondContact O-N 2.91Å; E559-R562 WeakPolarHBondContact O-CB 3.41Å; E559-R562 PolarHBondContact O-N 2.93Å; E559-R562 VanDerWaalsContact O-N 3.15Å; E559-D563 PolarHBondContact O-N 3.4Å
560E88.6Confident84.1Confident108 Ų108105.1 Ų105.151%0.50553%0.527SS..Hα-helixtrans-53.8-49.8168.4-72-175.6144.500113.2E556 R562 D563 Q564E556-E560 PolarHBondContact O-N 3.29Å; E560-R562 VanDerWaalsContact C-N 3.27Å; E560-R562 PolarHBondContact O-N 3.04Å; E560-D563 PolarHBondContact O-N 3.41Å; E560-Q564 WeakPolarHBondContact O-CB 3.4Å; E560-Q564 WeakPolarHBondContact O-CG 3.43Å; E560-Q564 PolarHBondContact O-N 3.22Å
561L86.1Confident84.8Confident94 Ų94102.5 Ų102.549%0.49252%0.515SS..Hα-helixtrans-67-29.3179.9-77.2170.1000112.4K557 E559 K565K557-L561 WeakPolarHBondContact O-CB 3.37Å; K557-L561 VanDerWaalsContact O-CG 3.28Å; K557-L561 WeakPolarHBondContact O-CG 3.13Å; K557-L561 PolarHBondContact O-N 3.27Å; K557-L561 VanDerWaalsContact O-N 3.12Å; E559-L561 PolarHBondContact O-N 2.91Å; L561-K565 WeakPolarHBondContact O-CB 3.4Å; L561-K565 PolarHBondContact O-N 3.26Å
562R87.1Confident85.5Confident134 Ų134103.8 Ų103.851%0.50651%0.513SS..Hα-helixtrans-69.2-44.1174.6-167.7-176.2-163.5149.76110.8Y558 E559 E560 K565 H566Y558-R562 VanDerWaalsContact O-CB 3.32Å; Y558-R562 WeakPolarHBondContact O-CB 3.36Å; Y558-R562 PolarHBondContact O-N 2.94Å; E559-R562 WeakPolarHBondContact O-CB 3.41Å; E559-R562 PolarHBondContact O-N 2.93Å; E559-R562 VanDerWaalsContact O-N 3.15Å; E560-R562 VanDerWaalsContact C-N 3.27Å; E560-R562 PolarHBondContact O-N 3.04Å; R562-K565 WeakPolarHBondContact O-CB 3.43Å; R562-K565 PolarHBondContact O-N 2.93Å; R562-H566 PolarHBondContact O-CD2 3.45Å; R562-H566 PolarHBondContact O-N 2.99Å
563D90.2Very high86.5Confident105 Ų105100.2 Ų100.256%0.56151%0.508SS*.Hα-helixtrans-72.7-37.2-179.6-68.3-9.8000111.5E559 E560 K565 H566 S567E559-D563 PolarHBondContact O-N 3.4Å; E560-D563 PolarHBondContact O-N 3.41Å; D563-K565 VanDerWaalsContact C-N 3.32Å; D563-K565 PolarHBondContact O-N 2.97Å; D563-H566 PolarHBondContact O-N 2.75Å; D563-S567 WeakPolarHBondContact O-CB 3.39Å; D563-S567 PolarHBondContact O-N 3.43Å
564Q89.1Confident87Confident111 Ų11199.9 Ų99.952%0.51950%0.503SS..Hα-helixtrans-59-41.8167.3-73.517617.500111.8E560 S567 L568E560-Q564 WeakPolarHBondContact O-CB 3.4Å; E560-Q564 WeakPolarHBondContact O-CG 3.43Å; E560-Q564 PolarHBondContact O-N 3.22Å; Q564-S567 PolarHBondContact O-N 2.88Å; Q564-L568 WeakPolarHBondContact O-CB 3.28Å; Q564-L568 WeakPolarHBondContact O-CG 3.47Å; Q564-L568 PolarHBondContact O-N 2.88Å
565K89.5Confident87.5Confident137 Ų137101.2 Ų101.260%0.59650%0.5SS*.Hα-helixtrans-65.8-39174.8-179.5175.7178.8175.80112.5L561 R562 D563 N569L561-K565 WeakPolarHBondContact O-CB 3.4Å; L561-K565 PolarHBondContact O-N 3.26Å; R562-K565 WeakPolarHBondContact O-CB 3.43Å; R562-K565 PolarHBondContact O-N 2.93Å; D563-K565 VanDerWaalsContact C-N 3.32Å; D563-K565 PolarHBondContact O-N 2.97Å; K565-N569 VanDerWaalsContact O-CB 3.3Å; K565-N569 WeakPolarHBondContact O-CB 3.24Å; K565-N569 VanDerWaalsContact O-CG 3.3Å; K565-N569 PolarHBondContact O-N 3.16Å
566H88.8Confident87.9Confident113 Ų113102 Ų10252%0.52350%0.503SS..Hα-helixtrans-67.1-40.5175-78.1-67.3000111.8R562 D563 N569 A570R562-H566 PolarHBondContact O-CD2 3.45Å; R562-H566 PolarHBondContact O-N 2.99Å; D563-H566 PolarHBondContact O-N 2.75Å; H566-N569 PolarHBondContact O-N 3.3Å; H566-A570 WeakPolarHBondContact O-CB 3.4Å; H566-A570 PolarHBondContact O-N 2.91Å
567S88.5Confident88.3Confident79 Ų7999.2 Ų99.255%0.55250%0.5SS*.Hα-helixtrans-61.6-48.9174-177.60000112.3D563 Q564 N569 A570 A571D563-S567 WeakPolarHBondContact O-CB 3.39Å; D563-S567 PolarHBondContact O-N 3.43Å; Q564-S567 PolarHBondContact O-N 2.88Å; S567-N569 PolarHBondContact O-N 2.98Å; S567-A570 PolarHBondContact O-N 3.44Å; S567-A571 PolarHBondContact O-N 2.79Å
568L88.8Confident88.5Confident116 Ų11696 Ų9661%0.60749%0.487SS*.Hα-helixtrans-63.8-38.9176.3-72.5170.4000112.6Q564 A571 L572Q564-L568 WeakPolarHBondContact O-CB 3.28Å; Q564-L568 WeakPolarHBondContact O-CG 3.47Å; Q564-L568 PolarHBondContact O-N 2.88Å; L568-A571 PolarHBondContact O-N 2.95Å; L568-L572 WeakPolarHBondContact O-CB 3.25Å; L568-L572 WeakPolarHBondContact O-CG 3.37Å; L568-L572 PolarHBondContact O-N 2.93Å
569N88.9Confident88.7Confident78 Ų7893.7 Ų93.742%0.41748%0.484SS..Hα-helixtrans-64.7-40.1173.9-81.6-10.7000112K565 H566 S567 L572 V573K565-N569 VanDerWaalsContact O-CB 3.3Å; K565-N569 WeakPolarHBondContact O-CB 3.24Å; K565-N569 VanDerWaalsContact O-CG 3.3Å; K565-N569 PolarHBondContact O-N 3.16Å; H566-N569 PolarHBondContact O-N 3.3Å; S567-N569 PolarHBondContact O-N 2.98Å; N569-L572 PolarHBondContact O-N 3.08Å; N569-V573 WeakPolarHBondContact O-CG2 3.23Å; N569-V573 PolarHBondContact O-N 2.98Å
570A89.7Confident88.7Confident55 Ų5592.5 Ų92.546%0.45549%0.488SS..Hα-helixtrans-62.8-46.3174.200000110.9H566 S567 L572 V573 L574H566-A570 WeakPolarHBondContact O-CB 3.4Å; H566-A570 PolarHBondContact O-N 2.91Å; S567-A570 PolarHBondContact O-N 3.44Å; A570-L572 VanDerWaalsContact C-N 3.35Å; A570-L572 PolarHBondContact O-N 3.05Å; A570-V573 PolarHBondContact O-N 3.33Å; A570-V573 VanDerWaalsContact O-N 3.17Å; A570-L574 WeakPolarHBondContact O-CG 3.31Å; A570-L574 PolarHBondContact O-N 3.39Å
571A89Confident88.7Confident44 Ų4489.5 Ų89.536%0.36447%0.474SS..Hα-helixtrans-58.3-42.917500000112.5S567 L568 V573 L574 L575S567-A571 PolarHBondContact O-N 2.79Å; L568-A571 PolarHBondContact O-N 2.95Å; A571-V573 PolarHBondContact O-N 2.98Å; A571-L574 PolarHBondContact O-N 2.98Å; A571-L575 WeakPolarHBondContact O-CB 3.39Å; A571-L575 WeakPolarHBondContact O-CG 3.24Å; A571-L575 PolarHBondContact O-N 3.18Å
572L86.7Confident88.7Confident87 Ų8790.5 Ų90.546%0.45548%0.479SS..Hα-helixtrans-64.8-35.6175.7-75171.1000113.2L568 N569 A570 R576L568-L572 WeakPolarHBondContact O-CB 3.25Å; L568-L572 WeakPolarHBondContact O-CG 3.37Å; L568-L572 PolarHBondContact O-N 2.93Å; N569-L572 PolarHBondContact O-N 3.08Å; A570-L572 VanDerWaalsContact C-N 3.35Å; A570-L572 PolarHBondContact O-N 3.05Å; L572-R576 WeakPolarHBondContact O-CB 3.34Å; L572-R576 VanDerWaalsContact O-CG 3.29Å; L572-R576 WeakPolarHBondContact O-CG 3.19Å; L572-R576 PolarHBondContact O-N 3.02Å
573V91.1Very high88.8Confident77 Ų7790 Ų9047%0.46748%0.483SS..Hα-helixtrans-67.7-42172.9170.10000110.8N569 A570 A571 R576 G577N569-V573 WeakPolarHBondContact O-CG2 3.23Å; N569-V573 PolarHBondContact O-N 2.98Å; A570-V573 PolarHBondContact O-N 3.33Å; A570-V573 VanDerWaalsContact O-N 3.17Å; A571-V573 PolarHBondContact O-N 2.98Å; V573-R576 PolarHBondContact O-N 3.43Å; V573-G577 PolarHBondContact O-N 3.34Å
574L88.6Confident88.8Confident81 Ų8191.2 Ų91.242%0.42448%0.483SS..Hα-helixtrans-65.4-39.7177-66.5-172.7000112.8A570 A571 G577 Q578 K1145A570-L574 WeakPolarHBondContact O-CG 3.31Å; A570-L574 PolarHBondContact O-N 3.39Å; A571-L574 PolarHBondContact O-N 2.98Å; L574-G577 PolarHBondContact O-N 3.48Å; L574-Q578 WeakPolarHBondContact O-CG 3.36Å; L574-Q578 PolarHBondContact O-N 2.98Å; L574-K1145 HydrophobicContact CD2-CD 3.59Å
575L87.9Confident88.7Confident95 Ų9589.5 Ų89.550%0.49748%0.477SS..Hα-helixtrans-67.3-40.9175.5-74.2168.7000112A571 G577 Q578 L579A571-L575 WeakPolarHBondContact O-CB 3.39Å; A571-L575 WeakPolarHBondContact O-CG 3.24Å; A571-L575 PolarHBondContact O-N 3.18Å; L575-G577 VanDerWaalsContact C-N 3.34Å; L575-Q578 PolarHBondContact O-N 3.39Å; L575-L579 WeakPolarHBondContact O-CG 3.47Å; L575-L579 PolarHBondContact O-N 2.92Å
576R90.2Very high88.6Confident175 Ų17588.3 Ų88.366%0.6647%0.474SS*.Hα-helixtrans-64.2-38174.1-76.9173.4176.3169.5-0.9112.5L572 V573 Q578 L579 A580L572-R576 WeakPolarHBondContact O-CB 3.34Å; L572-R576 VanDerWaalsContact O-CG 3.29Å; L572-R576 WeakPolarHBondContact O-CG 3.19Å; L572-R576 PolarHBondContact O-N 3.02Å; V573-R576 PolarHBondContact O-N 3.43Å; R576-Q578 VanDerWaalsContact C-N 3.35Å; R576-L579 PolarHBondContact O-N 3.4Å; R576-A580 PolarHBondContact O-N 2.91Å
577G89.6Confident88.6Confident38 Ų3886.1 Ų86.139%0.39247%0.471SS..Hα-helixtrans-60.4-44171.500000112.1V573 L574 L575 E581V573-G577 PolarHBondContact O-N 3.34Å; L574-G577 PolarHBondContact O-N 3.48Å; L575-G577 VanDerWaalsContact C-N 3.34Å; G577-E581 VanDerWaalsContact O-CB 3.28Å; G577-E581 WeakPolarHBondContact O-CB 3.42Å; G577-E581 PolarHBondContact O-N 2.94Å
578Q89.6Confident88.6Confident62 Ų6284.6 Ų84.629%0.2946%0.457SS..Hα-helixtrans-67.5-35.8177-74.9170.1-35.900113.1L574 L575 R576 E581 L582 M1149L574-Q578 WeakPolarHBondContact O-CG 3.36Å; L574-Q578 PolarHBondContact O-N 2.98Å; L575-Q578 PolarHBondContact O-N 3.39Å; R576-Q578 VanDerWaalsContact C-N 3.35Å; Q578-E581 PolarHBondContact O-N 3.32Å; Q578-L582 WeakPolarHBondContact O-CB 3.4Å; Q578-L582 VanDerWaalsContact O-CG 3.27Å; Q578-L582 WeakPolarHBondContact O-CG 3.49Å; Q578-L582 PolarHBondContact O-N 3.27Å; Q578-M1149 HydrophobicContact CG-CE 4.48Å; Q578-M1149 HydrophobicContact CG-SD 4.28Å; Q578-M1149 PolarHBondContact NE2-SD 2.87Å
579L86.9Confident88.5Confident100 Ų10085.6 Ų85.652%0.52446%0.456SS..Hα-helixtrans-65.6-50.5174.1-74.1170.5000111.7L575 R576 E581 L582 E583L575-L579 WeakPolarHBondContact O-CG 3.47Å; L575-L579 PolarHBondContact O-N 2.92Å; R576-L579 PolarHBondContact O-N 3.4Å; L579-E581 PolarHBondContact O-N 2.65Å; L579-L582 PolarHBondContact O-N 3.42Å; L579-E583 WeakPolarHBondContact O-CB 3.39Å; L579-E583 WeakPolarHBondContact O-CG 3.15Å; L579-E583 PolarHBondContact O-N 3.13Å
580A89Confident88.3Confident54 Ų5486.9 Ų86.945%0.44646%0.46SS..Hα-helixtrans-60.7-31.1177.300000112.8R576 K584R576-A580 PolarHBondContact O-N 2.91Å; A580-K584 WeakPolarHBondContact O-CB 3.38Å; A580-K584 PolarHBondContact O-N 2.38Å
581E87.7Confident88.3Confident44 Ų4490.1 Ų90.121%0.20647%0.466CS..Hα-helixtrans-74.5-35.3174.9-167.4146.1-100.400112.5G577 Q578 L579 N585 R1146G577-E581 VanDerWaalsContact O-CB 3.28Å; G577-E581 WeakPolarHBondContact O-CB 3.42Å; G577-E581 PolarHBondContact O-N 2.94Å; Q578-E581 PolarHBondContact O-N 3.32Å; L579-E581 PolarHBondContact O-N 2.65Å; E581-N585 VanDerWaalsContact O-CB 3.28Å; E581-N585 WeakPolarHBondContact O-CB 3.46Å; E581-N585 PolarHBondContact O-N 2.82Å; E581-N585 PolarHBondContact O-ND2 2.78Å; E581-R1146 IonicContact OE1-CZ 2.71Å; E581-R1146 IonicContact OE1-NE 2.64Å; E581-R1146 PolarHBondContact OE1-NE 3.12Å; E581-R1146 IonicContact OE1-NH2 3.64Å; E581-R1146 PolarHBondContact OE1-NH2 3.36Å
582L85.8Confident88.2Confident115 Ų11594.7 Ų94.760%0.60248%0.477SS*.Hα-helixtrans-70.4-42.2171.6-73.8168.6000112.1Q578 L579 N585 Q586Q578-L582 WeakPolarHBondContact O-CB 3.4Å; Q578-L582 VanDerWaalsContact O-CG 3.27Å; Q578-L582 WeakPolarHBondContact O-CG 3.49Å; Q578-L582 PolarHBondContact O-N 3.27Å; L579-L582 PolarHBondContact O-N 3.42Å; L582-N585 CarbonylContact O-C 3.52Å; L582-N585 PolarHBondContact O-N 3.08Å; L582-Q586 WeakPolarHBondContact O-CB 3.39Å; L582-Q586 PolarHBondContact O-N 3.45Å
583E88.5Confident88Confident124 Ų12495.4 Ų95.458%0.57948%0.481SS*.Hα-helixtrans-58.1-47.3173.6-72.9164.8-174.200111L579 Q586 S587L579-E583 WeakPolarHBondContact O-CB 3.39Å; L579-E583 WeakPolarHBondContact O-CG 3.15Å; L579-E583 PolarHBondContact O-N 3.13Å; E583-Q586 WeakPolarHBondContact O-CB 3.25Å; E583-Q586 PolarHBondContact O-N 3.43Å; E583-S587 PolarHBondContact O-N 2.49Å
584K90.9Very high87.9Confident130 Ų13099.9 Ų99.957%0.56549%0.49SS*.Hα-helixtrans-61.5-47.9173.4-168-159.3169.9-158.10111.6A580 Q586 S587 D588A580-K584 WeakPolarHBondContact O-CB 3.38Å; A580-K584 PolarHBondContact O-N 2.38Å; K584-Q586 PolarHBondContact O-N 2.7Å; K584-S587 PolarHBondContact O-N 3.19Å; K584-D588 WeakPolarHBondContact CE-OD2 3.35Å; K584-D588 IonicContact NZ-OD2 2.63Å; K584-D588 WeakPolarHBondContact O-CB 3.46Å; K584-D588 PolarHBondContact O-N 3.3Å
585N86.7Confident87.8Confident75 Ų75101.4 Ų101.440%0.40150%0.498SS..Hα-helixtrans-64.4-21.3178.2-82.9-59.4000113.5E581 L582 K589E581-N585 VanDerWaalsContact O-CB 3.28Å; E581-N585 WeakPolarHBondContact O-CB 3.46Å; E581-N585 PolarHBondContact O-N 2.82Å; E581-N585 PolarHBondContact O-ND2 2.78Å; L582-N585 CarbonylContact O-C 3.52Å; L582-N585 PolarHBondContact O-N 3.08Å; N585-K589 VanDerWaalsContact O-CD 3.26Å; N585-K589 WeakPolarHBondContact O-CD 3.47Å; N585-K589 WeakPolarHBondContact O-CG 3.46Å; N585-K589 PolarHBondContact O-N 3.03Å
586Q87.8Confident87.7Confident113 Ų113102.1 Ų102.153%0.52850%0.497SS..Hα-helixtrans-76.7-51170.1177.1172.3-19.100110.6L582 E583 K584 D588 K589 E590L582-Q586 WeakPolarHBondContact O-CB 3.39Å; L582-Q586 PolarHBondContact O-N 3.45Å; E583-Q586 WeakPolarHBondContact O-CB 3.25Å; E583-Q586 PolarHBondContact O-N 3.43Å; K584-Q586 PolarHBondContact O-N 2.7Å; Q586-D588 VanDerWaalsContact C-N 3.32Å; Q586-D588 PolarHBondContact O-N 3.46Å; Q586-K589 CarbonylContact O-C 3.59Å; Q586-K589 WeakPolarHBondContact O-CA 3.26Å; Q586-K589 WeakPolarHBondContact O-CB 3.35Å; Q586-K589 PolarHBondContact O-N 3.38Å; Q586-E590 HydrophobicContact CG-CG 4.35Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.49Å; Q586-E590 PolarHBondContact NE2-OE1 3.17Å; Q586-E590 WeakPolarHBondContact O-CG 3.48Å; Q586-E590 PolarHBondContact O-N 3.15Å
587S89Confident87.6Confident66 Ų6698.5 Ų98.546%0.46249%0.487SS..Hα-helixtrans-53.9-47.2174.1-177.40000112E583 K584 K589 E590 E591E583-S587 PolarHBondContact O-N 2.49Å; K584-S587 PolarHBondContact O-N 3.19Å; S587-K589 PolarHBondContact O-N 2.91Å; S587-K589 VanDerWaalsContact O-N 3.17Å; S587-E590 PolarHBondContact O-N 2.97Å; S587-E591 PolarHBondContact O-N 3.42Å
588D87.9Confident87.4Confident47 Ų47100.2 Ų100.225%0.25149%0.487SS..Hα-helixtrans-65-16.2177.4-724.8000113K584 Q586 K592K584-D588 WeakPolarHBondContact CE-OD2 3.35Å; K584-D588 IonicContact NZ-OD2 2.63Å; K584-D588 WeakPolarHBondContact O-CB 3.46Å; K584-D588 PolarHBondContact O-N 3.3Å; Q586-D588 VanDerWaalsContact C-N 3.32Å; Q586-D588 PolarHBondContact O-N 3.46Å; D588-K592 VanDerWaalsContact O-CD 3.3Å; D588-K592 WeakPolarHBondContact O-CD 3.36Å; D588-K592 WeakPolarHBondContact O-CG 3.33Å; D588-K592 PolarHBondContact O-NZ 3.4Å
589K86.2Confident87Confident137 Ų137102.3 Ų102.360%0.59650%0.498SS*.Hα-helixtrans-94.4-38.3173.1-77.3170.8-172173.90112N585 Q586 S587 K592 L593N585-K589 VanDerWaalsContact O-CD 3.26Å; N585-K589 WeakPolarHBondContact O-CD 3.47Å; N585-K589 WeakPolarHBondContact O-CG 3.46Å; N585-K589 PolarHBondContact O-N 3.03Å; Q586-K589 CarbonylContact O-C 3.59Å; Q586-K589 WeakPolarHBondContact O-CA 3.26Å; Q586-K589 WeakPolarHBondContact O-CB 3.35Å; Q586-K589 PolarHBondContact O-N 3.38Å; S587-K589 PolarHBondContact O-N 2.91Å; S587-K589 VanDerWaalsContact O-N 3.17Å; K589-K592 PolarHBondContact O-N 2.96Å; K589-L593 WeakPolarHBondContact O-CB 3.16Å; K589-L593 WeakPolarHBondContact O-CG 3.4Å; K589-L593 PolarHBondContact O-N 2.88Å
590E86.6Confident86.7Confident106 Ų106100.6 Ų100.650%0.49549%0.49SS..Hα-helixtrans-64.6-41.1175.8-72.8173.1-172.800111.2Q586 S587 L593 R594Q586-E590 HydrophobicContact CG-CG 4.35Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.49Å; Q586-E590 PolarHBondContact NE2-OE1 3.17Å; Q586-E590 WeakPolarHBondContact O-CG 3.48Å; Q586-E590 PolarHBondContact O-N 3.15Å; S587-E590 PolarHBondContact O-N 2.97Å; E590-L593 PolarHBondContact O-N 3.05Å; E590-R594 WeakPolarHBondContact O-CB 3.41Å; E590-R594 PolarHBondContact O-N 2.89Å
591E87.8Confident86.5Confident123 Ų123103.4 Ų103.458%0.57549%0.489SS*.Hα-helixtrans-61.9-43.6171.4-178.3169.8-153.800111.7S587 L593 R594 L595S587-E591 PolarHBondContact O-N 3.42Å; E591-L593 PolarHBondContact O-N 3.28Å; E591-R594 PolarHBondContact O-N 2.97Å; E591-L595 HydrophobicContact CG-CD1 3.79Å; E591-L595 PolarHBondContact O-N 2.92Å
592K87Confident86.3Confident139 Ų139106 Ų10660%0.60450%0.504SS*.Hα-helixtrans-65.6-36.6177.1-71.3179.8-170.898.40112.8D588 K589 K596D588-K592 VanDerWaalsContact O-CD 3.3Å; D588-K592 WeakPolarHBondContact O-CD 3.36Å; D588-K592 WeakPolarHBondContact O-CG 3.33Å; D588-K592 PolarHBondContact O-NZ 3.4Å; K589-K592 PolarHBondContact O-N 2.96Å; K592-K596 WeakPolarHBondContact O-CB 3.45Å; K592-K596 PolarHBondContact O-N 2.91Å
593L83.4Confident86.1Confident102 Ų102104.4 Ų104.453%0.53450%0.495SS..Hα-helixtrans-65.7-46.4173.1-77.4168.6000110.8K589 E590 E591 L595 K596 E597K589-L593 WeakPolarHBondContact O-CB 3.16Å; K589-L593 WeakPolarHBondContact O-CG 3.4Å; K589-L593 PolarHBondContact O-N 2.88Å; E590-L593 PolarHBondContact O-N 3.05Å; E591-L593 PolarHBondContact O-N 3.28Å; L593-L595 PolarHBondContact O-N 3.36Å; L593-K596 CarbonylContact O-C 3.59Å; L593-K596 WeakPolarHBondContact O-CA 3.37Å; L593-K596 WeakPolarHBondContact O-CB 3.27Å; L593-K596 PolarHBondContact O-N 3.05Å; L593-K596 VanDerWaalsContact O-N 3.1Å; L593-E597 PolarHBondContact O-N 3.21Å
594R89.2Confident85.8Confident172 Ų172104.1 Ų104.165%0.64949%0.494SS*.Hα-helixtrans-59.4-44.5176.2-178.7177.7174.1171.3-0.7112.7E590 E591 K596 E597 D598E590-R594 WeakPolarHBondContact O-CB 3.41Å; E590-R594 PolarHBondContact O-N 2.89Å; E591-R594 PolarHBondContact O-N 2.97Å; R594-K596 VanDerWaalsContact C-N 3.32Å; R594-K596 PolarHBondContact O-N 3.36Å; R594-E597 PolarHBondContact O-N 3.36Å; R594-D598 PolarHBondContact O-N 2.96Å
595L85.9Confident85.5Confident113 Ų113104.8 Ų104.859%0.59250%0.497SS*.Hα-helixtrans-61.9-38.1173.4-96.2129.6000112.4E591 L593 M599E591-L595 HydrophobicContact CG-CD1 3.79Å; E591-L595 PolarHBondContact O-N 2.92Å; L593-L595 PolarHBondContact O-N 3.36Å; L595-M599 VanDerWaalsContact O-CB 3.3Å; L595-M599 WeakPolarHBondContact O-CB 3.49Å; L595-M599 PolarHBondContact O-N 2.96Å
596K87.1Confident85.4Confident110 Ų110106.3 Ų106.348%0.47850%0.502SS..Hα-helixtrans-67.3-39.6174.4-172.1-177177.4-172.10111.8K592 L593 R594 N600K592-K596 WeakPolarHBondContact O-CB 3.45Å; K592-K596 PolarHBondContact O-N 2.91Å; L593-K596 CarbonylContact O-C 3.59Å; L593-K596 WeakPolarHBondContact O-CA 3.37Å; L593-K596 WeakPolarHBondContact O-CB 3.27Å; L593-K596 PolarHBondContact O-N 3.05Å; L593-K596 VanDerWaalsContact O-N 3.1Å; R594-K596 VanDerWaalsContact C-N 3.32Å; R594-K596 PolarHBondContact O-N 3.36Å; K596-N600 WeakPolarHBondContact O-CB 3.37Å; K596-N600 VanDerWaalsContact O-CG 3.28Å; K596-N600 PolarHBondContact O-N 3.47Å; K596-N600 PolarHBondContact O-OD1 3.35Å
597E86.9Confident85Confident98 Ų98105.5 Ų105.546%0.45850%0.5SS..Hα-helixtrans-64.8-46.1174.3-76.3-178-157.900112.4L593 R594 M599 N600 R601L593-E597 PolarHBondContact O-N 3.21Å; R594-E597 PolarHBondContact O-N 3.36Å; E597-M599 VanDerWaalsContact C-N 3.33Å; E597-M599 PolarHBondContact O-N 3.05Å; E597-N600 WeakPolarHBondContact O-CB 3.08Å; E597-N600 PolarHBondContact O-N 3.04Å; E597-R601 WeakPolarHBondContact O-CB 3.36Å; E597-R601 VanDerWaalsContact O-CG 3.29Å; E597-R601 WeakPolarHBondContact O-CG 3.48Å; E597-R601 PolarHBondContact O-N 2.95Å; E597-R601 IonicContact OE2-CZ 3.73Å; E597-R601 IonicContact OE2-NH1 3.46Å; E597-R601 IonicContact OE2-NH2 2.65Å; E597-R601 PolarHBondContact OE2-NH2 2.99Å
598D85.6Confident84.7Confident75 Ų75107.4 Ų107.440%0.40151%0.505SS..Hα-helixtrans-68.6-32.4178.8-75.3-28.6000111.9R594 R601 L602R594-D598 PolarHBondContact O-N 2.96Å; D598-R601 IonicContact OD1-CZ 3.67Å; D598-R601 IonicContact OD1-NH1 3.08Å; D598-R601 PolarHBondContact OD1-NH1 3.05Å; D598-L602 WeakPolarHBondContact O-CB 3.4Å; D598-L602 PolarHBondContact O-N 2.83Å
599M81Confident84.3Confident106 Ų106107.7 Ų107.752%0.52251%0.513SS..Hα-helixtrans-65.2-43.9168.1-174.6-178.27000112L595 E597 L602 L603L595-M599 VanDerWaalsContact O-CB 3.3Å; L595-M599 WeakPolarHBondContact O-CB 3.49Å; L595-M599 PolarHBondContact O-N 2.96Å; E597-M599 VanDerWaalsContact C-N 3.33Å; E597-M599 PolarHBondContact O-N 3.05Å; M599-L602 WeakPolarHBondContact O-CB 3.44Å; M599-L602 PolarHBondContact O-N 2.95Å; M599-L603 HydrophobicContact CG-CD1 4.3Å; M599-L603 WeakPolarHBondContact O-CG 3.32Å; M599-L603 PolarHBondContact O-N 3.45Å
600N80.8Confident84.2Confident63 Ų63106.9 Ų106.934%0.33751%0.51SS..Hα-helixtrans-62-44.6175.5-78.51.1000111.4K596 E597 L602 L603 E604K596-N600 WeakPolarHBondContact O-CB 3.37Å; K596-N600 VanDerWaalsContact O-CG 3.28Å; K596-N600 PolarHBondContact O-N 3.47Å; K596-N600 PolarHBondContact O-OD1 3.35Å; E597-N600 WeakPolarHBondContact O-CB 3.08Å; E597-N600 PolarHBondContact O-N 3.04Å; N600-L602 VanDerWaalsContact C-N 3.26Å; N600-L602 PolarHBondContact O-N 3.3Å; N600-L603 PolarHBondContact O-N 3.36Å; N600-E604 WeakPolarHBondContact O-CB 3.24Å; N600-E604 PolarHBondContact O-N 3.42Å
601R85Confident84Confident113 Ų113106.8 Ų106.843%0.42651%0.51SS..Hα-helixtrans-60.1-34.3174-71.3168.5-176.5138.712.2112.1E597 D598 K605E597-R601 WeakPolarHBondContact O-CB 3.36Å; E597-R601 VanDerWaalsContact O-CG 3.29Å; E597-R601 WeakPolarHBondContact O-CG 3.48Å; E597-R601 PolarHBondContact O-N 2.95Å; E597-R601 IonicContact OE2-CZ 3.73Å; E597-R601 IonicContact OE2-NH1 3.46Å; E597-R601 IonicContact OE2-NH2 2.65Å; E597-R601 PolarHBondContact OE2-NH2 2.99Å; D598-R601 IonicContact OD1-CZ 3.67Å; D598-R601 IonicContact OD1-NH1 3.08Å; D598-R601 PolarHBondContact OD1-NH1 3.05Å; R601-K605 WeakPolarHBondContact O-CB 3.47Å; R601-K605 WeakPolarHBondContact O-CD 3.4Å; R601-K605 WeakPolarHBondContact O-CG 3.05Å; R601-K605 PolarHBondContact O-N 3.42Å; R601-K605 VanDerWaalsContact O-N 3.1Å
602L82.6Confident83.7Confident99 Ų99102.2 Ų102.252%0.51850%0.496SS..Hα-helixtrans-71.5-43.6175.1-17762.3000111.7D598 M599 N600 K605 Q606D598-L602 WeakPolarHBondContact O-CB 3.4Å; D598-L602 PolarHBondContact O-N 2.83Å; M599-L602 WeakPolarHBondContact O-CB 3.44Å; M599-L602 PolarHBondContact O-N 2.95Å; N600-L602 VanDerWaalsContact C-N 3.26Å; N600-L602 PolarHBondContact O-N 3.3Å; L602-K605 PolarHBondContact O-N 3.39Å; L602-Q606 WeakPolarHBondContact O-CG 3.37Å; L602-Q606 PolarHBondContact O-N 2.94Å
603L81.5Confident83.5Confident82 Ų82100.2 Ų100.243%0.42949%0.488SS..Hα-helixtrans-64-41.8175.6-72.2168.9000111.9M599 N600 Q606 L607M599-L603 HydrophobicContact CG-CD1 4.3Å; M599-L603 WeakPolarHBondContact O-CG 3.32Å; M599-L603 PolarHBondContact O-N 3.45Å; N600-L603 PolarHBondContact O-N 3.36Å; L603-Q606 PolarHBondContact O-N 3.27Å; L603-L607 WeakPolarHBondContact O-CB 3.49Å; L603-L607 WeakPolarHBondContact O-CG 3.35Å; L603-L607 PolarHBondContact O-N 2.81Å
604E83.6Confident83.2Confident118 Ų118100.1 Ų100.155%0.55148%0.482SS*.Hα-helixtrans-62.1-45.3174.8-175.6177.2-148.400111.5N600 Q606 L607 L608N600-E604 WeakPolarHBondContact O-CB 3.24Å; N600-E604 PolarHBondContact O-N 3.42Å; E604-Q606 VanDerWaalsContact C-N 3.31Å; E604-Q606 PolarHBondContact O-N 2.92Å; E604-L607 PolarHBondContact O-N 3.34Å; E604-L608 HydrophobicContact CG-CD1 4.18Å; E604-L608 WeakPolarHBondContact O-CB 3.38Å; E604-L608 WeakPolarHBondContact O-CG 3.34Å; E604-L608 PolarHBondContact O-N 3.39Å
605K84.9Confident82.9Confident143 Ų14396.3 Ų96.362%0.62247%0.471SS*.Hα-helixtrans-60.9-38173.2-75.9169.8-176.9175.90112.5R601 L602 A609R601-K605 WeakPolarHBondContact O-CB 3.47Å; R601-K605 WeakPolarHBondContact O-CD 3.4Å; R601-K605 WeakPolarHBondContact O-CG 3.05Å; R601-K605 PolarHBondContact O-N 3.42Å; R601-K605 VanDerWaalsContact O-N 3.1Å; L602-K605 PolarHBondContact O-N 3.39Å; K605-A609 VanDerWaalsContact O-CB 3.29Å; K605-A609 WeakPolarHBondContact O-CB 3.49Å; K605-A609 PolarHBondContact O-N 3.14Å
606Q83.2Confident82.8Confident108 Ų10893.8 Ų93.851%0.50546%0.461SS..Hα-helixtrans-69-40.2174.5-73.3-178.521.200112.2L602 L603 E604 A609 K610L602-Q606 WeakPolarHBondContact O-CG 3.37Å; L602-Q606 PolarHBondContact O-N 2.94Å; L603-Q606 PolarHBondContact O-N 3.27Å; E604-Q606 VanDerWaalsContact C-N 3.31Å; E604-Q606 PolarHBondContact O-N 2.92Å; Q606-A609 PolarHBondContact O-N 2.88Å; Q606-K610 WeakPolarHBondContact O-CB 3.32Å; Q606-K610 VanDerWaalsContact O-CG 3.27Å; Q606-K610 WeakPolarHBondContact O-CG 3.29Å; Q606-K610 PolarHBondContact O-N 2.54Å
607L79.5Confident82.5Confident95 Ų9590.8 Ų90.850%0.49745%0.448SS..Hα-helixtrans-64.7-45176-75.9169.6000111.8L603 E604 A609 K610 Q611 L789L603-L607 WeakPolarHBondContact O-CB 3.49Å; L603-L607 WeakPolarHBondContact O-CG 3.35Å; L603-L607 PolarHBondContact O-N 2.81Å; E604-L607 PolarHBondContact O-N 3.34Å; L607-A609 PolarHBondContact O-N 2.92Å; L607-K610 PolarHBondContact O-N 2.83Å; L607-Q611 WeakPolarHBondContact O-CB 3.45Å; L607-Q611 PolarHBondContact O-N 2.9Å; L607-L789 HydrophobicContact CD2-CD1 3.98Å
608L82.6Confident82.2Confident106 Ų10690.8 Ų90.856%0.55545%0.448SS*.Hα-helixtrans-64.1-39175-71.2170000112E604 Q611 G612E604-L608 HydrophobicContact CG-CD1 4.18Å; E604-L608 WeakPolarHBondContact O-CB 3.38Å; E604-L608 WeakPolarHBondContact O-CG 3.34Å; E604-L608 PolarHBondContact O-N 3.39Å; L608-Q611 PolarHBondContact O-N 2.82Å; L608-G612 PolarHBondContact O-N 3.46Å
609A80.4Confident82.2Confident53 Ų5392.5 Ų92.544%0.43846%0.456SS..Hα-helixtrans-63.4-43172.700000111.9K605 Q606 L607 G612 E613K605-A609 VanDerWaalsContact O-CB 3.29Å; K605-A609 WeakPolarHBondContact O-CB 3.49Å; K605-A609 PolarHBondContact O-N 3.14Å; Q606-A609 PolarHBondContact O-N 2.88Å; L607-A609 PolarHBondContact O-N 2.92Å; A609-G612 PolarHBondContact O-N 2.78Å; A609-E613 WeakPolarHBondContact O-CG 3.4Å; A609-E613 PolarHBondContact O-N 2.87Å
610K83Confident82.5Confident121 Ų12190 Ų9053%0.52645%0.45SS..Hα-helixtrans-70.7-31.5177.8-71.7-70.8168.9-1330113.2Q606 L607 E613 Y614Q606-K610 WeakPolarHBondContact O-CB 3.32Å; Q606-K610 VanDerWaalsContact O-CG 3.27Å; Q606-K610 WeakPolarHBondContact O-CG 3.29Å; Q606-K610 PolarHBondContact O-N 2.54Å; L607-K610 PolarHBondContact O-N 2.83Å; K610-E613 IonicContact NZ-OE1 2.74Å; K610-E613 PolarHBondContact NZ-OE1 3.49Å; K610-E613 IonicContact NZ-OE2 2.62Å; K610-E613 PolarHBondContact NZ-OE2 3.32Å; K610-Y614 WeakPolarHBondContact O-CB 3.47Å; K610-Y614 PolarHBondContact O-N 3.24Å
611Q83.9Confident82.6Confident103 Ų10391.2 Ų91.248%0.48145%0.452SS..Hα-helixtrans-66.4-46.1169.7-176.3-179.4-30.700110.8L607 L608 E613 Y614 E615L607-Q611 WeakPolarHBondContact O-CB 3.45Å; L607-Q611 PolarHBondContact O-N 2.9Å; L608-Q611 PolarHBondContact O-N 2.82Å; Q611-E613 VanDerWaalsContact C-N 3.32Å; Q611-E613 PolarHBondContact O-N 2.98Å; Q611-Y614 CarbonylContact O-C 3.55Å; Q611-Y614 WeakPolarHBondContact O-CB 3.32Å; Q611-Y614 PolarHBondContact O-N 3.41Å; Q611-Y614 VanDerWaalsContact O-N 3.1Å; Q611-E615 HydrophobicContact CG-CG 4.48Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.4Å; Q611-E615 PolarHBondContact NE2-OE1 3.1Å; Q611-E615 WeakPolarHBondContact O-CG 3.29Å; Q611-E615 PolarHBondContact O-N 2.9Å
612G81.6Confident82.5Confident28 Ų2891.7 Ų91.729%0.28946%0.46SS..Hα-helixtrans-63.1-35.5174.900000113.4L608 A609 T616L608-G612 PolarHBondContact O-N 3.46Å; A609-G612 PolarHBondContact O-N 2.78Å; G612-T616 WeakPolarHBondContact O-CG2 3.34Å; G612-T616 PolarHBondContact O-N 3.23Å; G612-T616 VanDerWaalsContact O-N 3.14Å; G612-T616 PolarHBondContact O-OG1 3.27Å
613E82.6Confident82.7Confident96 Ų9691.4 Ų91.445%0.44946%0.459SS..Hα-helixtrans-61.1-49.7168.2-75.9174-140.300110.9A609 K610 Q611 E615 T616 F617A609-E613 WeakPolarHBondContact O-CG 3.4Å; A609-E613 PolarHBondContact O-N 2.87Å; K610-E613 IonicContact NZ-OE1 2.74Å; K610-E613 PolarHBondContact NZ-OE1 3.49Å; K610-E613 IonicContact NZ-OE2 2.62Å; K610-E613 PolarHBondContact NZ-OE2 3.32Å; Q611-E613 VanDerWaalsContact C-N 3.32Å; Q611-E613 PolarHBondContact O-N 2.98Å; E613-E615 PolarHBondContact O-N 2.77Å; E613-T616 PolarHBondContact O-N 2.96Å; E613-T616 PolarHBondContact O-OG1 2.81Å; E613-F617 WeakPolarHBondContact O-CB 3.33Å; E613-F617 PolarHBondContact O-N 3.23Å
614Y75.6Confident82.9Confident100 Ų10089.4 Ų89.439%0.39245%0.449SS..Hα-helixtrans-59.3-43.6179-179.5-87.8000113.1K610 Q611 F617 Q618 I782K610-Y614 WeakPolarHBondContact O-CB 3.47Å; K610-Y614 PolarHBondContact O-N 3.24Å; Q611-Y614 CarbonylContact O-C 3.55Å; Q611-Y614 WeakPolarHBondContact O-CB 3.32Å; Q611-Y614 PolarHBondContact O-N 3.41Å; Q611-Y614 VanDerWaalsContact O-N 3.1Å; Y614-F617 WeakPolarHBondContact O-CB 3.29Å; Y614-F617 PolarHBondContact O-N 3.38Å; Y614-Q618 WeakPolarHBondContact O-CB 3.49Å; Y614-Q618 PolarHBondContact O-N 2.95Å; Y614-I782 HydrophobicContact CE2-CD1 3.78Å; Y614-I782 HydrophobicContact CE2-CG1 4.19Å
615E83.3Confident83Confident92 Ų9291 Ų9143%0.4345%0.45SS..Hα-helixtrans-63.6-43.4176.4-71.6168.2-169.900111Q611 E613 F617 Q618 L619Q611-E615 HydrophobicContact CG-CG 4.48Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.4Å; Q611-E615 PolarHBondContact NE2-OE1 3.1Å; Q611-E615 WeakPolarHBondContact O-CG 3.29Å; Q611-E615 PolarHBondContact O-N 2.9Å; E613-E615 PolarHBondContact O-N 2.77Å; E615-F617 VanDerWaalsContact C-N 3.33Å; E615-F617 PolarHBondContact O-N 3.02Å; E615-Q618 PolarHBondContact O-N 3.22Å; E615-L619 WeakPolarHBondContact O-CG 3.33Å; E615-L619 PolarHBondContact O-N 3.48Å
616T85.1Confident83.1Confident60 Ų6088.9 Ų88.937%0.36844%0.442SS..Hα-helixtrans-69-30.1174.159.10000113.4G612 E613 S620G612-T616 WeakPolarHBondContact O-CG2 3.34Å; G612-T616 PolarHBondContact O-N 3.23Å; G612-T616 VanDerWaalsContact O-N 3.14Å; G612-T616 PolarHBondContact O-OG1 3.27Å; E613-T616 PolarHBondContact O-N 2.96Å; E613-T616 PolarHBondContact O-OG1 2.81Å; T616-S620 WeakPolarHBondContact O-CB 3.49Å; T616-S620 PolarHBondContact O-N 3.44Å; T616-S620 PolarHBondContact O-OG 2.82Å
617F79Confident83.3Confident48 Ų4889.1 Ų89.121%0.21144%0.443CS..Hα-helixtrans-65.8-48.6172.4178.4-83.7000110.2E613 Y614 E615 L619 S620 F621 L775 M778 V779E613-F617 WeakPolarHBondContact O-CB 3.33Å; E613-F617 PolarHBondContact O-N 3.23Å; Y614-F617 WeakPolarHBondContact O-CB 3.29Å; Y614-F617 PolarHBondContact O-N 3.38Å; E615-F617 VanDerWaalsContact C-N 3.33Å; E615-F617 PolarHBondContact O-N 3.02Å; F617-L619 PolarHBondContact O-N 3.06Å; F617-S620 PolarHBondContact O-N 3.34Å; F617-S620 PolarHBondContact O-OG 3.05Å; F617-F621 VanDerWaalsContact O-CB 3.32Å; F617-F621 WeakPolarHBondContact O-CB 3.37Å; F617-F621 PolarHBondContact O-N 3.28Å; F617-L775 HydrophobicContact CD2-CD2 4.28Å; F617-L775 HydrophobicContact CE1-CD2 4.46Å; F617-L775 HydrophobicContact CE2-CD2 3.32Å; F617-L775 HydrophobicContact CZ-CD2 3.43Å; F617-L775 VanDerWaalsContact CZ-CD2 3.43Å; F617-M778 HydrophobicContact CE2-CE 3.82Å; F617-M778 HydrophobicContact CE2-SD 4.14Å; F617-M778 HydrophobicContact CZ-CB 4.35Å; F617-M778 HydrophobicContact CZ-CE 4.37Å; F617-V779 HydrophobicContact CE1-CG2 4.44Å
618Q81.7Confident83.6Confident97 Ų9788.9 Ų88.945%0.45344%0.442SS..Hα-helixtrans-61.2-42.6179.9-173175.63.100111.6Y614 E615 F621 M622Y614-Q618 WeakPolarHBondContact O-CB 3.49Å; Y614-Q618 PolarHBondContact O-N 2.95Å; E615-Q618 PolarHBondContact O-N 3.22Å; Q618-F621 PolarHBondContact O-N 3.33Å; Q618-M622 WeakPolarHBondContact O-CG 3.27Å; Q618-M622 PolarHBondContact O-N 2.8Å; Q618-M622 VanDerWaalsContact O-N 3.08Å
619L85.4Confident83.8Confident112 Ų11288.9 Ų88.959%0.58644%0.44SS*.Hα-helixtrans-62-51.2171.9-69.6168.9000111.6E615 F617 F621 M622 D623E615-L619 WeakPolarHBondContact O-CG 3.33Å; E615-L619 PolarHBondContact O-N 3.48Å; F617-L619 PolarHBondContact O-N 3.06Å; L619-F621 PolarHBondContact O-N 3.05Å; L619-M622 PolarHBondContact O-N 3.48Å; L619-M622 VanDerWaalsContact O-N 3.08Å; L619-D623 PolarHBondContact O-N 3.05Å
620S87Confident84.3Confident54 Ų5492.3 Ų92.338%0.37845%0.445SS..Hα-helixtrans-64.4-27.8-179.670.30000113.4T616 F617 L624T616-S620 WeakPolarHBondContact O-CB 3.49Å; T616-S620 PolarHBondContact O-N 3.44Å; T616-S620 PolarHBondContact O-OG 2.82Å; F617-S620 PolarHBondContact O-N 3.34Å; F617-S620 PolarHBondContact O-OG 3.05Å; S620-L624 VanDerWaalsContact O-CB 3.3Å; S620-L624 WeakPolarHBondContact O-CB 3.5Å; S620-L624 PolarHBondContact O-N 3.04Å
621F82.9Confident84.5Confident88 Ų8890.9 Ų90.939%0.38644%0.442SS..Hα-helixtrans-71.6-38.1173.3-179.4-98.6000112.3F617 Q618 L619 R625 L775F617-F621 VanDerWaalsContact O-CB 3.32Å; F617-F621 WeakPolarHBondContact O-CB 3.37Å; F617-F621 PolarHBondContact O-N 3.28Å; Q618-F621 PolarHBondContact O-N 3.33Å; L619-F621 PolarHBondContact O-N 3.05Å; F621-R625 VanDerWaalsContact O-CB 3.24Å; F621-R625 WeakPolarHBondContact O-CB 3.5Å; F621-R625 PolarHBondContact O-N 3.31Å; F621-L775 HydrophobicContact CD2-CD1 4.39Å
622M84Confident84.7Confident123 Ų12388.9 Ų88.961%0.60644%0.443SS*.Hα-helixtrans-66.1-40.5170.9-71.7-17565.200111.8Q618 L619 R625 Q626Q618-M622 WeakPolarHBondContact O-CG 3.27Å; Q618-M622 PolarHBondContact O-N 2.8Å; Q618-M622 VanDerWaalsContact O-N 3.08Å; L619-M622 PolarHBondContact O-N 3.48Å; L619-M622 VanDerWaalsContact O-N 3.08Å; M622-R625 PolarHBondContact O-N 3.45Å; M622-Q626 WeakPolarHBondContact O-CB 3.19Å; M622-Q626 PolarHBondContact O-N 3.19Å
623D86Confident85.1Confident93 Ų9389 Ų8950%0.49745%0.445SS..Hα-helixtrans-63.8-47.8174.6-73.4-28.6000111.8L619 R625 Q626 Q627L619-D623 PolarHBondContact O-N 3.05Å; D623-R625 VanDerWaalsContact C-N 3.3Å; D623-R625 PolarHBondContact O-N 2.85Å; D623-Q626 PolarHBondContact O-N 3.46Å; D623-Q627 WeakPolarHBondContact O-CB 3.45Å; D623-Q627 WeakPolarHBondContact O-CG 3.24Å; D623-Q627 PolarHBondContact O-N 2.91Å
624L86.7Confident85.4Confident40 Ų4087.7 Ų87.721%0.20944%0.444CS..Hα-helixtrans-59.9-39175.1-93.7161.2000112S620 Q627 N628 L775S620-L624 VanDerWaalsContact O-CB 3.3Å; S620-L624 WeakPolarHBondContact O-CB 3.5Å; S620-L624 PolarHBondContact O-N 3.04Å; L624-Q627 PolarHBondContact O-N 2.97Å; L624-N628 WeakPolarHBondContact O-CB 3.34Å; L624-N628 PolarHBondContact O-N 2.97Å; L624-N628 PolarHBondContact O-ND2 2.91Å; L624-L775 HydrophobicContact CD1-CD1 4.19Å
625R84.3Confident86Confident151 Ų15186.1 Ų86.157%0.5744%0.444SS*.Hα-helixtrans-64.4-47.7174.4179.9174.6176.2160.12.8111.4F621 M622 D623 Q627 N628 E629F621-R625 VanDerWaalsContact O-CB 3.24Å; F621-R625 WeakPolarHBondContact O-CB 3.5Å; F621-R625 PolarHBondContact O-N 3.31Å; M622-R625 PolarHBondContact O-N 3.45Å; D623-R625 VanDerWaalsContact C-N 3.3Å; D623-R625 PolarHBondContact O-N 2.85Å; R625-Q627 VanDerWaalsContact C-N 3.29Å; R625-Q627 PolarHBondContact O-N 3.48Å; R625-N628 PolarHBondContact O-N 3.08Å; R625-E629 WeakPolarHBondContact CG-OE1 3.28Å; R625-E629 IonicContact CZ-OE1 3.57Å; R625-E629 IonicContact NE-OE1 3.37Å; R625-E629 PolarHBondContact NE-OE1 3.42Å; R625-E629 IonicContact NH2-OE1 3.39Å; R625-E629 PolarHBondContact NH2-OE1 3.4Å; R625-E629 WeakPolarHBondContact O-CG 3.33Å; R625-E629 PolarHBondContact O-N 3.44Å
626Q88.1Confident86.3Confident99 Ų9987.3 Ų87.346%0.46345%0.45SS..Hα-helixtrans-64.5-34.5177.9-161.1-161.775.200111.8M622 D623 K630M622-Q626 WeakPolarHBondContact O-CB 3.19Å; M622-Q626 PolarHBondContact O-N 3.19Å; D623-Q626 PolarHBondContact O-N 3.46Å; Q626-K630 WeakPolarHBondContact O-CB 3.22Å; Q626-K630 WeakPolarHBondContact O-CD 3.39Å; Q626-K630 VanDerWaalsContact O-CG 3.24Å; Q626-K630 WeakPolarHBondContact O-CG 3.4Å; Q626-K630 PolarHBondContact O-N 2.92Å
627Q87.1Confident86.6Confident112 Ų11288 Ų8852%0.52345%0.454SS..Hα-helixtrans-68.7-41172.8-72.5-179.127.800112.1D623 L624 R625 K630 L631D623-Q627 WeakPolarHBondContact O-CB 3.45Å; D623-Q627 WeakPolarHBondContact O-CG 3.24Å; D623-Q627 PolarHBondContact O-N 2.91Å; L624-Q627 PolarHBondContact O-N 2.97Å; R625-Q627 VanDerWaalsContact C-N 3.29Å; R625-Q627 PolarHBondContact O-N 3.48Å; Q627-K630 PolarHBondContact O-N 3.44Å; Q627-L631 WeakPolarHBondContact O-CB 3.44Å; Q627-L631 WeakPolarHBondContact O-CG 3.42Å; Q627-L631 PolarHBondContact O-N 3.34Å
628N85.6Confident87.1Confident90 Ų9090 Ų9048%0.48147%0.466SS..Hα-helixtrans-65.1-39.3173.7-83.8-37.1000112.5L624 R625 L631 A632L624-N628 WeakPolarHBondContact O-CB 3.34Å; L624-N628 PolarHBondContact O-N 2.97Å; L624-N628 PolarHBondContact O-ND2 2.91Å; R625-N628 PolarHBondContact O-N 3.08Å; N628-L631 PolarHBondContact O-N 3.12Å; N628-A632 VanDerWaalsContact O-CB 3.29Å; N628-A632 WeakPolarHBondContact O-CB 3.47Å; N628-A632 PolarHBondContact O-N 2.91Å
629E87.7Confident87.5Confident106 Ų10690 Ų9050%0.49547%0.466SS..Hα-helixtrans-65-39.7174.8-72.2169-173.400111.1R625 G633R625-E629 WeakPolarHBondContact CG-OE1 3.28Å; R625-E629 IonicContact CZ-OE1 3.57Å; R625-E629 IonicContact NE-OE1 3.37Å; R625-E629 PolarHBondContact NE-OE1 3.42Å; R625-E629 IonicContact NH2-OE1 3.39Å; R625-E629 PolarHBondContact NH2-OE1 3.4Å; R625-E629 WeakPolarHBondContact O-CG 3.33Å; R625-E629 PolarHBondContact O-N 3.44Å; E629-G633 PolarHBondContact O-N 3.48Å
630K89.4Confident87.7Confident126 Ų12686.9 Ų86.955%0.54845%0.45SS..Hα-helixtrans-63.3-46.5170.3-74.4163.9176.3170.60112.4Q626 Q627 G633 T634Q626-K630 WeakPolarHBondContact O-CB 3.22Å; Q626-K630 WeakPolarHBondContact O-CD 3.39Å; Q626-K630 VanDerWaalsContact O-CG 3.24Å; Q626-K630 WeakPolarHBondContact O-CG 3.4Å; Q626-K630 PolarHBondContact O-N 2.92Å; Q627-K630 PolarHBondContact O-N 3.44Å; K630-G633 PolarHBondContact O-N 2.9Å; K630-T634 PolarHBondContact O-N 3.47Å
631L88.4Confident87.8Confident90 Ų9089.8 Ų89.847%0.47146%0.456SS..Hα-helixtrans-64.6-43.4179.9-77.9170.3000111.5Q627 N628 G633 T634 V635Q627-L631 WeakPolarHBondContact O-CB 3.44Å; Q627-L631 WeakPolarHBondContact O-CG 3.42Å; Q627-L631 PolarHBondContact O-N 3.34Å; N628-L631 PolarHBondContact O-N 3.12Å; L631-G633 VanDerWaalsContact C-N 3.32Å; L631-G633 PolarHBondContact O-N 3.21Å; L631-T634 WeakPolarHBondContact CA-OG1 3.34Å; L631-T634 CarbonylContact O-C 3.6Å; L631-T634 WeakPolarHBondContact O-CA 3.3Å; L631-T634 PolarHBondContact O-N 3.41Å; L631-T634 PolarHBondContact O-OG1 3.08Å; L631-V635 WeakPolarHBondContact O-CG2 3.44Å; L631-V635 PolarHBondContact O-N 3.27Å
632A87.2Confident88Confident61 Ų6189.8 Ų89.850%0.50446%0.459SS..Hα-helixtrans-56-46.1173.900000111.3N628 T634 V635 E636N628-A632 VanDerWaalsContact O-CB 3.29Å; N628-A632 WeakPolarHBondContact O-CB 3.47Å; N628-A632 PolarHBondContact O-N 2.91Å; A632-T634 PolarHBondContact O-N 3.47Å; A632-V635 PolarHBondContact O-N 3.41Å; A632-E636 PolarHBondContact O-N 2.81Å
633G89.9Confident88.2Confident31 Ų3188.8 Ų88.832%0.3245%0.449SS..Hα-helixtrans-58.3-42.8172.100000113E629 K630 L631 E636 T637E629-G633 PolarHBondContact O-N 3.48Å; K630-G633 PolarHBondContact O-N 2.9Å; L631-G633 VanDerWaalsContact C-N 3.32Å; L631-G633 PolarHBondContact O-N 3.21Å; G633-E636 PolarHBondContact O-N 2.93Å; G633-T637 WeakPolarHBondContact O-CG2 3.42Å; G633-T637 PolarHBondContact O-N 3.27Å
634T89.6Confident88.3Confident69 Ų6992.3 Ų92.342%0.42346%0.455SS..Hα-helixtrans-65.9-40.5175.663.40000112.9K630 L631 A632 T637 L638K630-T634 PolarHBondContact O-N 3.47Å; L631-T634 WeakPolarHBondContact CA-OG1 3.34Å; L631-T634 CarbonylContact O-C 3.6Å; L631-T634 WeakPolarHBondContact O-CA 3.3Å; L631-T634 PolarHBondContact O-N 3.41Å; L631-T634 PolarHBondContact O-OG1 3.08Å; A632-T634 PolarHBondContact O-N 3.47Å; T634-T637 PolarHBondContact O-N 3.19Å; T634-T637 PolarHBondContact O-OG1 2.92Å; T634-L638 WeakPolarHBondContact O-CG 3.35Å; T634-L638 PolarHBondContact O-N 2.92Å
635V88.1Confident88.3Confident66 Ų6696.2 Ų96.240%0.447%0.472SS..Hα-helixtrans-61.2-45.5175.4171.10000110.1L631 A632 T637 L638 E639L631-V635 WeakPolarHBondContact O-CG2 3.44Å; L631-V635 PolarHBondContact O-N 3.27Å; A632-V635 PolarHBondContact O-N 3.41Å; V635-T637 VanDerWaalsContact C-N 3.32Å; V635-T637 PolarHBondContact O-N 2.94Å; V635-L638 CarbonylContact O-C 3.59Å; V635-L638 WeakPolarHBondContact O-CA 3.3Å; V635-L638 PolarHBondContact O-N 2.84Å; V635-E639 HydrophobicContact CG1-CG 4.34Å; V635-E639 PolarHBondContact O-N 3.16Å
636E90.1Very high88.1Confident118 Ų11894 Ų9455%0.55147%0.468SS*.Hα-helixtrans-58.9-42175.6-159-161.5152.300111.5A632 G633 L638 N640A632-E636 PolarHBondContact O-N 2.81Å; G633-E636 PolarHBondContact O-N 2.93Å; E636-L638 VanDerWaalsContact C-N 3.29Å; E636-L638 PolarHBondContact O-N 3.43Å; E636-N640 VanDerWaalsContact O-CB 3.22Å; E636-N640 WeakPolarHBondContact O-CB 3.5Å; E636-N640 VanDerWaalsContact O-CG 3.23Å; E636-N640 PolarHBondContact O-N 2.81Å; E636-N640 PolarHBondContact O-ND2 2.91Å
637T90.2Very high87.9Confident73 Ų7394.2 Ų94.245%0.44847%0.469SS..Hα-helixtrans-68-25.6174.8690000113.9G633 T634 V635 K641G633-T637 WeakPolarHBondContact O-CG2 3.42Å; G633-T637 PolarHBondContact O-N 3.27Å; T634-T637 PolarHBondContact O-N 3.19Å; T634-T637 PolarHBondContact O-OG1 2.92Å; V635-T637 VanDerWaalsContact C-N 3.32Å; V635-T637 PolarHBondContact O-N 2.94Å; T637-K641 WeakPolarHBondContact O-CD 3.38Å; T637-K641 VanDerWaalsContact O-CG 3.28Å; T637-K641 WeakPolarHBondContact O-CG 3.46Å; T637-K641 PolarHBondContact O-N 2.91Å
638L90.2Very high87.7Confident92 Ų9293.9 Ų93.948%0.48247%0.47SS..Hα-helixtrans-80.7-43.2176-72.7171.2000111.3T634 V635 E636 N640 K641 I642T634-L638 WeakPolarHBondContact O-CG 3.35Å; T634-L638 PolarHBondContact O-N 2.92Å; V635-L638 CarbonylContact O-C 3.59Å; V635-L638 WeakPolarHBondContact O-CA 3.3Å; V635-L638 PolarHBondContact O-N 2.84Å; E636-L638 VanDerWaalsContact C-N 3.29Å; E636-L638 PolarHBondContact O-N 3.43Å; L638-N640 VanDerWaalsContact C-N 3.32Å; L638-N640 PolarHBondContact O-N 3.28Å; L638-K641 HydrophobicContact CD2-CD 4.38Å; L638-K641 CarbonylContact O-C 3.57Å; L638-K641 WeakPolarHBondContact O-CA 3.42Å; L638-K641 WeakPolarHBondContact O-CB 3.31Å; L638-K641 PolarHBondContact O-N 2.97Å; L638-I642 WeakPolarHBondContact O-CG1 3.33Å; L638-I642 PolarHBondContact O-N 3.11Å
639E89Confident87.4Confident95 Ų9593.4 Ų93.444%0.44447%0.467SS..Hα-helixtrans-60.6-42.1171.2-69.9-173.1-170.900111.9V635 K641 I642 R643V635-E639 HydrophobicContact CG1-CG 4.34Å; V635-E639 PolarHBondContact O-N 3.16Å; E639-K641 PolarHBondContact O-N 3.15Å; E639-I642 PolarHBondContact O-N 3.26Å; E639-R643 WeakPolarHBondContact O-CB 3.43Å; E639-R643 PolarHBondContact O-N 3.19Å; E639-R643 IonicContact OE2-NH2 2.63Å; E639-R643 PolarHBondContact OE2-NH2 3.38Å
640N89.9Confident87Confident48 Ų4894 Ų9426%0.25747%0.474SS..Hα-helixtrans-63.9-22.6174.2-77.4-43.1000112.6E636 L638 R643 R644E636-N640 VanDerWaalsContact O-CB 3.22Å; E636-N640 WeakPolarHBondContact O-CB 3.5Å; E636-N640 VanDerWaalsContact O-CG 3.23Å; E636-N640 PolarHBondContact O-N 2.81Å; E636-N640 PolarHBondContact O-ND2 2.91Å; L638-N640 VanDerWaalsContact C-N 3.32Å; L638-N640 PolarHBondContact O-N 3.28Å; N640-R643 PolarHBondContact OD1-NH1 3.33Å; N640-R644 VanDerWaalsContact O-CD 3.29Å; N640-R644 WeakPolarHBondContact O-CD 3.35Å; N640-R644 VanDerWaalsContact O-CG 3.23Å; N640-R644 WeakPolarHBondContact O-CG 3.42Å; N640-R644 PolarHBondContact O-NE 2.95Å
641K89.8Confident86.5Confident115 Ų11595.5 Ų95.550%0.548%0.483SS..Hα-helixtrans-81.6-42.7169.5-74.8164.8-177.11700111.8T637 L638 E639 R644 Q645T637-K641 WeakPolarHBondContact O-CD 3.38Å; T637-K641 VanDerWaalsContact O-CG 3.28Å; T637-K641 WeakPolarHBondContact O-CG 3.46Å; T637-K641 PolarHBondContact O-N 2.91Å; L638-K641 HydrophobicContact CD2-CD 4.38Å; L638-K641 CarbonylContact O-C 3.57Å; L638-K641 WeakPolarHBondContact O-CA 3.42Å; L638-K641 WeakPolarHBondContact O-CB 3.31Å; L638-K641 PolarHBondContact O-N 2.97Å; E639-K641 PolarHBondContact O-N 3.15Å; K641-R644 PolarHBondContact O-N 3.03Å; K641-Q645 WeakPolarHBondContact O-CG 3.48Å; K641-Q645 PolarHBondContact O-N 3.23Å
642I87Confident86Confident88 Ų8895.3 Ų95.345%0.45149%0.488SS..Hα-helixtrans-62.9-45.2178.7-68.7166.3000110.4L638 E639 R644 Q645 Q646L638-I642 WeakPolarHBondContact O-CG1 3.33Å; L638-I642 PolarHBondContact O-N 3.11Å; E639-I642 PolarHBondContact O-N 3.26Å; I642-R644 PolarHBondContact O-N 2.88Å; I642-Q645 CarbonylContact O-C 3.58Å; I642-Q645 WeakPolarHBondContact O-CA 3.28Å; I642-Q645 PolarHBondContact O-N 2.88Å; I642-Q646 HydrophobicContact CG2-CG 4.41Å; I642-Q646 WeakPolarHBondContact O-CG 3.45Å; I642-Q646 PolarHBondContact O-N 2.84Å
643R87.8Confident85.3Confident101 Ų10195.1 Ų95.138%0.38149%0.492SS..Hα-helixtrans-58.5-45.5174.4-81.8-179.1-98.7115.3-2.7111.9E639 N640 Q645 Q646 E647E639-R643 WeakPolarHBondContact O-CB 3.43Å; E639-R643 PolarHBondContact O-N 3.19Å; E639-R643 IonicContact OE2-NH2 2.63Å; E639-R643 PolarHBondContact OE2-NH2 3.38Å; N640-R643 PolarHBondContact OD1-NH1 3.33Å; R643-Q645 VanDerWaalsContact C-N 3.3Å; R643-Q645 PolarHBondContact O-N 3.27Å; R643-Q646 PolarHBondContact O-N 2.85Å; R643-E647 WeakPolarHBondContact O-CB 3.45Å; R643-E647 WeakPolarHBondContact O-CG 3.3Å; R643-E647 PolarHBondContact O-N 3.13Å
644R87.7Confident84Confident167 Ų16797.3 Ų97.363%0.6350%0.499SS*.Hα-helixtrans-62.2-32.6173-70.5172-168.11676113.7N640 K641 I642 L648N640-R644 VanDerWaalsContact O-CD 3.29Å; N640-R644 WeakPolarHBondContact O-CD 3.35Å; N640-R644 VanDerWaalsContact O-CG 3.23Å; N640-R644 WeakPolarHBondContact O-CG 3.42Å; N640-R644 PolarHBondContact O-NE 2.95Å; K641-R644 PolarHBondContact O-N 3.03Å; I642-R644 PolarHBondContact O-N 2.88Å; R644-L648 VanDerWaalsContact O-CB 3.26Å; R644-L648 WeakPolarHBondContact O-CB 3.42Å; R644-L648 PolarHBondContact O-N 3.47Å; R644-L648 VanDerWaalsContact O-N 3.08Å
645Q86.6Confident82.3Confident123 Ų12399.4 Ų99.458%0.57551%0.512SS*.Hα-helixtrans-75.3-36.1175.8-75.7176.8-33.500112.1K641 I642 R643 L648 L649K641-Q645 WeakPolarHBondContact O-CG 3.48Å; K641-Q645 PolarHBondContact O-N 3.23Å; I642-Q645 CarbonylContact O-C 3.58Å; I642-Q645 WeakPolarHBondContact O-CA 3.28Å; I642-Q645 PolarHBondContact O-N 2.88Å; R643-Q645 VanDerWaalsContact C-N 3.3Å; R643-Q645 PolarHBondContact O-N 3.27Å; Q645-L648 PolarHBondContact O-N 2.88Å; Q645-L649 WeakPolarHBondContact O-CB 3.37Å; Q645-L649 VanDerWaalsContact O-CG 3.3Å; Q645-L649 WeakPolarHBondContact O-CG 3.33Å; Q645-L649 PolarHBondContact O-N 2.9Å
646Q80.5Confident80.6Confident104 Ų104101.9 Ų101.949%0.48653%0.527SS..Hα-helixtrans-65.8-49.9171.5-71.3173.9-51.900110.6I642 R643 L648 L649 D650I642-Q646 HydrophobicContact CG2-CG 4.41Å; I642-Q646 WeakPolarHBondContact O-CG 3.45Å; I642-Q646 PolarHBondContact O-N 2.84Å; R643-Q646 PolarHBondContact O-N 2.85Å; Q646-L648 PolarHBondContact O-N 3.43Å; Q646-L648 VanDerWaalsContact O-N 3.15Å; Q646-L649 PolarHBondContact O-N 2.83Å; Q646-D650 WeakPolarHBondContact O-CB 3.49Å; Q646-D650 PolarHBondContact O-N 3.44Å
647E83.5Confident78.9Confident104 Ų104101.2 Ų101.249%0.48653%0.531SS..Hα-helixtrans-51.8-38172.4-73.1161.5-164.500112.1R643 Q651R643-E647 WeakPolarHBondContact O-CB 3.45Å; R643-E647 WeakPolarHBondContact O-CG 3.3Å; R643-E647 PolarHBondContact O-N 3.13Å; E647-Q651 WeakPolarHBondContact O-CB 3.31Å; E647-Q651 WeakPolarHBondContact O-CG 3.32Å; E647-Q651 PolarHBondContact O-N 3.01Å; E647-Q651 PolarHBondContact O-NE2 3.21Å
648L84.3Confident77Confident104 Ų104103 Ų10355%0.54554%0.544SS..Hα-helixtrans-79.7-32.8179.1-167.1137.7000113.1R644 Q645 Q646 C652R644-L648 VanDerWaalsContact O-CB 3.26Å; R644-L648 WeakPolarHBondContact O-CB 3.42Å; R644-L648 PolarHBondContact O-N 3.47Å; R644-L648 VanDerWaalsContact O-N 3.08Å; Q645-L648 PolarHBondContact O-N 2.88Å; Q646-L648 PolarHBondContact O-N 3.43Å; Q646-L648 VanDerWaalsContact O-N 3.15Å; L648-C652 WeakPolarHBondContact O-CB 3.24Å; L648-C652 PolarHBondContact O-N 3.22Å; L648-C652 PolarHBondContact O-SG 2.95Å
649L79.5Confident74.7Confident80 Ų80105.9 Ų105.942%0.41956%0.559SS.*Hα-helixtrans-69.1-39.2171.9-76.2167000112Q645 Q646 C652 G653 V654Q645-L649 WeakPolarHBondContact O-CB 3.37Å; Q645-L649 VanDerWaalsContact O-CG 3.3Å; Q645-L649 WeakPolarHBondContact O-CG 3.33Å; Q645-L649 PolarHBondContact O-N 2.9Å; Q646-L649 PolarHBondContact O-N 2.83Å; L649-C652 CarbonylContact O-C 3.47Å; L649-C652 PolarHBondContact O-N 3.08Å; L649-G653 PolarHBondContact O-N 3.09Å; L649-V654 HydrophobicContact CD2-CB 4.16Å; L649-V654 HydrophobicContact CD2-CG1 4.47Å; L649-V654 PolarHBondContact O-N 2.89Å
650D78Confident72.7Confident119 Ų119107.7 Ų107.764%0.63658%0.577SS**Hα-helixtrans-64.6-43.9173.2-71.6-25.2000110.8Q646 C652 G653Q646-D650 WeakPolarHBondContact O-CB 3.49Å; Q646-D650 PolarHBondContact O-N 3.44Å; D650-C652 VanDerWaalsContact C-N 3.28Å; D650-C652 PolarHBondContact O-N 3.05Å; D650-G653 PolarHBondContact O-N 3.4Å
651Q79.7Confident70.6Confident157 Ų157113.2 Ų113.273%0.73461%0.606SS**Hα-helixtrans-61.5-32.4171.4-78.6166.968.200113.1E647 G653E647-Q651 WeakPolarHBondContact O-CB 3.31Å; E647-Q651 WeakPolarHBondContact O-CG 3.32Å; E647-Q651 PolarHBondContact O-N 3.01Å; E647-Q651 PolarHBondContact O-NE2 3.21Å; Q651-G653 VanDerWaalsContact C-N 3.33Å
652C76.5Confident68.3Low86 Ų86111.4 Ų111.458%0.58162%0.62SS**THydrogen-bonded Turntrans-81.9-5.8173.7-70.90000114.1L648 L649 D650 V654L648-C652 WeakPolarHBondContact O-CB 3.24Å; L648-C652 PolarHBondContact O-N 3.22Å; L648-C652 PolarHBondContact O-SG 2.95Å; L649-C652 CarbonylContact O-C 3.47Å; L649-C652 PolarHBondContact O-N 3.08Å; D650-C652 VanDerWaalsContact C-N 3.28Å; D650-C652 PolarHBondContact O-N 3.05Å; C652-V654 VanDerWaalsContact C-N 3.31Å; C652-V654 HydrophobicContact CB-CG2 4Å; C652-V654 PolarHBondContact O-N 3.29Å
653G73Confident66.1Low57 Ų57115.4 Ų115.459%0.58864%0.637SS**THydrogen-bonded Turntrans69.121.8-17900000114.9L649 D650 Q651 T655L649-G653 PolarHBondContact O-N 3.09Å; D650-G653 PolarHBondContact O-N 3.4Å; Q651-G653 VanDerWaalsContact C-N 3.33Å; G653-T655 PolarHBondContact O-N 3.36Å
654V62.3Low63.9Low78 Ų78116.7 Ų116.747%0.47366%0.659SS.*  trans-93.475.2-175.5-172.70000110.3L649 C652 V656L649-V654 HydrophobicContact CD2-CB 4.16Å; L649-V654 HydrophobicContact CD2-CG1 4.47Å; L649-V654 PolarHBondContact O-N 2.89Å; C652-V654 VanDerWaalsContact C-N 3.31Å; C652-V654 HydrophobicContact CB-CG2 4Å; C652-V654 PolarHBondContact O-N 3.29Å; V654-V656 HydrophobicContact CG1-CG2 4.3Å; V654-V656 PolarHBondContact O-N 2.7Å
655T54.7Low61.9Low113 Ų113114.6 Ų114.669%0.69367%0.665SS**  trans-71.798177.954.90000111.5G653 T657G653-T655 PolarHBondContact O-N 3.36Å; T655-T657 PolarHBondContact O-N 3.1Å; T655-T657 VanDerWaalsContact O-N 3.09Å
656V53.1Low59.8Low117 Ų117114.6 Ų114.671%0.70968%0.678SS**  trans-79.586.6175.7-174.80000110.2V654 P658V654-V656 HydrophobicContact CG1-CG2 4.3Å; V654-V656 PolarHBondContact O-N 2.7Å; V656-P658 WeakPolarHBondContact O-CD 3.36Å
657T53.6Low57.9Low105 Ų105115 Ų11564%0.64469%0.692SS**  trans-77.5118.9170.151.40000110.2T655 L659T655-T657 PolarHBondContact O-N 3.1Å; T655-T657 VanDerWaalsContact O-N 3.09Å; T657-L659 PolarHBondContact O-N 3.33Å
658P50.1Low55.7Low111 Ų111121.6 Ų121.672%0.72171%0.713SS**  trans-69.5127.417828-33.7000110.9V656 T660V656-P658 WeakPolarHBondContact O-CD 3.36Å; P658-T660 PolarHBondContact O-N 2.9Å
659L41.5Very low53.5Low152 Ų152121 Ų12180%0.79672%0.722SS**  trans-76.292174.7-87.272.3000110.2T657T657-L659 PolarHBondContact O-N 3.33Å
660T47.1Very low51.7Low133 Ų133126.7 Ų126.782%0.81674%0.744SS**  trans-72.7128.9161.247.90000109.4P658 G662P658-T660 PolarHBondContact O-N 2.9Å; T660-G662 PolarHBondContact O-N 2.92Å
661N46.8Very low50Low163 Ų163129.4 Ų129.487%0.87276%0.757SS**  trans-75.3124.8-166.7-71.1-63.6000113.6
662G40.9Very low48.1Very low77 Ų77126.7 Ų126.779%0.79476%0.761SS**  trans88.885132.700000119.2T660T660-G662 PolarHBondContact O-N 2.92Å
663E40.8Very low46.6Very low172 Ų172127.9 Ų127.980%0.80477%0.77SS**  trans-145.4128.3137.4-146.3177.5-138.800111.6T665E663-T665 PolarHBondContact O-N 3.47Å
664P41.8Very low45Very low128 Ų128134.3 Ų134.383%0.83179%0.785SS**  trans-99.381.9-169.337-34.8000113.7
665T46Very low44.2Very low124 Ų124140.5 Ų140.576%0.76181%0.806SS**  trans-112.1100.7173.646.70000113.7E663 S667E663-T665 PolarHBondContact O-N 3.47Å; T665-S667 PolarHBondContact O-N 3.49Å
666S41.5Very low43.5Very low123 Ų123140 Ų14086%0.8681%0.813SS**  trans-31.9114170.5-179.70000116
667S40.8Very low42.7Very low111 Ų111143.6 Ų143.678%0.77682%0.822SS**  -177.9170.7127.356.90000113.8T665T665-S667 PolarHBondContact O-N 3.49Å
668R37.7Very low42.2Very low244 Ų244146.4 Ų146.492%0.92183%0.831SS**  trans76.863.4155.7-144.9169.2-163.2146.41.4119.2
669A38.2Very low41.6Very low90 Ų90148.7 Ų148.774%0.74484%0.836SS**  trans-40.6168.1152.400000117.1
670K41.7Very low41.5Very low200 Ų200147.3 Ų147.387%0.8784%0.839SS**  trans87.4101.1174.3-55.8-179.7179.5-176.30115.9
671I42.2Very low41Very low177 Ų177152.9 Ų152.991%0.90885%0.845SS**  -151.813494.3-87.5145.7000107.7
672A39.8Very low40.3Very low99 Ų99149.7 Ų149.782%0.81884%0.841SS**  trans-149.1125.8174.800000109.1E674A672-E674 PolarHBondContact O-N 3.11Å
673S45.2Very low39.9Very low111 Ų111158.2 Ų158.278%0.77685%0.849SS**  trans-94.189.6-173.240.90000113K675S673-K675 PolarHBondContact O-N 3.3Å; S673-K675 VanDerWaalsContact O-N 3.07Å
674E40.4Very low39.6Very low193 Ų193159.3 Ų159.390%0.90286%0.855SS**SBend44.657.3125.1-160.3172.4-146.400117.4A672A672-E674 PolarHBondContact O-N 3.11Å
675K44.6Very low39.3Very low208 Ų208159.1 Ų159.190%0.90485%0.851SS**  trans-155.810.9170.9-120.8159.2-169.41720118.7S673S673-K675 PolarHBondContact O-N 3.3Å; S673-K675 VanDerWaalsContact O-N 3.07Å
676A39.9Very low38.7Very low102 Ų102161.3 Ų161.384%0.84385%0.852SS**  trans-126.96.1-168.300000116.9
677E36.5Very low38.5Very low192 Ų192161.2 Ų161.290%0.89785%0.846SS**  trans-107.165-168.5-163.1-178-165.500114
678I42.9Very low38.2Very low164 Ų164163.1 Ų163.184%0.84185%0.848SS**SBendtrans-132.8-31.7175.2-67.9-173.8000114.8
679I38.3Very low38.2Very low159 Ų159162 Ų16282%0.81585%0.85SS**SBendtrans-11677.1-167.8-47.9-179.5000112.8
680S37.7Very low38.6Very low123 Ų123161.7 Ų161.786%0.8685%0.848SS**  trans-177.188.2151.5-85.70000112
681R36.7Very low38.9Very low250 Ų250161.1 Ų161.194%0.94384%0.841SS**  trans-150.1131165.9-124.5179.4-168.9174.57114
682A31.9Very low39.4Very low96 Ų96159 Ų15979%0.79384%0.837SS**  trans62.5115.7160.900000119.7
683R33.6Very low40Very low257 Ų257159.8 Ų159.897%0.9783%0.827SS**  -165.998.6128.7-110.1-179.2-170.1-157.93112.4
684E34.4Very low40.4Very low195 Ų195158.7 Ų158.791%0.91181%0.809SS**  trans-164.7128.1157.8-160.7166.8-128.500109.1
685V36.4Very low41.3Very low124 Ų124157.3 Ų157.375%0.75280%0.803SS**  trans170.7123.3163.5137.90000111.5
686Q31.6Very low42.2Very low170 Ų170151.3 Ų151.379%0.79478%0.784SS**  trans59.6156.1151.6-65.7-174.9-71.300120.4
687T37.7Very low43.2Very low120 Ų120148.6 Ų148.674%0.73676%0.757SS**  cis-158.7161.1-1.34.90000111.4
688D34.1Very low44.7Very low152 Ų152144 Ų14481%0.81374%0.736SS**  trans-84.3155.1174.2-51.4-77.3000115.3
689F39.1Very low46.2Very low221 Ų221140.4 Ų140.497%0.96973%0.726SS**  trans-154165.1158.8-117.5-85000111.5
690A45.6Very low47.9Very low83 Ų83137.7 Ų137.769%0.68671%0.71SS**  trans-134.7154-145.100000121.1V692A690-V692 PolarHBondContact O-N 3.19Å
691Y47.6Very low49.5Very low187 Ų187135.6 Ų135.673%0.73369%0.689SS**SBendtrans67.1-45.1149.6-153-96.9000122.2D693 H694Y691-D693 VanDerWaalsContact C-N 3.32Å; Y691-D693 PolarHBondContact O-N 2.94Å; Y691-H694 AromaticContact CE2-CD2 3.85Å; Y691-H694 WeakPolarHBondContact O-CB 3.38Å; Y691-H694 PolarHBondContact O-N 2.93Å
692V53.2Low51.5Low134 Ų134129.3 Ų129.381%0.81267%0.673SS**THydrogen-bonded Turntrans-69.2-34.7-176176.60000111.7A690 H694A690-V692 PolarHBondContact O-N 3.19Å; V692-H694 PolarHBondContact O-N 3.41Å
693D53.4Low53.8Low115 Ų115127.5 Ų127.562%0.61566%0.658SS**THydrogen-bonded Turntrans-65.1-15.4170.1-69.8-58.8000113.1Y691 Q695 T696 T697Y691-D693 VanDerWaalsContact C-N 3.32Å; Y691-D693 PolarHBondContact O-N 2.94Å; D693-Q695 PolarHBondContact O-N 3.25Å; D693-T696 PolarHBondContact O-N 3.38Å; D693-T696 VanDerWaalsContact O-N 3.11Å; D693-T697 HydrophobicContact CB-CG2 4.08Å; D693-T697 WeakPolarHBondContact O-CG2 3.47Å; D693-T697 PolarHBondContact O-N 2.7Å; D693-T697 PolarHBondContact O-OG1 3.22Å
694H52Low56Low87 Ų87120.2 Ų120.240%0.40364%0.638SS.*Hα-helixtrans-57.1-31-167.8-167.12.4000114.2Y691 V692 T697 M698Y691-H694 AromaticContact CE2-CD2 3.85Å; Y691-H694 WeakPolarHBondContact O-CB 3.38Å; Y691-H694 PolarHBondContact O-N 2.93Å; V692-H694 PolarHBondContact O-N 3.41Å; H694-T697 VanDerWaalsContact CA-OG1 3.26Å; H694-T697 WeakPolarHBondContact CA-OG1 3.41Å; H694-T697 CarbonylContact O-C 3.57Å; H694-T697 PolarHBondContact O-OG1 3.15Å; H694-M698 WeakPolarHBondContact O-CB 3.5Å; H694-M698 WeakPolarHBondContact O-CG 3.37Å; H694-M698 PolarHBondContact O-N 3.12Å
695Q60.1Low58.4Low165 Ų165116.6 Ų116.677%0.77162%0.619SS**Hα-helixtrans-86.4-32.5-179.3-160.5157.914.400113.1D693 M698D693-Q695 PolarHBondContact O-N 3.25Å; Q695-M698 PolarHBondContact O-N 3.35Å
696T64.1Low60.7Low82 Ų82117.1 Ų117.150%0.50361%0.613SS.*Hα-helixtrans-67.2-43.6167.3-45.70000109.7D693 M698 S699 Q700D693-T696 PolarHBondContact O-N 3.38Å; D693-T696 VanDerWaalsContact O-N 3.11Å; T696-M698 VanDerWaalsContact C-N 3.29Å; T696-M698 PolarHBondContact O-N 2.88Å; T696-S699 PolarHBondContact O-N 2.86Å; T696-Q700 WeakPolarHBondContact O-CG 3.5Å; T696-Q700 PolarHBondContact O-N 2.91Å
697T59.8Low63.3Low44 Ų44114 Ų11427%0.2760%0.599SS.*Hα-helixtrans-69.3-20172.768.10000112.8D693 H694 Q700 L701D693-T697 HydrophobicContact CB-CG2 4.08Å; D693-T697 WeakPolarHBondContact O-CG2 3.47Å; D693-T697 PolarHBondContact O-N 2.7Å; D693-T697 PolarHBondContact O-OG1 3.22Å; H694-T697 VanDerWaalsContact CA-OG1 3.26Å; H694-T697 WeakPolarHBondContact CA-OG1 3.41Å; H694-T697 CarbonylContact O-C 3.57Å; H694-T697 PolarHBondContact O-OG1 3.15Å; T697-Q700 CarbonylContact O-C 3.48Å; T697-Q700 PolarHBondContact O-N 3.29Å; T697-L701 VanDerWaalsContact O-CA 3.27Å; T697-L701 WeakPolarHBondContact O-CA 3.31Å; T697-L701 WeakPolarHBondContact O-CB 3.43Å; T697-L701 VanDerWaalsContact O-CD1 3.32Å; T697-L701 WeakPolarHBondContact O-CD1 3.29Å; T697-L701 WeakPolarHBondContact O-CG 3.19Å; T697-L701 PolarHBondContact O-N 2.91Å
698M69.3Low65.7Low96 Ų96115 Ų11547%0.47359%0.59SS.*Hα-helixtrans-64.7-43.9170.8-88.2-93.870.900111.7H694 Q695 T696 L701 L702H694-M698 WeakPolarHBondContact O-CB 3.5Å; H694-M698 WeakPolarHBondContact O-CG 3.37Å; H694-M698 PolarHBondContact O-N 3.12Å; Q695-M698 PolarHBondContact O-N 3.35Å; T696-M698 VanDerWaalsContact C-N 3.29Å; T696-M698 PolarHBondContact O-N 2.88Å; M698-L701 HydrophobicContact CE-CB 4.27Å; M698-L701 HydrophobicContact CE-CD1 4.07Å; M698-L701 PolarHBondContact O-N 3.44Å; M698-L702 PolarHBondContact O-N 3.07Å
699S74.2Confident68.2Low88 Ų88111.6 Ų111.662%0.61557%0.572SS**Hα-helixtrans-69-43.5173.7-62.10000111.6T696 L701 L702 A703T696-S699 PolarHBondContact O-N 2.86Å; S699-L701 PolarHBondContact O-N 2.89Å; S699-L702 PolarHBondContact O-N 3.45Å; S699-A703 PolarHBondContact O-N 3.44Å
700Q72.5Confident70.5Confident102 Ų102106.1 Ų106.148%0.47755%0.547SS..Hα-helixtrans-69-20174.4-61.4166.9-23.800112.5T696 T697 L704T696-Q700 WeakPolarHBondContact O-CG 3.5Å; T696-Q700 PolarHBondContact O-N 2.91Å; T697-Q700 CarbonylContact O-C 3.48Å; T697-Q700 PolarHBondContact O-N 3.29Å; Q700-L704 WeakPolarHBondContact O-CA 3.46Å; Q700-L704 WeakPolarHBondContact O-CB 3.41Å; Q700-L704 WeakPolarHBondContact O-CD1 3.3Å; Q700-L704 WeakPolarHBondContact O-CG 3.47Å; Q700-L704 PolarHBondContact O-N 3.28Å
701L71.6Confident72.5Confident80 Ų80107.9 Ų107.942%0.41955%0.545SS..Hα-helixtrans-80.3-23.8175.2-85.1164000111.5T697 M698 S699 K705T697-L701 VanDerWaalsContact O-CA 3.27Å; T697-L701 WeakPolarHBondContact O-CA 3.31Å; T697-L701 WeakPolarHBondContact O-CB 3.43Å; T697-L701 VanDerWaalsContact O-CD1 3.32Å; T697-L701 WeakPolarHBondContact O-CD1 3.29Å; T697-L701 WeakPolarHBondContact O-CG 3.19Å; T697-L701 PolarHBondContact O-N 2.91Å; M698-L701 HydrophobicContact CE-CB 4.27Å; M698-L701 HydrophobicContact CE-CD1 4.07Å; M698-L701 PolarHBondContact O-N 3.44Å; S699-L701 PolarHBondContact O-N 2.89Å; L701-K705 WeakPolarHBondContact O-CA 3.37Å; L701-K705 WeakPolarHBondContact O-CB 3.4Å; L701-K705 PolarHBondContact O-N 2.84Å
702L79.6Confident74.5Confident118 Ų118103.2 Ų103.262%0.61853%0.528SS*.Hα-helixtrans-74.6-43.4167.8-69.8174.2000110.4M698 S699 K705 E706M698-L702 PolarHBondContact O-N 3.07Å; S699-L702 PolarHBondContact O-N 3.45Å; L702-K705 PolarHBondContact O-N 2.82Å; L702-K705 VanDerWaalsContact O-N 3.17Å; L702-E706 PolarHBondContact O-N 2.66Å
703A81.1Confident76.2Confident58 Ų5899.9 Ų99.948%0.47952%0.515SS..Hα-helixtrans-64.2-47.617200000112S699 K705 E706 E707S699-A703 PolarHBondContact O-N 3.44Å; A703-K705 PolarHBondContact O-N 2.78Å; A703-E706 PolarHBondContact O-N 2.94Å; A703-E707 WeakPolarHBondContact O-CG 3.28Å; A703-E707 PolarHBondContact O-N 2.89Å
704L78.2Confident77.9Confident104 Ų10499.6 Ų99.655%0.54551%0.513SS..Hα-helixtrans-65.8-18.9172.1-79163.1000112.2Q700 Y708Q700-L704 WeakPolarHBondContact O-CA 3.46Å; Q700-L704 WeakPolarHBondContact O-CB 3.41Å; Q700-L704 WeakPolarHBondContact O-CD1 3.3Å; Q700-L704 WeakPolarHBondContact O-CG 3.47Å; Q700-L704 PolarHBondContact O-N 3.28Å; L704-Y708 WeakPolarHBondContact O-CA 3.45Å; L704-Y708 WeakPolarHBondContact O-CB 3.45Å; L704-Y708 PolarHBondContact O-N 2.84Å
705K85.7Confident79.6Confident119 Ų119100.9 Ų100.952%0.51752%0.519SS..Hα-helixtrans-77.9-42.4170.3179.8175.5178.4-171.30111.1L701 L702 A703 E707 Y708 D709L701-K705 WeakPolarHBondContact O-CA 3.37Å; L701-K705 WeakPolarHBondContact O-CB 3.4Å; L701-K705 PolarHBondContact O-N 2.84Å; L702-K705 PolarHBondContact O-N 2.82Å; L702-K705 VanDerWaalsContact O-N 3.17Å; A703-K705 PolarHBondContact O-N 2.78Å; K705-E707 VanDerWaalsContact C-N 3.34Å; K705-Y708 PolarHBondContact O-N 3.35Å; K705-D709 VanDerWaalsContact CE-OD2 3.24Å; K705-D709 WeakPolarHBondContact CE-OD2 3.47Å; K705-D709 WeakPolarHBondContact CG-OD2 3.46Å; K705-D709 VanDerWaalsContact O-CB 3.28Å; K705-D709 WeakPolarHBondContact O-CB 3.41Å; K705-D709 VanDerWaalsContact O-CG 3.28Å; K705-D709 PolarHBondContact O-N 2.84Å
706E85.2Confident81Confident134 Ų13496.4 Ų96.463%0.62650%0.5SS*.Hα-helixtrans-64-41.1171.1-72.5-167.2175.700111.6L702 A703 K710L702-E706 PolarHBondContact O-N 2.66Å; A703-E706 PolarHBondContact O-N 2.94Å; E706-K710 WeakPolarHBondContact O-CD 3.48Å; E706-K710 WeakPolarHBondContact O-CE 3.42Å; E706-K710 WeakPolarHBondContact O-CG 3.49Å; E706-K710 PolarHBondContact O-N 2.95Å
707E86.3Confident82.1Confident106 Ų10696.1 Ų96.150%0.49550%0.501SS..Hα-helixtrans-64.2-42.9172-67.5-67.898.900111.2A703 K705 K710 L711A703-E707 WeakPolarHBondContact O-CG 3.28Å; A703-E707 PolarHBondContact O-N 2.89Å; K705-E707 VanDerWaalsContact C-N 3.34Å; E707-K710 WeakPolarHBondContact O-CB 3.46Å; E707-K710 PolarHBondContact O-N 3.35Å; E707-K710 IonicContact OE1-NZ 2.68Å; E707-K710 PolarHBondContact OE1-NZ 3.24Å; E707-L711 WeakPolarHBondContact O-CB 3.22Å; E707-L711 PolarHBondContact O-N 3.19Å
708Y87.1Confident83.5Confident140 Ų140100 Ų10055%0.54952%0.516SS..Hα-helixtrans-66.8-38.9177173.3-91.3000112.1L704 K705 K710 L711 K712L704-Y708 WeakPolarHBondContact O-CA 3.45Å; L704-Y708 WeakPolarHBondContact O-CB 3.45Å; L704-Y708 PolarHBondContact O-N 2.84Å; K705-Y708 PolarHBondContact O-N 3.35Å; Y708-K710 VanDerWaalsContact C-N 3.33Å; Y708-L711 CarbonylContact O-C 3.58Å; Y708-L711 PolarHBondContact O-N 2.92Å; Y708-K712 HydrophobicContact CE1-CB 4.41Å; Y708-K712 HydrophobicContact CE1-CD 3.89Å; Y708-K712 WeakPolarHBondContact O-CA 3.3Å; Y708-K712 WeakPolarHBondContact O-CB 3.24Å; Y708-K712 PolarHBondContact O-N 3.23Å
709D86.6Confident84.4Confident80 Ų8097.3 Ų97.343%0.42851%0.507SS..Hα-helixtrans-69.8-32.7177.9-72.5-26.4000110.2K705 A713K705-D709 VanDerWaalsContact CE-OD2 3.24Å; K705-D709 WeakPolarHBondContact CE-OD2 3.47Å; K705-D709 WeakPolarHBondContact CG-OD2 3.46Å; K705-D709 VanDerWaalsContact O-CB 3.28Å; K705-D709 WeakPolarHBondContact O-CB 3.41Å; K705-D709 VanDerWaalsContact O-CG 3.28Å; K705-D709 PolarHBondContact O-N 2.84Å; D709-A713 WeakPolarHBondContact O-CB 3.44Å; D709-A713 PolarHBondContact O-N 3.47Å
710K87.7Confident84.9Confident106 Ų10696.6 Ų96.646%0.46150%0.502SS..Hα-helixtrans-68.1-48.4166.7-67.1165.2-150.2163.50112.3E706 E707 Y708 K712 A713 L714E706-K710 WeakPolarHBondContact O-CD 3.48Å; E706-K710 WeakPolarHBondContact O-CE 3.42Å; E706-K710 WeakPolarHBondContact O-CG 3.49Å; E706-K710 PolarHBondContact O-N 2.95Å; E707-K710 WeakPolarHBondContact O-CB 3.46Å; E707-K710 PolarHBondContact O-N 3.35Å; E707-K710 IonicContact OE1-NZ 2.68Å; E707-K710 PolarHBondContact OE1-NZ 3.24Å; Y708-K710 VanDerWaalsContact C-N 3.33Å; K710-K712 PolarHBondContact O-N 3.17Å; K710-A713 PolarHBondContact O-N 2.97Å; K710-L714 WeakPolarHBondContact O-CG 3.45Å; K710-L714 PolarHBondContact O-N 2.79Å
711L87.9Confident85.7Confident120 Ų12096.6 Ų96.663%0.62850%0.502SS*.Hα-helixtrans-67.6-27.7-178-151.778.1000111E707 Y708 H715E707-L711 WeakPolarHBondContact O-CB 3.22Å; E707-L711 PolarHBondContact O-N 3.19Å; Y708-L711 CarbonylContact O-C 3.58Å; Y708-L711 PolarHBondContact O-N 2.92Å; L711-H715 WeakPolarHBondContact O-CA 3.35Å; L711-H715 WeakPolarHBondContact O-CB 3.43Å; L711-H715 PolarHBondContact O-N 2.8Å
712K90.1Very high86.4Confident89 Ų8994.9 Ų94.939%0.38750%0.497SS..Hα-helixtrans-75.8-42.2170.6-178.6172.7179.21780111.4Y708 K710 L714 H715 D716Y708-K712 HydrophobicContact CE1-CB 4.41Å; Y708-K712 HydrophobicContact CE1-CD 3.89Å; Y708-K712 WeakPolarHBondContact O-CA 3.3Å; Y708-K712 WeakPolarHBondContact O-CB 3.24Å; Y708-K712 PolarHBondContact O-N 3.23Å; K710-K712 PolarHBondContact O-N 3.17Å; K712-L714 VanDerWaalsContact C-N 3.26Å; K712-L714 PolarHBondContact O-N 2.73Å; K712-H715 PolarHBondContact O-N 3.27Å; K712-D716 WeakPolarHBondContact CE-OD2 3.46Å; K712-D716 WeakPolarHBondContact CG-OD2 3.39Å; K712-D716 WeakPolarHBondContact O-CB 3.28Å; K712-D716 PolarHBondContact O-N 3.29Å
713A87.6Confident86.9Confident65 Ų6593.3 Ų93.354%0.53749%0.489SS..Hα-helixtrans-60.7-38.5170.600000111.8D709 K710 S717D709-A713 WeakPolarHBondContact O-CB 3.44Å; D709-A713 PolarHBondContact O-N 3.47Å; K710-A713 PolarHBondContact O-N 2.97Å; A713-S717 WeakPolarHBondContact O-CB 3.4Å; A713-S717 PolarHBondContact O-N 2.88Å
714L88.7Confident87.3Confident109 Ų10995.7 Ų95.757%0.57149%0.494SS*.Hα-helixtrans-68.7-44.9172.7-72171.7000112.3K710 K712 S717 E718K710-L714 WeakPolarHBondContact O-CG 3.45Å; K710-L714 PolarHBondContact O-N 2.79Å; K712-L714 VanDerWaalsContact C-N 3.26Å; K712-L714 PolarHBondContact O-N 2.73Å; L714-S717 CarbonylContact O-C 3.59Å; L714-S717 WeakPolarHBondContact O-CB 3.39Å; L714-S717 PolarHBondContact O-N 2.75Å; L714-E718 VanDerWaalsContact O-CB 3.3Å; L714-E718 WeakPolarHBondContact O-CB 3.45Å; L714-E718 PolarHBondContact O-N 2.73Å
715H88.9Confident87.9Confident113 Ų11395.2 Ų95.252%0.52349%0.487SS..Hα-helixtrans-65.3-40.2176.6168.8-85.6000112L711 K712 S717 E718 S719L711-H715 WeakPolarHBondContact O-CA 3.35Å; L711-H715 WeakPolarHBondContact O-CB 3.43Å; L711-H715 PolarHBondContact O-N 2.8Å; K712-H715 PolarHBondContact O-N 3.27Å; H715-S717 VanDerWaalsContact C-N 3.3Å; H715-E718 PolarHBondContact O-N 2.88Å; H715-S719 WeakPolarHBondContact O-CA 3.46Å; H715-S719 WeakPolarHBondContact O-CB 3.36Å; H715-S719 PolarHBondContact O-N 3.42Å
716D88.1Confident88.1Confident71 Ų7194.9 Ų94.938%0.3849%0.49SS..Hα-helixtrans-72.9-30.1179.6-64.7-9.2000109.8K712 S720K712-D716 WeakPolarHBondContact CE-OD2 3.46Å; K712-D716 WeakPolarHBondContact CG-OD2 3.39Å; K712-D716 WeakPolarHBondContact O-CB 3.28Å; K712-D716 PolarHBondContact O-N 3.29Å; D716-S720 VanDerWaalsContact O-CB 3.22Å; D716-S720 WeakPolarHBondContact O-CB 3.41Å; D716-S720 PolarHBondContact O-N 3.17Å; D716-S720 PolarHBondContact O-OG 3.31Å
717S87.6Confident88.3Confident76 Ų7692.2 Ų92.253%0.53148%0.483SS..Hα-helixtrans-67.3-49.8166.7173.30000112.7A713 L714 H715 S720 Q721A713-S717 WeakPolarHBondContact O-CB 3.4Å; A713-S717 PolarHBondContact O-N 2.88Å; L714-S717 CarbonylContact O-C 3.59Å; L714-S717 WeakPolarHBondContact O-CB 3.39Å; L714-S717 PolarHBondContact O-N 2.75Å; H715-S717 VanDerWaalsContact C-N 3.3Å; S717-S720 WeakPolarHBondContact O-CB 3.45Å; S717-S720 PolarHBondContact O-N 3.02Å; S717-Q721 PolarHBondContact O-N 3.47Å
718E89.7Confident88.5Confident125 Ų12592.6 Ų92.658%0.58449%0.485SS*.Hα-helixtrans-71.8-32.6-178.5-176.6167.4-148.200112L714 H715 Q721 S722L714-E718 VanDerWaalsContact O-CB 3.3Å; L714-E718 WeakPolarHBondContact O-CB 3.45Å; L714-E718 PolarHBondContact O-N 2.73Å; H715-E718 PolarHBondContact O-N 2.88Å; E718-Q721 CarbonylContact O-C 3.59Å; E718-Q721 PolarHBondContact O-N 2.99Å; E718-S722 WeakPolarHBondContact O-CB 3.35Å; E718-S722 PolarHBondContact O-N 3.19Å; E718-S722 PolarHBondContact O-OG 3.39Å
719S88.5Confident88.8Confident41 Ų4191 Ų9129%0.28749%0.486SS..Hα-helixtrans-67.9-43168.9-179.50000110.2H715 Q721 S722 N723H715-S719 WeakPolarHBondContact O-CA 3.46Å; H715-S719 WeakPolarHBondContact O-CB 3.36Å; H715-S719 PolarHBondContact O-N 3.42Å; S719-Q721 VanDerWaalsContact C-N 3.33Å; S719-Q721 PolarHBondContact O-N 3.09Å; S719-S722 PolarHBondContact O-N 3Å; S719-N723 VanDerWaalsContact O-CB 3.25Å; S719-N723 WeakPolarHBondContact O-CB 3.37Å; S719-N723 PolarHBondContact O-N 3.48Å; S719-N723 PolarHBondContact O-ND2 2.6Å; S719-N723 PolarHBondContact OG-ND2 2.93Å
720S85.2Confident89Confident72 Ų7289 Ų8950%0.50348%0.483SS..Hα-helixtrans-60-43.1171-630000111.7D716 S717 L724D716-S720 VanDerWaalsContact O-CB 3.22Å; D716-S720 WeakPolarHBondContact O-CB 3.41Å; D716-S720 PolarHBondContact O-N 3.17Å; D716-S720 PolarHBondContact O-OG 3.31Å; S717-S720 WeakPolarHBondContact O-CB 3.45Å; S717-S720 PolarHBondContact O-N 3.02Å; S720-L724 WeakPolarHBondContact O-CB 3.5Å; S720-L724 WeakPolarHBondContact O-CG 3.2Å; S720-L724 PolarHBondContact O-N 3.39Å
721Q89.4Confident89.2Confident102 Ų10290.1 Ų90.148%0.47749%0.49SS..Hα-helixtrans-68-34.2176-159-167.940.600112.7S717 E718 S719 K725S717-Q721 PolarHBondContact O-N 3.47Å; E718-Q721 CarbonylContact O-C 3.59Å; E718-Q721 PolarHBondContact O-N 2.99Å; S719-Q721 VanDerWaalsContact C-N 3.33Å; S719-Q721 PolarHBondContact O-N 3.09Å; Q721-K725 VanDerWaalsContact O-CG 3.29Å; Q721-K725 WeakPolarHBondContact O-CG 3.46Å; Q721-K725 PolarHBondContact O-N 3.35Å; Q721-K725 VanDerWaalsContact OE1-NZ 3.13Å
722S85.5Confident89.4Confident45 Ų4587.9 Ų87.932%0.31548%0.482SS..Hα-helixtrans-76.3-35.4178.1-61.70000111.6E718 S719 K725 L726E718-S722 WeakPolarHBondContact O-CB 3.35Å; E718-S722 PolarHBondContact O-N 3.19Å; E718-S722 PolarHBondContact O-OG 3.39Å; S719-S722 PolarHBondContact O-N 3Å; S722-K725 PolarHBondContact O-N 3.06Å; S722-L726 VanDerWaalsContact O-CB 3.31Å; S722-L726 WeakPolarHBondContact O-CB 3.48Å; S722-L726 VanDerWaalsContact O-CG 3.22Å; S722-L726 WeakPolarHBondContact O-CG 3.38Å; S722-L726 PolarHBondContact O-N 2.91Å
723N89.7Confident89.4Confident85 Ų8588.9 Ų88.946%0.45549%0.491SS..Hα-helixtrans-67.1-38170.6-71.8-42.1000111.2S719 L726 T727S719-N723 VanDerWaalsContact O-CB 3.25Å; S719-N723 WeakPolarHBondContact O-CB 3.37Å; S719-N723 PolarHBondContact O-N 3.48Å; S719-N723 PolarHBondContact O-ND2 2.6Å; S719-N723 PolarHBondContact OG-ND2 2.93Å; N723-L726 PolarHBondContact O-N 3.06Å; N723-T727 WeakPolarHBondContact O-CB 3.27Å; N723-T727 PolarHBondContact O-N 3.44Å; N723-T727 PolarHBondContact O-OG1 3.14Å
724L89.2Confident89.7Confident108 Ų10892 Ų9257%0.56549%0.492SS*.Hα-helixtrans-60.3-51.5169-76.6166.7000111.1S720 L726 T727 E728S720-L724 WeakPolarHBondContact O-CB 3.5Å; S720-L724 WeakPolarHBondContact O-CG 3.2Å; S720-L724 PolarHBondContact O-N 3.39Å; L724-L726 VanDerWaalsContact C-N 3.3Å; L724-L726 PolarHBondContact O-N 3.13Å; L724-T727 CarbonylContact O-C 3.57Å; L724-T727 WeakPolarHBondContact O-CA 3.41Å; L724-T727 WeakPolarHBondContact O-CB 3.44Å; L724-T727 PolarHBondContact O-N 3.35Å; L724-E728 WeakPolarHBondContact O-CG 3.46Å; L724-E728 PolarHBondContact O-N 3.05Å
725K91Very high89.8Confident94 Ų9489.6 Ų89.641%0.40949%0.488SS..Hα-helixtrans-59-36.7175-71.6164.6-175.5163.60113.1Q721 S722 T727 L729Q721-K725 VanDerWaalsContact O-CG 3.29Å; Q721-K725 WeakPolarHBondContact O-CG 3.46Å; Q721-K725 PolarHBondContact O-N 3.35Å; Q721-K725 VanDerWaalsContact OE1-NZ 3.13Å; S722-K725 PolarHBondContact O-N 3.06Å; K725-T727 VanDerWaalsContact C-N 3.34Å; K725-L729 VanDerWaalsContact O-CB 3.26Å; K725-L729 WeakPolarHBondContact O-CB 3.29Å; K725-L729 WeakPolarHBondContact O-CG 3.3Å; K725-L729 PolarHBondContact O-N 3.37Å
726L90.6Very high90Very high111 Ų11190.8 Ų90.858%0.58149%0.491SS*.Hα-helixtrans-71.2-29.5174.7-75.8169.2000112.1S722 N723 L724 G730S722-L726 VanDerWaalsContact O-CB 3.31Å; S722-L726 WeakPolarHBondContact O-CB 3.48Å; S722-L726 VanDerWaalsContact O-CG 3.22Å; S722-L726 WeakPolarHBondContact O-CG 3.38Å; S722-L726 PolarHBondContact O-N 2.91Å; N723-L726 PolarHBondContact O-N 3.06Å; L724-L726 VanDerWaalsContact C-N 3.3Å; L724-L726 PolarHBondContact O-N 3.13Å; L726-G730 PolarHBondContact O-N 3.43Å
727T89.9Confident90.2Very high79 Ų7992.3 Ų92.349%0.48550%0.499SS..Hα-helixtrans-72.4-46.2172.6-51.30000110.1N723 L724 K725 L729 G730 E731N723-T727 WeakPolarHBondContact O-CB 3.27Å; N723-T727 PolarHBondContact O-N 3.44Å; N723-T727 PolarHBondContact O-OG1 3.14Å; L724-T727 CarbonylContact O-C 3.57Å; L724-T727 WeakPolarHBondContact O-CA 3.41Å; L724-T727 WeakPolarHBondContact O-CB 3.44Å; L724-T727 PolarHBondContact O-N 3.35Å; K725-T727 VanDerWaalsContact C-N 3.34Å; T727-L729 VanDerWaalsContact C-N 3.34Å; T727-L729 PolarHBondContact O-N 2.95Å; T727-G730 CarbonylContact O-C 3.53Å; T727-G730 WeakPolarHBondContact O-CA 3.34Å; T727-G730 PolarHBondContact O-N 3.03Å; T727-E731 WeakPolarHBondContact O-CG 3.48Å; T727-E731 PolarHBondContact O-N 3.23Å
728E90.4Very high90.4Very high114 Ų11492.5 Ų92.553%0.53350%0.495SS..Hα-helixtrans-59.7-41172.8-68.1167.7178.200112L724 T732L724-E728 WeakPolarHBondContact O-CG 3.46Å; L724-E728 PolarHBondContact O-N 3.05Å; E728-T732 WeakPolarHBondContact O-CB 3.44Å; E728-T732 WeakPolarHBondContact O-CG2 3.49Å; E728-T732 PolarHBondContact O-N 3.17Å; E728-T732 PolarHBondContact O-OG1 2.81Å
729L91.4Very high90.5Very high107 Ų10791.4 Ų91.456%0.5649%0.492SS*.Hα-helixtrans-67.7-36.3172.2-75.5169.3000111.9K725 T727 T732 L733K725-L729 VanDerWaalsContact O-CB 3.26Å; K725-L729 WeakPolarHBondContact O-CB 3.29Å; K725-L729 WeakPolarHBondContact O-CG 3.3Å; K725-L729 PolarHBondContact O-N 3.37Å; T727-L729 VanDerWaalsContact C-N 3.34Å; T727-L729 PolarHBondContact O-N 2.95Å; L729-T732 WeakPolarHBondContact CA-OG1 3.41Å; L729-T732 PolarHBondContact O-OG1 2.73Å; L729-L733 WeakPolarHBondContact O-CB 3.26Å; L729-L733 PolarHBondContact O-N 3.36Å
730G92.3Very high90.7Very high37 Ų3793.4 Ų93.438%0.38150%0.502SS..Hα-helixtrans-65.4-43.1173.700000112.7L726 T727 K734L726-G730 PolarHBondContact O-N 3.43Å; T727-G730 CarbonylContact O-C 3.53Å; T727-G730 WeakPolarHBondContact O-CA 3.34Å; T727-G730 PolarHBondContact O-N 3.03Å; G730-K734 VanDerWaalsContact O-CB 3.23Å; G730-K734 WeakPolarHBondContact O-CB 3.42Å; G730-K734 PolarHBondContact O-N 3.18Å
731E91.6Very high91Very high129 Ų12992.7 Ų92.760%0.60350%0.501SS*.Hα-helixtrans-67.8-42.3176.1-73.2-178.1175.700111.8T727 K734 A735T727-E731 WeakPolarHBondContact O-CG 3.48Å; T727-E731 PolarHBondContact O-N 3.23Å; E731-K734 PolarHBondContact O-N 3.4Å; E731-A735 WeakPolarHBondContact O-CB 3.49Å; E731-A735 PolarHBondContact O-N 3.41Å
732T91.2Very high91.1Very high73 Ų7392.5 Ų92.545%0.44850%0.503SS..Hα-helixtrans-73.3-3117653.30000113.2E728 L729 K736E728-T732 WeakPolarHBondContact O-CB 3.44Å; E728-T732 WeakPolarHBondContact O-CG2 3.49Å; E728-T732 PolarHBondContact O-N 3.17Å; E728-T732 PolarHBondContact O-OG1 2.81Å; L729-T732 WeakPolarHBondContact CA-OG1 3.41Å; L729-T732 PolarHBondContact O-OG1 2.73Å; T732-K736 WeakPolarHBondContact O-CB 3.37Å; T732-K736 VanDerWaalsContact O-CG 3.28Å; T732-K736 WeakPolarHBondContact O-CG 3.39Å; T732-K736 PolarHBondContact O-N 3.46Å
733L91.9Very high91.4Very high110 Ų11094.2 Ų94.258%0.57651%0.508SS*.Hα-helixtrans-68-42.1169.2-169.682.4000110.7L729 K736 N737L729-L733 WeakPolarHBondContact O-CB 3.26Å; L729-L733 PolarHBondContact O-N 3.36Å; L733-K736 PolarHBondContact O-N 3.06Å; L733-N737 PolarHBondContact O-N 2.99Å
734K93Very high91.5Very high132 Ų13294.2 Ų94.257%0.57451%0.512SS*.Hα-helixtrans-61.3-49.5174.7-174.5-172.8171.7-170.10110.9G730 E731 K736 N737 D738G730-K734 VanDerWaalsContact O-CB 3.23Å; G730-K734 WeakPolarHBondContact O-CB 3.42Å; G730-K734 PolarHBondContact O-N 3.18Å; E731-K734 PolarHBondContact O-N 3.4Å; K734-K736 PolarHBondContact O-N 3.5Å; K734-N737 CarbonylContact O-C 3.53Å; K734-N737 PolarHBondContact O-N 3.16Å; K734-D738 WeakPolarHBondContact O-CB 3.27Å; K734-D738 VanDerWaalsContact O-CG 3.26Å; K734-D738 PolarHBondContact O-N 3.32Å
735A90.9Very high91.6Very high57 Ų5792.4 Ų92.447%0.47151%0.508SS..Hα-helixtrans-59.3-33.1176.300000112.6E731 L739E731-A735 WeakPolarHBondContact O-CB 3.49Å; E731-A735 PolarHBondContact O-N 3.41Å; A735-L739 VanDerWaalsContact O-CB 3.28Å; A735-L739 WeakPolarHBondContact O-CB 3.18Å; A735-L739 PolarHBondContact O-N 3.4Å
736K92.1Very high91.6Very high138 Ų13893.4 Ų93.460%0.651%0.514SS*.Hα-helixtrans-70.8-40.3171.3-76.8172.5179.3178.20112.9T732 L733 K734 L739 V740T732-K736 WeakPolarHBondContact O-CB 3.37Å; T732-K736 VanDerWaalsContact O-CG 3.28Å; T732-K736 WeakPolarHBondContact O-CG 3.39Å; T732-K736 PolarHBondContact O-N 3.46Å; L733-K736 PolarHBondContact O-N 3.06Å; K734-K736 PolarHBondContact O-N 3.5Å; K736-L739 PolarHBondContact O-N 3.23Å; K736-V740 WeakPolarHBondContact O-CB 3.3Å; K736-V740 VanDerWaalsContact O-CG2 3.31Å; K736-V740 WeakPolarHBondContact O-CG2 3.49Å; K736-V740 PolarHBondContact O-N 3.26Å
737N92.3Very high91.6Very high103 Ų10393.1 Ų93.155%0.55151%0.512SS*.Hα-helixtrans-65.6-41.5173.1-86.3-0000111.8L733 K734 L739 V740 A741L733-N737 PolarHBondContact O-N 2.99Å; K734-N737 CarbonylContact O-C 3.53Å; K734-N737 PolarHBondContact O-N 3.16Å; N737-L739 VanDerWaalsContact C-N 3.32Å; N737-L739 PolarHBondContact O-N 3.48Å; N737-V740 PolarHBondContact O-N 3.17Å; N737-A741 VanDerWaalsContact O-CB 3.31Å; N737-A741 WeakPolarHBondContact O-CB 3.43Å; N737-A741 PolarHBondContact O-N 3.36Å
738D91.6Very high91.7Very high81 Ų8194.3 Ų94.343%0.43351%0.512SS..Hα-helixtrans-64.2-38175.5-64.9-20.9000110.2K734 N742K734-D738 WeakPolarHBondContact O-CB 3.27Å; K734-D738 VanDerWaalsContact O-CG 3.26Å; K734-D738 PolarHBondContact O-N 3.32Å; D738-N742 WeakPolarHBondContact O-CB 3.14Å; D738-N742 VanDerWaalsContact O-CG 3.28Å; D738-N742 PolarHBondContact O-N 2.94Å; D738-N742 PolarHBondContact O-ND2 3.17Å
739L92.9Very high91.6Very high101 Ų10192 Ų9253%0.52951%0.506SS..Hα-helixtrans-65.8-44.5171.7178.762.4000112.5A735 K736 N737 N742 L743A735-L739 VanDerWaalsContact O-CB 3.28Å; A735-L739 WeakPolarHBondContact O-CB 3.18Å; A735-L739 PolarHBondContact O-N 3.4Å; K736-L739 PolarHBondContact O-N 3.23Å; N737-L739 VanDerWaalsContact C-N 3.32Å; N737-L739 PolarHBondContact O-N 3.48Å; L739-N742 PolarHBondContact O-N 3.14Å; L739-L743 HydrophobicContact CD1-CD1 4.21Å; L739-L743 HydrophobicContact CD1-CG 4.37Å; L739-L743 HydrophobicContact CG-CD1 4.04Å; L739-L743 WeakPolarHBondContact O-CB 3.42Å; L739-L743 WeakPolarHBondContact O-CG 3.34Å; L739-L743 PolarHBondContact O-N 3.11Å
740V92.9Very high91.5Very high83 Ų8391.1 Ų91.150%0.50350%0.501SS..Hα-helixtrans-64.5-40.9176.4168.40000110.8K736 N737 L743 T744K736-V740 WeakPolarHBondContact O-CB 3.3Å; K736-V740 VanDerWaalsContact O-CG2 3.31Å; K736-V740 WeakPolarHBondContact O-CG2 3.49Å; K736-V740 PolarHBondContact O-N 3.26Å; N737-V740 PolarHBondContact O-N 3.17Å; V740-L743 PolarHBondContact O-N 2.93Å; V740-T744 WeakPolarHBondContact O-CB 3.33Å; V740-T744 PolarHBondContact O-N 2.86Å; V740-T744 PolarHBondContact O-OG1 3.16Å
741A90.5Very high91.4Very high58 Ų5892.6 Ų92.648%0.47951%0.505SS..Hα-helixtrans-63.2-41.9174.700000111.9N737 T744 S745N737-A741 VanDerWaalsContact O-CB 3.31Å; N737-A741 WeakPolarHBondContact O-CB 3.43Å; N737-A741 PolarHBondContact O-N 3.36Å; A741-T744 PolarHBondContact O-N 3.26Å; A741-S745 WeakPolarHBondContact O-CB 3.49Å; A741-S745 PolarHBondContact O-N 3.02Å
742N92.2Very high91.2Very high97 Ų9790.3 Ų90.352%0.51950%0.497SS..Hα-helixtrans-64-42.2173.6-77.2-49.1000112.2D738 L739 S745 Q746D738-N742 WeakPolarHBondContact O-CB 3.14Å; D738-N742 VanDerWaalsContact O-CG 3.28Å; D738-N742 PolarHBondContact O-N 2.94Å; D738-N742 PolarHBondContact O-ND2 3.17Å; L739-N742 PolarHBondContact O-N 3.14Å; N742-S745 PolarHBondContact O-N 2.68Å; N742-Q746 WeakPolarHBondContact O-CB 3.36Å; N742-Q746 VanDerWaalsContact O-CG 3.3Å; N742-Q746 WeakPolarHBondContact O-CG 3.35Å; N742-Q746 PolarHBondContact O-N 3.1Å
743L91.8Very high91.1Very high81 Ų8192.4 Ų92.442%0.42450%0.502SS..Hα-helixtrans-65.5-43.2175.8-75.1166.4000111.9L739 V740 S745 Q746 I747L739-L743 HydrophobicContact CD1-CD1 4.21Å; L739-L743 HydrophobicContact CD1-CG 4.37Å; L739-L743 HydrophobicContact CG-CD1 4.04Å; L739-L743 WeakPolarHBondContact O-CB 3.42Å; L739-L743 WeakPolarHBondContact O-CG 3.34Å; L739-L743 PolarHBondContact O-N 3.11Å; V740-L743 PolarHBondContact O-N 2.93Å; L743-S745 VanDerWaalsContact C-N 3.32Å; L743-S745 PolarHBondContact O-N 3.38Å; L743-Q746 PolarHBondContact O-N 3.38Å; L743-I747 WeakPolarHBondContact O-CB 3.38Å; L743-I747 VanDerWaalsContact O-CG1 3.28Å; L743-I747 WeakPolarHBondContact O-CG1 3.48Å; L743-I747 PolarHBondContact O-N 3.24Å
744T92.5Very high90.8Very high86 Ų8694 Ų9453%0.52850%0.504SS..Hα-helixtrans-61.6-40.9173.2-58.90000111.2V740 A741 I747 Q748V740-T744 WeakPolarHBondContact O-CB 3.33Å; V740-T744 PolarHBondContact O-N 2.86Å; V740-T744 PolarHBondContact O-OG1 3.16Å; A741-T744 PolarHBondContact O-N 3.26Å; T744-I747 PolarHBondContact O-N 3.29Å; T744-Q748 WeakPolarHBondContact O-CB 3.47Å; T744-Q748 PolarHBondContact O-N 3.26Å
745S91.2Very high90.7Very high69 Ų6993 Ų9348%0.48350%0.502SS..Hα-helixtrans-64.6-41.5175.2-169.40000112.1A741 N742 L743 Q748 T749A741-S745 WeakPolarHBondContact O-CB 3.49Å; A741-S745 PolarHBondContact O-N 3.02Å; N742-S745 PolarHBondContact O-N 2.68Å; L743-S745 VanDerWaalsContact C-N 3.32Å; L743-S745 PolarHBondContact O-N 3.38Å; S745-Q748 PolarHBondContact O-N 2.76Å; S745-T749 PolarHBondContact O-N 2.78Å; S745-T749 PolarHBondContact O-OG1 2.95Å
746Q91.1Very high90.5Very high116 Ų11692.9 Ų92.954%0.54250%0.501SS..Hα-helixtrans-65.9-41176-75.2171.5-1.600111.9N742 L743 T749 L750N742-Q746 WeakPolarHBondContact O-CB 3.36Å; N742-Q746 VanDerWaalsContact O-CG 3.3Å; N742-Q746 WeakPolarHBondContact O-CG 3.35Å; N742-Q746 PolarHBondContact O-N 3.1Å; L743-Q746 PolarHBondContact O-N 3.38Å; Q746-T749 PolarHBondContact O-N 2.79Å; Q746-L750 WeakPolarHBondContact O-CB 3.32Å; Q746-L750 WeakPolarHBondContact O-CG 3.49Å; Q746-L750 PolarHBondContact O-N 3.33Å
747I90.9Very high90.2Very high104 Ų10490.6 Ų90.653%0.53350%0.495SS..Hα-helixtrans-63.5-43.3174.3-69.7164.7000110.4L743 T744 L750 C751L743-I747 WeakPolarHBondContact O-CB 3.38Å; L743-I747 VanDerWaalsContact O-CG1 3.28Å; L743-I747 WeakPolarHBondContact O-CG1 3.48Å; L743-I747 PolarHBondContact O-N 3.24Å; T744-I747 PolarHBondContact O-N 3.29Å; I747-L750 PolarHBondContact O-N 3.48Å; I747-C751 PolarHBondContact O-N 2.97Å; I747-C751 PolarHBondContact O-SG 3.11Å
748Q90.8Very high90Very high105 Ų10591.1 Ų91.149%0.49149%0.494SS..Hα-helixtrans-62.4-47175.4-172.863.653.400111.4T744 S745 L750 C751 D752T744-Q748 WeakPolarHBondContact O-CB 3.47Å; T744-Q748 PolarHBondContact O-N 3.26Å; S745-Q748 PolarHBondContact O-N 2.76Å; Q748-L750 VanDerWaalsContact C-N 3.31Å; Q748-L750 PolarHBondContact O-N 3.23Å; Q748-C751 WeakPolarHBondContact O-CB 3.26Å; Q748-C751 PolarHBondContact O-N 2.82Å; Q748-C751 VanDerWaalsContact O-N 3.1Å; Q748-D752 PolarHBondContact NE2-OD1 3.38Å; Q748-D752 PolarHBondContact O-N 3.41Å
749T89.4Confident89.8Confident64 Ų6491.3 Ų91.339%0.39349%0.492SS..Hα-helixtrans-59.6-40.8176.7-56.20000111.8S745 Q746 D752 E753S745-T749 PolarHBondContact O-N 2.78Å; S745-T749 PolarHBondContact O-OG1 2.95Å; Q746-T749 PolarHBondContact O-N 2.79Å; T749-D752 PolarHBondContact O-N 2.94Å; T749-E753 HydrophobicContact CG2-CG 4.5Å; T749-E753 WeakPolarHBondContact O-CB 3.39Å; T749-E753 VanDerWaalsContact O-CG 3.3Å; T749-E753 WeakPolarHBondContact O-CG 3.46Å; T749-E753 PolarHBondContact O-N 2.87Å
750L88.7Confident89.6Confident90 Ų9087.7 Ų87.747%0.47148%0.479SS..Hα-helixtrans-64.8-39.8174-74.8170.2000112.3Q746 I747 Q748 E753 F754Q746-L750 WeakPolarHBondContact O-CB 3.32Å; Q746-L750 WeakPolarHBondContact O-CG 3.49Å; Q746-L750 PolarHBondContact O-N 3.33Å; I747-L750 PolarHBondContact O-N 3.48Å; Q748-L750 VanDerWaalsContact C-N 3.31Å; Q748-L750 PolarHBondContact O-N 3.23Å; L750-E753 PolarHBondContact O-N 3.35Å; L750-F754 WeakPolarHBondContact O-CB 3.44Å; L750-F754 WeakPolarHBondContact O-CD2 3.5Å; L750-F754 PolarHBondContact O-N 3.39Å
751C89.3Confident89.3Confident67 Ų6788.7 Ų88.745%0.45348%0.477SS..Hα-helixtrans-63.3-43.4173.7-70.90000111.9I747 Q748 E753 F754 Q755I747-C751 PolarHBondContact O-N 2.97Å; I747-C751 PolarHBondContact O-SG 3.11Å; Q748-C751 WeakPolarHBondContact O-CB 3.26Å; Q748-C751 PolarHBondContact O-N 2.82Å; Q748-C751 VanDerWaalsContact O-N 3.1Å; C751-E753 VanDerWaalsContact C-N 3.35Å; C751-F754 PolarHBondContact O-N 2.95Å; C751-Q755 WeakPolarHBondContact O-CB 3.42Å; C751-Q755 PolarHBondContact O-N 3.06Å
752D88.3Confident89Confident82 Ų8290.5 Ų90.544%0.43948%0.475SS..Hα-helixtrans-63.9-40.4177-59.4-18.7000110.9Q748 T749 Q755 A756Q748-D752 PolarHBondContact NE2-OD1 3.38Å; Q748-D752 PolarHBondContact O-N 3.41Å; T749-D752 PolarHBondContact O-N 2.94Å; D752-Q755 PolarHBondContact O-N 2.83Å; D752-A756 WeakPolarHBondContact O-CB 3.12Å; D752-A756 PolarHBondContact O-N 3.11Å
753E89Confident88.7Confident117 Ų11793.7 Ų93.755%0.54748%0.48SS..Hα-helixtrans-66.6-42.3174.2-76.3175.8179.100112.2T749 L750 C751 A756 L757T749-E753 HydrophobicContact CG2-CG 4.5Å; T749-E753 WeakPolarHBondContact O-CB 3.39Å; T749-E753 VanDerWaalsContact O-CG 3.3Å; T749-E753 WeakPolarHBondContact O-CG 3.46Å; T749-E753 PolarHBondContact O-N 2.87Å; L750-E753 PolarHBondContact O-N 3.35Å; C751-E753 VanDerWaalsContact C-N 3.35Å; E753-A756 PolarHBondContact O-N 3.4Å; E753-L757 VanDerWaalsContact O-CB 3.31Å; E753-L757 WeakPolarHBondContact O-CB 3.43Å; E753-L757 PolarHBondContact O-N 3.44Å
754F86.1Confident88.3Confident142 Ų14294 Ų9462%0.62348%0.479SS*.Hα-helixtrans-64.8-39.8174.4-90.2-65.4000112.2L750 C751 L757 Q758L750-F754 WeakPolarHBondContact O-CB 3.44Å; L750-F754 WeakPolarHBondContact O-CD2 3.5Å; L750-F754 PolarHBondContact O-N 3.39Å; C751-F754 PolarHBondContact O-N 2.95Å; F754-L757 PolarHBondContact O-N 2.65Å; F754-Q758 PolarHBondContact O-N 3.38Å
755Q89.7Confident87.8Confident112 Ų11298.1 Ų98.152%0.52349%0.485SS..Hα-helixtrans-65-46.9174.3-177.8176.8-27.400110.8C751 D752 L757 Q758 E759C751-Q755 WeakPolarHBondContact O-CB 3.42Å; C751-Q755 PolarHBondContact O-N 3.06Å; D752-Q755 PolarHBondContact O-N 2.83Å; Q755-L757 PolarHBondContact O-N 3.14Å; Q755-Q758 PolarHBondContact O-N 2.87Å; Q755-Q758 VanDerWaalsContact O-N 3.13Å; Q755-E759 HydrophobicContact CG-CG 4.38Å; Q755-E759 WeakPolarHBondContact CG-OE1 3.42Å; Q755-E759 PolarHBondContact NE2-OE1 3.41Å; Q755-E759 WeakPolarHBondContact O-CB 3.49Å; Q755-E759 WeakPolarHBondContact O-CG 3.35Å; Q755-E759 PolarHBondContact O-N 3.46Å
756A86.6Confident87.5Confident55 Ų5598.6 Ų98.646%0.45549%0.488SS..Hα-helixtrans-61.4-32.617700000112.8D752 E753 G760D752-A756 WeakPolarHBondContact O-CB 3.12Å; D752-A756 PolarHBondContact O-N 3.11Å; E753-A756 PolarHBondContact O-N 3.4Å; A756-G760 PolarHBondContact O-N 2.96Å
757L87.4Confident87.2Confident90 Ų9094.2 Ų94.247%0.47147%0.471SS..Hα-helixtrans-70.3-43.1173.2-16975.3000111.8E753 F754 Q755 G760 F761E753-L757 VanDerWaalsContact O-CB 3.31Å; E753-L757 WeakPolarHBondContact O-CB 3.43Å; E753-L757 PolarHBondContact O-N 3.44Å; F754-L757 PolarHBondContact O-N 2.65Å; Q755-L757 PolarHBondContact O-N 3.14Å; L757-G760 WeakPolarHBondContact O-CA 3.43Å; L757-G760 PolarHBondContact O-N 3.09Å; L757-G760 VanDerWaalsContact O-N 3.15Å; L757-F761 HydrophobicContact CD1-CE2 4.2Å; L757-F761 HydrophobicContact CD1-CZ 4.33Å; L757-F761 HydrophobicContact CD2-CE2 3.9Å; L757-F761 HydrophobicContact CG-CD2 4.19Å; L757-F761 HydrophobicContact CG-CE2 3.65Å; L757-F761 HydrophobicContact CG-CZ 4.27Å; L757-F761 WeakPolarHBondContact O-CD2 3.33Å; L757-F761 PolarHBondContact O-N 2.63Å
758Q86.5Confident86.8Confident113 Ų11394.6 Ų94.653%0.52847%0.466SS..Hα-helixtrans-62.8-49.2174.7179.1175.9-19.900111.4F754 Q755 G760 F761 E762F754-Q758 PolarHBondContact O-N 3.38Å; Q755-Q758 PolarHBondContact O-N 2.87Å; Q755-Q758 VanDerWaalsContact O-N 3.13Å; Q758-G760 PolarHBondContact O-N 2.87Å; Q758-F761 PolarHBondContact O-N 3.39Å; Q758-F761 VanDerWaalsContact O-N 3.1Å; Q758-E762 HydrophobicContact CG-CG 4.41Å; Q758-E762 WeakPolarHBondContact CG-OE1 3.3Å; Q758-E762 PolarHBondContact NE2-OE1 3.47Å; Q758-E762 WeakPolarHBondContact O-CG 3.3Å; Q758-E762 PolarHBondContact O-N 2.93Å
759E89.1Confident86.5Confident86 Ų8692 Ų9240%0.40246%0.463SS..Hα-helixtrans-59.6-28.4173.1-70.6176.4-165.900111.8Q755 R763Q755-E759 HydrophobicContact CG-CG 4.38Å; Q755-E759 WeakPolarHBondContact CG-OE1 3.42Å; Q755-E759 PolarHBondContact NE2-OE1 3.41Å; Q755-E759 WeakPolarHBondContact O-CB 3.49Å; Q755-E759 WeakPolarHBondContact O-CG 3.35Å; Q755-E759 PolarHBondContact O-N 3.46Å; E759-R763 WeakPolarHBondContact O-CB 3.49Å; E759-R763 WeakPolarHBondContact O-CG 3.28Å; E759-R763 PolarHBondContact O-N 3.32Å; E759-R763 PolarHBondContact O-NE 3.24Å
760G88.2Confident86.3Confident25 Ų2591 Ų9126%0.25845%0.454SS..Hα-helixtrans-62.7-57.8168.600000112.3A756 L757 Q758 E762 R763 E764A756-G760 PolarHBondContact O-N 2.96Å; L757-G760 WeakPolarHBondContact O-CA 3.43Å; L757-G760 PolarHBondContact O-N 3.09Å; L757-G760 VanDerWaalsContact O-N 3.15Å; Q758-G760 PolarHBondContact O-N 2.87Å; G760-E762 VanDerWaalsContact C-N 3.31Å; G760-E762 PolarHBondContact O-N 3.2Å; G760-R763 PolarHBondContact O-N 3.1Å; G760-E764 PolarHBondContact O-N 3.49Å
761F85.3Confident86.1Confident104 Ų10490 Ų9046%0.45645%0.447SS..Hα-helixtrans-63.5-32.2179.1-67.9-50.3000113.4L757 Q758 E764 R765L757-F761 HydrophobicContact CD1-CE2 4.2Å; L757-F761 HydrophobicContact CD1-CZ 4.33Å; L757-F761 HydrophobicContact CD2-CE2 3.9Å; L757-F761 HydrophobicContact CG-CD2 4.19Å; L757-F761 HydrophobicContact CG-CE2 3.65Å; L757-F761 HydrophobicContact CG-CZ 4.27Å; L757-F761 WeakPolarHBondContact O-CD2 3.33Å; L757-F761 PolarHBondContact O-N 2.63Å; Q758-F761 PolarHBondContact O-N 3.39Å; Q758-F761 VanDerWaalsContact O-N 3.1Å; F761-E764 PolarHBondContact O-N 3.44Å; F761-R765 WeakPolarHBondContact O-CB 3.5Å; F761-R765 VanDerWaalsContact O-CG 3.24Å; F761-R765 WeakPolarHBondContact O-CG 3.24Å; F761-R765 PolarHBondContact O-N 2.91Å
762E85.2Confident85.6Confident96 Ų9689.4 Ų89.445%0.44945%0.446SS..Hα-helixtrans-69.5-39.5175.8-73.9174.7-171.400111.7Q758 G760 E764 S766Q758-E762 HydrophobicContact CG-CG 4.41Å; Q758-E762 WeakPolarHBondContact CG-OE1 3.3Å; Q758-E762 PolarHBondContact NE2-OE1 3.47Å; Q758-E762 WeakPolarHBondContact O-CG 3.3Å; Q758-E762 PolarHBondContact O-N 2.93Å; G760-E762 VanDerWaalsContact C-N 3.31Å; G760-E762 PolarHBondContact O-N 3.2Å; E762-E764 VanDerWaalsContact C-N 3.35Å; E762-S766 VanDerWaalsContact O-CB 3.28Å; E762-S766 WeakPolarHBondContact O-CB 3.35Å; E762-S766 PolarHBondContact O-N 3.38Å
763R85.5Confident85.4Confident163 Ų16391.2 Ų91.262%0.61546%0.456SS*.Hα-helixtrans-65.2-36.8169.7-76.4175.2-70.6160.4-3.4112.5E759 G760 C767E759-R763 WeakPolarHBondContact O-CB 3.49Å; E759-R763 WeakPolarHBondContact O-CG 3.28Å; E759-R763 PolarHBondContact O-N 3.32Å; E759-R763 PolarHBondContact O-NE 3.24Å; G760-R763 PolarHBondContact O-N 3.1Å; R763-C767 WeakPolarHBondContact O-CB 3.37Å; R763-C767 PolarHBondContact O-N 2.92Å
764E82.6Confident85.2Confident88 Ų8888.2 Ų88.241%0.41144%0.442SS..Hα-helixtrans-67.4-47.7177-154.3-169.1166.200111.6G760 F761 E762 S766 C767 Y768G760-E764 PolarHBondContact O-N 3.49Å; F761-E764 PolarHBondContact O-N 3.44Å; E762-E764 VanDerWaalsContact C-N 3.35Å; E764-S766 VanDerWaalsContact C-N 3.34Å; E764-S766 PolarHBondContact O-N 3.09Å; E764-C767 WeakPolarHBondContact O-CB 3.4Å; E764-C767 PolarHBondContact O-N 2.95Å; E764-C767 VanDerWaalsContact O-N 3.17Å; E764-Y768 HydrophobicContact CG-CD2 4.23Å; E764-Y768 HydrophobicContact CG-CE2 3.57Å; E764-Y768 VanDerWaalsContact O-CD2 3.3Å; E764-Y768 WeakPolarHBondContact O-CD2 3.43Å; E764-Y768 PolarHBondContact O-N 3.5Å; E764-Y768 VanDerWaalsContact OE1-CE2 3.29Å; E764-Y768 WeakPolarHBondContact OE1-CE2 3.24Å; E764-Y768 PolarHBondContact OE1-OH 3.34Å
765R82.8Confident84.9Confident173 Ų17382.5 Ų82.565%0.65342%0.418SS*.Hα-helixtrans-58.6-43.3173-73.4172.6-175-173.62.7112.2F761 C767 Y768 A769F761-R765 WeakPolarHBondContact O-CB 3.5Å; F761-R765 VanDerWaalsContact O-CG 3.24Å; F761-R765 WeakPolarHBondContact O-CG 3.24Å; F761-R765 PolarHBondContact O-N 2.91Å; R765-C767 VanDerWaalsContact C-N 3.32Å; R765-C767 PolarHBondContact O-N 2.93Å; R765-Y768 PolarHBondContact O-N 2.94Å; R765-A769 WeakPolarHBondContact O-CB 3.5Å; R765-A769 PolarHBondContact O-N 2.75Å
766S85.5Confident84.6Confident78 Ų7878.7 Ų78.755%0.54541%0.409SS..Hα-helixtrans-60.4-42.5176-171.90000111.3E762 E764 A769 Q770E762-S766 VanDerWaalsContact O-CB 3.28Å; E762-S766 WeakPolarHBondContact O-CB 3.35Å; E762-S766 PolarHBondContact O-N 3.38Å; E764-S766 VanDerWaalsContact C-N 3.34Å; E764-S766 PolarHBondContact O-N 3.09Å; S766-A769 PolarHBondContact O-N 2.87Å; S766-Q770 WeakPolarHBondContact O-CB 3.34Å; S766-Q770 PolarHBondContact O-N 3.45Å
767C85Confident84.5Confident25 Ų2578.9 Ų78.917%0.16941%0.41CS..Hα-helixtrans-62-46.3174.3-172.50000113R240 R763 E764 R765 A769 Q770 Q771R240-C767 PolarHBondContact NH1-SG 3.29Å; R240-C767 VanDerWaalsContact NH1-SG 3.38Å; R240-C767 PolarHBondContact NH2-SG 3.13Å; R763-C767 WeakPolarHBondContact O-CB 3.37Å; R763-C767 PolarHBondContact O-N 2.92Å; E764-C767 WeakPolarHBondContact O-CB 3.4Å; E764-C767 PolarHBondContact O-N 2.95Å; E764-C767 VanDerWaalsContact O-N 3.17Å; R765-C767 VanDerWaalsContact C-N 3.32Å; R765-C767 PolarHBondContact O-N 2.93Å; C767-A769 VanDerWaalsContact C-N 3.31Å; C767-A769 PolarHBondContact O-N 3.34Å; C767-Q770 PolarHBondContact O-N 3.17Å; C767-Q771 WeakPolarHBondContact O-CB 3.29Å; C767-Q771 PolarHBondContact O-N 3.06Å
768Y82Confident84.1Confident111 Ų11179.1 Ų79.144%0.43541%0.41SS..Hα-helixtrans-66.9-33177.7-66.2-51.5000112.2E764 R765 A772E764-Y768 HydrophobicContact CG-CD2 4.23Å; E764-Y768 HydrophobicContact CG-CE2 3.57Å; E764-Y768 VanDerWaalsContact O-CD2 3.3Å; E764-Y768 WeakPolarHBondContact O-CD2 3.43Å; E764-Y768 PolarHBondContact O-N 3.5Å; E764-Y768 VanDerWaalsContact OE1-CE2 3.29Å; E764-Y768 WeakPolarHBondContact OE1-CE2 3.24Å; E764-Y768 PolarHBondContact OE1-OH 3.34Å; R765-Y768 PolarHBondContact O-N 2.94Å; Y768-A772 VanDerWaalsContact O-CB 3.27Å; Y768-A772 WeakPolarHBondContact O-CB 3.41Å; Y768-A772 PolarHBondContact O-N 2.92Å
769A84.3Confident83.9Confident51 Ų5176.8 Ų76.842%0.42140%0.403SS..Hα-helixtrans-67.3-4417300000112R765 S766 C767 A772 N773R765-A769 WeakPolarHBondContact O-CB 3.5Å; R765-A769 PolarHBondContact O-N 2.75Å; S766-A769 PolarHBondContact O-N 2.87Å; C767-A769 VanDerWaalsContact C-N 3.31Å; C767-A769 PolarHBondContact O-N 3.34Å; A769-A772 PolarHBondContact O-N 2.82Å; A769-N773 WeakPolarHBondContact O-CB 3.49Å; A769-N773 VanDerWaalsContact O-CG 3.24Å; A769-N773 PolarHBondContact O-N 3.06Å; A769-N773 PolarHBondContact O-ND2 3.11Å
770Q85.3Confident83.6Confident43 Ų4380.4 Ų80.420%0.20142%0.42CS..Hα-helixtrans-59.1-47.2173.5-172.6-177.65.900110.9D229 S766 C767 N773 Q774D229-Q770 PolarHBondContact O-NE2 3.16Å; S766-Q770 WeakPolarHBondContact O-CB 3.34Å; S766-Q770 PolarHBondContact O-N 3.45Å; C767-Q770 PolarHBondContact O-N 3.17Å; Q770-N773 PolarHBondContact O-N 2.88Å; Q770-Q774 WeakPolarHBondContact O-CG 3.17Å; Q770-Q774 PolarHBondContact O-N 3.45Å
771Q83.9Confident83.4Confident70 Ų7086.4 Ų86.433%0.32744%0.435SS..Hα-helixtrans-61.7-45176.4-169.41801000111.8C767 N773 Q774 L775C767-Q771 WeakPolarHBondContact O-CB 3.29Å; C767-Q771 PolarHBondContact O-N 3.06Å; Q771-N773 VanDerWaalsContact C-N 3.31Å; Q771-N773 PolarHBondContact O-N 2.99Å; Q771-Q774 WeakPolarHBondContact O-CB 3.49Å; Q771-Q774 PolarHBondContact O-N 3.1Å; Q771-L775 HydrophobicContact CG-CD1 4.27Å; Q771-L775 VanDerWaalsContact O-CG 3.24Å; Q771-L775 WeakPolarHBondContact O-CG 3.41Å; Q771-L775 PolarHBondContact O-N 3.41Å
772A78.3Confident83.2Confident54 Ų5483 Ų8345%0.44642%0.421SS..Hα-helixtrans-60.3-39.3176.300000112.4Y768 A769 L775 G776Y768-A772 VanDerWaalsContact O-CB 3.27Å; Y768-A772 WeakPolarHBondContact O-CB 3.41Å; Y768-A772 PolarHBondContact O-N 2.92Å; A769-A772 PolarHBondContact O-N 2.82Å; A772-L775 PolarHBondContact O-N 3.41Å; A772-G776 PolarHBondContact O-N 3.16Å
773N85.5Confident83.2Confident120 Ų12082.2 Ų82.264%0.64243%0.425SS*.Hα-helixtrans-65.7-40.2175.4-70.8-20.5000112.1A769 Q770 Q771 G776 A777A769-N773 WeakPolarHBondContact O-CB 3.49Å; A769-N773 VanDerWaalsContact O-CG 3.24Å; A769-N773 PolarHBondContact O-N 3.06Å; A769-N773 PolarHBondContact O-ND2 3.11Å; Q770-N773 PolarHBondContact O-N 2.88Å; Q771-N773 VanDerWaalsContact C-N 3.31Å; Q771-N773 PolarHBondContact O-N 2.99Å; N773-G776 PolarHBondContact O-N 3.49Å; N773-A777 WeakPolarHBondContact O-CB 3.39Å; N773-A777 PolarHBondContact O-N 3.26Å
774Q83.6Confident83Confident54 Ų5481 Ų8125%0.25242%0.421SS..Hα-helixtrans-64.4-44.1173.9-67.4166.7-13.900112.3E233 Q770 Q771 G776 A777 M778E233-Q774 PolarHBondContact OE1-NE2 3.26Å; E233-Q774 PolarHBondContact OE2-NE2 3.31Å; E233-Q774 VanDerWaalsContact OE2-NE2 3.07Å; Q770-Q774 WeakPolarHBondContact O-CG 3.17Å; Q770-Q774 PolarHBondContact O-N 3.45Å; Q771-Q774 WeakPolarHBondContact O-CB 3.49Å; Q771-Q774 PolarHBondContact O-N 3.1Å; Q774-G776 VanDerWaalsContact C-N 3.32Å; Q774-G776 PolarHBondContact O-N 2.82Å; Q774-A777 PolarHBondContact O-N 3.18Å; Q774-M778 HydrophobicContact CB-CE 4.34Å; Q774-M778 WeakPolarHBondContact O-CE 3.47Å; Q774-M778 PolarHBondContact O-N 3.07Å
775L80.7Confident83.1Confident22 Ų2280.6 Ų80.612%0.11542%0.421CS..Hα-helixtrans-59.2-44.9174.9-66.7170.5000110.3F617 F621 L624 Q771 A772 M778 V779F617-L775 HydrophobicContact CD2-CD2 4.28Å; F617-L775 HydrophobicContact CE1-CD2 4.46Å; F617-L775 HydrophobicContact CE2-CD2 3.32Å; F617-L775 HydrophobicContact CZ-CD2 3.43Å; F617-L775 VanDerWaalsContact CZ-CD2 3.43Å; F621-L775 HydrophobicContact CD2-CD1 4.39Å; L624-L775 HydrophobicContact CD1-CD1 4.19Å; Q771-L775 HydrophobicContact CG-CD1 4.27Å; Q771-L775 VanDerWaalsContact O-CG 3.24Å; Q771-L775 WeakPolarHBondContact O-CG 3.41Å; Q771-L775 PolarHBondContact O-N 3.41Å; A772-L775 PolarHBondContact O-N 3.41Å; L775-M778 HydrophobicContact CD2-CE 4.23Å; L775-M778 PolarHBondContact O-N 3.15Å; L775-V779 WeakPolarHBondContact O-CG2 3.46Å; L775-V779 PolarHBondContact O-N 2.88Å
776G82.8Confident83.3Confident32 Ų3278 Ų7833%0.3342%0.416SS..Hα-helixtrans-60.2-45.2174.300000113.5A772 N773 Q774 M778 V779 Q780A772-G776 PolarHBondContact O-N 3.16Å; N773-G776 PolarHBondContact O-N 3.49Å; Q774-G776 VanDerWaalsContact C-N 3.32Å; Q774-G776 PolarHBondContact O-N 2.82Å; G776-M778 PolarHBondContact O-N 2.83Å; G776-V779 PolarHBondContact O-N 2.74Å; G776-Q780 WeakPolarHBondContact O-CG 3.39Å; G776-Q780 PolarHBondContact O-N 3.46Å
777A84.5Confident83.3Confident58 Ų5881.8 Ų81.848%0.47942%0.423SS..Hα-helixtrans-65.2-36.8177.300000112.8N773 Q774 R781N773-A777 WeakPolarHBondContact O-CB 3.39Å; N773-A777 PolarHBondContact O-N 3.26Å; Q774-A777 PolarHBondContact O-N 3.18Å; A777-R781 PolarHBondContact O-N 3.04Å
778M78.9Confident83.3Confident95 Ų9584.8 Ų84.847%0.46843%0.434SS..Hα-helixtrans-66.6-43.2172.3-75.9-174.6-80.800111.7F617 Q774 L775 G776 Q780 R781 I782F617-M778 HydrophobicContact CE2-CE 3.82Å; F617-M778 HydrophobicContact CE2-SD 4.14Å; F617-M778 HydrophobicContact CZ-CB 4.35Å; F617-M778 HydrophobicContact CZ-CE 4.37Å; Q774-M778 HydrophobicContact CB-CE 4.34Å; Q774-M778 WeakPolarHBondContact O-CE 3.47Å; Q774-M778 PolarHBondContact O-N 3.07Å; L775-M778 HydrophobicContact CD2-CE 4.23Å; L775-M778 PolarHBondContact O-N 3.15Å; G776-M778 PolarHBondContact O-N 2.83Å; M778-Q780 PolarHBondContact O-N 2.62Å; M778-R781 WeakPolarHBondContact O-CB 3.26Å; M778-R781 PolarHBondContact O-N 3Å; M778-I782 PolarHBondContact O-N 2.84Å
779V82Confident83.4Confident65 Ų6582.1 Ų82.139%0.39443%0.428SS..Hα-helixtrans-61.8-41.3176.8168.50000111.9F617 L775 G776 R781 I782F617-V779 HydrophobicContact CE1-CG2 4.44Å; L775-V779 WeakPolarHBondContact O-CG2 3.46Å; L775-V779 PolarHBondContact O-N 2.88Å; G776-V779 PolarHBondContact O-N 2.74Å; V779-R781 PolarHBondContact O-N 2.83Å; V779-I782 HydrophobicContact CB-CD1 4.31Å; V779-I782 HydrophobicContact CG1-CD1 4.42Å; V779-I782 HydrophobicContact CG2-CD1 4.16Å; V779-I782 WeakPolarHBondContact O-CB 3.25Å; V779-I782 PolarHBondContact O-N 3.1Å; V779-I782 VanDerWaalsContact O-N 3.14Å
780Q83.4Confident83.6Confident162 Ų16285.4 Ų85.476%0.75744%0.437SS*.Hα-helixtrans-62.2-22.4174.1-72.3177.912.200113.5G776 M778G776-Q780 WeakPolarHBondContact O-CG 3.39Å; G776-Q780 PolarHBondContact O-N 3.46Å; M778-Q780 PolarHBondContact O-N 2.62Å
781R85Confident83.8Confident150 Ų15087.3 Ų87.357%0.56645%0.445SS*.Hα-helixtrans-86.3-17.3177.1-164.1173.3178.3170.31113.5A777 M778 V779 Y784 L785A777-R781 PolarHBondContact O-N 3.04Å; M778-R781 WeakPolarHBondContact O-CB 3.26Å; M778-R781 PolarHBondContact O-N 3Å; V779-R781 PolarHBondContact O-N 2.83Å; R781-Y784 WeakPolarHBondContact O-CB 3.32Å; R781-Y784 PolarHBondContact O-N 3.32Å; R781-Y784 VanDerWaalsContact O-N 3.17Å; R781-L785 HydrophobicContact CG-CD1 4.09Å; R781-L785 HydrophobicContact CG-CG 4.13Å; R781-L785 PolarHBondContact O-N 3.44Å; R781-L785 VanDerWaalsContact O-N 3.09Å
782I79.5Confident83.9Confident34 Ų3487.6 Ų87.617%0.17445%0.451CS..Hα-helixtrans-53.6-51.8179.8-62.9165.6000111.7Y614 M778 V779 Y784 L785 E786Y614-I782 HydrophobicContact CE2-CD1 3.78Å; Y614-I782 HydrophobicContact CE2-CG1 4.19Å; M778-I782 PolarHBondContact O-N 2.84Å; V779-I782 HydrophobicContact CB-CD1 4.31Å; V779-I782 HydrophobicContact CG1-CD1 4.42Å; V779-I782 HydrophobicContact CG2-CD1 4.16Å; V779-I782 WeakPolarHBondContact O-CB 3.25Å; V779-I782 PolarHBondContact O-N 3.1Å; V779-I782 VanDerWaalsContact O-N 3.14Å; I782-Y784 PolarHBondContact O-N 3.28Å; I782-Y784 VanDerWaalsContact O-N 3.13Å; I782-L785 PolarHBondContact O-N 2.84Å; I782-E786 HydrophobicContact CG2-CG 3.94Å; I782-E786 WeakPolarHBondContact O-CG 3.2Å; I782-E786 PolarHBondContact O-N 2.89Å
783P85.6Confident84.4Confident79 Ų7992.8 Ų92.851%0.51346%0.46SS..Hα-helixtrans-65.7-22.2-176.8-2235.4000114.2K787P783-K787 VanDerWaalsContact O-CB 3.29Å; P783-K787 WeakPolarHBondContact O-CB 3.3Å; P783-K787 PolarHBondContact O-N 3.31Å
784Y81.9Confident84.5Confident136 Ų13689 Ų8953%0.53344%0.44SS..Hα-helixtrans-74.5-47.4172.6-175.8-89.4000110.6R781 I782 K787 E788R781-Y784 WeakPolarHBondContact O-CB 3.32Å; R781-Y784 PolarHBondContact O-N 3.32Å; R781-Y784 VanDerWaalsContact O-N 3.17Å; I782-Y784 PolarHBondContact O-N 3.28Å; I782-Y784 VanDerWaalsContact O-N 3.13Å; Y784-K787 WeakPolarHBondContact O-CB 3.35Å; Y784-K787 PolarHBondContact O-N 3.48Å; Y784-E788 HydrophobicContact CD1-CG 4.19Å; Y784-E788 HydrophobicContact CE1-CG 3.92Å; Y784-E788 WeakPolarHBondContact CE1-OE2 3.31Å; Y784-E788 PolarHBondContact O-N 2.82Å
785L84.7Confident84.5Confident81 Ų8189 Ų8942%0.42444%0.442SS..Hα-helixtrans-65.3-39.1177.7-66.2170000111.9R781 I782 K787 E788 L789R781-L785 HydrophobicContact CG-CD1 4.09Å; R781-L785 HydrophobicContact CG-CG 4.13Å; R781-L785 PolarHBondContact O-N 3.44Å; R781-L785 VanDerWaalsContact O-N 3.09Å; I782-L785 PolarHBondContact O-N 2.84Å; L785-K787 VanDerWaalsContact C-N 3.31Å; L785-K787 PolarHBondContact O-N 2.83Å; L785-E788 PolarHBondContact O-N 2.89Å; L785-L789 WeakPolarHBondContact O-CB 3.45Å; L785-L789 PolarHBondContact O-N 2.86Å
786E86.3Confident84.6Confident118 Ų11892.3 Ų92.355%0.55146%0.459SS*.Hα-helixtrans-60-41.4171.9-72.3176.3148.800111.7I782 L789 L790I782-E786 HydrophobicContact CG2-CG 3.94Å; I782-E786 WeakPolarHBondContact O-CG 3.2Å; I782-E786 PolarHBondContact O-N 2.89Å; E786-L789 PolarHBondContact O-N 3.46Å; E786-L790 VanDerWaalsContact O-CB 3.28Å; E786-L790 WeakPolarHBondContact O-CB 3.24Å; E786-L790 PolarHBondContact O-N 3.13Å
787K86.4Confident84.8Confident158 Ų15898.3 Ų98.369%0.68747%0.471SS*.Hα-helixtrans-68.6-39.8177.2-176.6179.7178.8-177.70112.4P783 Y784 L785 K791P783-K787 VanDerWaalsContact O-CB 3.29Å; P783-K787 WeakPolarHBondContact O-CB 3.3Å; P783-K787 PolarHBondContact O-N 3.31Å; Y784-K787 WeakPolarHBondContact O-CB 3.35Å; Y784-K787 PolarHBondContact O-N 3.48Å; L785-K787 VanDerWaalsContact C-N 3.31Å; L785-K787 PolarHBondContact O-N 2.83Å; K787-K791 WeakPolarHBondContact O-CB 3.4Å; K787-K791 PolarHBondContact O-N 3.26Å
788E84.9Confident85Confident87 Ų8796.4 Ų96.441%0.40745%0.453SS..Hα-helixtrans-66-41.7172.8-71.3-167.8123.600111.7Y784 L785 K791 T792Y784-E788 HydrophobicContact CD1-CG 4.19Å; Y784-E788 HydrophobicContact CE1-CG 3.92Å; Y784-E788 WeakPolarHBondContact CE1-OE2 3.31Å; Y784-E788 PolarHBondContact O-N 2.82Å; L785-E788 PolarHBondContact O-N 2.89Å; E788-K791 CarbonylContact O-C 3.57Å; E788-K791 WeakPolarHBondContact O-CB 3.49Å; E788-K791 PolarHBondContact O-N 3.46Å; E788-T792 PolarHBondContact O-N 2.8Å; E788-T792 PolarHBondContact O-OG1 3.42Å
789L84.9Confident85.3Confident56 Ų5694 Ų9429%0.29345%0.448SS..Hα-helixtrans-69.7-37.1179.3-166.3157.8000111.8L607 L785 E786 K791 T792 R793L607-L789 HydrophobicContact CD2-CD1 3.98Å; L785-L789 WeakPolarHBondContact O-CB 3.45Å; L785-L789 PolarHBondContact O-N 2.86Å; E786-L789 PolarHBondContact O-N 3.46Å; L789-K791 VanDerWaalsContact C-N 3.32Å; L789-T792 WeakPolarHBondContact CA-OG1 3.24Å; L789-T792 PolarHBondContact O-OG1 3.32Å; L789-R793 HydrophobicContact CD2-CG 4.23Å; L789-R793 WeakPolarHBondContact O-CB 3.39Å; L789-R793 WeakPolarHBondContact O-CG 3.46Å; L789-R793 PolarHBondContact O-N 3.1Å
790L88.5Confident85.5Confident119 Ų11996.3 Ų96.362%0.62345%0.454SS*.Hα-helixtrans-63-40.9170.1-164.887000110.8E786 V794E786-L790 VanDerWaalsContact O-CB 3.28Å; E786-L790 WeakPolarHBondContact O-CB 3.24Å; E786-L790 PolarHBondContact O-N 3.13Å; L790-V794 WeakPolarHBondContact O-CB 3.28Å; L790-V794 PolarHBondContact O-N 2.89Å; L790-V794 VanDerWaalsContact O-N 3.09Å
791K88.7Confident85.7Confident84 Ų8492.7 Ų92.737%0.36544%0.437SS..Hα-helixtrans-65-48.5176.4-171.1-160.2169.6-156.80111.5K787 E788 L789 R793 V794 D795K787-K791 WeakPolarHBondContact O-CB 3.4Å; K787-K791 PolarHBondContact O-N 3.26Å; E788-K791 CarbonylContact O-C 3.57Å; E788-K791 WeakPolarHBondContact O-CB 3.49Å; E788-K791 PolarHBondContact O-N 3.46Å; L789-K791 VanDerWaalsContact C-N 3.32Å; K791-R793 PolarHBondContact O-N 3Å; K791-V794 CarbonylContact O-C 3.57Å; K791-V794 WeakPolarHBondContact O-CA 3.17Å; K791-V794 VanDerWaalsContact O-CB 3.28Å; K791-V794 WeakPolarHBondContact O-CB 3.39Å; K791-V794 PolarHBondContact O-N 2.9Å; K791-V794 VanDerWaalsContact O-N 3.08Å; K791-D795 WeakPolarHBondContact CE-OD2 3.36Å; K791-D795 IonicContact NZ-OD2 3.02Å; K791-D795 PolarHBondContact O-N 3.18Å
792T84.8Confident85.9Confident75 Ų7588.1 Ų88.146%0.4642%0.424SS..Hα-helixtrans-67-36.1-179.753.90000112.7E788 L789 V794 D795 M796E788-T792 PolarHBondContact O-N 2.8Å; E788-T792 PolarHBondContact O-OG1 3.42Å; L789-T792 WeakPolarHBondContact CA-OG1 3.24Å; L789-T792 PolarHBondContact O-OG1 3.32Å; T792-V794 VanDerWaalsContact C-N 3.28Å; T792-V794 PolarHBondContact O-N 3.22Å; T792-D795 PolarHBondContact O-N 2.59Å; T792-M796 WeakPolarHBondContact O-CB 3.5Å; T792-M796 WeakPolarHBondContact O-CG 3.28Å; T792-M796 PolarHBondContact O-N 3.03Å
793R88.9Confident86.2Confident163 Ų16388.8 Ų88.862%0.61544%0.435SS*.Hα-helixtrans-60-38169.1-78178.5172.6162.6-0.4112.6L789 K791 R797L789-R793 HydrophobicContact CD2-CG 4.23Å; L789-R793 WeakPolarHBondContact O-CB 3.39Å; L789-R793 WeakPolarHBondContact O-CG 3.46Å; L789-R793 PolarHBondContact O-N 3.1Å; K791-R793 PolarHBondContact O-N 3Å; R793-R797 PolarHBondContact O-N 2.93Å; R793-R797 VanDerWaalsContact O-N 3.1Å
794V89.1Confident86.5Confident40 Ų4086.4 Ų86.424%0.24243%0.425CS..Hα-helixtrans-68-45.6174.6143.50000111.5L790 K791 T792 M796 R797 N798L790-V794 WeakPolarHBondContact O-CB 3.28Å; L790-V794 PolarHBondContact O-N 2.89Å; L790-V794 VanDerWaalsContact O-N 3.09Å; K791-V794 CarbonylContact O-C 3.57Å; K791-V794 WeakPolarHBondContact O-CA 3.17Å; K791-V794 VanDerWaalsContact O-CB 3.28Å; K791-V794 WeakPolarHBondContact O-CB 3.39Å; K791-V794 PolarHBondContact O-N 2.9Å; K791-V794 VanDerWaalsContact O-N 3.08Å; T792-V794 VanDerWaalsContact C-N 3.28Å; T792-V794 PolarHBondContact O-N 3.22Å; V794-M796 VanDerWaalsContact C-N 3.33Å; V794-M796 PolarHBondContact O-N 3.05Å; V794-R797 PolarHBondContact O-N 3.31Å; V794-N798 WeakPolarHBondContact O-CB 3.05Å; V794-N798 PolarHBondContact O-N 3.31Å; V794-N798 PolarHBondContact O-OD1 3.07Å
795D84Confident86.8Confident54 Ų5482.3 Ų82.329%0.28942%0.416SS..Hα-helixtrans-66.5-36.9-179.8-64.1-15.7000110.7K791 T792 A799 Q1613K791-D795 WeakPolarHBondContact CE-OD2 3.36Å; K791-D795 IonicContact NZ-OD2 3.02Å; K791-D795 PolarHBondContact O-N 3.18Å; T792-D795 PolarHBondContact O-N 2.59Å; D795-A799 WeakPolarHBondContact O-CB 3.46Å; D795-A799 PolarHBondContact O-N 3.14Å; D795-Q1613 PolarHBondContact OD1-NE2 3.23Å
796M82.1Confident86.9Confident93 Ų9383.9 Ų83.946%0.45842%0.421SS..Hα-helixtrans-60.1-54.3169.6-80179.661.400112.1T792 V794 N798 A799 E800T792-M796 WeakPolarHBondContact O-CB 3.5Å; T792-M796 WeakPolarHBondContact O-CG 3.28Å; T792-M796 PolarHBondContact O-N 3.03Å; V794-M796 VanDerWaalsContact C-N 3.33Å; V794-M796 PolarHBondContact O-N 3.05Å; M796-N798 VanDerWaalsContact C-N 3.3Å; M796-N798 PolarHBondContact O-N 2.88Å; M796-A799 CarbonylContact O-C 3.48Å; M796-A799 WeakPolarHBondContact O-CA 3.2Å; M796-A799 WeakPolarHBondContact O-CB 3.49Å; M796-A799 PolarHBondContact O-N 3.26Å; M796-E800 WeakPolarHBondContact O-CG 3.24Å; M796-E800 PolarHBondContact O-N 2.92Å
797R87.3Confident87Confident158 Ų15887.6 Ų87.660%0.59643%0.43SS*.Hα-helixtrans-58.2-43.5179.5-174-172.8-62172.7-0.1111.5R793 V794 A799 E800 E801R793-R797 PolarHBondContact O-N 2.93Å; R793-R797 VanDerWaalsContact O-N 3.1Å; V794-R797 PolarHBondContact O-N 3.31Å; R797-A799 VanDerWaalsContact C-N 3.28Å; R797-A799 PolarHBondContact O-N 2.84Å; R797-E800 PolarHBondContact O-N 2.94Å; R797-E801 WeakPolarHBondContact CD-OE1 3.42Å; R797-E801 HydrophobicContact CG-CG 4.35Å; R797-E801 WeakPolarHBondContact CG-OE1 3.17Å; R797-E801 WeakPolarHBondContact O-CB 3.23Å; R797-E801 WeakPolarHBondContact O-CG 3.29Å; R797-E801 PolarHBondContact O-N 3.29Å
798N88.3Confident87.1Confident17 Ų1784.4 Ų84.49%0.09142%0.419CS..Hα-helixtrans-62.3-34.1176-90.6109.3000112.3V794 M796 L802 Q1613V794-N798 WeakPolarHBondContact O-CB 3.05Å; V794-N798 PolarHBondContact O-N 3.31Å; V794-N798 PolarHBondContact O-OD1 3.07Å; M796-N798 VanDerWaalsContact C-N 3.3Å; M796-N798 PolarHBondContact O-N 2.88Å; N798-L802 VanDerWaalsContact O-CB 3.3Å; N798-L802 WeakPolarHBondContact O-CB 3.32Å; N798-L802 PolarHBondContact O-N 3.34Å; N798-Q1613 HydrophobicContact CB-CG 4.49Å; N798-Q1613 PolarHBondContact OD1-NE2 2.9Å
799A84.1Confident87.3Confident44 Ų4483.9 Ų83.936%0.36442%0.419SS..Hα-helixtrans-74.9-31.2174.300000113.5D795 M796 R797 A803D795-A799 WeakPolarHBondContact O-CB 3.46Å; D795-A799 PolarHBondContact O-N 3.14Å; M796-A799 CarbonylContact O-C 3.48Å; M796-A799 WeakPolarHBondContact O-CA 3.2Å; M796-A799 WeakPolarHBondContact O-CB 3.49Å; M796-A799 PolarHBondContact O-N 3.26Å; R797-A799 VanDerWaalsContact C-N 3.28Å; R797-A799 PolarHBondContact O-N 2.84Å; A799-A803 VanDerWaalsContact O-CB 3.26Å; A799-A803 WeakPolarHBondContact O-CB 3.33Å; A799-A803 PolarHBondContact O-N 3.31Å
800E87.4Confident87.5Confident114 Ų11487.9 Ų87.953%0.53344%0.435SS..Hα-helixtrans-71.4-44.4173.2-71.4161.6-175.100111.3M796 R797 A803 G804M796-E800 WeakPolarHBondContact O-CG 3.24Å; M796-E800 PolarHBondContact O-N 2.92Å; R797-E800 PolarHBondContact O-N 2.94Å; E800-A803 PolarHBondContact O-N 3.35Å; E800-G804 PolarHBondContact O-N 2.86Å
801E87.2Confident87.6Confident86 Ų8687 Ų8740%0.40243%0.428SS..Hα-helixtrans-58.7-45.4171.5-74.1169.6-170.600111R797 G804 S805R797-E801 WeakPolarHBondContact CD-OE1 3.42Å; R797-E801 HydrophobicContact CG-CG 4.35Å; R797-E801 WeakPolarHBondContact CG-OE1 3.17Å; R797-E801 WeakPolarHBondContact O-CB 3.23Å; R797-E801 WeakPolarHBondContact O-CG 3.29Å; R797-E801 PolarHBondContact O-N 3.29Å; E801-G804 PolarHBondContact O-N 2.88Å; E801-S805 PolarHBondContact O-N 3.43Å
802L90.3Very high87.7Confident55 Ų5588.4 Ų88.429%0.28843%0.43SS..Hα-helixtrans-62.4-51.2175.9-178.463.4000111.4N798 G804 S805 E806N798-L802 VanDerWaalsContact O-CB 3.3Å; N798-L802 WeakPolarHBondContact O-CB 3.32Å; N798-L802 PolarHBondContact O-N 3.34Å; L802-G804 VanDerWaalsContact C-N 3.29Å; L802-G804 PolarHBondContact O-N 2.85Å; L802-S805 PolarHBondContact O-N 2.81Å; L802-S805 VanDerWaalsContact O-N 3.07Å; L802-S805 PolarHBondContact O-OG 2.96Å; L802-E806 HydrophobicContact CD1-CG 4.45Å; L802-E806 WeakPolarHBondContact O-CG 3.43Å; L802-E806 PolarHBondContact O-N 3.15Å
803A85.3Confident87.9Confident48 Ų4888.9 Ų88.940%0.39743%0.433SS..Hα-helixtrans-62.7-33.9179.200000112.8A799 E800 R807A799-A803 VanDerWaalsContact O-CB 3.26Å; A799-A803 WeakPolarHBondContact O-CB 3.33Å; A799-A803 PolarHBondContact O-N 3.31Å; E800-A803 PolarHBondContact O-N 3.35Å; A803-R807 WeakPolarHBondContact O-CB 3.39Å; A803-R807 PolarHBondContact O-N 3.35Å
804G90.9Very high88Confident29 Ų2985.5 Ų85.530%0.29943%0.425SS..Hα-helixtrans-64-45.6170.500000112E800 E801 L802 E806 R807 I808E800-G804 PolarHBondContact O-N 2.86Å; E801-G804 PolarHBondContact O-N 2.88Å; L802-G804 VanDerWaalsContact C-N 3.29Å; L802-G804 PolarHBondContact O-N 2.85Å; G804-E806 PolarHBondContact O-N 2.83Å; G804-R807 PolarHBondContact O-N 3.2Å; G804-I808 WeakPolarHBondContact O-CB 3.47Å; G804-I808 VanDerWaalsContact O-CG1 3.3Å; G804-I808 WeakPolarHBondContact O-CG1 3.27Å; G804-I808 PolarHBondContact O-N 2.99Å
805S87.8Confident88.1Confident49 Ų4988.1 Ų88.134%0.34344%0.435SS..Hα-helixtrans-63.8-39.6175.981.30000112.5E801 L802 I808 N809E801-S805 PolarHBondContact O-N 3.43Å; L802-S805 PolarHBondContact O-N 2.81Å; L802-S805 VanDerWaalsContact O-N 3.07Å; L802-S805 PolarHBondContact O-OG 2.96Å; S805-I808 PolarHBondContact O-N 3.5Å; S805-N809 VanDerWaalsContact O-CB 3.28Å; S805-N809 WeakPolarHBondContact O-CB 3.32Å; S805-N809 PolarHBondContact O-N 2.87Å; S805-N809 PolarHBondContact O-ND2 3.48Å; S805-N809 VanDerWaalsContact O-ND2 3.11Å
806E86.7Confident88.5Confident114 Ų11491.2 Ų91.253%0.53345%0.448SS..Hα-helixtrans-66-42.5175.5-73179175.400111.3L802 G804 N809 F810L802-E806 HydrophobicContact CD1-CG 4.45Å; L802-E806 WeakPolarHBondContact O-CG 3.43Å; L802-E806 PolarHBondContact O-N 3.15Å; G804-E806 PolarHBondContact O-N 2.83Å; E806-N809 PolarHBondContact O-N 3.25Å; E806-F810 VanDerWaalsContact O-CB 3.3Å; E806-F810 WeakPolarHBondContact O-CB 3.42Å; E806-F810 PolarHBondContact O-N 3.04Å
807R89.2Confident88.8Confident196 Ų19690.4 Ų90.474%0.7445%0.452SS*.Hα-helixtrans-60.5-46.7174.1-173.5-176.8-66.8-168.1-1.8111.7A803 G804 F810 Q811A803-R807 WeakPolarHBondContact O-CB 3.39Å; A803-R807 PolarHBondContact O-N 3.35Å; G804-R807 PolarHBondContact O-N 3.2Å; R807-F810 PolarHBondContact O-N 3.39Å; R807-Q811 WeakPolarHBondContact O-CB 3.44Å; R807-Q811 PolarHBondContact O-N 2.76Å
808I88.9Confident88.9Confident91 Ų9187.2 Ų87.247%0.46745%0.446SS..Hα-helixtrans-65-39.8177.8-69.5166.2000111.2G804 S805 R812G804-I808 WeakPolarHBondContact O-CB 3.47Å; G804-I808 VanDerWaalsContact O-CG1 3.3Å; G804-I808 WeakPolarHBondContact O-CG1 3.27Å; G804-I808 PolarHBondContact O-N 2.99Å; S805-I808 PolarHBondContact O-N 3.5Å; I808-R812 VanDerWaalsContact O-CB 3.31Å; I808-R812 WeakPolarHBondContact O-CB 3.46Å; I808-R812 PolarHBondContact O-N 2.75Å
809N88.7Confident89.1Confident77 Ų7791 Ų9141%0.41247%0.469SS..Hα-helixtrans-69.3-38.7177.1-72.2-27.8000111.9S805 E806 R812 T813S805-N809 VanDerWaalsContact O-CB 3.28Å; S805-N809 WeakPolarHBondContact O-CB 3.32Å; S805-N809 PolarHBondContact O-N 2.87Å; S805-N809 PolarHBondContact O-ND2 3.48Å; S805-N809 VanDerWaalsContact O-ND2 3.11Å; E806-N809 PolarHBondContact O-N 3.25Å; N809-R812 PolarHBondContact O-N 3.25Å; N809-R812 PolarHBondContact OD1-NH1 3.17Å; N809-T813 WeakPolarHBondContact O-CB 3.39Å; N809-T813 PolarHBondContact O-N 2.99Å; N809-T813 PolarHBondContact O-OG1 3.48Å
810F88.1Confident89.4Confident140 Ų14093.1 Ų93.161%0.61447%0.472SS*.Hα-helixtrans-64.5-47.9173.7179.5-108000111.6E806 R807 R812 T813 M814E806-F810 VanDerWaalsContact O-CB 3.3Å; E806-F810 WeakPolarHBondContact O-CB 3.42Å; E806-F810 PolarHBondContact O-N 3.04Å; R807-F810 PolarHBondContact O-N 3.39Å; F810-R812 PolarHBondContact O-N 3.43Å; F810-T813 PolarHBondContact O-N 3.06Å; F810-M814 HydrophobicContact CD1-CE 4.13Å; F810-M814 HydrophobicContact CE1-CE 3.39Å; F810-M814 HydrophobicContact CZ-CE 3.8Å; F810-M814 WeakPolarHBondContact O-CB 3.47Å; F810-M814 PolarHBondContact O-N 3.12Å
811Q91.3Very high89.5Confident101 Ų10191.7 Ų91.747%0.47247%0.468SS..Hα-helixtrans-56.5-49.9173.5177.8177.9-13.200111.2R807 T813 M814 E815R807-Q811 WeakPolarHBondContact O-CB 3.44Å; R807-Q811 PolarHBondContact O-N 2.76Å; Q811-T813 VanDerWaalsContact C-N 3.27Å; Q811-T813 PolarHBondContact O-N 3.31Å; Q811-M814 WeakPolarHBondContact O-CB 3.42Å; Q811-M814 PolarHBondContact O-N 2.94Å; Q811-M814 VanDerWaalsContact O-N 3.11Å; Q811-E815 HydrophobicContact CG-CG 4.33Å; Q811-E815 WeakPolarHBondContact CG-OE1 3.45Å; Q811-E815 PolarHBondContact NE2-OE1 2.7Å; Q811-E815 WeakPolarHBondContact O-CB 3.05Å; Q811-E815 WeakPolarHBondContact O-CG 3.46Å; Q811-E815 PolarHBondContact O-N 3.19Å
812R90.6Very high89.7Confident113 Ų11391.7 Ų91.743%0.42647%0.47SS..Hα-helixtrans-60.5-36.8178.2-167.4-174.5-58.6118.10.8112.4I808 N809 F810 Q816I808-R812 VanDerWaalsContact O-CB 3.31Å; I808-R812 WeakPolarHBondContact O-CB 3.46Å; I808-R812 PolarHBondContact O-N 2.75Å; N809-R812 PolarHBondContact O-N 3.25Å; N809-R812 PolarHBondContact OD1-NH1 3.17Å; F810-R812 PolarHBondContact O-N 3.43Å; R812-Q816 WeakPolarHBondContact O-CB 3.35Å; R812-Q816 WeakPolarHBondContact O-CG 3.35Å; R812-Q816 PolarHBondContact O-N 3.48Å
813T90Very high90Very high85 Ų8594.3 Ų94.352%0.52148%0.476SS..Hα-helixtrans-69.5-38.6176.4-54.70000111.3N809 F810 Q811 S817N809-T813 WeakPolarHBondContact O-CB 3.39Å; N809-T813 PolarHBondContact O-N 2.99Å; N809-T813 PolarHBondContact O-OG1 3.48Å; F810-T813 PolarHBondContact O-N 3.06Å; Q811-T813 VanDerWaalsContact C-N 3.27Å; Q811-T813 PolarHBondContact O-N 3.31Å; T813-S817 VanDerWaalsContact O-CB 3.29Å; T813-S817 WeakPolarHBondContact O-CB 3.2Å; T813-S817 PolarHBondContact O-N 3.5Å
814M90.5Very high90.3Very high91 Ų9195 Ų9545%0.44848%0.476SS..Hα-helixtrans-65.6-47173.9-169.7-167.1-59.800111.4F810 Q811 Q816 S817 L818F810-M814 HydrophobicContact CD1-CE 4.13Å; F810-M814 HydrophobicContact CE1-CE 3.39Å; F810-M814 HydrophobicContact CZ-CE 3.8Å; F810-M814 WeakPolarHBondContact O-CB 3.47Å; F810-M814 PolarHBondContact O-N 3.12Å; Q811-M814 WeakPolarHBondContact O-CB 3.42Å; Q811-M814 PolarHBondContact O-N 2.94Å; Q811-M814 VanDerWaalsContact O-N 3.11Å; M814-Q816 VanDerWaalsContact C-N 3.34Å; M814-Q816 PolarHBondContact O-N 3Å; M814-S817 PolarHBondContact O-N 3.46Å; M814-L818 HydrophobicContact CG-CD1 4.03Å; M814-L818 HydrophobicContact CG-CG 4.48Å; M814-L818 WeakPolarHBondContact O-CB 3.35Å; M814-L818 VanDerWaalsContact O-CG 3.31Å; M814-L818 WeakPolarHBondContact O-CG 3.45Å; M814-L818 PolarHBondContact O-N 3.45Å
815E91.8Very high90.3Very high96 Ų9698.7 Ų98.745%0.44949%0.485SS..Hα-helixtrans-59.4-42.5175.3-73.4172-179.100111.8Q811 T819Q811-E815 HydrophobicContact CG-CG 4.33Å; Q811-E815 WeakPolarHBondContact CG-OE1 3.45Å; Q811-E815 PolarHBondContact NE2-OE1 2.7Å; Q811-E815 WeakPolarHBondContact O-CB 3.05Å; Q811-E815 WeakPolarHBondContact O-CG 3.46Å; Q811-E815 PolarHBondContact O-N 3.19Å; E815-T819 VanDerWaalsContact O-CB 3.24Å; E815-T819 WeakPolarHBondContact O-CB 3.39Å; E815-T819 PolarHBondContact O-N 2.92Å; E815-T819 PolarHBondContact O-OG1 3.31Å
816Q91.3Very high90.5Very high118 Ų118100.9 Ų100.955%0.55149%0.493SS*.Hα-helixtrans-64.5-45.4174.2-75.8172.2000111.9R812 M814 T819 E820R812-Q816 WeakPolarHBondContact O-CB 3.35Å; R812-Q816 WeakPolarHBondContact O-CG 3.35Å; R812-Q816 PolarHBondContact O-N 3.48Å; M814-Q816 VanDerWaalsContact C-N 3.34Å; M814-Q816 PolarHBondContact O-N 3Å; Q816-T819 PolarHBondContact O-N 3.17Å; Q816-E820 VanDerWaalsContact O-CB 3.32Å; Q816-E820 WeakPolarHBondContact O-CB 3.46Å; Q816-E820 PolarHBondContact O-N 3.12Å
817S88.8Confident90.8Very high77 Ų77100.4 Ų100.454%0.53849%0.49SS..Hα-helixtrans-62.1-44.5177.3-175.10000112.2T813 M814 E820 N821T813-S817 VanDerWaalsContact O-CB 3.29Å; T813-S817 WeakPolarHBondContact O-CB 3.2Å; T813-S817 PolarHBondContact O-N 3.5Å; M814-S817 PolarHBondContact O-N 3.46Å; S817-E820 PolarHBondContact O-N 3.46Å; S817-N821 VanDerWaalsContact O-CB 3.24Å; S817-N821 WeakPolarHBondContact O-CB 3.42Å; S817-N821 PolarHBondContact O-N 2.91Å
818L90.6Very high91Very high91 Ų9194.3 Ų94.348%0.47648%0.475SS..Hα-helixtrans-65.5-41.9175.3-71.3170.9000111.7M814 N821 L822M814-L818 HydrophobicContact CG-CD1 4.03Å; M814-L818 HydrophobicContact CG-CG 4.48Å; M814-L818 WeakPolarHBondContact O-CB 3.35Å; M814-L818 VanDerWaalsContact O-CG 3.31Å; M814-L818 WeakPolarHBondContact O-CG 3.45Å; M814-L818 PolarHBondContact O-N 3.45Å; L818-N821 PolarHBondContact O-N 3.29Å; L818-L822 WeakPolarHBondContact O-CB 3.32Å; L818-L822 VanDerWaalsContact O-CG 3.24Å; L818-L822 WeakPolarHBondContact O-CG 3.49Å; L818-L822 PolarHBondContact O-N 3.21Å
819T92.5Very high91.1Very high95 Ų9591.9 Ų91.958%0.58347%0.469SS*.Hα-helixtrans-63.8-42.4177-58.90000111.5E815 Q816 R823E815-T819 VanDerWaalsContact O-CB 3.24Å; E815-T819 WeakPolarHBondContact O-CB 3.39Å; E815-T819 PolarHBondContact O-N 2.92Å; E815-T819 PolarHBondContact O-OG1 3.31Å; Q816-T819 PolarHBondContact O-N 3.17Å; T819-R823 WeakPolarHBondContact O-CB 3.4Å; T819-R823 PolarHBondContact O-N 3.13Å
820E88.9Confident91.3Very high90 Ų9090.3 Ų90.342%0.42146%0.464SS..Hα-helixtrans-69.1-40.3177.3178.561.9-176.800111.9Q816 S817 R823 V824Q816-E820 VanDerWaalsContact O-CB 3.32Å; Q816-E820 WeakPolarHBondContact O-CB 3.46Å; Q816-E820 PolarHBondContact O-N 3.12Å; S817-E820 PolarHBondContact O-N 3.46Å; E820-R823 WeakPolarHBondContact O-CB 3.09Å; E820-R823 PolarHBondContact O-N 2.89Å; E820-R823 IonicContact OE1-CZ 2.68Å; E820-R823 IonicContact OE1-NE 3.75Å; E820-R823 IonicContact OE1-NH2 2.7Å; E820-R823 PolarHBondContact OE1-NH2 2.64Å; E820-R823 IonicContact OE2-CZ 2.65Å; E820-R823 IonicContact OE2-NE 3.62Å; E820-R823 PolarHBondContact OE2-NE 3.07Å; E820-R823 IonicContact OE2-NH2 2.59Å; E820-R823 PolarHBondContact OE2-NH2 3.43Å; E820-V824 WeakPolarHBondContact O-CG2 3.26Å; E820-V824 PolarHBondContact O-N 3.22Å
821N90.4Very high91.7Very high83 Ų8389.2 Ų89.244%0.44446%0.459SS..Hα-helixtrans-63.5-45174.5-165-19.1000110.9S817 L818 R823 V824 Q825S817-N821 VanDerWaalsContact O-CB 3.24Å; S817-N821 WeakPolarHBondContact O-CB 3.42Å; S817-N821 PolarHBondContact O-N 2.91Å; L818-N821 PolarHBondContact O-N 3.29Å; N821-R823 VanDerWaalsContact C-N 3.32Å; N821-R823 PolarHBondContact O-N 2.88Å; N821-V824 PolarHBondContact O-N 3.09Å; N821-Q825 WeakPolarHBondContact O-CB 3.47Å; N821-Q825 VanDerWaalsContact O-CG 3.28Å; N821-Q825 WeakPolarHBondContact O-CG 3.23Å; N821-Q825 PolarHBondContact O-N 3.38Å; N821-Q825 PolarHBondContact OD1-NE2 3Å
822L91.7Very high92Very high87 Ų8791.1 Ų91.146%0.45546%0.462SS..Hα-helixtrans-62.2-35.8173-72.6169.3000112.6L818 N826L818-L822 WeakPolarHBondContact O-CB 3.32Å; L818-L822 VanDerWaalsContact O-CG 3.24Å; L818-L822 WeakPolarHBondContact O-CG 3.49Å; L818-L822 PolarHBondContact O-N 3.21Å; L822-N826 WeakPolarHBondContact O-CB 3.44Å; L822-N826 PolarHBondContact O-N 3.12Å
823R95.1Very high92.1Very high110 Ų11092.3 Ų92.342%0.41547%0.466SS..Hα-helixtrans-62-51.3172.4-171.9-174.871.279.13.2110.9T819 E820 N821 Q825 N826 E827T819-R823 WeakPolarHBondContact O-CB 3.4Å; T819-R823 PolarHBondContact O-N 3.13Å; E820-R823 WeakPolarHBondContact O-CB 3.09Å; E820-R823 PolarHBondContact O-N 2.89Å; E820-R823 IonicContact OE1-CZ 2.68Å; E820-R823 IonicContact OE1-NE 3.75Å; E820-R823 IonicContact OE1-NH2 2.7Å; E820-R823 PolarHBondContact OE1-NH2 2.64Å; E820-R823 IonicContact OE2-CZ 2.65Å; E820-R823 IonicContact OE2-NE 3.62Å; E820-R823 PolarHBondContact OE2-NE 3.07Å; E820-R823 IonicContact OE2-NH2 2.59Å; E820-R823 PolarHBondContact OE2-NH2 3.43Å; N821-R823 VanDerWaalsContact C-N 3.32Å; N821-R823 PolarHBondContact O-N 2.88Å; R823-Q825 PolarHBondContact O-N 3.05Å; R823-N826 PolarHBondContact O-N 2.72Å; R823-E827 WeakPolarHBondContact CG-OE1 3.32Å; R823-E827 IonicContact CZ-OE1 3.3Å; R823-E827 IonicContact CZ-OE2 2.65Å; R823-E827 IonicContact NH1-OE1 3.49Å; R823-E827 PolarHBondContact NH1-OE1 3.27Å; R823-E827 IonicContact NH1-OE2 2.69Å; R823-E827 PolarHBondContact NH1-OE2 2.95Å; R823-E827 WeakPolarHBondContact O-CB 3.41Å; R823-E827 WeakPolarHBondContact O-CG 3.49Å; R823-E827 PolarHBondContact O-N 3.39Å
824V91.9Very high92.4Very high63 Ų6394.2 Ų94.238%0.38247%0.473SS..Hα-helixtrans-64.4-37.5179.1172.60000111.8E820 N821 E827 T828E820-V824 WeakPolarHBondContact O-CG2 3.26Å; E820-V824 PolarHBondContact O-N 3.22Å; N821-V824 PolarHBondContact O-N 3.09Å; V824-E827 PolarHBondContact O-N 3.32Å; V824-T828 HydrophobicContact CG1-CG2 4.42Å; V824-T828 WeakPolarHBondContact O-CB 3.43Å; V824-T828 WeakPolarHBondContact O-CG2 3.26Å; V824-T828 PolarHBondContact O-N 2.71Å; V824-T828 PolarHBondContact O-OG1 3.47Å
825Q91.3Very high92.6Very high105 Ų10594.4 Ų94.449%0.49147%0.471SS..Hα-helixtrans-64.3-44.2172.8-73.8179.227.600111.8N821 R823 T828 A829N821-Q825 WeakPolarHBondContact O-CB 3.47Å; N821-Q825 VanDerWaalsContact O-CG 3.28Å; N821-Q825 WeakPolarHBondContact O-CG 3.23Å; N821-Q825 PolarHBondContact O-N 3.38Å; N821-Q825 PolarHBondContact OD1-NE2 3Å; R823-Q825 PolarHBondContact O-N 3.05Å; Q825-T828 WeakPolarHBondContact CA-OG1 3.48Å; Q825-T828 PolarHBondContact O-OG1 3.24Å; Q825-T828 VanDerWaalsContact O-OG1 3.07Å; Q825-A829 WeakPolarHBondContact O-CB 3.33Å; Q825-A829 PolarHBondContact O-N 2.84Å
826N92.8Very high92.7Very high96 Ų9694.7 Ų94.751%0.51348%0.475SS..Hα-helixtrans-69.1-35.3177.3-167.67.5000112.3L822 R823 S830 R833L822-N826 WeakPolarHBondContact O-CB 3.44Å; L822-N826 PolarHBondContact O-N 3.12Å; R823-N826 PolarHBondContact O-N 2.72Å; N826-S830 WeakPolarHBondContact O-CB 3.38Å; N826-S830 PolarHBondContact O-N 3.4Å; N826-S830 PolarHBondContact O-OG 2.77Å; N826-S830 PolarHBondContact OD1-OG 3.16Å; N826-R833 PolarHBondContact OD1-NH2 2.57Å
827E93.2Very high92.8Very high103 Ų10391.3 Ų91.348%0.48147%0.465SS..Hα-helixtrans-67.9-44.9174.9-77.4173.3-166.200112.1R823 V824 S830 F831R823-E827 WeakPolarHBondContact CG-OE1 3.32Å; R823-E827 IonicContact CZ-OE1 3.3Å; R823-E827 IonicContact CZ-OE2 2.65Å; R823-E827 IonicContact NH1-OE1 3.49Å; R823-E827 PolarHBondContact NH1-OE1 3.27Å; R823-E827 IonicContact NH1-OE2 2.69Å; R823-E827 PolarHBondContact NH1-OE2 2.95Å; R823-E827 WeakPolarHBondContact O-CB 3.41Å; R823-E827 WeakPolarHBondContact O-CG 3.49Å; R823-E827 PolarHBondContact O-N 3.39Å; V824-E827 PolarHBondContact O-N 3.32Å; E827-S830 PolarHBondContact O-N 2.8Å; E827-F831 WeakPolarHBondContact O-CB 3.49Å; E827-F831 PolarHBondContact O-N 3.15Å
828T92.3Very high93.1Very high69 Ų6994 Ų9442%0.42347%0.467SS..Hα-helixtrans-66.6-41.9174.651.60000111.9V824 Q825 S830 F831 W832V824-T828 HydrophobicContact CG1-CG2 4.42Å; V824-T828 WeakPolarHBondContact O-CB 3.43Å; V824-T828 WeakPolarHBondContact O-CG2 3.26Å; V824-T828 PolarHBondContact O-N 2.71Å; V824-T828 PolarHBondContact O-OG1 3.47Å; Q825-T828 WeakPolarHBondContact CA-OG1 3.48Å; Q825-T828 PolarHBondContact O-OG1 3.24Å; Q825-T828 VanDerWaalsContact O-OG1 3.07Å; T828-S830 VanDerWaalsContact C-N 3.3Å; T828-S830 PolarHBondContact O-N 3.43Å; T828-F831 WeakPolarHBondContact O-CB 3.21Å; T828-F831 PolarHBondContact O-N 3.45Å; T828-W832 PolarHBondContact O-N 2.9Å
829A91.3Very high93.2Very high40 Ų4095.1 Ų95.133%0.33147%0.471SS..Hα-helixtrans-61.7-37.4172.300000112Q825 W832 R833Q825-A829 WeakPolarHBondContact O-CB 3.33Å; Q825-A829 PolarHBondContact O-N 2.84Å; A829-W832 PolarHBondContact O-N 2.89Å; A829-R833 WeakPolarHBondContact O-CB 3.43Å; A829-R833 VanDerWaalsContact O-CG 3.3Å; A829-R833 WeakPolarHBondContact O-CG 3.48Å; A829-R833 PolarHBondContact O-N 2.93Å; A829-R833 PolarHBondContact O-NE 2.76Å
830S93.2Very high93.3Very high44 Ų4496.4 Ų96.431%0.30847%0.47SS..Hα-helixtrans-69.3-38.6175.4-62.60000112.1N826 E827 T828 R833 L834N826-S830 WeakPolarHBondContact O-CB 3.38Å; N826-S830 PolarHBondContact O-N 3.4Å; N826-S830 PolarHBondContact O-OG 2.77Å; N826-S830 PolarHBondContact OD1-OG 3.16Å; E827-S830 PolarHBondContact O-N 2.8Å; T828-S830 VanDerWaalsContact C-N 3.3Å; T828-S830 PolarHBondContact O-N 3.43Å; S830-R833 PolarHBondContact O-N 3.43Å; S830-R833 PolarHBondContact OG-NH1 3.28Å; S830-R833 PolarHBondContact OG-NH2 2.85Å; S830-L834 WeakPolarHBondContact O-CB 3.39Å; S830-L834 PolarHBondContact O-N 3.07Å
831F95.6Very high93.5Very high117 Ų11797.2 Ų97.251%0.51347%0.474SS..Hα-helixtrans-61.2-45.8170.8169.7-95.1000111.7E827 T828 L834 K835E827-F831 WeakPolarHBondContact O-CB 3.49Å; E827-F831 PolarHBondContact O-N 3.15Å; T828-F831 WeakPolarHBondContact O-CB 3.21Å; T828-F831 PolarHBondContact O-N 3.45Å; F831-L834 PolarHBondContact O-N 2.95Å; F831-K835 HydrophobicContact CE1-CD 3.85Å; F831-K835 HydrophobicContact CZ-CD 3.99Å; F831-K835 VanDerWaalsContact O-CB 3.24Å; F831-K835 WeakPolarHBondContact O-CB 3.5Å; F831-K835 PolarHBondContact O-N 3.07Å
832W97.4Very high93.6Very high141 Ų14197.2 Ų97.253%0.53447%0.471SS..Hα-helixtrans-67.1-40.8177.1-74114.6000112.3T828 A829 L834 K835 L836T828-W832 PolarHBondContact O-N 2.9Å; A829-W832 PolarHBondContact O-N 2.89Å; W832-L834 PolarHBondContact O-N 2.93Å; W832-K835 HydrophobicContact CE3-CD 3.8Å; W832-K835 HydrophobicContact CH2-CD 4.5Å; W832-K835 VanDerWaalsContact CH2-NZ 3.29Å; W832-K835 HydrophobicContact CZ3-CD 3.71Å; W832-K835 PolarHBondContact O-N 3.01Å; W832-L836 WeakPolarHBondContact O-CB 3.43Å; W832-L836 VanDerWaalsContact O-CG 3.31Å; W832-L836 WeakPolarHBondContact O-CG 3.39Å; W832-L836 PolarHBondContact O-N 3.22Å
833R94.6Very high93.7Very high137 Ų13797.9 Ų97.952%0.51748%0.475SS..Hα-helixtrans-56.2-46.9170.7-79.1179.1-100.6124.9-5.6111.9N826 A829 S830 S837N826-R833 PolarHBondContact OD1-NH2 2.57Å; A829-R833 WeakPolarHBondContact O-CB 3.43Å; A829-R833 VanDerWaalsContact O-CG 3.3Å; A829-R833 WeakPolarHBondContact O-CG 3.48Å; A829-R833 PolarHBondContact O-N 2.93Å; A829-R833 PolarHBondContact O-NE 2.76Å; S830-R833 PolarHBondContact O-N 3.43Å; S830-R833 PolarHBondContact OG-NH1 3.28Å; S830-R833 PolarHBondContact OG-NH2 2.85Å; R833-S837 WeakPolarHBondContact O-CB 3.41Å; R833-S837 PolarHBondContact O-N 3.44Å
834L95Very high93.7Very high126 Ų12696.3 Ų96.366%0.6647%0.472SS*.Hα-helixtrans-65.1-40.6177.2-179.462.3000112.3S830 F831 W832 K838S830-L834 WeakPolarHBondContact O-CB 3.39Å; S830-L834 PolarHBondContact O-N 3.07Å; F831-L834 PolarHBondContact O-N 2.95Å; W832-L834 PolarHBondContact O-N 2.93Å; L834-K838 WeakPolarHBondContact O-CB 3.32Å; L834-K838 PolarHBondContact O-N 3.13Å
835K95.2Very high93.8Very high94 Ų9499.2 Ų99.241%0.40948%0.48SS..Hα-helixtrans-68.5-40.8178.7-174.4172.2172-173.30111.9F831 W832 K838 M839F831-K835 HydrophobicContact CE1-CD 3.85Å; F831-K835 HydrophobicContact CZ-CD 3.99Å; F831-K835 VanDerWaalsContact O-CB 3.24Å; F831-K835 WeakPolarHBondContact O-CB 3.5Å; F831-K835 PolarHBondContact O-N 3.07Å; W832-K835 HydrophobicContact CE3-CD 3.8Å; W832-K835 HydrophobicContact CH2-CD 4.5Å; W832-K835 VanDerWaalsContact CH2-NZ 3.29Å; W832-K835 HydrophobicContact CZ3-CD 3.71Å; W832-K835 PolarHBondContact O-N 3.01Å; K835-K838 PolarHBondContact O-N 3.01Å; K835-M839 VanDerWaalsContact O-CG 3.32Å; K835-M839 WeakPolarHBondContact O-CG 3.4Å; K835-M839 PolarHBondContact O-N 3.17Å
836L92.8Very high93.9Very high103 Ų103101.2 Ų101.254%0.53948%0.484SS..Hα-helixtrans-61.5-52171.7-74.8169.1000110.6W832 K838 M839 E840W832-L836 WeakPolarHBondContact O-CB 3.43Å; W832-L836 VanDerWaalsContact O-CG 3.31Å; W832-L836 WeakPolarHBondContact O-CG 3.39Å; W832-L836 PolarHBondContact O-N 3.22Å; L836-K838 PolarHBondContact O-N 3.43Å; L836-M839 CarbonylContact O-C 3.55Å; L836-M839 WeakPolarHBondContact O-CA 3.39Å; L836-M839 WeakPolarHBondContact O-CB 3.44Å; L836-M839 PolarHBondContact O-N 2.83Å; L836-E840 WeakPolarHBondContact O-CG 3.44Å; L836-E840 PolarHBondContact O-N 2.84Å
837S93.9Very high93.9Very high46 Ų46102 Ų10232%0.32248%0.482SS..Hα-helixtrans-57.9-36.4177.7-170.50000112.9R833 E840 Q841R833-S837 WeakPolarHBondContact O-CB 3.41Å; R833-S837 PolarHBondContact O-N 3.44Å; S837-E840 WeakPolarHBondContact CA-OE2 3.36Å; S837-E840 PolarHBondContact O-N 2.61Å; S837-Q841 WeakPolarHBondContact O-CB 3.47Å; S837-Q841 VanDerWaalsContact O-CG 3.23Å; S837-Q841 WeakPolarHBondContact O-CG 3.43Å; S837-Q841 PolarHBondContact O-N 2.85Å
838K94.6Very high94Very high134 Ų134102.1 Ų102.158%0.58348%0.481SS*.Hα-helixtrans-65.3-38.4173.2-173.3176.6179.8179.30112.7L834 K835 L836 Q842L834-K838 WeakPolarHBondContact O-CB 3.32Å; L834-K838 PolarHBondContact O-N 3.13Å; K835-K838 PolarHBondContact O-N 3.01Å; L836-K838 PolarHBondContact O-N 3.43Å; K838-Q842 WeakPolarHBondContact O-CG 3.39Å; K838-Q842 PolarHBondContact O-N 2.85Å
839M92.5Very high94.1Very high114 Ų114106 Ų10656%0.56249%0.488SS*.Hα-helixtrans-71.7-40.7175.4-68.1-64.3-67.500111.8K835 L836 Q842 L843K835-M839 VanDerWaalsContact O-CG 3.32Å; K835-M839 WeakPolarHBondContact O-CG 3.4Å; K835-M839 PolarHBondContact O-N 3.17Å; L836-M839 CarbonylContact O-C 3.55Å; L836-M839 WeakPolarHBondContact O-CA 3.39Å; L836-M839 WeakPolarHBondContact O-CB 3.44Å; L836-M839 PolarHBondContact O-N 2.83Å; M839-Q842 WeakPolarHBondContact O-CB 3.3Å; M839-Q842 PolarHBondContact O-N 2.73Å; M839-Q842 VanDerWaalsContact O-N 3.1Å; M839-L843 WeakPolarHBondContact O-CB 3.39Å; M839-L843 PolarHBondContact O-N 3.34Å
840E94.7Very high94.2Very high123 Ų123109.2 Ų109.258%0.57550%0.5SS*.Hα-helixtrans-59.4-45.9173.2-69.5170.5159.700111.2L836 S837 Q842 L843 E844L836-E840 WeakPolarHBondContact O-CG 3.44Å; L836-E840 PolarHBondContact O-N 2.84Å; S837-E840 WeakPolarHBondContact CA-OE2 3.36Å; S837-E840 PolarHBondContact O-N 2.61Å; E840-Q842 PolarHBondContact O-N 3.4Å; E840-L843 PolarHBondContact O-N 2.94Å; E840-E844 VanDerWaalsContact O-CB 3.23Å; E840-E844 WeakPolarHBondContact O-CB 3.46Å; E840-E844 PolarHBondContact O-N 3.27Å
841Q93.4Very high94.3Very high106 Ų106110.8 Ų110.850%0.49550%0.504SS..Hα-helixtrans-62.9-26.8174.2-74.3176.239.400113.6S837 K845S837-Q841 WeakPolarHBondContact O-CB 3.47Å; S837-Q841 VanDerWaalsContact O-CG 3.23Å; S837-Q841 WeakPolarHBondContact O-CG 3.43Å; S837-Q841 PolarHBondContact O-N 2.85Å; Q841-K845 WeakPolarHBondContact O-CD 3.45Å; Q841-K845 WeakPolarHBondContact O-CG 3.37Å; Q841-K845 PolarHBondContact O-N 3.25Å
842Q94Very high94.2Very high84 Ų84110.5 Ų110.539%0.39351%0.505SS..Hα-helixtrans-77.5-47171.8-75-178.6-4.200110.9K838 M839 E840 E844 K845 Y846K838-Q842 WeakPolarHBondContact O-CG 3.39Å; K838-Q842 PolarHBondContact O-N 2.85Å; M839-Q842 WeakPolarHBondContact O-CB 3.3Å; M839-Q842 PolarHBondContact O-N 2.73Å; M839-Q842 VanDerWaalsContact O-N 3.1Å; E840-Q842 PolarHBondContact O-N 3.4Å; Q842-E844 VanDerWaalsContact C-N 3.29Å; Q842-E844 PolarHBondContact O-N 2.85Å; Q842-K845 CarbonylContact O-C 3.55Å; Q842-K845 WeakPolarHBondContact O-CA 3.38Å; Q842-K845 WeakPolarHBondContact O-CB 3.32Å; Q842-K845 PolarHBondContact O-N 3.22Å; Q842-Y846 HydrophobicContact CB-CE2 4.39Å; Q842-Y846 WeakPolarHBondContact O-CD2 3.28Å; Q842-Y846 PolarHBondContact O-N 3.1Å
843L93.6Very high94Very high100 Ų100109.4 Ų109.452%0.52450%0.504SS..Hα-helixtrans-58.3-41.3177.9-169.3156000111.3M839 E840 Y846 K847M839-L843 WeakPolarHBondContact O-CB 3.39Å; M839-L843 PolarHBondContact O-N 3.34Å; E840-L843 PolarHBondContact O-N 2.94Å; L843-Y846 PolarHBondContact O-N 3.02Å; L843-K847 HydrophobicContact CD2-CD 3.87Å; L843-K847 VanDerWaalsContact CD2-CE 3.48Å; L843-K847 HydrophobicContact CD2-CG 4.18Å; L843-K847 PolarHBondContact O-N 2.82Å
844E94.3Very high94.1Very high77 Ų77109 Ų10936%0.3651%0.508SS..Hα-helixtrans-66.2-34.9174.8-177.960.6-168.600113E840 Q842 K848E840-E844 VanDerWaalsContact O-CB 3.23Å; E840-E844 WeakPolarHBondContact O-CB 3.46Å; E840-E844 PolarHBondContact O-N 3.27Å; Q842-E844 VanDerWaalsContact C-N 3.29Å; Q842-E844 PolarHBondContact O-N 2.85Å; E844-K848 PolarHBondContact O-N 3.39Å; E844-K848 VanDerWaalsContact O-N 3.08Å; E844-K848 VanDerWaalsContact OE1-CE 3.3Å; E844-K848 WeakPolarHBondContact OE1-CE 3.44Å; E844-K848 IonicContact OE1-NZ 3.87Å; E844-K848 PolarHBondContact OE1-NZ 2.9Å
845K93.6Very high94Very high124 Ų124107.8 Ų107.854%0.53950%0.502SS..Hα-helixtrans-70.7-32.1171.5-73.5165.6-170.6165.70112.1Q841 Q842 R849Q841-K845 WeakPolarHBondContact O-CD 3.45Å; Q841-K845 WeakPolarHBondContact O-CG 3.37Å; Q841-K845 PolarHBondContact O-N 3.25Å; Q842-K845 CarbonylContact O-C 3.55Å; Q842-K845 WeakPolarHBondContact O-CA 3.38Å; Q842-K845 WeakPolarHBondContact O-CB 3.32Å; Q842-K845 PolarHBondContact O-N 3.22Å; K845-R849 VanDerWaalsContact O-CG 3.31Å; K845-R849 WeakPolarHBondContact O-CG 3.08Å; K845-R849 PolarHBondContact O-N 2.89Å
846Y93Very high94Very high148 Ų148108.2 Ų108.258%0.5851%0.505SS*.Hα-helixtrans-74.3-39.6173.9-73.9-64.7000112.2Q842 L843 R849 L850Q842-Y846 HydrophobicContact CB-CE2 4.39Å; Q842-Y846 WeakPolarHBondContact O-CD2 3.28Å; Q842-Y846 PolarHBondContact O-N 3.1Å; L843-Y846 PolarHBondContact O-N 3.02Å; Y846-R849 PolarHBondContact O-N 3.48Å; Y846-L850 WeakPolarHBondContact O-CB 3.48Å; Y846-L850 PolarHBondContact O-N 3.26Å
847K94.5Very high94.1Very high111 Ų111109.2 Ų109.248%0.48351%0.511SS..Hα-helixtrans-54.8-56.8170.1-80.3176.9172.1172.50111.1L843 R849 L850 D851L843-K847 HydrophobicContact CD2-CD 3.87Å; L843-K847 VanDerWaalsContact CD2-CE 3.48Å; L843-K847 HydrophobicContact CD2-CG 4.18Å; L843-K847 PolarHBondContact O-N 2.82Å; K847-R849 VanDerWaalsContact C-N 3.26Å; K847-R849 PolarHBondContact O-N 3.21Å; K847-L850 CarbonylContact O-C 3.53Å; K847-L850 WeakPolarHBondContact O-CA 3.39Å; K847-L850 VanDerWaalsContact O-CB 3.3Å; K847-L850 WeakPolarHBondContact O-CB 3.37Å; K847-L850 PolarHBondContact O-N 3.34Å; K847-D851 PolarHBondContact O-N 2.83Å
848K94.4Very high94.1Very high106 Ų106109.4 Ų109.446%0.46151%0.512SS..Hα-helixtrans-56-38179.6-79.5167.4168.7139.50113.5E844 D851 E852E844-K848 PolarHBondContact O-N 3.39Å; E844-K848 VanDerWaalsContact O-N 3.08Å; E844-K848 VanDerWaalsContact OE1-CE 3.3Å; E844-K848 WeakPolarHBondContact OE1-CE 3.44Å; E844-K848 IonicContact OE1-NZ 3.87Å; E844-K848 PolarHBondContact OE1-NZ 2.9Å; K848-D851 PolarHBondContact O-N 3.19Å; K848-E852 VanDerWaalsContact O-CB 3.29Å; K848-E852 WeakPolarHBondContact O-CB 3.35Å; K848-E852 WeakPolarHBondContact O-CG 3.27Å; K848-E852 PolarHBondContact O-N 3.36Å
849R94.6Very high94.1Very high151 Ų151107.7 Ų107.757%0.5751%0.506SS*.Hα-helixtrans-68.5-32.2172.7-75.5172.1172.8-177.1-3.6113.8K845 Y846 K847 K853K845-R849 VanDerWaalsContact O-CG 3.31Å; K845-R849 WeakPolarHBondContact O-CG 3.08Å; K845-R849 PolarHBondContact O-N 2.89Å; Y846-R849 PolarHBondContact O-N 3.48Å; K847-R849 VanDerWaalsContact C-N 3.26Å; K847-R849 PolarHBondContact O-N 3.21Å; R849-K853 WeakPolarHBondContact O-CB 3.36Å; R849-K853 WeakPolarHBondContact O-CG 3.26Å; R849-K853 PolarHBondContact O-N 3.38Å; R849-K853 VanDerWaalsContact O-N 3.1Å
850L93.5Very high94.2Very high108 Ų108104.8 Ų104.857%0.56550%0.5SS*.Hα-helixtrans-71.3-46.6174.3-163.2160.8000109.5Y846 K847 E852 K853 E854Y846-L850 WeakPolarHBondContact O-CB 3.48Å; Y846-L850 PolarHBondContact O-N 3.26Å; K847-L850 CarbonylContact O-C 3.53Å; K847-L850 WeakPolarHBondContact O-CA 3.39Å; K847-L850 VanDerWaalsContact O-CB 3.3Å; K847-L850 WeakPolarHBondContact O-CB 3.37Å; K847-L850 PolarHBondContact O-N 3.34Å; L850-E852 PolarHBondContact O-N 3Å; L850-K853 CarbonylContact O-C 3.55Å; L850-K853 PolarHBondContact O-N 2.92Å; L850-K853 VanDerWaalsContact O-N 3.08Å; L850-E854 PolarHBondContact O-N 2.91Å
851D94.2Very high94.2Very high77 Ų77104.4 Ų104.441%0.41250%0.502SS..Hα-helixtrans-58.4-45.5174.3-51.1-34.6000111K847 K848 K853 E854 N855K847-D851 PolarHBondContact O-N 2.83Å; K848-D851 PolarHBondContact O-N 3.19Å; D851-K853 VanDerWaalsContact C-N 3.32Å; D851-K853 PolarHBondContact O-N 3.44Å; D851-E854 PolarHBondContact O-N 2.86Å; D851-N855 WeakPolarHBondContact O-CB 3.18Å; D851-N855 PolarHBondContact O-N 3.22Å; D851-N855 PolarHBondContact O-ND2 3.43Å
852E95.2Very high94.2Very high110 Ų110104.5 Ų104.551%0.51450%0.504SS..Hα-helixtrans-55.8-44.7172.8-78.3161.4-171.500111.4K848 L850 N855 E856K848-E852 VanDerWaalsContact O-CB 3.29Å; K848-E852 WeakPolarHBondContact O-CB 3.35Å; K848-E852 WeakPolarHBondContact O-CG 3.27Å; K848-E852 PolarHBondContact O-N 3.36Å; L850-E852 PolarHBondContact O-N 3Å; E852-N855 PolarHBondContact O-N 3.5Å; E852-E856 WeakPolarHBondContact O-CG 3.35Å; E852-E856 PolarHBondContact O-N 3.4Å
853K92.9Very high94.2Very high119 Ų119108.2 Ų108.252%0.51752%0.515SS..Hα-helixtrans-76.2-31.3-179.4-69.4-66.4170.8-141.30114R849 L850 D851 E856 L857R849-K853 WeakPolarHBondContact O-CB 3.36Å; R849-K853 WeakPolarHBondContact O-CG 3.26Å; R849-K853 PolarHBondContact O-N 3.38Å; R849-K853 VanDerWaalsContact O-N 3.1Å; L850-K853 CarbonylContact O-C 3.55Å; L850-K853 PolarHBondContact O-N 2.92Å; L850-K853 VanDerWaalsContact O-N 3.08Å; D851-K853 VanDerWaalsContact C-N 3.32Å; D851-K853 PolarHBondContact O-N 3.44Å; K853-E856 WeakPolarHBondContact CD-OE2 3.38Å; K853-E856 IonicContact NZ-OE1 2.7Å; K853-E856 PolarHBondContact NZ-OE1 3.08Å; K853-E856 IonicContact NZ-OE2 3.64Å; K853-E856 PolarHBondContact NZ-OE2 3.03Å; K853-L857 VanDerWaalsContact O-CB 3.26Å; K853-L857 WeakPolarHBondContact O-CB 3.44Å; K853-L857 PolarHBondContact O-N 3.46Å
854E95.6Very high94.2Very high129 Ų129109.4 Ų109.460%0.60352%0.516SS*.Hα-helixtrans-68.5-40.2171.1-174.2167.5-174.500110.6L850 D851 L857 S858L850-E854 PolarHBondContact O-N 2.91Å; D851-E854 PolarHBondContact O-N 2.86Å; E854-L857 PolarHBondContact O-N 3.32Å; E854-S858 WeakPolarHBondContact O-CB 3.44Å; E854-S858 PolarHBondContact O-N 3.41Å
855N94.2Very high94.1Very high100 Ų100107.4 Ų107.454%0.53552%0.516SS..Hα-helixtrans-62.5-49.3171.9-78-66.6000111.7D851 E852 L857 S858 E859D851-N855 WeakPolarHBondContact O-CB 3.18Å; D851-N855 PolarHBondContact O-N 3.22Å; D851-N855 PolarHBondContact O-ND2 3.43Å; E852-N855 PolarHBondContact O-N 3.5Å; N855-L857 VanDerWaalsContact C-N 3.31Å; N855-L857 PolarHBondContact O-N 2.99Å; N855-S858 PolarHBondContact O-N 2.93Å; N855-S858 VanDerWaalsContact O-N 3.15Å; N855-S858 PolarHBondContact O-OG 3.43Å; N855-E859 PolarHBondContact O-N 3.09Å
856E94.7Very high94.1Very high103 Ų103107.1 Ų107.148%0.48152%0.52SS..Hα-helixtrans-55.1-43.8173.8-80176.5-144.400112.5E852 K853 E859 A860E852-E856 WeakPolarHBondContact O-CG 3.35Å; E852-E856 PolarHBondContact O-N 3.4Å; K853-E856 WeakPolarHBondContact CD-OE2 3.38Å; K853-E856 IonicContact NZ-OE1 2.7Å; K853-E856 PolarHBondContact NZ-OE1 3.08Å; K853-E856 IonicContact NZ-OE2 3.64Å; K853-E856 PolarHBondContact NZ-OE2 3.03Å; E856-E859 PolarHBondContact O-N 2.86Å; E856-A860 WeakPolarHBondContact O-CB 3.38Å; E856-A860 PolarHBondContact O-N 3.4Å
857L95Very high94.1Very high124 Ų124105.6 Ų105.665%0.64952%0.518SS*.Hα-helixtrans-66.9-39.2178.1-176.464.6000111.7K853 E854 N855 A860 N861K853-L857 VanDerWaalsContact O-CB 3.26Å; K853-L857 WeakPolarHBondContact O-CB 3.44Å; K853-L857 PolarHBondContact O-N 3.46Å; E854-L857 PolarHBondContact O-N 3.32Å; N855-L857 VanDerWaalsContact C-N 3.31Å; N855-L857 PolarHBondContact O-N 2.99Å; L857-A860 PolarHBondContact O-N 2.86Å; L857-N861 VanDerWaalsContact O-CB 3.29Å; L857-N861 WeakPolarHBondContact O-CB 3.47Å; L857-N861 PolarHBondContact O-N 3.36Å
858S94.1Very high94.1Very high50 Ų50106.8 Ų106.835%0.3552%0.524SS..Hα-helixtrans-65.4-42.7175.783.10000111.5E854 N855 N861 I862E854-S858 WeakPolarHBondContact O-CB 3.44Å; E854-S858 PolarHBondContact O-N 3.41Å; N855-S858 PolarHBondContact O-N 2.93Å; N855-S858 VanDerWaalsContact O-N 3.15Å; N855-S858 PolarHBondContact O-OG 3.43Å; S858-N861 PolarHBondContact O-N 2.78Å; S858-I862 WeakPolarHBondContact O-CB 3.38Å; S858-I862 VanDerWaalsContact O-CG1 3.26Å; S858-I862 WeakPolarHBondContact O-CG1 3.33Å; S858-I862 PolarHBondContact O-N 2.99Å
859E95.3Very high94Very high98 Ų98104.1 Ų104.146%0.45852%0.521SS..Hα-helixtrans-62.4-46.3173.5-86-155.9-13900111.5N855 E856 N861 I862 R863N855-E859 PolarHBondContact O-N 3.09Å; E856-E859 PolarHBondContact O-N 2.86Å; E859-N861 VanDerWaalsContact C-N 3.31Å; E859-N861 PolarHBondContact O-N 3Å; E859-I862 PolarHBondContact O-N 3.34Å; E859-R863 WeakPolarHBondContact O-CB 3.37Å; E859-R863 WeakPolarHBondContact O-CG 3.39Å; E859-R863 PolarHBondContact O-N 3.21Å; E859-R863 IonicContact OE2-CZ 3.68Å; E859-R863 IonicContact OE2-NE 3.38Å; E859-R863 PolarHBondContact OE2-NE 2.83Å; E859-R863 IonicContact OE2-NH2 2.71Å; E859-R863 PolarHBondContact OE2-NH2 2.95Å
860A93.6Very high94Very high52 Ų52101.7 Ų101.743%0.4352%0.519SS..Hα-helixtrans-60.4-41.3177.200000111.6E856 L857 R863 F864E856-A860 WeakPolarHBondContact O-CB 3.38Å; E856-A860 PolarHBondContact O-N 3.4Å; L857-A860 PolarHBondContact O-N 2.86Å; A860-R863 PolarHBondContact O-N 3.05Å; A860-F864 VanDerWaalsContact O-CB 3.31Å; A860-F864 WeakPolarHBondContact O-CB 3.47Å; A860-F864 PolarHBondContact O-N 3.39Å
861N94.7Very high93.9Very high115 Ų115100.6 Ų100.662%0.61551%0.514SS*.Hα-helixtrans-68.5-37.3176.8-167.421.9000112.3L857 S858 E859 G865L857-N861 VanDerWaalsContact O-CB 3.29Å; L857-N861 WeakPolarHBondContact O-CB 3.47Å; L857-N861 PolarHBondContact O-N 3.36Å; S858-N861 PolarHBondContact O-N 2.78Å; E859-N861 VanDerWaalsContact C-N 3.31Å; E859-N861 PolarHBondContact O-N 3Å; N861-G865 PolarHBondContact O-N 3.31Å
862I94Very high93.8Very high108 Ų10899 Ų9955%0.55451%0.511SS*.Hα-helixtrans-65.8-46.3172.5-70.5163.9000110.6S858 E859 G865 L866S858-I862 WeakPolarHBondContact O-CB 3.38Å; S858-I862 VanDerWaalsContact O-CG1 3.26Å; S858-I862 WeakPolarHBondContact O-CG1 3.33Å; S858-I862 PolarHBondContact O-N 2.99Å; E859-I862 PolarHBondContact O-N 3.34Å; I862-G865 PolarHBondContact O-N 3.2Å; I862-L866 HydrophobicContact CG2-CD1 4.03Å; I862-L866 HydrophobicContact CG2-CG 4.48Å; I862-L866 WeakPolarHBondContact O-CB 3.31Å; I862-L866 WeakPolarHBondContact O-CG 3.48Å; I862-L866 PolarHBondContact O-N 2.97Å
863R93.5Very high93.6Very high162 Ų16299 Ų9961%0.61151%0.511SS*.Hα-helixtrans-59.7-47.8176.7-70.1169.6-167.8-149.38.8111.1E859 A860 G865 L866 E867E859-R863 WeakPolarHBondContact O-CB 3.37Å; E859-R863 WeakPolarHBondContact O-CG 3.39Å; E859-R863 PolarHBondContact O-N 3.21Å; E859-R863 IonicContact OE2-CZ 3.68Å; E859-R863 IonicContact OE2-NE 3.38Å; E859-R863 PolarHBondContact OE2-NE 2.83Å; E859-R863 IonicContact OE2-NH2 2.71Å; E859-R863 PolarHBondContact OE2-NH2 2.95Å; A860-R863 PolarHBondContact O-N 3.05Å; R863-G865 VanDerWaalsContact C-N 3.34Å; R863-G865 PolarHBondContact O-N 3.29Å; R863-L866 PolarHBondContact O-N 2.97Å; R863-E867 WeakPolarHBondContact O-CB 3.33Å; R863-E867 PolarHBondContact O-N 3.49Å
864F92.7Very high93.5Very high125 Ų12599 Ų9955%0.54851%0.513SS..Hα-helixtrans-64.8-36.1175.4-175.8-108.9000112.4A860 K868A860-F864 VanDerWaalsContact O-CB 3.31Å; A860-F864 WeakPolarHBondContact O-CB 3.47Å; A860-F864 PolarHBondContact O-N 3.39Å; F864-K868 HydrophobicContact CE1-CD 4.47Å; F864-K868 WeakPolarHBondContact O-CB 3.35Å; F864-K868 PolarHBondContact O-N 2.83Å
865G93.9Very high93.3Very high36 Ų3696.6 Ų96.637%0.37151%0.507SS..Hα-helixtrans-62.8-43.1172.700000112.8N861 I862 R863 A869N861-G865 PolarHBondContact O-N 3.31Å; I862-G865 PolarHBondContact O-N 3.2Å; R863-G865 VanDerWaalsContact C-N 3.34Å; R863-G865 PolarHBondContact O-N 3.29Å; G865-A869 VanDerWaalsContact O-CB 3.25Å; G865-A869 WeakPolarHBondContact O-CB 3.48Å; G865-A869 PolarHBondContact O-N 3.42Å
866L93.8Very high93.2Very high118 Ų11899.3 Ų99.362%0.61851%0.51SS*.Hα-helixtrans-68.3-43.7175.1-71.6170.4000112I862 R863 A869 N870I862-L866 HydrophobicContact CG2-CD1 4.03Å; I862-L866 HydrophobicContact CG2-CG 4.48Å; I862-L866 WeakPolarHBondContact O-CB 3.31Å; I862-L866 WeakPolarHBondContact O-CG 3.48Å; I862-L866 PolarHBondContact O-N 2.97Å; R863-L866 PolarHBondContact O-N 2.97Å; L866-A869 PolarHBondContact O-N 2.95Å; L866-N870 VanDerWaalsContact O-CB 3.31Å; L866-N870 WeakPolarHBondContact O-CB 3.34Å; L866-N870 PolarHBondContact O-N 2.9Å
867E93.1Very high92.9Very high116 Ų11698.7 Ų98.754%0.54251%0.509SS..Hα-helixtrans-62.4-46.4175.6-175.6177.3-16300111.1R863 A869 N870 L871R863-E867 WeakPolarHBondContact O-CB 3.33Å; R863-E867 PolarHBondContact O-N 3.49Å; E867-A869 VanDerWaalsContact C-N 3.32Å; E867-A869 PolarHBondContact O-N 3.3Å; E867-N870 PolarHBondContact O-N 3.3Å; E867-L871 HydrophobicContact CG-CD1 4.05Å; E867-L871 HydrophobicContact CG-CG 4.47Å; E867-L871 WeakPolarHBondContact O-CB 3.5Å; E867-L871 WeakPolarHBondContact O-CG 3.3Å; E867-L871 PolarHBondContact O-N 3.48Å
868K93.7Very high92.6Very high136 Ų13695.1 Ų95.159%0.59150%0.495SS*.Hα-helixtrans-62.2-37.2174.3-176.4175-179.5175.60112.3F864 A872F864-K868 HydrophobicContact CE1-CD 4.47Å; F864-K868 WeakPolarHBondContact O-CB 3.35Å; F864-K868 PolarHBondContact O-N 2.83Å; K868-A872 WeakPolarHBondContact O-CB 3.33Å; K868-A872 PolarHBondContact O-N 3.15Å
869A92.1Very high92.4Very high50 Ų5098.7 Ų98.741%0.41351%0.507SS..Hα-helixtrans-68.2-40.3174.500000112G865 L866 E867 A872 Q873G865-A869 VanDerWaalsContact O-CB 3.25Å; G865-A869 WeakPolarHBondContact O-CB 3.48Å; G865-A869 PolarHBondContact O-N 3.42Å; L866-A869 PolarHBondContact O-N 2.95Å; E867-A869 VanDerWaalsContact C-N 3.32Å; E867-A869 PolarHBondContact O-N 3.3Å; A869-A872 CarbonylContact O-C 3.53Å; A869-A872 PolarHBondContact O-N 2.79Å; A869-Q873 WeakPolarHBondContact O-CB 3.2Å; A869-Q873 PolarHBondContact O-N 3.44Å
870N93.7Very high92Very high99 Ų9998 Ų9853%0.52951%0.51SS..Hα-helixtrans-67.2-47.9176.5-171.625.3000111.3L866 E867 A872 Q873 Q874L866-N870 VanDerWaalsContact O-CB 3.31Å; L866-N870 WeakPolarHBondContact O-CB 3.34Å; L866-N870 PolarHBondContact O-N 2.9Å; E867-N870 PolarHBondContact O-N 3.3Å; N870-A872 VanDerWaalsContact C-N 3.34Å; N870-A872 PolarHBondContact O-N 2.87Å; N870-Q873 CarbonylContact O-C 3.57Å; N870-Q873 WeakPolarHBondContact O-CA 3.29Å; N870-Q873 WeakPolarHBondContact O-CB 3.38Å; N870-Q873 PolarHBondContact O-N 3.06Å; N870-Q874 WeakPolarHBondContact O-CB 3.46Å; N870-Q874 PolarHBondContact O-N 2.87Å
871L93Very high91.8Very high85 Ų85100.7 Ų100.745%0.44551%0.514SS..Hα-helixtrans-58.9-43171.7-73.2169.8000111.3E867 Q873 Q874 V875E867-L871 HydrophobicContact CG-CD1 4.05Å; E867-L871 HydrophobicContact CG-CG 4.47Å; E867-L871 WeakPolarHBondContact O-CB 3.5Å; E867-L871 WeakPolarHBondContact O-CG 3.3Å; E867-L871 PolarHBondContact O-N 3.48Å; L871-Q873 VanDerWaalsContact C-N 3.27Å; L871-Q873 PolarHBondContact O-N 2.94Å; L871-Q874 PolarHBondContact O-N 3.35Å; L871-V875 WeakPolarHBondContact O-CB 3.4Å; L871-V875 VanDerWaalsContact O-CG2 3.29Å; L871-V875 WeakPolarHBondContact O-CG2 3.48Å; L871-V875 PolarHBondContact O-N 2.89Å
872A90.8Very high91.3Very high43 Ų4399.3 Ų99.336%0.35551%0.509SS..Hα-helixtrans-66.9-26.9174.200000112.9K868 A869 N870 R876K868-A872 WeakPolarHBondContact O-CB 3.33Å; K868-A872 PolarHBondContact O-N 3.15Å; A869-A872 CarbonylContact O-C 3.53Å; A869-A872 PolarHBondContact O-N 2.79Å; N870-A872 VanDerWaalsContact C-N 3.34Å; N870-A872 PolarHBondContact O-N 2.87Å; A872-R876 WeakPolarHBondContact O-CB 3.37Å; A872-R876 VanDerWaalsContact O-CG 3.29Å; A872-R876 WeakPolarHBondContact O-CG 3.46Å; A872-R876 PolarHBondContact O-N 2.8Å; A872-R876 VanDerWaalsContact O-N 3.14Å; A872-R876 PolarHBondContact O-NE 3.41Å
873Q91.9Very high90.8Very high112 Ų11296.4 Ų96.452%0.52350%0.501SS..Hα-helixtrans-74.8-44.4170.8177.9170.3-26.800111.2A869 N870 L871 V875 R876 L877A869-Q873 WeakPolarHBondContact O-CB 3.2Å; A869-Q873 PolarHBondContact O-N 3.44Å; N870-Q873 CarbonylContact O-C 3.57Å; N870-Q873 WeakPolarHBondContact O-CA 3.29Å; N870-Q873 WeakPolarHBondContact O-CB 3.38Å; N870-Q873 PolarHBondContact O-N 3.06Å; L871-Q873 VanDerWaalsContact C-N 3.27Å; L871-Q873 PolarHBondContact O-N 2.94Å; Q873-V875 PolarHBondContact O-N 2.85Å; Q873-R876 PolarHBondContact O-N 3.47Å; Q873-L877 HydrophobicContact CG-CD1 4.14Å; Q873-L877 WeakPolarHBondContact O-CB 3.37Å; Q873-L877 WeakPolarHBondContact O-CG 3.42Å; Q873-L877 PolarHBondContact O-N 2.95Å
874Q91.3Very high90.3Very high118 Ų11892.6 Ų92.655%0.55149%0.49SS*.Hα-helixtrans-63.3-39.9176.3-169.1-179.413.800111.9N870 L871 L877 S878N870-Q874 WeakPolarHBondContact O-CB 3.46Å; N870-Q874 PolarHBondContact O-N 2.87Å; L871-Q874 PolarHBondContact O-N 3.35Å; Q874-L877 PolarHBondContact O-N 2.86Å; Q874-S878 WeakPolarHBondContact O-CB 3.36Å; Q874-S878 PolarHBondContact O-N 2.97Å; Q874-S878 PolarHBondContact O-OG 3.36Å
875V91.2Very high89.7Confident78 Ų7892.1 Ų92.147%0.47349%0.488SS..Hα-helixtrans-68.1-36.9172.6170.70000111.4L871 Q873 S878 M879L871-V875 WeakPolarHBondContact O-CB 3.4Å; L871-V875 VanDerWaalsContact O-CG2 3.29Å; L871-V875 WeakPolarHBondContact O-CG2 3.48Å; L871-V875 PolarHBondContact O-N 2.89Å; Q873-V875 PolarHBondContact O-N 2.85Å; V875-S878 WeakPolarHBondContact CA-OG 3.29Å; V875-S878 PolarHBondContact O-OG 2.87Å; V875-M879 HydrophobicContact CG1-CG 4.38Å; V875-M879 HydrophobicContact CG1-SD 4.17Å; V875-M879 VanDerWaalsContact O-CB 3.24Å; V875-M879 WeakPolarHBondContact O-CB 3.22Å; V875-M879 WeakPolarHBondContact O-CG 3.47Å; V875-M879 PolarHBondContact O-N 3.31Å
876R90.9Very high89.1Confident157 Ų15795.9 Ų95.959%0.59250%0.496SS*.Hα-helixtrans-66.5-41.9172.3-82.3175-70.5177.51.8111.8A872 Q873 M879 T880A872-R876 WeakPolarHBondContact O-CB 3.37Å; A872-R876 VanDerWaalsContact O-CG 3.29Å; A872-R876 WeakPolarHBondContact O-CG 3.46Å; A872-R876 PolarHBondContact O-N 2.8Å; A872-R876 VanDerWaalsContact O-N 3.14Å; A872-R876 PolarHBondContact O-NE 3.41Å; Q873-R876 PolarHBondContact O-N 3.47Å; R876-M879 PolarHBondContact O-N 3.24Å; R876-T880 WeakPolarHBondContact O-CG2 3.5Å; R876-T880 PolarHBondContact O-N 2.9Å; R876-T880 PolarHBondContact O-OG1 2.94Å
877L89.8Confident88.5Confident90 Ų9097.4 Ų97.447%0.47150%0.498SS..Hα-helixtrans-62-51.1174.9-73.4169.7000110.7Q873 Q874 M879 T880 E881Q873-L877 HydrophobicContact CG-CD1 4.14Å; Q873-L877 WeakPolarHBondContact O-CB 3.37Å; Q873-L877 WeakPolarHBondContact O-CG 3.42Å; Q873-L877 PolarHBondContact O-N 2.95Å; Q874-L877 PolarHBondContact O-N 2.86Å; L877-M879 VanDerWaalsContact C-N 3.33Å; L877-M879 PolarHBondContact O-N 2.98Å; L877-T880 WeakPolarHBondContact CA-OG1 3.23Å; L877-T880 CarbonylContact O-C 3.6Å; L877-T880 WeakPolarHBondContact O-CA 3.33Å; L877-T880 PolarHBondContact O-N 3.36Å; L877-T880 PolarHBondContact O-OG1 2.91Å; L877-E881 WeakPolarHBondContact O-CG 3.45Å; L877-E881 PolarHBondContact O-N 2.94Å
878S88.4Confident87.7Confident49 Ų4999.4 Ų99.434%0.34350%0.5SS..Hα-helixtrans-66.3-31.6178.372.10000112.7Q874 V875 E881 V882Q874-S878 WeakPolarHBondContact O-CB 3.36Å; Q874-S878 PolarHBondContact O-N 2.97Å; Q874-S878 PolarHBondContact O-OG 3.36Å; V875-S878 WeakPolarHBondContact CA-OG 3.29Å; V875-S878 PolarHBondContact O-OG 2.87Å; S878-E881 PolarHBondContact O-N 3.34Å; S878-V882 VanDerWaalsContact O-CB 3.29Å; S878-V882 WeakPolarHBondContact O-CB 3.37Å; S878-V882 WeakPolarHBondContact O-CG2 3.33Å; S878-V882 PolarHBondContact O-N 3.23Å
879M88.7Confident86.2Confident126 Ų126101.2 Ų101.262%0.62151%0.508SS*.Hα-helixtrans-66.5-38.3168.6-77.1-177.974.200112.4V875 R876 L877 A883V875-M879 HydrophobicContact CG1-CG 4.38Å; V875-M879 HydrophobicContact CG1-SD 4.17Å; V875-M879 VanDerWaalsContact O-CB 3.24Å; V875-M879 WeakPolarHBondContact O-CB 3.22Å; V875-M879 WeakPolarHBondContact O-CG 3.47Å; V875-M879 PolarHBondContact O-N 3.31Å; R876-M879 PolarHBondContact O-N 3.24Å; L877-M879 VanDerWaalsContact C-N 3.33Å; L877-M879 PolarHBondContact O-N 2.98Å; M879-A883 WeakPolarHBondContact O-CB 3.4Å; M879-A883 PolarHBondContact O-N 3.03Å
880T88.3Confident84.4Confident83 Ų83104.5 Ų104.551%0.50952%0.519SS..Hα-helixtrans-70.7-34.8173.3510000112.8R876 L877 A883 E884R876-T880 WeakPolarHBondContact O-CG2 3.5Å; R876-T880 PolarHBondContact O-N 2.9Å; R876-T880 PolarHBondContact O-OG1 2.94Å; L877-T880 WeakPolarHBondContact CA-OG1 3.23Å; L877-T880 CarbonylContact O-C 3.6Å; L877-T880 WeakPolarHBondContact O-CA 3.33Å; L877-T880 PolarHBondContact O-N 3.36Å; L877-T880 PolarHBondContact O-OG1 2.91Å; T880-A883 PolarHBondContact O-N 2.82Å; T880-E884 WeakPolarHBondContact O-CB 3.3Å; T880-E884 PolarHBondContact O-N 2.96Å
881E87.9Confident82.1Confident109 Ų109108.8 Ų108.851%0.50953%0.528SS..Hα-helixtrans-67.6-43172.4-72.4171.2-175.400111.1L877 S878 A883 E884 F885L877-E881 WeakPolarHBondContact O-CG 3.45Å; L877-E881 PolarHBondContact O-N 2.94Å; S878-E881 PolarHBondContact O-N 3.34Å; E881-A883 VanDerWaalsContact C-N 3.31Å; E881-A883 PolarHBondContact O-N 3.27Å; E881-E884 CarbonylContact O-C 3.52Å; E881-E884 WeakPolarHBondContact O-CB 3.44Å; E881-E884 PolarHBondContact O-N 3.31Å; E881-F885 HydrophobicContact CB-CD2 4.49Å; E881-F885 WeakPolarHBondContact O-CB 3.41Å; E881-F885 WeakPolarHBondContact O-CD2 3.32Å; E881-F885 PolarHBondContact O-N 3.18Å
882V85.6Confident79.6Confident86 Ų86111.3 Ų111.352%0.52155%0.549SS..Hα-helixtrans-64.2-36.5173.2167.70000110.7S878 F885 Q886S878-V882 VanDerWaalsContact O-CB 3.29Å; S878-V882 WeakPolarHBondContact O-CB 3.37Å; S878-V882 WeakPolarHBondContact O-CG2 3.33Å; S878-V882 PolarHBondContact O-N 3.23Å; V882-F885 PolarHBondContact O-N 3.31Å; V882-Q886 VanDerWaalsContact O-CB 3.23Å; V882-Q886 WeakPolarHBondContact O-CB 3.44Å; V882-Q886 PolarHBondContact O-N 2.99Å
883A83.3Confident77.4Confident46 Ų46115.5 Ų115.538%0.3857%0.57SS.*Hα-helixtrans-68.5-36.7172.500000112.8M879 T880 E881 K887M879-A883 WeakPolarHBondContact O-CB 3.4Å; M879-A883 PolarHBondContact O-N 3.03Å; T880-A883 PolarHBondContact O-N 2.82Å; E881-A883 VanDerWaalsContact C-N 3.31Å; E881-A883 PolarHBondContact O-N 3.27Å; A883-K887 WeakPolarHBondContact O-CB 3.25Å; A883-K887 VanDerWaalsContact O-CG 3.26Å; A883-K887 WeakPolarHBondContact O-CG 3.43Å; A883-K887 PolarHBondContact O-N 3.07Å
884E83.3Confident74.9Confident83 Ų83114.1 Ų114.139%0.38858%0.579SS.*Hα-helixtrans-62.1-50.1168.7-88.7-77.5126.400111.3T880 E881 Q886 K887 R888T880-E884 WeakPolarHBondContact O-CB 3.3Å; T880-E884 PolarHBondContact O-N 2.96Å; E881-E884 CarbonylContact O-C 3.52Å; E881-E884 WeakPolarHBondContact O-CB 3.44Å; E881-E884 PolarHBondContact O-N 3.31Å; E884-Q886 VanDerWaalsContact C-N 3.32Å; E884-Q886 PolarHBondContact O-N 3.44Å; E884-K887 WeakPolarHBondContact O-CB 3.5Å; E884-K887 PolarHBondContact O-N 3.04Å; E884-R888 VanDerWaalsContact O-CG 3.24Å; E884-R888 WeakPolarHBondContact O-CG 3.37Å; E884-R888 PolarHBondContact O-N 3.46Å; E884-R888 IonicContact OE2-CZ 2.62Å; E884-R888 IonicContact OE2-NE 3.81Å; E884-R888 PolarHBondContact OE2-NE 2.9Å; E884-R888 IonicContact OE2-NH2 2.59Å; E884-R888 PolarHBondContact OE2-NH2 2.74Å
885F79.4Confident72.2Confident114 Ų114115.6 Ų115.650%0.559%0.59SS.*Hα-helixtrans-61.2-40.3176.7-83-64.4000111.2E881 V882 R888 F889E881-F885 HydrophobicContact CB-CD2 4.49Å; E881-F885 WeakPolarHBondContact O-CB 3.41Å; E881-F885 WeakPolarHBondContact O-CD2 3.32Å; E881-F885 PolarHBondContact O-N 3.18Å; V882-F885 PolarHBondContact O-N 3.31Å; F885-R888 CarbonylContact O-C 3.57Å; F885-R888 WeakPolarHBondContact O-CB 3.41Å; F885-R888 PolarHBondContact O-N 3.12Å; F885-R888 VanDerWaalsContact O-N 3.12Å; F885-F889 WeakPolarHBondContact O-CB 3.24Å; F885-F889 WeakPolarHBondContact O-CD2 3.34Å; F885-F889 PolarHBondContact O-N 3.1Å
886Q81.4Confident69.8Low115 Ų115121 Ų12154%0.53761%0.61SS.*Hα-helixtrans-72.4-32.2177.9-164.7151.117.600112.2V882 E884 R888 N890V882-Q886 VanDerWaalsContact O-CB 3.23Å; V882-Q886 WeakPolarHBondContact O-CB 3.44Å; V882-Q886 PolarHBondContact O-N 2.99Å; E884-Q886 VanDerWaalsContact C-N 3.32Å; E884-Q886 PolarHBondContact O-N 3.44Å; Q886-R888 VanDerWaalsContact C-N 3.32Å; Q886-N890 WeakPolarHBondContact O-CB 3.4Å; Q886-N890 PolarHBondContact O-N 3.38Å; Q886-N890 PolarHBondContact O-ND2 3.16Å
887K80Confident67.4Low150 Ų150123 Ų12365%0.65262%0.623SS**Hα-helixtrans-63.2-35.2165.4-74.4168.4-177.11740112.5A883 E884A883-K887 WeakPolarHBondContact O-CB 3.25Å; A883-K887 VanDerWaalsContact O-CG 3.26Å; A883-K887 WeakPolarHBondContact O-CG 3.43Å; A883-K887 PolarHBondContact O-N 3.07Å; E884-K887 WeakPolarHBondContact O-CB 3.5Å; E884-K887 PolarHBondContact O-N 3.04Å
888R77Confident65.2Low158 Ų158127.1 Ų127.160%0.59664%0.644SS**Hα-helixtrans-75.7-42.3178-67.8167.5-167-1496.7112.2E884 F885 Q886 R891E884-R888 VanDerWaalsContact O-CG 3.24Å; E884-R888 WeakPolarHBondContact O-CG 3.37Å; E884-R888 PolarHBondContact O-N 3.46Å; E884-R888 IonicContact OE2-CZ 2.62Å; E884-R888 IonicContact OE2-NE 3.81Å; E884-R888 PolarHBondContact OE2-NE 2.9Å; E884-R888 IonicContact OE2-NH2 2.59Å; E884-R888 PolarHBondContact OE2-NH2 2.74Å; F885-R888 CarbonylContact O-C 3.57Å; F885-R888 WeakPolarHBondContact O-CB 3.41Å; F885-R888 PolarHBondContact O-N 3.12Å; F885-R888 VanDerWaalsContact O-N 3.12Å; Q886-R888 VanDerWaalsContact C-N 3.32Å; R888-R891 WeakPolarHBondContact O-CB 3.42Å; R888-R891 PolarHBondContact O-N 2.9Å
889F61.3Low62.6Low174 Ų174133 Ų13376%0.76367%0.668SS**Hα-helixtrans-70.9-32.7176.2-96.1-84.5000112.8F885 R891F885-F889 WeakPolarHBondContact O-CB 3.24Å; F885-F889 WeakPolarHBondContact O-CD2 3.34Å; F885-F889 PolarHBondContact O-N 3.1Å; F889-R891 PolarHBondContact O-N 3.05Å; F889-R891 VanDerWaalsContact O-N 3.15Å
890N55.1Low60.3Low119 Ų119133.5 Ų133.564%0.63668%0.678SS**THydrogen-bonded Turntrans-76.914172.8-67.7-11.1000113.3Q886 P892Q886-N890 WeakPolarHBondContact O-CB 3.4Å; Q886-N890 PolarHBondContact O-N 3.38Å; Q886-N890 PolarHBondContact O-ND2 3.16Å; N890-P892 WeakPolarHBondContact O-CD 3.34Å
891R46.6Very low58Low190 Ų190138.1 Ų138.172%0.71769%0.693SS**SBendtrans-75.1113.1158-80-173.9162.5-177.5-4.3108.7R888 F889 T893R888-R891 WeakPolarHBondContact O-CB 3.42Å; R888-R891 PolarHBondContact O-N 2.9Å; F889-R891 PolarHBondContact O-N 3.05Å; F889-R891 VanDerWaalsContact O-N 3.15Å; R891-T893 PolarHBondContact O-N 3.16Å; R891-T893 PolarHBondContact O-OG1 3.03Å; R891-T893 VanDerWaalsContact O-OG1 3.1Å
892P39.7Very low55.8Low137 Ų137138.8 Ų138.889%0.8971%0.707SS**  trans-6899.6-175.928.2-34.6000110.7N890N890-P892 WeakPolarHBondContact O-CD 3.34Å
893T45.3Very low53.8Low131 Ų131140.2 Ų140.280%0.80472%0.719SS**  trans-136.1127.5178-24.10000107.8R891R891-T893 PolarHBondContact O-N 3.16Å; R891-T893 PolarHBondContact O-OG1 3.03Å; R891-T893 VanDerWaalsContact O-OG1 3.1Å
894A38.6Very low51.5Low84 Ų84146.6 Ų146.669%0.69474%0.742SS**  trans-98.7153.3-154.600000115.5
895N35.1Very low49.3Very low148 Ų148152.4 Ų152.479%0.79176%0.761SS**  trans60.894.8149.2-59.8-24.8000120.1
896Q40.8Very low47.4Very low192 Ų192153.5 Ų153.590%0.89777%0.772SS**  -178.9106.9129.3-97.3156.330.100108.6
897K40.1Very low45.2Very low199 Ų199155.9 Ų155.987%0.86578%0.783SS**  55105.880.6-81.8-165.7174.2-174.80115.4
898I42.8Very low43.3Very low177 Ų177155.8 Ų155.891%0.90879%0.785SS**  trans-162.9153.1133.6-96.6148.6000107.8
899M34.6Very low41.4Very low173 Ų173153.7 Ų153.785%0.85279%0.79SS**  trans-125.3164.9-177.7-70.5167.151.900110.7
900V39.4Very low40Very low135 Ų135152 Ų15282%0.81879%0.789SS**  169.2147.5124.8152.60000111.1
901Q41.2Very low38.9Very low180 Ų180151.2 Ų151.284%0.84179%0.791SS**  trans-111.8161.7170.3-77.8-176.8-3000111
902P41.4Very low38.1Very low124 Ų124151 Ų15181%0.80580%0.796SS**  trans-141.3168.7130.734.9-19.7000115.3
903P43.3Very low37.7Very low116 Ų116150.4 Ų150.475%0.75379%0.79SS**  trans-129.7177.9-169.544.2-29.9000117.1
904M36.2Very low37.1Very low179 Ų179151.6 Ų151.688%0.88278%0.784SS**  trans82.6174.4156.1-72.9-76.2-85.500120.6
905R37.1Very low36.8Very low206 Ų206158 Ų15878%0.77779%0.79SS**  trans-106.3157.1-139-101.8178.4166179-1.1117.4
906D39.6Very low36.8Very low136 Ų136156 Ų15673%0.72779%0.787SS**  trans58.8147.9138-51.6-19.6000124.4
907Q34.8Very low36.6Very low165 Ų165153.7 Ų153.777%0.77178%0.781SS**  trans111.9106.4148.6-150.7168.61500120.9
908E39.5Very low36.7Very low148 Ų148150.6 Ų150.669%0.69278%0.779SS**  trans56.3142143.1-65.2172.5-12900126.6
909T37.8Very low36.3Very low115 Ų115145.7 Ų145.771%0.70676%0.764SS**  trans82.1142.3155.974.40000122.2
910N32.2Very low36.7Very low137 Ų137143.6 Ų143.673%0.73376%0.762SS**  trans67.3115.2146.9-68.4-29.9000122.8
911C31.9Very low36.6Very low103 Ų103145.4 Ų145.470%0.69676%0.761SS**  73.2117.3126.5-65.30000122.7
912F28.3Very low36.5Very low186 Ų186142 Ų14282%0.81675%0.752SS**  trans73.7172.3136.2-90.3-96.3000120.5
913V31.4Very low36.5Very low124 Ų124143 Ų14375%0.75275%0.746SS**  trans72.289.6172-164.90000114.7
914K32.1Very low36.3Very low156 Ų156146.1 Ų146.168%0.67874%0.743SS**  77.6112.571.2-73.6178.5176.71710116.2
915R33.1Very low36.5Very low219 Ų219143 Ų14383%0.82673%0.73SS**  trans79.8158.1130.6-68.8178.5173.3-179.7-4.5120.6
916S36.3Very low36.8Very low105 Ų105140.6 Ų140.673%0.73473%0.728SS**  trans79.9134.9166.877.90000115.9
917N36.3Very low36.8Very low145 Ų145143 Ų14378%0.77573%0.732SS**  cis-164.5164.5-7.4-1191.5000112.1
918V40.8Very low37.1Very low134 Ų134140.3 Ų140.381%0.81273%0.73SS**  trans69134.4149.3161.20000117.7
919A34.9Very low37.2Very low73 Ų73136.8 Ų136.860%0.60373%0.726SS**  cis-166.8-175-12.600000111.5
920T43Very low37.3Very low130 Ų130138.9 Ų138.980%0.79873%0.733SS**  trans76.6144.5169.768.30000118.2
921E37.1Very low37.6Very low173 Ų173136.7 Ų136.781%0.80873%0.734SS**  cis-164.2173.1-32.9-158.9160.4137.600110
922V40.4Very low38.1Very low107 Ų107136.9 Ų136.965%0.64874%0.736SS**  trans88.797.4161.9-172.10000119.5
923Q40.3Very low38.6Very low146 Ų146134.8 Ų134.868%0.68274%0.739SS**  trans59.4146133.3-57.7-173.950.400121
924R39.4Very low39.3Very low181 Ų181134.2 Ų134.268%0.68373%0.728SS**  cis-166.9154.4-4.7-115.3-175.9155.7118.4-3.2111.7
925D40.7Very low39.8Very low113 Ų113133.1 Ų133.160%0.60473%0.734SS**  trans46.5143.7138.3-48.2-14.5000120.6
926E42.8Very low40.5Very low157 Ų157127.7 Ų127.773%0.73473%0.725SS**  cis-162.5142.13.3-126169.2-172.800112.6
927F39.5Very low41.2Very low187 Ų187130.2 Ų130.282%0.8272%0.719SS**  trans45.9147.9134.7-82.4-114.8000122.9
928C41.1Very low42.1Very low108 Ų108131.2 Ų131.273%0.7371%0.713SS**  cis-158.8172-4.1-156.70000111.5
929A42.6Very low43Very low73 Ų73132.1 Ų132.160%0.60371%0.708SS**  trans-110.1163.4163.300000111.4
930D39.9Very low44.5Very low159 Ų159134.3 Ų134.385%0.8571%0.706SS**  166.8166.3124.9-87.8-15.9000113.9
931A37.7Very low45.8Very low92 Ų92132.4 Ų132.476%0.7669%0.691SS**  trans62.1118.6176.800000117
932S41.4Very low47.5Very low106 Ų106129.5 Ų129.574%0.74168%0.677SS**  cis78.479.624.394.90000117
933T40.1Very low49.2Very low142 Ų142130.7 Ų130.787%0.87168%0.676SS**  trans176.282.2138.244.70000113.3
934E45.7Very low51Low113 Ų113127.7 Ų127.753%0.52867%0.667SS.*  trans-160.347.4154-143.1178.315700112.7V936 R937E934-V936 VanDerWaalsContact C-N 3.29Å; E934-V936 PolarHBondContact O-N 2.91Å; E934-R937 IonicContact OE1-NH1 3.65Å; E934-R937 PolarHBondContact OE1-NH1 2.96Å
935T43.3Very low53.1Low132 Ų132126.2 Ų126.281%0.8166%0.662SS**THydrogen-bonded Turntrans-81.152.3-16656.60000114.9
936V46.6Very low55.1Low105 Ų105125.4 Ų125.464%0.63666%0.657SS**THydrogen-bonded Turntrans-137-50.5170.7-177.40000111.3E934 Y938 E939E934-V936 VanDerWaalsContact C-N 3.29Å; E934-V936 PolarHBondContact O-N 2.91Å; V936-Y938 VanDerWaalsContact C-N 3.3Å; V936-Y938 PolarHBondContact O-N 3.36Å; V936-E939 PolarHBondContact O-N 2.67Å
937R51Low57.2Low158 Ų158123 Ų12360%0.59665%0.648SS**Hα-helixtrans-65.3-29.2-176.6-77.3176.9167.2155.1-8.9114.5E934 E939 E940 D941E934-R937 IonicContact OE1-NH1 3.65Å; E934-R937 PolarHBondContact OE1-NH1 2.96Å; R937-E939 VanDerWaalsContact C-N 3.32Å; R937-E939 PolarHBondContact O-N 2.9Å; R937-E940 PolarHBondContact O-N 3.34Å; R937-D941 WeakPolarHBondContact O-CB 3.46Å; R937-D941 PolarHBondContact O-N 3.13Å
938Y55.1Low59.4Low167 Ų167121 Ų12166%0.65564%0.639SS**Hα-helixtrans-70.1-23.9-177-81.2-83.3000114.1V936 H942V936-Y938 VanDerWaalsContact C-N 3.3Å; V936-Y938 PolarHBondContact O-N 3.36Å; Y938-H942 WeakPolarHBondContact O-CB 3.49Å; Y938-H942 PolarHBondContact O-N 2.82Å
939E60.8Low61.7Low152 Ų152117.3 Ų117.371%0.7162%0.62SS**Hα-helixtrans-77.5-40.1172.3-67.9-167.4136.700111.3V936 R937 H942 Q943V936-E939 PolarHBondContact O-N 2.67Å; R937-E939 VanDerWaalsContact C-N 3.32Å; R937-E939 PolarHBondContact O-N 2.9Å; E939-H942 PolarHBondContact O-N 3.49Å; E939-Q943 PolarHBondContact O-N 2.76Å
940E66.7Low63.8Low120 Ų120118.9 Ų118.956%0.56162%0.615SS**Hα-helixtrans-59.4-48.9171.3-63.7-175.5136.900110.9R937 H942 Q943 V944R937-E940 PolarHBondContact O-N 3.34Å; E940-H942 PolarHBondContact O-N 3.23Å; E940-Q943 PolarHBondContact O-N 2.8Å; E940-V944 WeakPolarHBondContact O-CB 3.43Å; E940-V944 VanDerWaalsContact O-CG2 3.27Å; E940-V944 WeakPolarHBondContact O-CG2 3.29Å; E940-V944 PolarHBondContact O-N 3.16Å
941D69.7Low66.2Low90 Ų90115.8 Ų115.848%0.48160%0.597SS.*Hα-helixtrans-67.4-14177.9-102.5-17.5000114.4R937 R945R937-D941 WeakPolarHBondContact O-CB 3.46Å; R937-D941 PolarHBondContact O-N 3.13Å; D941-R945 WeakPolarHBondContact O-CB 3.36Å; D941-R945 PolarHBondContact O-NE 2.99Å; D941-R945 PolarHBondContact O-NH2 3.37Å
942H73.1Confident68.5Low112 Ų112115.4 Ų115.452%0.51959%0.586SS.*Hα-helixtrans-94.4-37.5173.5-154-62.3000111.9Y938 E939 E940 R945 L946Y938-H942 WeakPolarHBondContact O-CB 3.49Å; Y938-H942 PolarHBondContact O-N 2.82Å; E939-H942 PolarHBondContact O-N 3.49Å; E940-H942 PolarHBondContact O-N 3.23Å; H942-R945 WeakPolarHBondContact O-CB 3.48Å; H942-R945 PolarHBondContact O-N 3.32Å; H942-L946 PolarHBondContact O-N 2.94Å
943Q76.5Confident70.7Confident131 Ų131114 Ų11461%0.61257%0.573SS**Hα-helixtrans-65.1-44.7169.4-75.9-169.4-6.900111.5E939 E940 R945 L946 L947E939-Q943 PolarHBondContact O-N 2.76Å; E940-Q943 PolarHBondContact O-N 2.8Å; Q943-R945 PolarHBondContact O-N 3.13Å; Q943-L946 PolarHBondContact O-N 3.35Å; Q943-L947 WeakPolarHBondContact O-CB 3.36Å; Q943-L947 WeakPolarHBondContact O-CG 3.47Å; Q943-L947 PolarHBondContact O-N 2.94Å
944V77.5Confident73Confident83 Ų83110 Ų11050%0.50355%0.549SS..Hα-helixtrans-60.7-33.4174170.10000111E940 K948E940-V944 WeakPolarHBondContact O-CB 3.43Å; E940-V944 VanDerWaalsContact O-CG2 3.27Å; E940-V944 WeakPolarHBondContact O-CG2 3.29Å; E940-V944 PolarHBondContact O-N 3.16Å; V944-K948 WeakPolarHBondContact O-CB 3.49Å; V944-K948 PolarHBondContact O-N 3.14Å
945R82.7Confident75Confident150 Ų150112.7 Ų112.757%0.56655%0.554SS**Hα-helixtrans-67.7-44.9173.8-128.4170.1-64.1-174.1-2.1112.7D941 H942 Q943 K948 G949D941-R945 WeakPolarHBondContact O-CB 3.36Å; D941-R945 PolarHBondContact O-NE 2.99Å; D941-R945 PolarHBondContact O-NH2 3.37Å; H942-R945 WeakPolarHBondContact O-CB 3.48Å; H942-R945 PolarHBondContact O-N 3.32Å; Q943-R945 PolarHBondContact O-N 3.13Å; R945-K948 PolarHBondContact O-N 2.86Å; R945-G949 PolarHBondContact O-N 3.39Å
946L83.6Confident77.1Confident97 Ų97108.7 Ų108.751%0.50853%0.534SS..Hα-helixtrans-61.5-55.2175.6-95155.1000111.3H942 Q943 K948 G949 E950H942-L946 PolarHBondContact O-N 2.94Å; Q943-L946 PolarHBondContact O-N 3.35Å; L946-K948 VanDerWaalsContact C-N 3.27Å; L946-K948 PolarHBondContact O-N 2.94Å; L946-G949 CarbonylContact O-C 3.57Å; L946-G949 WeakPolarHBondContact O-CA 3.21Å; L946-G949 PolarHBondContact O-N 3.48Å; L946-E950 WeakPolarHBondContact O-CG 3.49Å; L946-E950 PolarHBondContact O-N 3.19Å
947L86.9Confident79.1Confident105 Ų105109.4 Ų109.455%0.5553%0.531SS..Hα-helixtrans-59.9-35.3178.3-69.2170.5000112.4Q943 L951Q943-L947 WeakPolarHBondContact O-CB 3.36Å; Q943-L947 WeakPolarHBondContact O-CG 3.47Å; Q943-L947 PolarHBondContact O-N 2.94Å; L947-L951 WeakPolarHBondContact O-CB 3.47Å; L947-L951 PolarHBondContact O-N 2.8Å
948K86Confident81.1Confident146 Ų146106.4 Ų106.464%0.63553%0.525SS*.Hα-helixtrans-70.4-36.2174.1-171172.4-175.3177.10111.9V944 R945 L946 T952V944-K948 WeakPolarHBondContact O-CB 3.49Å; V944-K948 PolarHBondContact O-N 3.14Å; R945-K948 PolarHBondContact O-N 2.86Å; L946-K948 VanDerWaalsContact C-N 3.27Å; L946-K948 PolarHBondContact O-N 2.94Å; K948-T952 WeakPolarHBondContact O-CG2 3.37Å; K948-T952 PolarHBondContact O-N 2.75Å; K948-T952 PolarHBondContact O-OG1 3.33Å
949G87.8Confident82.7Confident31 Ų31103 Ų10332%0.3252%0.518SS..Hα-helixtrans-60.2-53.617000000111.8R945 L946 L951 T952 T953R945-G949 PolarHBondContact O-N 3.39Å; L946-G949 CarbonylContact O-C 3.57Å; L946-G949 WeakPolarHBondContact O-CA 3.21Å; L946-G949 PolarHBondContact O-N 3.48Å; G949-L951 VanDerWaalsContact C-N 3.32Å; G949-L951 PolarHBondContact O-N 2.9Å; G949-T952 PolarHBondContact O-N 3.42Å; G949-T952 PolarHBondContact O-OG1 3.21Å; G949-T953 PolarHBondContact O-N 2.81Å; G949-T953 PolarHBondContact O-OG1 3.38Å
950E87.9Confident84.1Confident106 Ų106100.2 Ų100.250%0.49551%0.508SS..Hα-helixtrans-60-38.3176.9-68.3172.5173.200112.5L946 T952 T953 T954L946-E950 WeakPolarHBondContact O-CG 3.49Å; L946-E950 PolarHBondContact O-N 3.19Å; E950-T952 VanDerWaalsContact C-N 3.34Å; E950-T952 PolarHBondContact O-N 3.1Å; E950-T953 WeakPolarHBondContact CA-OG1 3.47Å; E950-T953 PolarHBondContact O-N 2.86Å; E950-T953 PolarHBondContact O-OG1 2.99Å; E950-T953 VanDerWaalsContact O-OG1 3.06Å; E950-T954 WeakPolarHBondContact O-CB 3.44Å; E950-T954 WeakPolarHBondContact O-CG2 3.27Å; E950-T954 PolarHBondContact O-N 3.01Å; E950-T954 PolarHBondContact O-OG1 3.34Å
951L89.1Confident85.3Confident93 Ų9399.9 Ų99.949%0.48751%0.509SS..Hα-helixtrans-67.1-33.2173.6-171.665.1000112.3L947 G949 T954 R955L947-L951 WeakPolarHBondContact O-CB 3.47Å; L947-L951 PolarHBondContact O-N 2.8Å; G949-L951 VanDerWaalsContact C-N 3.32Å; G949-L951 PolarHBondContact O-N 2.9Å; L951-T954 WeakPolarHBondContact CA-OG1 3.35Å; L951-T954 PolarHBondContact O-OG1 2.94Å; L951-R955 VanDerWaalsContact O-CB 3.3Å; L951-R955 WeakPolarHBondContact O-CB 3.25Å; L951-R955 VanDerWaalsContact O-CG 3.28Å; L951-R955 WeakPolarHBondContact O-CG 3.43Å; L951-R955 PolarHBondContact O-N 3.23Å
952T87.4Confident86.2Confident84 Ų84100.7 Ų100.752%0.51551%0.51SS..Hα-helixtrans-74-38173.653.20000113K948 G949 E950 A956K948-T952 WeakPolarHBondContact O-CG2 3.37Å; K948-T952 PolarHBondContact O-N 2.75Å; K948-T952 PolarHBondContact O-OG1 3.33Å; G949-T952 PolarHBondContact O-N 3.42Å; G949-T952 PolarHBondContact O-OG1 3.21Å; E950-T952 VanDerWaalsContact C-N 3.34Å; E950-T952 PolarHBondContact O-N 3.1Å; T952-A956 WeakPolarHBondContact O-CB 3.42Å; T952-A956 PolarHBondContact O-N 2.69Å
953T87.9Confident86.9Confident76 Ų7699.8 Ų99.847%0.46651%0.509SS..Hα-helixtrans-71-40.417755.90000111.8G949 E950 A956 Q957G949-T953 PolarHBondContact O-N 2.81Å; G949-T953 PolarHBondContact O-OG1 3.38Å; E950-T953 WeakPolarHBondContact CA-OG1 3.47Å; E950-T953 PolarHBondContact O-N 2.86Å; E950-T953 PolarHBondContact O-OG1 2.99Å; E950-T953 VanDerWaalsContact O-OG1 3.06Å; T953-A956 PolarHBondContact O-N 2.92Å; T953-Q957 WeakPolarHBondContact O-CG 3.23Å; T953-Q957 PolarHBondContact O-N 3.44Å
954T87.7Confident87.6Confident60 Ų6099.7 Ų99.737%0.36851%0.506SS..Hα-helixtrans-66.1-40.2173.750.60000112.3E950 L951 A956 Q957 I958E950-T954 WeakPolarHBondContact O-CB 3.44Å; E950-T954 WeakPolarHBondContact O-CG2 3.27Å; E950-T954 PolarHBondContact O-N 3.01Å; E950-T954 PolarHBondContact O-OG1 3.34Å; L951-T954 WeakPolarHBondContact CA-OG1 3.35Å; L951-T954 PolarHBondContact O-OG1 2.94Å; T954-A956 VanDerWaalsContact C-N 3.35Å; T954-A956 PolarHBondContact O-N 3.36Å; T954-Q957 PolarHBondContact O-N 3.07Å; T954-I958 VanDerWaalsContact O-CG1 3.32Å; T954-I958 WeakPolarHBondContact O-CG1 3.5Å; T954-I958 PolarHBondContact O-N 3.34Å
955R87.8Confident88.1Confident169 Ų169100.9 Ų100.964%0.63851%0.509SS*.Hα-helixtrans-61.2-40.2170.4-81.2-179.2173.6-171.7-1.5112.8L951 I958 N959L951-R955 VanDerWaalsContact O-CB 3.3Å; L951-R955 WeakPolarHBondContact O-CB 3.25Å; L951-R955 VanDerWaalsContact O-CG 3.28Å; L951-R955 WeakPolarHBondContact O-CG 3.43Å; L951-R955 PolarHBondContact O-N 3.23Å; R955-I958 PolarHBondContact O-N 3.04Å; R955-N959 PolarHBondContact O-N 2.86Å
956A88.3Confident88.5Confident48 Ų4898 Ų9840%0.39750%0.504SS..Hα-helixtrans-63.6-43.117500000111.7T952 T953 T954 N959 I960T952-A956 WeakPolarHBondContact O-CB 3.42Å; T952-A956 PolarHBondContact O-N 2.69Å; T953-A956 PolarHBondContact O-N 2.92Å; T954-A956 VanDerWaalsContact C-N 3.35Å; T954-A956 PolarHBondContact O-N 3.36Å; A956-N959 PolarHBondContact O-N 3.42Å; A956-I960 WeakPolarHBondContact O-CD1 3.43Å; A956-I960 VanDerWaalsContact O-CG1 3.25Å; A956-I960 WeakPolarHBondContact O-CG1 3.45Å; A956-I960 PolarHBondContact O-N 3.23Å
957Q88.7Confident88.8Confident120 Ų12097.6 Ų97.656%0.56150%0.503SS*.Hα-helixtrans-63.1-42175.2-72.5171.4-2.300112.4T953 T954 I960 L961T953-Q957 WeakPolarHBondContact O-CG 3.23Å; T953-Q957 PolarHBondContact O-N 3.44Å; T954-Q957 PolarHBondContact O-N 3.07Å; Q957-I960 PolarHBondContact O-N 3.46Å; Q957-L961 WeakPolarHBondContact O-CG 3.41Å; Q957-L961 PolarHBondContact O-N 2.83Å
958I91.7Very high88.9Confident94 Ų9497.9 Ų97.948%0.48250%0.501SS..Hα-helixtrans-63.6-45175.6-69.7166.3000110.8T954 R955 I960 L961 Q962T954-I958 VanDerWaalsContact O-CG1 3.32Å; T954-I958 WeakPolarHBondContact O-CG1 3.5Å; T954-I958 PolarHBondContact O-N 3.34Å; R955-I958 PolarHBondContact O-N 3.04Å; I958-I960 VanDerWaalsContact C-N 3.32Å; I958-I960 PolarHBondContact O-N 3.44Å; I958-L961 PolarHBondContact O-N 3Å; I958-L961 VanDerWaalsContact O-N 3.14Å; I958-Q962 HydrophobicContact CG2-CG 4.34Å; I958-Q962 WeakPolarHBondContact O-CG 3.25Å; I958-Q962 PolarHBondContact O-N 2.91Å
959N90Very high88.9Confident96 Ų9695.1 Ų95.151%0.51349%0.493SS..Hα-helixtrans-60.1-39.7173.9-98.4-10.6000112.3R955 A956 L961 N963R955-N959 PolarHBondContact O-N 2.86Å; A956-N959 PolarHBondContact O-N 3.42Å; N959-L961 VanDerWaalsContact C-N 3.34Å; N959-N963 VanDerWaalsContact O-CB 3.29Å; N959-N963 WeakPolarHBondContact O-CB 3.37Å; N959-N963 VanDerWaalsContact O-CG 3.31Å; N959-N963 PolarHBondContact O-N 2.83Å; N959-N963 PolarHBondContact O-ND2 3.4Å
960I90.2Very high88.8Confident94 Ų9499 Ų9948%0.48250%0.501SS..Hα-helixtrans-64.7-39.2175.5-70.4163.1000110.9A956 Q957 I958 K964A956-I960 WeakPolarHBondContact O-CD1 3.43Å; A956-I960 VanDerWaalsContact O-CG1 3.25Å; A956-I960 WeakPolarHBondContact O-CG1 3.45Å; A956-I960 PolarHBondContact O-N 3.23Å; Q957-I960 PolarHBondContact O-N 3.46Å; I958-I960 VanDerWaalsContact C-N 3.32Å; I958-I960 PolarHBondContact O-N 3.44Å; I960-K964 HydrophobicContact CG2-CD 4.46Å; I960-K964 WeakPolarHBondContact O-CB 3.32Å; I960-K964 VanDerWaalsContact O-CG 3.29Å; I960-K964 WeakPolarHBondContact O-CG 3.39Å; I960-K964 PolarHBondContact O-N 2.94Å
961L90Very high88.8Confident112 Ų112100.7 Ų100.759%0.58651%0.507SS*.Hα-helixtrans-71.6-40.9177.1-71.7170.8000112.5Q957 I958 N959 K964 L965Q957-L961 WeakPolarHBondContact O-CG 3.41Å; Q957-L961 PolarHBondContact O-N 2.83Å; I958-L961 PolarHBondContact O-N 3Å; I958-L961 VanDerWaalsContact O-N 3.14Å; N959-L961 VanDerWaalsContact C-N 3.34Å; L961-K964 PolarHBondContact O-N 3.47Å; L961-L965 PolarHBondContact O-N 3.4Å
962Q89.1Confident88.6Confident107 Ų107103.8 Ų103.850%0.551%0.512SS..Hα-helixtrans-64.6-44.8174.8-71.2-176-74.300111.5I958 K964 L965 I966I958-Q962 HydrophobicContact CG2-CG 4.34Å; I958-Q962 WeakPolarHBondContact O-CG 3.25Å; I958-Q962 PolarHBondContact O-N 2.91Å; Q962-K964 VanDerWaalsContact C-N 3.29Å; Q962-K964 PolarHBondContact O-N 2.9Å; Q962-L965 PolarHBondContact O-N 3Å; Q962-I966 WeakPolarHBondContact O-CB 3.29Å; Q962-I966 VanDerWaalsContact O-CG1 3.29Å; Q962-I966 WeakPolarHBondContact O-CG1 3.4Å; Q962-I966 PolarHBondContact O-N 3.5Å
963N88.4Confident88.6Confident93 Ų93103.6 Ų103.650%0.49751%0.511SS..Hα-helixtrans-64.9-32174.8-74.8-24.3000112.5N959 N967N959-N963 VanDerWaalsContact O-CB 3.29Å; N959-N963 WeakPolarHBondContact O-CB 3.37Å; N959-N963 VanDerWaalsContact O-CG 3.31Å; N959-N963 PolarHBondContact O-N 2.83Å; N959-N963 PolarHBondContact O-ND2 3.4Å; N963-N967 VanDerWaalsContact O-CB 3.28Å; N963-N967 WeakPolarHBondContact O-CB 3.35Å; N963-N967 PolarHBondContact O-N 3.22Å; N963-N967 VanDerWaalsContact O-N 3.12Å; N963-N967 PolarHBondContact O-ND2 3.38Å
964K90.5Very high88.5Confident129 Ų129105.1 Ų105.156%0.56151%0.512SS*.Hα-helixtrans-65-50.3170.4-82.5179.6176.1-1700111.5I960 L961 Q962 I966 N967 E968I960-K964 HydrophobicContact CG2-CD 4.46Å; I960-K964 WeakPolarHBondContact O-CB 3.32Å; I960-K964 VanDerWaalsContact O-CG 3.29Å; I960-K964 WeakPolarHBondContact O-CG 3.39Å; I960-K964 PolarHBondContact O-N 2.94Å; L961-K964 PolarHBondContact O-N 3.47Å; Q962-K964 VanDerWaalsContact C-N 3.29Å; Q962-K964 PolarHBondContact O-N 2.9Å; K964-I966 PolarHBondContact O-N 3.41Å; K964-N967 CarbonylContact O-C 3.6Å; K964-N967 PolarHBondContact O-N 2.82Å; K964-N967 VanDerWaalsContact O-N 3.15Å; K964-E968 WeakPolarHBondContact O-CB 3.44Å; K964-E968 PolarHBondContact O-N 2.87Å
965L89.2Confident88.3Confident109 Ų109104.9 Ų104.957%0.57152%0.517SS*.Hα-helixtrans-59.3-47.1-179.3-14682.6000111.5L961 Q962 N967 E968 D969L961-L965 PolarHBondContact O-N 3.4Å; Q962-L965 PolarHBondContact O-N 3Å; L965-N967 VanDerWaalsContact C-N 3.3Å; L965-N967 PolarHBondContact O-N 2.92Å; L965-E968 WeakPolarHBondContact O-CA 3.4Å; L965-E968 WeakPolarHBondContact O-CB 3.09Å; L965-E968 PolarHBondContact O-N 3.23Å; L965-D969 PolarHBondContact O-N 2.94Å
966I90Very high88.2Confident88 Ų88102.5 Ų102.545%0.45152%0.517SS..Hα-helixtrans-61.1-38177.2-68164.8000111.6Q962 K964 E968 K970Q962-I966 WeakPolarHBondContact O-CB 3.29Å; Q962-I966 VanDerWaalsContact O-CG1 3.29Å; Q962-I966 WeakPolarHBondContact O-CG1 3.4Å; Q962-I966 PolarHBondContact O-N 3.5Å; K964-I966 PolarHBondContact O-N 3.41Å; I966-E968 VanDerWaalsContact C-N 3.31Å; I966-K970 WeakPolarHBondContact O-CB 3.17Å; I966-K970 VanDerWaalsContact O-CG 3.3Å; I966-K970 WeakPolarHBondContact O-CG 3.39Å; I966-K970 PolarHBondContact O-N 2.94Å
967N89.4Confident88Confident90 Ų90105.9 Ų105.948%0.48152%0.524SS..Hα-helixtrans-75.8-17.5175.2-72.2-15.9000113.3N963 K964 L965 K971N963-N967 VanDerWaalsContact O-CB 3.28Å; N963-N967 WeakPolarHBondContact O-CB 3.35Å; N963-N967 PolarHBondContact O-N 3.22Å; N963-N967 VanDerWaalsContact O-N 3.12Å; N963-N967 PolarHBondContact O-ND2 3.38Å; K964-N967 CarbonylContact O-C 3.6Å; K964-N967 PolarHBondContact O-N 2.82Å; K964-N967 VanDerWaalsContact O-N 3.15Å; L965-N967 VanDerWaalsContact C-N 3.3Å; L965-N967 PolarHBondContact O-N 2.92Å; N967-K971 WeakPolarHBondContact O-CD 3.39Å; N967-K971 VanDerWaalsContact O-CG 3.24Å; N967-K971 WeakPolarHBondContact O-CG 3.37Å; N967-K971 PolarHBondContact O-N 2.88Å
968E89Confident87.8Confident111 Ų111105.9 Ų105.952%0.51953%0.528SS..Hα-helixtrans-87.2-38.8176.6-152.4168.6173.900110.9K964 L965 I966 K971 R972K964-E968 WeakPolarHBondContact O-CB 3.44Å; K964-E968 PolarHBondContact O-N 2.87Å; L965-E968 WeakPolarHBondContact O-CA 3.4Å; L965-E968 WeakPolarHBondContact O-CB 3.09Å; L965-E968 PolarHBondContact O-N 3.23Å; I966-E968 VanDerWaalsContact C-N 3.31Å; E968-K971 PolarHBondContact O-N 3.31Å; E968-R972 WeakPolarHBondContact O-CG 3.32Å; E968-R972 PolarHBondContact O-N 2.9Å
969D85.8Confident87.5Confident87 Ų87103.3 Ų103.347%0.46552%0.524SS..Hα-helixtrans-66.3-42.1170.8-72.8-30.1000111.8L965 K971 R972 V973L965-D969 PolarHBondContact O-N 2.94Å; D969-K971 VanDerWaalsContact C-N 3.33Å; D969-K971 PolarHBondContact O-N 2.92Å; D969-R972 WeakPolarHBondContact O-CB 3.43Å; D969-R972 PolarHBondContact O-N 2.95Å; D969-V973 PolarHBondContact O-N 3.01Å; D969-V973 VanDerWaalsContact O-N 3.16Å
970K87.1Confident87.3Confident113 Ų113104 Ų10449%0.49153%0.528SS..Hα-helixtrans-55.6-46.8171.9-83-178.9175.3-172.40112.3I966 R972 V973 E974I966-K970 WeakPolarHBondContact O-CB 3.17Å; I966-K970 VanDerWaalsContact O-CG 3.3Å; I966-K970 WeakPolarHBondContact O-CG 3.39Å; I966-K970 PolarHBondContact O-N 2.94Å; K970-R972 PolarHBondContact O-N 3.33Å; K970-V973 PolarHBondContact O-N 3.32Å; K970-V973 VanDerWaalsContact O-N 3.15Å; K970-E974 WeakPolarHBondContact O-CB 3.35Å; K970-E974 VanDerWaalsContact O-CG 3.24Å; K970-E974 WeakPolarHBondContact O-CG 3.43Å; K970-E974 PolarHBondContact O-N 3.49Å
971K88.1Confident87Confident142 Ų142104.5 Ų104.562%0.61753%0.531SS*.Hα-helixtrans-63.3-19.6177.3-79.2177.6177.1-167.10114.5N967 E968 D969 A975N967-K971 WeakPolarHBondContact O-CD 3.39Å; N967-K971 VanDerWaalsContact O-CG 3.24Å; N967-K971 WeakPolarHBondContact O-CG 3.37Å; N967-K971 PolarHBondContact O-N 2.88Å; E968-K971 PolarHBondContact O-N 3.31Å; D969-K971 VanDerWaalsContact C-N 3.33Å; D969-K971 PolarHBondContact O-N 2.92Å; K971-A975 VanDerWaalsContact O-CB 3.24Å; K971-A975 WeakPolarHBondContact O-CB 3.38Å; K971-A975 PolarHBondContact O-N 3.48Å
972R84.6Confident86.7Confident158 Ų158107 Ų10760%0.59653%0.534SS*.Hα-helixtrans-78.4-49171.6-68.5173.1-178.6-143.30.3110.5E968 D969 K970 E974 A975 D976E968-R972 WeakPolarHBondContact O-CG 3.32Å; E968-R972 PolarHBondContact O-N 2.9Å; D969-R972 WeakPolarHBondContact O-CB 3.43Å; D969-R972 PolarHBondContact O-N 2.95Å; K970-R972 PolarHBondContact O-N 3.33Å; R972-E974 PolarHBondContact O-N 3.4Å; R972-A975 PolarHBondContact O-N 3.42Å; R972-D976 PolarHBondContact O-N 2.8Å
973V86.7Confident86.6Confident79 Ų79107.5 Ų107.548%0.47953%0.534SS..Hα-helixtrans-58.5-47.8175-179.90000110.9D969 K970 A975 D976 E977D969-V973 PolarHBondContact O-N 3.01Å; D969-V973 VanDerWaalsContact O-N 3.16Å; K970-V973 PolarHBondContact O-N 3.32Å; K970-V973 VanDerWaalsContact O-N 3.15Å; V973-A975 PolarHBondContact O-N 3.03Å; V973-D976 PolarHBondContact O-N 3.29Å; V973-E977 HydrophobicContact CG1-CG 4.34Å; V973-E977 WeakPolarHBondContact CG1-OE1 3.39Å; V973-E977 WeakPolarHBondContact O-CB 3.36Å; V973-E977 WeakPolarHBondContact O-CG 3.42Å; V973-E977 PolarHBondContact O-N 3Å
974E85.3Confident86.4Confident108 Ų108109.5 Ų109.551%0.50554%0.538SS..Hα-helixtrans-58.4-30.2175-70.1161.7-166.900112.6K970 R972 L978K970-E974 WeakPolarHBondContact O-CB 3.35Å; K970-E974 VanDerWaalsContact O-CG 3.24Å; K970-E974 WeakPolarHBondContact O-CG 3.43Å; K970-E974 PolarHBondContact O-N 3.49Å; R972-E974 PolarHBondContact O-N 3.4Å; E974-L978 WeakPolarHBondContact O-CB 3.5Å; E974-L978 PolarHBondContact O-N 2.84Å
975A84.6Confident86.1Confident56 Ų56105.9 Ų105.946%0.46353%0.532SS..Hα-helixtrans-84.2-36.117800000113.2K971 R972 V973 L978 G979K971-A975 VanDerWaalsContact O-CB 3.24Å; K971-A975 WeakPolarHBondContact O-CB 3.38Å; K971-A975 PolarHBondContact O-N 3.48Å; R972-A975 PolarHBondContact O-N 3.42Å; V973-A975 PolarHBondContact O-N 3.03Å; A975-L978 PolarHBondContact O-N 3.01Å; A975-G979 PolarHBondContact O-N 3.41Å
976D85.2Confident85.7Confident119 Ų119104.9 Ų104.964%0.63653%0.526SS*.Hα-helixtrans-68.3-42.7174.9-67.7-28.8000110.3R972 V973 L978 G979 D980R972-D976 PolarHBondContact O-N 2.8Å; V973-D976 PolarHBondContact O-N 3.29Å; D976-L978 VanDerWaalsContact C-N 3.34Å; D976-L978 PolarHBondContact O-N 3.27Å; D976-G979 WeakPolarHBondContact O-CA 3.26Å; D976-G979 PolarHBondContact O-N 3.12Å; D976-G979 VanDerWaalsContact O-N 3.08Å; D976-D980 PolarHBondContact O-N 2.88Å; D976-D980 VanDerWaalsContact O-N 3.09Å
977E84.5Confident85.4Confident118 Ų118105 Ų10555%0.55153%0.525SS*.Hα-helixtrans-60.3-41.1172.1-72.8174.217400111.8V973 G979 D980 L981V973-E977 HydrophobicContact CG1-CG 4.34Å; V973-E977 WeakPolarHBondContact CG1-OE1 3.39Å; V973-E977 WeakPolarHBondContact O-CB 3.36Å; V973-E977 WeakPolarHBondContact O-CG 3.42Å; V973-E977 PolarHBondContact O-N 3Å; E977-G979 VanDerWaalsContact C-N 3.27Å; E977-G979 PolarHBondContact O-N 3.28Å; E977-D980 PolarHBondContact O-N 3.2Å; E977-L981 WeakPolarHBondContact O-CB 3.36Å; E977-L981 WeakPolarHBondContact O-CG 3.37Å; E977-L981 PolarHBondContact O-N 2.89Å
978L84.9Confident85Confident121 Ų121106.9 Ų106.963%0.63453%0.531SS*.Hα-helixtrans-64.4-31.7174-159.377.1000112.3E974 A975 D976 Y982E974-L978 WeakPolarHBondContact O-CB 3.5Å; E974-L978 PolarHBondContact O-N 2.84Å; A975-L978 PolarHBondContact O-N 3.01Å; D976-L978 VanDerWaalsContact C-N 3.34Å; D976-L978 PolarHBondContact O-N 3.27Å; L978-Y982 WeakPolarHBondContact O-CB 3.34Å; L978-Y982 PolarHBondContact O-N 3.05Å
979G84.6Confident84.6Confident39 Ų39104.1 Ų104.140%0.40253%0.527SS..Hα-helixtrans-66.9-47.6175.300000113A975 D976 E977 Y982 K983A975-G979 PolarHBondContact O-N 3.41Å; D976-G979 WeakPolarHBondContact O-CA 3.26Å; D976-G979 PolarHBondContact O-N 3.12Å; D976-G979 VanDerWaalsContact O-N 3.08Å; E977-G979 VanDerWaalsContact C-N 3.27Å; E977-G979 PolarHBondContact O-N 3.28Å; G979-Y982 PolarHBondContact O-N 3.33Å; G979-K983 PolarHBondContact O-N 3.47Å
980D85.4Confident84.5Confident111 Ų111106.2 Ų106.259%0.59453%0.534SS*.Hα-helixtrans-67.9-34.8176.3-89.6-13.5000112.2D976 E977 K983 K984D976-D980 PolarHBondContact O-N 2.88Å; D976-D980 VanDerWaalsContact O-N 3.09Å; E977-D980 PolarHBondContact O-N 3.2Å; D980-K983 PolarHBondContact O-N 2.84Å; D980-K984 PolarHBondContact O-N 3.36Å
981L84Confident84.2Confident105 Ų105106 Ų10655%0.5554%0.538SS..Hα-helixtrans-63.7-44.2170.6-75170.4000111.8E977 K983 K984 A985E977-L981 WeakPolarHBondContact O-CB 3.36Å; E977-L981 WeakPolarHBondContact O-CG 3.37Å; E977-L981 PolarHBondContact O-N 2.89Å; L981-K983 VanDerWaalsContact C-N 3.29Å; L981-K983 PolarHBondContact O-N 3.24Å; L981-K984 PolarHBondContact O-N 3.4Å; L981-A985 WeakPolarHBondContact O-CB 3.33Å; L981-A985 PolarHBondContact O-N 2.87Å
982Y84.2Confident83.8Confident165 Ų165103.7 Ų103.765%0.64753%0.532SS*.Hα-helixtrans-62.4-37.1175.6-169.4-85000111.9L978 G979 A985 M986L978-Y982 WeakPolarHBondContact O-CB 3.34Å; L978-Y982 PolarHBondContact O-N 3.05Å; G979-Y982 PolarHBondContact O-N 3.33Å; Y982-A985 PolarHBondContact O-N 2.89Å; Y982-M986 HydrophobicContact CD1-CG 4.04Å; Y982-M986 HydrophobicContact CE1-CG 3.72Å; Y982-M986 HydrophobicContact CE1-SD 4.21Å; Y982-M986 WeakPolarHBondContact O-CG 3.43Å; Y982-M986 PolarHBondContact O-N 3.45Å
983K86.2Confident83.7Confident117 Ų117102.8 Ų102.851%0.50954%0.535SS..Hα-helixtrans-66.4-43.3175.7-172.6173.6179.7-75.60112.4G979 D980 L981 A985 M986 E987G979-K983 PolarHBondContact O-N 3.47Å; D980-K983 PolarHBondContact O-N 2.84Å; L981-K983 VanDerWaalsContact C-N 3.29Å; L981-K983 PolarHBondContact O-N 3.24Å; K983-A985 VanDerWaalsContact C-N 3.34Å; K983-M986 WeakPolarHBondContact O-CB 2.82Å; K983-M986 PolarHBondContact O-N 3.3Å; K983-E987 IonicContact NZ-OE1 3.91Å; K983-E987 PolarHBondContact NZ-OE1 2.76Å; K983-E987 PolarHBondContact O-N 3.36Å
984K85.3Confident83.5Confident134 Ų134105.4 Ų105.458%0.58354%0.542SS*.Hα-helixtrans-63.9-38173.2-74.1177.2179.4173.80112.4D980 L981 M986 E987 Q988D980-K984 PolarHBondContact O-N 3.36Å; L981-K984 PolarHBondContact O-N 3.4Å; K984-M986 VanDerWaalsContact C-N 3.34Å; K984-E987 PolarHBondContact O-N 3.32Å; K984-Q988 WeakPolarHBondContact O-CB 3.48Å; K984-Q988 WeakPolarHBondContact O-CG 3.38Å; K984-Q988 PolarHBondContact O-N 3.44Å
985A83.4Confident83Confident53 Ų53106.4 Ų106.444%0.43855%0.546SS..Hα-helixtrans-65.9-34.8175.500000112.5L981 Y982 K983 A989L981-A985 WeakPolarHBondContact O-CB 3.33Å; L981-A985 PolarHBondContact O-N 2.87Å; Y982-A985 PolarHBondContact O-N 2.89Å; K983-A985 VanDerWaalsContact C-N 3.34Å; A985-A989 VanDerWaalsContact O-CB 3.25Å; A985-A989 WeakPolarHBondContact O-CB 3.36Å; A985-A989 PolarHBondContact O-N 3.37Å
986M82.5Confident82.8Confident88 Ų88106.9 Ų106.943%0.43354%0.541SS..Hα-helixtrans-64.3-48.4170.1-79.8-78.5-57.200111.9Y982 K983 K984 Q988 A989 E990Y982-M986 HydrophobicContact CD1-CG 4.04Å; Y982-M986 HydrophobicContact CE1-CG 3.72Å; Y982-M986 HydrophobicContact CE1-SD 4.21Å; Y982-M986 WeakPolarHBondContact O-CG 3.43Å; Y982-M986 PolarHBondContact O-N 3.45Å; K983-M986 WeakPolarHBondContact O-CB 2.82Å; K983-M986 PolarHBondContact O-N 3.3Å; K984-M986 VanDerWaalsContact C-N 3.34Å; M986-Q988 PolarHBondContact O-N 2.83Å; M986-A989 WeakPolarHBondContact O-CB 3.45Å; M986-A989 PolarHBondContact O-N 3.22Å; M986-A989 VanDerWaalsContact O-N 3.12Å; M986-E990 PolarHBondContact O-N 3.38Å
987E82.6Confident82.6Confident92 Ų92104.6 Ų104.643%0.4353%0.534SS..Hα-helixtrans-61-44.9178.6-72167-174.800111K983 K984 A989 E990 D991K983-E987 IonicContact NZ-OE1 3.91Å; K983-E987 PolarHBondContact NZ-OE1 2.76Å; K983-E987 PolarHBondContact O-N 3.36Å; K984-E987 PolarHBondContact O-N 3.32Å; E987-A989 VanDerWaalsContact C-N 3.33Å; E987-A989 PolarHBondContact O-N 3.32Å; E987-E990 PolarHBondContact O-N 2.75Å; E987-D991 PolarHBondContact O-N 3.01Å; E987-D991 VanDerWaalsContact O-N 3.14Å
988Q82.1Confident82.3Confident129 Ų129103.3 Ų103.360%0.60353%0.53SS*.Hα-helixtrans-64.1-32.8172.7-73.8-175.1-40.900113.6K984 M986 L992K984-Q988 WeakPolarHBondContact O-CB 3.48Å; K984-Q988 WeakPolarHBondContact O-CG 3.38Å; K984-Q988 PolarHBondContact O-N 3.44Å; M986-Q988 PolarHBondContact O-N 2.83Å; Q988-L992 VanDerWaalsContact O-CB 3.27Å; Q988-L992 WeakPolarHBondContact O-CB 3.37Å; Q988-L992 WeakPolarHBondContact O-CD1 3.29Å; Q988-L992 WeakPolarHBondContact O-CG 3.48Å; Q988-L992 PolarHBondContact O-N 3.25Å
989A80.6Confident82Confident53 Ų5399.6 Ų99.644%0.43851%0.514SS..Hα-helixtrans-69.8-32.7176.600000112.4A985 M986 E987 Q993A985-A989 VanDerWaalsContact O-CB 3.25Å; A985-A989 WeakPolarHBondContact O-CB 3.36Å; A985-A989 PolarHBondContact O-N 3.37Å; M986-A989 WeakPolarHBondContact O-CB 3.45Å; M986-A989 PolarHBondContact O-N 3.22Å; M986-A989 VanDerWaalsContact O-N 3.12Å; E987-A989 VanDerWaalsContact C-N 3.33Å; E987-A989 PolarHBondContact O-N 3.32Å; A989-Q993 VanDerWaalsContact O-CB 3.25Å; A989-Q993 WeakPolarHBondContact O-CB 3.42Å; A989-Q993 PolarHBondContact O-N 3.22Å
990E81.9Confident81.8Confident130 Ų130103.9 Ų103.961%0.60752%0.521SS*.Hα-helixtrans-70.1-45173.5-69.8-173.5-179.500111.5M986 E987 Q993 Q994M986-E990 PolarHBondContact O-N 3.38Å; E987-E990 PolarHBondContact O-N 2.75Å; E990-Q993 PolarHBondContact O-N 2.91Å; E990-Q994 PolarHBondContact O-N 3.43Å
991D80.8Confident81.5Confident108 Ų108100.9 Ų100.958%0.57851%0.512SS*.Hα-helixtrans-59.7-49.7174.1-78-25.8000111.6E987 Q993 Q994 E995E987-D991 PolarHBondContact O-N 3.01Å; E987-D991 VanDerWaalsContact O-N 3.14Å; D991-Q993 PolarHBondContact O-N 3.27Å; D991-Q994 WeakPolarHBondContact O-CA 3.38Å; D991-Q994 WeakPolarHBondContact O-CB 3.45Å; D991-Q994 PolarHBondContact O-N 2.93Å; D991-E995 PolarHBondContact O-N 2.84Å
992L80.1Confident81.1Confident95 Ų95101.8 Ų101.850%0.49751%0.513SS..Hα-helixtrans-61.3-31.5176.3-74.8169.2000112.5Q988 L996Q988-L992 VanDerWaalsContact O-CB 3.27Å; Q988-L992 WeakPolarHBondContact O-CB 3.37Å; Q988-L992 WeakPolarHBondContact O-CD1 3.29Å; Q988-L992 WeakPolarHBondContact O-CG 3.48Å; Q988-L992 PolarHBondContact O-N 3.25Å; L992-L996 VanDerWaalsContact O-CB 3.23Å; L992-L996 WeakPolarHBondContact O-CB 3.49Å; L992-L996 WeakPolarHBondContact O-CG 3.33Å; L992-L996 PolarHBondContact O-N 3.13Å
993Q82.6Confident80.9Confident139 Ų13996.6 Ų96.665%0.6550%0.499SS*.Hα-helixtrans-71.8-30.9174.4-171.4170.5-86.400112.1A989 E990 D991 S997A989-Q993 VanDerWaalsContact O-CB 3.25Å; A989-Q993 WeakPolarHBondContact O-CB 3.42Å; A989-Q993 PolarHBondContact O-N 3.22Å; E990-Q993 PolarHBondContact O-N 2.91Å; D991-Q993 PolarHBondContact O-N 3.27Å; Q993-S997 PolarHBondContact O-N 3.32Å; Q993-S997 PolarHBondContact O-OG 3.48Å
994Q82.2Confident80.9Confident134 Ų13497.6 Ų97.663%0.62650%0.503SS*.Hα-helixtrans-72.9-43.6172.2-170.1166.9-57.800111.6E990 D991 S997 I998E990-Q994 PolarHBondContact O-N 3.43Å; D991-Q994 WeakPolarHBondContact O-CA 3.38Å; D991-Q994 WeakPolarHBondContact O-CB 3.45Å; D991-Q994 PolarHBondContact O-N 2.93Å; Q994-S997 WeakPolarHBondContact O-CA 3.32Å; Q994-S997 WeakPolarHBondContact O-CB 3.46Å; Q994-S997 PolarHBondContact O-N 3.01Å; Q994-I998 PolarHBondContact O-N 3.08Å; Q994-I998 VanDerWaalsContact O-N 3.08Å
995E75.5Confident80.8Confident128 Ų12896 Ų9660%0.59850%0.5SS*.Hα-helixtrans-61.7-44.1173.2-69.3-168.1149.300112D991 S997 I998 S999D991-E995 PolarHBondContact O-N 2.84Å; E995-S997 PolarHBondContact O-N 3.19Å; E995-S997 VanDerWaalsContact O-N 3.13Å; E995-I998 PolarHBondContact O-N 3.33Å; E995-I998 VanDerWaalsContact O-N 3.09Å; E995-S999 WeakPolarHBondContact O-CB 3.3Å; E995-S999 PolarHBondContact O-N 3.24Å
996L79.7Confident80.7Confident67 Ų6795.7 Ų95.735%0.35150%0.498SS..Hα-helixtrans-57.8-25.4171.3-90165.2000113.1L992 K1000L992-L996 VanDerWaalsContact O-CB 3.23Å; L992-L996 WeakPolarHBondContact O-CB 3.49Å; L992-L996 WeakPolarHBondContact O-CG 3.33Å; L992-L996 PolarHBondContact O-N 3.13Å; L996-K1000 VanDerWaalsContact O-CB 3.32Å; L996-K1000 WeakPolarHBondContact O-CB 3.5Å; L996-K1000 WeakPolarHBondContact O-CD 3.42Å; L996-K1000 WeakPolarHBondContact O-CG 3.22Å; L996-K1000 PolarHBondContact O-N 2.89Å
997S81Confident80.8Confident70 Ų7098 Ų9849%0.4951%0.507SS..Hα-helixtrans-82-33.7177.4-59.90000112.1Q993 Q994 E995 A1001Q993-S997 PolarHBondContact O-N 3.32Å; Q993-S997 PolarHBondContact O-OG 3.48Å; Q994-S997 WeakPolarHBondContact O-CA 3.32Å; Q994-S997 WeakPolarHBondContact O-CB 3.46Å; Q994-S997 PolarHBondContact O-N 3.01Å; E995-S997 PolarHBondContact O-N 3.19Å; E995-S997 VanDerWaalsContact O-N 3.13Å; S997-A1001 PolarHBondContact O-N 3.27Å
998I79.3Confident81Confident92 Ų9298.6 Ų98.647%0.47251%0.51SS..Hα-helixtrans-71.2-51.1172.8-64169.4000110Q994 E995 K1000 A1001 E1002Q994-I998 PolarHBondContact O-N 3.08Å; Q994-I998 VanDerWaalsContact O-N 3.08Å; E995-I998 PolarHBondContact O-N 3.33Å; E995-I998 VanDerWaalsContact O-N 3.09Å; I998-K1000 VanDerWaalsContact C-N 3.28Å; I998-K1000 PolarHBondContact O-N 3.34Å; I998-A1001 WeakPolarHBondContact O-CA 3.46Å; I998-A1001 WeakPolarHBondContact O-CB 3.44Å; I998-A1001 PolarHBondContact O-N 3.15Å; I998-E1002 HydrophobicContact CG2-CG 4.4Å; I998-E1002 PolarHBondContact O-N 2.89Å
999S77.9Confident81Confident42 Ų4296.8 Ų96.829%0.29451%0.505SS..Hα-helixtrans-56-38.7176.2168.20000112.4E995 A1001 E1002 T1003E995-S999 WeakPolarHBondContact O-CB 3.3Å; E995-S999 PolarHBondContact O-N 3.24Å; S999-A1001 VanDerWaalsContact C-N 3.3Å; S999-A1001 PolarHBondContact O-N 2.83Å; S999-E1002 PolarHBondContact O-N 3.24Å; S999-T1003 WeakPolarHBondContact O-CB 3.44Å; S999-T1003 WeakPolarHBondContact O-CG2 3.25Å; S999-T1003 PolarHBondContact O-N 3.39Å; S999-T1003 PolarHBondContact O-OG1 3.47Å
1000K81.4Confident81.2Confident129 Ų12999.7 Ų99.756%0.56151%0.512SS*.Hα-helixtrans-64.1-29.6172.5-79.8167.9-165.9162.80113.9L996 I998 T1003 K1004L996-K1000 VanDerWaalsContact O-CB 3.32Å; L996-K1000 WeakPolarHBondContact O-CB 3.5Å; L996-K1000 WeakPolarHBondContact O-CD 3.42Å; L996-K1000 WeakPolarHBondContact O-CG 3.22Å; L996-K1000 PolarHBondContact O-N 2.89Å; I998-K1000 VanDerWaalsContact C-N 3.28Å; I998-K1000 PolarHBondContact O-N 3.34Å; K1000-T1003 WeakPolarHBondContact CA-OG1 3.36Å; K1000-T1003 PolarHBondContact O-OG1 3.04Å; K1000-K1004 WeakPolarHBondContact O-CB 3.43Å; K1000-K1004 PolarHBondContact O-N 2.93Å
1001A77.6Confident81.4Confident48 Ų48100 Ų10040%0.39751%0.512SS..Hα-helixtrans-76.4-43.2173.800000111.1S997 I998 S999 K1004 I1005S997-A1001 PolarHBondContact O-N 3.27Å; I998-A1001 WeakPolarHBondContact O-CA 3.46Å; I998-A1001 WeakPolarHBondContact O-CB 3.44Å; I998-A1001 PolarHBondContact O-N 3.15Å; S999-A1001 VanDerWaalsContact C-N 3.3Å; S999-A1001 PolarHBondContact O-N 2.83Å; A1001-K1004 PolarHBondContact O-N 3.44Å; A1001-I1005 WeakPolarHBondContact O-CG1 3.36Å; A1001-I1005 PolarHBondContact O-N 2.89Å
1002E76.8Confident81.7Confident124 Ų12499.8 Ų99.858%0.57951%0.508SS*.Hα-helixtrans-65.9-45.7178.9-67.1178.9146.900112.2I998 S999 K1004 I1005 A1006I998-E1002 HydrophobicContact CG2-CG 4.4Å; I998-E1002 PolarHBondContact O-N 2.89Å; S999-E1002 PolarHBondContact O-N 3.24Å; E1002-K1004 VanDerWaalsContact C-N 3.28Å; E1002-K1004 PolarHBondContact O-N 3.48Å; E1002-I1005 PolarHBondContact O-N 2.84Å; E1002-A1006 WeakPolarHBondContact O-CB 3.36Å; E1002-A1006 PolarHBondContact O-N 3.29Å
1003T80.5Confident81.9Confident57 Ų57104.5 Ų104.535%0.3552%0.519SS..Hα-helixtrans-61.2-35.3173.650.20000112.2S999 K1000 A1006 Q1007S999-T1003 WeakPolarHBondContact O-CB 3.44Å; S999-T1003 WeakPolarHBondContact O-CG2 3.25Å; S999-T1003 PolarHBondContact O-N 3.39Å; S999-T1003 PolarHBondContact O-OG1 3.47Å; K1000-T1003 WeakPolarHBondContact CA-OG1 3.36Å; K1000-T1003 PolarHBondContact O-OG1 3.04Å; T1003-A1006 PolarHBondContact O-N 2.81Å; T1003-Q1007 WeakPolarHBondContact O-CB 3.36Å; T1003-Q1007 WeakPolarHBondContact O-CG 3.34Å; T1003-Q1007 PolarHBondContact O-N 3.29Å
1004K86.1Confident82Confident137 Ų137102.6 Ų102.660%0.59651%0.513SS*.Hα-helixtrans-67.4-43.4173.7-172.2-174175.1-165.90111.9K1000 A1001 E1002 A1006 Q1007 E1008K1000-K1004 WeakPolarHBondContact O-CB 3.43Å; K1000-K1004 PolarHBondContact O-N 2.93Å; A1001-K1004 PolarHBondContact O-N 3.44Å; E1002-K1004 VanDerWaalsContact C-N 3.28Å; E1002-K1004 PolarHBondContact O-N 3.48Å; K1004-A1006 VanDerWaalsContact C-N 3.32Å; K1004-Q1007 PolarHBondContact O-N 3.32Å; K1004-E1008 WeakPolarHBondContact O-CB 3.49Å; K1004-E1008 PolarHBondContact O-N 2.95Å
1005I81.3Confident82.2Confident100 Ų100102.2 Ų102.251%0.51351%0.511SS..Hα-helixtrans-63.6-39.6175-68.7163.6000110.5A1001 E1002 E1008 N1009A1001-I1005 WeakPolarHBondContact O-CG1 3.36Å; A1001-I1005 PolarHBondContact O-N 2.89Å; E1002-I1005 PolarHBondContact O-N 2.84Å; I1005-E1008 PolarHBondContact O-N 3.47Å; I1005-N1009 WeakPolarHBondContact O-CB 3.4Å; I1005-N1009 VanDerWaalsContact O-CG 3.23Å; I1005-N1009 PolarHBondContact O-N 3.01Å; I1005-N1009 PolarHBondContact O-ND2 3.37Å
1006A82.4Confident82.7Confident47 Ų4799 Ų9939%0.38851%0.506SS..Hα-helixtrans-64.2-43.2174.800000112.2E1002 T1003 K1004 N1009 L1010E1002-A1006 WeakPolarHBondContact O-CB 3.36Å; E1002-A1006 PolarHBondContact O-N 3.29Å; T1003-A1006 PolarHBondContact O-N 2.81Å; K1004-A1006 VanDerWaalsContact C-N 3.32Å; A1006-N1009 PolarHBondContact O-N 2.84Å; A1006-L1010 WeakPolarHBondContact O-CB 3.28Å; A1006-L1010 VanDerWaalsContact O-CG 3.29Å; A1006-L1010 WeakPolarHBondContact O-CG 3.43Å; A1006-L1010 PolarHBondContact O-N 2.89Å
1007Q84.1Confident83.1Confident137 Ų137102.4 Ų102.464%0.6452%0.515SS*.Hα-helixtrans-63.3-40.7173.8-76.7177.7-3.700112.3T1003 K1004 L1010 F1011T1003-Q1007 WeakPolarHBondContact O-CB 3.36Å; T1003-Q1007 WeakPolarHBondContact O-CG 3.34Å; T1003-Q1007 PolarHBondContact O-N 3.29Å; K1004-Q1007 PolarHBondContact O-N 3.32Å; Q1007-L1010 PolarHBondContact O-N 2.9Å; Q1007-F1011 WeakPolarHBondContact O-CB 3.44Å; Q1007-F1011 PolarHBondContact O-N 2.87Å
1008E86.1Confident83.3Confident104 Ų104102.2 Ų102.249%0.48651%0.506SS..Hα-helixtrans-67-41.6177.4-167.4167.8166.400111.6K1004 I1005 F1011 Q1012K1004-E1008 WeakPolarHBondContact O-CB 3.49Å; K1004-E1008 PolarHBondContact O-N 2.95Å; I1005-E1008 PolarHBondContact O-N 3.47Å; E1008-F1011 PolarHBondContact O-N 3.21Å; E1008-Q1012 WeakPolarHBondContact O-CG 3.38Å; E1008-Q1012 PolarHBondContact O-N 2.85Å
1009N84.2Confident83.6Confident91 Ų91100.3 Ų100.349%0.48750%0.504SS..Hα-helixtrans-65.1-39.2173.3-73.3-28.1000112.6I1005 A1006 R1013I1005-N1009 WeakPolarHBondContact O-CB 3.4Å; I1005-N1009 VanDerWaalsContact O-CG 3.23Å; I1005-N1009 PolarHBondContact O-N 3.01Å; I1005-N1009 PolarHBondContact O-ND2 3.37Å; A1006-N1009 PolarHBondContact O-N 2.84Å; N1009-R1013 WeakPolarHBondContact O-CB 3.4Å; N1009-R1013 PolarHBondContact O-N 3.44Å
1010L83.8Confident84Confident115 Ų115103.8 Ų103.860%0.60252%0.515SS*.Hα-helixtrans-65-42.9174.1-77.4169.6000111.4A1006 Q1007 R1013 D1014A1006-L1010 WeakPolarHBondContact O-CB 3.28Å; A1006-L1010 VanDerWaalsContact O-CG 3.29Å; A1006-L1010 WeakPolarHBondContact O-CG 3.43Å; A1006-L1010 PolarHBondContact O-N 2.89Å; Q1007-L1010 PolarHBondContact O-N 2.9Å; L1010-R1013 PolarHBondContact O-N 2.66Å; L1010-D1014 WeakPolarHBondContact O-CB 3.37Å; L1010-D1014 PolarHBondContact O-N 2.88Å
1011F86.7Confident84.3Confident136 Ų136101.4 Ų101.460%0.59651%0.505SS*.Hα-helixtrans-63.3-42.5176.2-177.1-99.4000112.2Q1007 E1008 D1014 Q1015Q1007-F1011 WeakPolarHBondContact O-CB 3.44Å; Q1007-F1011 PolarHBondContact O-N 2.87Å; E1008-F1011 PolarHBondContact O-N 3.21Å; F1011-D1014 PolarHBondContact O-N 2.95Å; F1011-Q1015 WeakPolarHBondContact O-CB 3.22Å; F1011-Q1015 PolarHBondContact O-N 2.94Å
1012Q86.4Confident84.7Confident104 Ų104102.2 Ų102.249%0.48650%0.503SS..Hα-helixtrans-63.4-39.6173.2-71.4179.133.800112.1E1008 A1016E1008-Q1012 WeakPolarHBondContact O-CG 3.38Å; E1008-Q1012 PolarHBondContact O-N 2.85Å; Q1012-A1016 WeakPolarHBondContact O-CB 3.4Å; Q1012-A1016 PolarHBondContact O-N 3.36Å
1013R83.8Confident85.3Confident193 Ų193102.5 Ų102.573%0.72850%0.504SS*.Hα-helixtrans-68.7-40177.5-172.1178.6179.598.52.4112.5N1009 L1010 A1016 W1017N1009-R1013 WeakPolarHBondContact O-CB 3.4Å; N1009-R1013 PolarHBondContact O-N 3.44Å; L1010-R1013 PolarHBondContact O-N 2.66Å; R1013-A1016 PolarHBondContact O-N 2.82Å; R1013-W1017 WeakPolarHBondContact O-CB 3.31Å; R1013-W1017 PolarHBondContact O-N 2.79Å
1014D85.8Confident85.6Confident99 Ų99105.1 Ų105.153%0.52952%0.516SS..Hα-helixtrans-67.8-41.6176.6-168.449.8000111.1L1010 F1011 A1016 W1017 Q1018L1010-D1014 WeakPolarHBondContact O-CB 3.37Å; L1010-D1014 PolarHBondContact O-N 2.88Å; F1011-D1014 PolarHBondContact O-N 2.95Å; D1014-A1016 VanDerWaalsContact C-N 3.35Å; D1014-A1016 PolarHBondContact O-N 3.35Å; D1014-W1017 PolarHBondContact O-N 3.45Å; D1014-Q1018 WeakPolarHBondContact O-CB 3.4Å; D1014-Q1018 PolarHBondContact O-N 2.84Å
1015Q86.5Confident85.6Confident127 Ų127102 Ų10259%0.59351%0.505SS*.Hα-helixtrans-60.5-41.3171.3-178172.877.400112.3F1011 A1019F1011-Q1015 WeakPolarHBondContact O-CB 3.22Å; F1011-Q1015 PolarHBondContact O-N 2.94Å; Q1015-A1019 WeakPolarHBondContact O-CB 3.48Å; Q1015-A1019 PolarHBondContact O-N 3.14Å
1016A85.2Confident85.8Confident60 Ų60104.2 Ų104.250%0.49651%0.507SS..Hα-helixtrans-66.2-43.7175.700000112.3Q1012 R1013 D1014 A1019 E1020Q1012-A1016 WeakPolarHBondContact O-CB 3.4Å; Q1012-A1016 PolarHBondContact O-N 3.36Å; R1013-A1016 PolarHBondContact O-N 2.82Å; D1014-A1016 VanDerWaalsContact C-N 3.35Å; D1014-A1016 PolarHBondContact O-N 3.35Å; A1016-A1019 PolarHBondContact O-N 3.17Å; A1016-E1020 PolarHBondContact O-N 3.3Å
1017W88.2Confident86.1Confident139 Ų139104.3 Ų104.353%0.52751%0.508SS..Hα-helixtrans-65.7-41.7177.4179.974.4000112.4R1013 D1014 A1019 E1020 K1021R1013-W1017 WeakPolarHBondContact O-CB 3.31Å; R1013-W1017 PolarHBondContact O-N 2.79Å; D1014-W1017 PolarHBondContact O-N 3.45Å; W1017-A1019 VanDerWaalsContact C-N 3.32Å; W1017-A1019 PolarHBondContact O-N 3.01Å; W1017-E1020 PolarHBondContact O-N 2.86Å; W1017-K1021 HydrophobicContact CE3-CD 4.38Å; W1017-K1021 HydrophobicContact CH2-CD 3.67Å; W1017-K1021 HydrophobicContact CZ2-CD 4.06Å; W1017-K1021 HydrophobicContact CZ3-CD 3.83Å; W1017-K1021 VanDerWaalsContact O-CB 3.26Å; W1017-K1021 WeakPolarHBondContact O-CB 3.41Å; W1017-K1021 PolarHBondContact O-N 2.95Å
1018Q85.2Confident86.2Confident66 Ų66102.3 Ų102.331%0.30850%0.498SS..Hα-helixtrans-65.6-35.4175-179.15444.600111.4D1014 D1022D1014-Q1018 WeakPolarHBondContact O-CB 3.4Å; D1014-Q1018 PolarHBondContact O-N 2.84Å; Q1018-D1022 PolarHBondContact NE2-OD1 3.03Å; Q1018-D1022 PolarHBondContact NE2-OD2 3.28Å; Q1018-D1022 WeakPolarHBondContact O-CB 3.44Å; Q1018-D1022 PolarHBondContact O-N 3.01Å
1019A86.3Confident86.2Confident52 Ų52103.6 Ų103.643%0.4350%0.502SS..Hα-helixtrans-66.1-40.3172.500000113Q1015 A1016 W1017 D1022 Q1023Q1015-A1019 WeakPolarHBondContact O-CB 3.48Å; Q1015-A1019 PolarHBondContact O-N 3.14Å; A1016-A1019 PolarHBondContact O-N 3.17Å; W1017-A1019 VanDerWaalsContact C-N 3.32Å; W1017-A1019 PolarHBondContact O-N 3.01Å; A1019-D1022 PolarHBondContact O-N 3.06Å; A1019-Q1023 WeakPolarHBondContact O-CB 3.27Å; A1019-Q1023 PolarHBondContact O-N 3.33Å
1020E85.6Confident86.3Confident114 Ų114103.1 Ų103.153%0.53350%0.5SS..Hα-helixtrans-65.3-45.5173.9-177.9176.4-15900111.5A1016 W1017 D1022 Q1023 L1024A1016-E1020 PolarHBondContact O-N 3.3Å; W1017-E1020 PolarHBondContact O-N 2.86Å; E1020-D1022 PolarHBondContact O-N 2.67Å; E1020-Q1023 CarbonylContact O-C 3.52Å; E1020-Q1023 WeakPolarHBondContact O-CA 3.41Å; E1020-Q1023 WeakPolarHBondContact O-CB 3.35Å; E1020-Q1023 PolarHBondContact O-N 2.96Å; E1020-L1024 HydrophobicContact CG-CD1 4.33Å; E1020-L1024 WeakPolarHBondContact O-CG 3.48Å; E1020-L1024 PolarHBondContact O-N 2.98Å
1021K87.3Confident86.4Confident79 Ų79105.1 Ų105.134%0.34350%0.499SS..Hα-helixtrans-58.5-43.6173.8174.6176.2161.7-155.60112W1017 Q1023 L1024 L1025W1017-K1021 HydrophobicContact CE3-CD 4.38Å; W1017-K1021 HydrophobicContact CH2-CD 3.67Å; W1017-K1021 HydrophobicContact CZ2-CD 4.06Å; W1017-K1021 HydrophobicContact CZ3-CD 3.83Å; W1017-K1021 VanDerWaalsContact O-CB 3.26Å; W1017-K1021 WeakPolarHBondContact O-CB 3.41Å; W1017-K1021 PolarHBondContact O-N 2.95Å; K1021-Q1023 VanDerWaalsContact C-N 3.3Å; K1021-Q1023 PolarHBondContact O-N 3.26Å; K1021-L1024 PolarHBondContact O-N 2.92Å; K1021-L1025 HydrophobicContact CG-CD1 4.24Å; K1021-L1025 WeakPolarHBondContact O-CB 3.3Å; K1021-L1025 WeakPolarHBondContact O-CG 3.38Å; K1021-L1025 PolarHBondContact O-N 3.39Å
1022D85.8Confident86.3Confident66 Ų66104.5 Ų104.535%0.35350%0.497SS..Hα-helixtrans-69.4-26.6174-74.8-28.4000112.6Q1018 A1019 E1020 R1026Q1018-D1022 PolarHBondContact NE2-OD1 3.03Å; Q1018-D1022 PolarHBondContact NE2-OD2 3.28Å; Q1018-D1022 WeakPolarHBondContact O-CB 3.44Å; Q1018-D1022 PolarHBondContact O-N 3.01Å; A1019-D1022 PolarHBondContact O-N 3.06Å; E1020-D1022 PolarHBondContact O-N 2.67Å; D1022-R1026 WeakPolarHBondContact O-CB 3.5Å; D1022-R1026 WeakPolarHBondContact O-CG 3.41Å; D1022-R1026 PolarHBondContact O-N 3.25Å; D1022-R1026 VanDerWaalsContact O-N 3.15Å; D1022-R1026 PolarHBondContact O-NE 3.42Å
1023Q89.4Confident86.2Confident130 Ų130104.5 Ų104.561%0.60750%0.499SS*.Hα-helixtrans-73.1-42.5171.8-179.3176.1-10.800111.7A1019 E1020 K1021 R1026 A1027A1019-Q1023 WeakPolarHBondContact O-CB 3.27Å; A1019-Q1023 PolarHBondContact O-N 3.33Å; E1020-Q1023 CarbonylContact O-C 3.52Å; E1020-Q1023 WeakPolarHBondContact O-CA 3.41Å; E1020-Q1023 WeakPolarHBondContact O-CB 3.35Å; E1020-Q1023 PolarHBondContact O-N 2.96Å; K1021-Q1023 VanDerWaalsContact C-N 3.3Å; K1021-Q1023 PolarHBondContact O-N 3.26Å; Q1023-R1026 PolarHBondContact O-N 3.42Å; Q1023-A1027 WeakPolarHBondContact O-CB 3.42Å; Q1023-A1027 PolarHBondContact O-N 3.38Å
1024L87.1Confident86.3Confident112 Ų112102.2 Ų102.259%0.58649%0.491SS*.Hα-helixtrans-64.6-44.4174.7-70.4171.9000111.3E1020 K1021 R1026 A1027 E1028E1020-L1024 HydrophobicContact CG-CD1 4.33Å; E1020-L1024 WeakPolarHBondContact O-CG 3.48Å; E1020-L1024 PolarHBondContact O-N 2.98Å; K1021-L1024 PolarHBondContact O-N 2.92Å; L1024-R1026 VanDerWaalsContact C-N 3.26Å; L1024-R1026 PolarHBondContact O-N 2.86Å; L1024-A1027 PolarHBondContact O-N 3.33Å; L1024-E1028 WeakPolarHBondContact O-CB 3.49Å; L1024-E1028 PolarHBondContact O-N 2.96Å
1025L87Confident86.4Confident71 Ų71100.3 Ų100.337%0.37248%0.48SS..Hα-helixtrans-63.1-29.7174.1-76.1169.2000113K1021 K1029K1021-L1025 HydrophobicContact CG-CD1 4.24Å; K1021-L1025 WeakPolarHBondContact O-CB 3.3Å; K1021-L1025 WeakPolarHBondContact O-CG 3.38Å; K1021-L1025 PolarHBondContact O-N 3.39Å; L1025-K1029 WeakPolarHBondContact O-CB 3.41Å; L1025-K1029 WeakPolarHBondContact O-CD 3.27Å; L1025-K1029 WeakPolarHBondContact O-CG 3.42Å; L1025-K1029 PolarHBondContact O-N 3.08Å; L1025-K1029 VanDerWaalsContact O-N 3.15Å
1026R85.8Confident86.3Confident146 Ų146100 Ų10055%0.55148%0.479SS*.Hα-helixtrans-70.4-53.1169.8-84.7172.3-77.5171.6-2.2111D1022 Q1023 L1024 E1028 K1029 D1030D1022-R1026 WeakPolarHBondContact O-CB 3.5Å; D1022-R1026 WeakPolarHBondContact O-CG 3.41Å; D1022-R1026 PolarHBondContact O-N 3.25Å; D1022-R1026 VanDerWaalsContact O-N 3.15Å; D1022-R1026 PolarHBondContact O-NE 3.42Å; Q1023-R1026 PolarHBondContact O-N 3.42Å; L1024-R1026 VanDerWaalsContact C-N 3.26Å; L1024-R1026 PolarHBondContact O-N 2.86Å; R1026-E1028 VanDerWaalsContact C-N 3.26Å; R1026-E1028 PolarHBondContact O-N 3.47Å; R1026-K1029 PolarHBondContact O-N 2.94Å; R1026-K1029 VanDerWaalsContact O-N 3.08Å; R1026-D1030 VanDerWaalsContact O-CG 3.23Å; R1026-D1030 PolarHBondContact O-N 3.06Å
1027A87.1Confident86.3Confident49 Ų49102 Ų10241%0.40548%0.476SS..Hα-helixtrans-59.3-34.7179.700000113.3Q1023 L1024 R1031Q1023-A1027 WeakPolarHBondContact O-CB 3.42Å; Q1023-A1027 PolarHBondContact O-N 3.38Å; L1024-A1027 PolarHBondContact O-N 3.33Å; A1027-R1031 WeakPolarHBondContact O-CB 3.32Å; A1027-R1031 PolarHBondContact O-N 2.86Å
1028E85.9Confident86.3Confident95 Ų9599.7 Ų99.744%0.44447%0.472SS..Hα-helixtrans-73-41174.4-176.2167.3-132.400112.2L1024 R1026 D1030 R1031 F1032L1024-E1028 WeakPolarHBondContact O-CB 3.49Å; L1024-E1028 PolarHBondContact O-N 2.96Å; R1026-E1028 VanDerWaalsContact C-N 3.26Å; R1026-E1028 PolarHBondContact O-N 3.47Å; E1028-D1030 VanDerWaalsContact C-N 3.34Å; E1028-D1030 PolarHBondContact O-N 3.33Å; E1028-R1031 CarbonylContact O-C 3.59Å; E1028-R1031 WeakPolarHBondContact O-CB 3.45Å; E1028-R1031 PolarHBondContact O-N 3.39Å; E1028-R1031 VanDerWaalsContact O-N 3.13Å; E1028-F1032 HydrophobicContact CG-CD2 3.75Å; E1028-F1032 HydrophobicContact CG-CE2 3.51Å; E1028-F1032 VanDerWaalsContact O-CD2 3.27Å; E1028-F1032 WeakPolarHBondContact O-CD2 3.43Å; E1028-F1032 PolarHBondContact O-N 2.99Å
1029K86.3Confident86.4Confident131 Ų131102.3 Ų102.357%0.5748%0.482SS*.Hα-helixtrans-60.7-42.3170.3-76.5169.4-175.6174.20111.7L1025 R1026 R1031 F1032 L1033L1025-K1029 WeakPolarHBondContact O-CB 3.41Å; L1025-K1029 WeakPolarHBondContact O-CD 3.27Å; L1025-K1029 WeakPolarHBondContact O-CG 3.42Å; L1025-K1029 PolarHBondContact O-N 3.08Å; L1025-K1029 VanDerWaalsContact O-N 3.15Å; R1026-K1029 PolarHBondContact O-N 2.94Å; R1026-K1029 VanDerWaalsContact O-N 3.08Å; K1029-R1031 PolarHBondContact O-N 3.38Å; K1029-F1032 PolarHBondContact O-N 3.12Å; K1029-L1033 WeakPolarHBondContact O-CB 3.39Å; K1029-L1033 WeakPolarHBondContact O-CG 3.34Å; K1029-L1033 PolarHBondContact O-N 3.33Å
1030D86.4Confident86.4Confident81 Ų81102.6 Ų102.643%0.43348%0.475SS..Hα-helixtrans-64.5-28.2175.1-64.2-25.1000112.3R1026 E1028 R1034R1026-D1030 VanDerWaalsContact O-CG 3.23Å; R1026-D1030 PolarHBondContact O-N 3.06Å; E1028-D1030 VanDerWaalsContact C-N 3.34Å; E1028-D1030 PolarHBondContact O-N 3.33Å; D1030-R1034 WeakPolarHBondContact O-CB 3.36Å; D1030-R1034 WeakPolarHBondContact O-CG 3.42Å; D1030-R1034 PolarHBondContact O-N 2.89Å; D1030-R1034 PolarHBondContact O-NE 2.92Å
1031R87.6Confident86.5Confident158 Ų158101.7 Ų101.760%0.59647%0.471SS*.Hα-helixtrans-75.3-43.7172.5-175.5-175.8177.8-149.60.7111.2A1027 E1028 K1029 R1034 L1035A1027-R1031 WeakPolarHBondContact O-CB 3.32Å; A1027-R1031 PolarHBondContact O-N 2.86Å; E1028-R1031 CarbonylContact O-C 3.59Å; E1028-R1031 WeakPolarHBondContact O-CB 3.45Å; E1028-R1031 PolarHBondContact O-N 3.39Å; E1028-R1031 VanDerWaalsContact O-N 3.13Å; K1029-R1031 PolarHBondContact O-N 3.38Å; R1031-R1034 PolarHBondContact O-N 3.32Å; R1031-L1035 HydrophobicContact CG-CD1 4.27Å; R1031-L1035 WeakPolarHBondContact O-CG 3.34Å; R1031-L1035 PolarHBondContact O-N 3.07Å
1032F84.1Confident86.5Confident123 Ų123102 Ų10254%0.53948%0.479SS..Hα-helixtrans-63.5-41.4174.7-80.2-61.5000112.2E1028 K1029 R1034 L1035 E1036E1028-F1032 HydrophobicContact CG-CD2 3.75Å; E1028-F1032 HydrophobicContact CG-CE2 3.51Å; E1028-F1032 VanDerWaalsContact O-CD2 3.27Å; E1028-F1032 WeakPolarHBondContact O-CD2 3.43Å; E1028-F1032 PolarHBondContact O-N 2.99Å; K1029-F1032 PolarHBondContact O-N 3.12Å; F1032-R1034 VanDerWaalsContact C-N 3.35Å; F1032-R1034 PolarHBondContact O-N 3.04Å; F1032-L1035 PolarHBondContact O-N 3.39Å; F1032-E1036 WeakPolarHBondContact O-CB 3.47Å; F1032-E1036 PolarHBondContact O-N 3.33Å
1033L84.1Confident86.6Confident104 Ų104105.3 Ų105.355%0.54549%0.487SS..Hα-helixtrans-65.1-35.6175.1-72.5168000112.5K1029 K1037K1029-L1033 WeakPolarHBondContact O-CB 3.39Å; K1029-L1033 WeakPolarHBondContact O-CG 3.34Å; K1029-L1033 PolarHBondContact O-N 3.33Å; L1033-K1037 WeakPolarHBondContact O-CB 3.34Å; L1033-K1037 PolarHBondContact O-N 3.21Å
1034R86.3Confident86.6Confident144 Ų144104.5 Ų104.554%0.54348%0.483SS..Hα-helixtrans-64.9-48.8170.8-84.8175.9-80-175.3-5.9111.8D1030 R1031 F1032 E1036 K1037 E1038D1030-R1034 WeakPolarHBondContact O-CB 3.36Å; D1030-R1034 WeakPolarHBondContact O-CG 3.42Å; D1030-R1034 PolarHBondContact O-N 2.89Å; D1030-R1034 PolarHBondContact O-NE 2.92Å; R1031-R1034 PolarHBondContact O-N 3.32Å; F1032-R1034 VanDerWaalsContact C-N 3.35Å; F1032-R1034 PolarHBondContact O-N 3.04Å; R1034-E1036 PolarHBondContact O-N 2.79Å; R1034-K1037 WeakPolarHBondContact O-CB 3.4Å; R1034-K1037 PolarHBondContact O-N 3.01Å; R1034-E1038 WeakPolarHBondContact O-CG 3.33Å; R1034-E1038 PolarHBondContact O-N 2.84Å
1035L86.9Confident86.7Confident59 Ų59105.6 Ų105.631%0.30949%0.485SS..Hα-helixtrans-61.7-40176.6-71.5168.7000112.3R1031 F1032 E1038 F1039R1031-L1035 HydrophobicContact CG-CD1 4.27Å; R1031-L1035 WeakPolarHBondContact O-CG 3.34Å; R1031-L1035 PolarHBondContact O-N 3.07Å; F1032-L1035 PolarHBondContact O-N 3.39Å; L1035-E1038 PolarHBondContact O-N 3.47Å; L1035-F1039 HydrophobicContact CB-CE2 4.5Å; L1035-F1039 WeakPolarHBondContact O-CB 3.46Å; L1035-F1039 WeakPolarHBondContact O-CD2 3.38Å; L1035-F1039 PolarHBondContact O-N 3.08Å
1036E85Confident86.8Confident122 Ų122106.9 Ų106.957%0.5749%0.492SS*.Hα-helixtrans-63.9-41.7175.7-177.1169.1-145.500111.7F1032 R1034 F1039 E1040F1032-E1036 WeakPolarHBondContact O-CB 3.47Å; F1032-E1036 PolarHBondContact O-N 3.33Å; R1034-E1036 PolarHBondContact O-N 2.79Å; E1036-F1039 PolarHBondContact O-N 3.09Å; E1036-E1040 PolarHBondContact O-N 3.43Å
1037K85.6Confident87Confident101 Ų101105.2 Ų105.244%0.43949%0.489SS..Hα-helixtrans-62.7-43.4172.6-173.9-176.5175.9-170.10111.6L1033 R1034 E1040 M1041L1033-K1037 WeakPolarHBondContact O-CB 3.34Å; L1033-K1037 PolarHBondContact O-N 3.21Å; R1034-K1037 WeakPolarHBondContact O-CB 3.4Å; R1034-K1037 PolarHBondContact O-N 3.01Å; K1037-E1040 PolarHBondContact O-N 3.47Å; K1037-M1041 WeakPolarHBondContact O-CG 3.4Å; K1037-M1041 PolarHBondContact O-N 3.27Å
1038E87.6Confident87.2Confident91 Ų91105.7 Ų105.743%0.42549%0.493SS..Hα-helixtrans-62.2-45.3175.4-73.6165.4-155.800111.7R1034 L1035 E1040 M1041 V1042R1034-E1038 WeakPolarHBondContact O-CG 3.33Å; R1034-E1038 PolarHBondContact O-N 2.84Å; L1035-E1038 PolarHBondContact O-N 3.47Å; E1038-E1040 VanDerWaalsContact C-N 3.35Å; E1038-E1040 PolarHBondContact O-N 3.5Å; E1038-M1041 HydrophobicContact CG-CE 4.17Å; E1038-M1041 PolarHBondContact O-N 2.8Å; E1038-V1042 WeakPolarHBondContact O-CG2 3.45Å; E1038-V1042 PolarHBondContact O-N 3.3Å
1039F86.5Confident87.3Confident121 Ų121107.1 Ų107.153%0.53150%0.501SS..Hα-helixtrans-62.9-36.5174.7-78.8-58.7000112.9L1035 E1036 R1043L1035-F1039 HydrophobicContact CB-CE2 4.5Å; L1035-F1039 WeakPolarHBondContact O-CB 3.46Å; L1035-F1039 WeakPolarHBondContact O-CD2 3.38Å; L1035-F1039 PolarHBondContact O-N 3.08Å; E1036-F1039 PolarHBondContact O-N 3.09Å; F1039-R1043 WeakPolarHBondContact O-CG 3.24Å; F1039-R1043 PolarHBondContact O-N 3.48Å
1040E87.3Confident87.4Confident58 Ų58106 Ų10627%0.27150%0.499SS..Hα-helixtrans-73.7-33.7175.2-172.255.1-140.700112.5E1036 K1037 E1038 R1043 Q1044 K1047E1036-E1040 PolarHBondContact O-N 3.43Å; K1037-E1040 PolarHBondContact O-N 3.47Å; E1038-E1040 VanDerWaalsContact C-N 3.35Å; E1038-E1040 PolarHBondContact O-N 3.5Å; E1040-R1043 PolarHBondContact O-N 2.89Å; E1040-R1043 WeakPolarHBondContact OE2-CD 3.38Å; E1040-R1043 IonicContact OE2-CZ 3.78Å; E1040-R1043 IonicContact OE2-NE 3.94Å; E1040-R1043 IonicContact OE2-NH1 2.64Å; E1040-R1043 PolarHBondContact OE2-NH1 2.74Å; E1040-Q1044 VanDerWaalsContact O-CG 3.31Å; E1040-Q1044 WeakPolarHBondContact O-CG 3.34Å; E1040-Q1044 PolarHBondContact O-N 2.87Å; E1040-Q1044 PolarHBondContact OE1-NE2 2.74Å; E1040-K1047 IonicContact OE1-NZ 2.78Å
1041M87.2Confident87.7Confident94 Ų94107.5 Ų107.546%0.46351%0.506SS..Hα-helixtrans-61.2-47.6168.4-70.4-169.4-54.100111.1K1037 E1038 R1043 Q1044 E1045K1037-M1041 WeakPolarHBondContact O-CG 3.4Å; K1037-M1041 PolarHBondContact O-N 3.27Å; E1038-M1041 HydrophobicContact CG-CE 4.17Å; E1038-M1041 PolarHBondContact O-N 2.8Å; M1041-R1043 VanDerWaalsContact C-N 3.32Å; M1041-R1043 PolarHBondContact O-N 2.91Å; M1041-Q1044 CarbonylContact O-C 3.56Å; M1041-Q1044 WeakPolarHBondContact O-CA 3.43Å; M1041-Q1044 PolarHBondContact O-N 3.34Å; M1041-E1045 PolarHBondContact O-N 2.95Å
1042V88.6Confident87.9Confident85 Ų85105.9 Ų105.952%0.51550%0.503SS..Hα-helixtrans-61.4-37.4176.6171.50000111.8E1038 Q1044 L1046E1038-V1042 WeakPolarHBondContact O-CG2 3.45Å; E1038-V1042 PolarHBondContact O-N 3.3Å; V1042-Q1044 VanDerWaalsContact C-N 3.33Å; V1042-Q1044 PolarHBondContact O-N 2.85Å; V1042-L1046 VanDerWaalsContact O-CB 3.26Å; V1042-L1046 WeakPolarHBondContact O-CB 3.47Å; V1042-L1046 PolarHBondContact O-N 3.4Å
1043R87.1Confident88.2Confident137 Ų137105.9 Ų105.952%0.51750%0.504SS..Hα-helixtrans-62.8-38170.9-75.5168.4-175157.76.3112.3F1039 E1040 M1041 K1047F1039-R1043 WeakPolarHBondContact O-CG 3.24Å; F1039-R1043 PolarHBondContact O-N 3.48Å; E1040-R1043 PolarHBondContact O-N 2.89Å; E1040-R1043 WeakPolarHBondContact OE2-CD 3.38Å; E1040-R1043 IonicContact OE2-CZ 3.78Å; E1040-R1043 IonicContact OE2-NE 3.94Å; E1040-R1043 IonicContact OE2-NH1 2.64Å; E1040-R1043 PolarHBondContact OE2-NH1 2.74Å; M1041-R1043 VanDerWaalsContact C-N 3.32Å; M1041-R1043 PolarHBondContact O-N 2.91Å; R1043-K1047 WeakPolarHBondContact O-CB 3.07Å; R1043-K1047 WeakPolarHBondContact O-CD 3.49Å; R1043-K1047 WeakPolarHBondContact O-CG 3.48Å; R1043-K1047 PolarHBondContact O-N 2.83Å
1044Q89.7Confident88.6Confident112 Ų112106.5 Ų106.552%0.52351%0.505SS..Hα-helixtrans-73.1-39.9179.4-71.8174.927.300112E1040 M1041 V1042 K1047 A1048E1040-Q1044 VanDerWaalsContact O-CG 3.31Å; E1040-Q1044 WeakPolarHBondContact O-CG 3.34Å; E1040-Q1044 PolarHBondContact O-N 2.87Å; E1040-Q1044 PolarHBondContact OE1-NE2 2.74Å; M1041-Q1044 CarbonylContact O-C 3.56Å; M1041-Q1044 WeakPolarHBondContact O-CA 3.43Å; M1041-Q1044 PolarHBondContact O-N 3.34Å; V1042-Q1044 VanDerWaalsContact C-N 3.33Å; V1042-Q1044 PolarHBondContact O-N 2.85Å; Q1044-K1047 PolarHBondContact O-N 3.1Å; Q1044-A1048 WeakPolarHBondContact O-CB 3.44Å; Q1044-A1048 PolarHBondContact O-N 3.28Å
1045E88.7Confident88.8Confident135 Ų135106.8 Ų106.863%0.63151%0.51SS*.Hα-helixtrans-63.8-41.8171.1-67.9-161.6138.600112M1041 A1048 M1049M1041-E1045 PolarHBondContact O-N 2.95Å; E1045-A1048 PolarHBondContact O-N 2.87Å; E1045-M1049 WeakPolarHBondContact O-CB 3.28Å; E1045-M1049 PolarHBondContact O-N 2.79Å
1046L89.6Confident89Confident98 Ų98108.3 Ų108.351%0.51352%0.515SS..Hα-helixtrans-63.6-43.6175.4-17662.5000111.8V1042 A1048 M1049 M1050V1042-L1046 VanDerWaalsContact O-CB 3.26Å; V1042-L1046 WeakPolarHBondContact O-CB 3.47Å; V1042-L1046 PolarHBondContact O-N 3.4Å; L1046-A1048 VanDerWaalsContact C-N 3.34Å; L1046-A1048 PolarHBondContact O-N 3.15Å; L1046-M1049 PolarHBondContact O-N 2.9Å; L1046-M1050 WeakPolarHBondContact O-CB 3.38Å; L1046-M1050 WeakPolarHBondContact O-CG 3.39Å; L1046-M1050 PolarHBondContact O-N 3.24Å
1047K90.3Very high89.4Confident112 Ų112108.4 Ų108.449%0.48751%0.514SS..Hα-helixtrans-58.3-45172-73.7162.4-172.5166.40111.2E1040 R1043 Q1044 M1050 I1051E1040-K1047 IonicContact OE1-NZ 2.78Å; R1043-K1047 WeakPolarHBondContact O-CB 3.07Å; R1043-K1047 WeakPolarHBondContact O-CD 3.49Å; R1043-K1047 WeakPolarHBondContact O-CG 3.48Å; R1043-K1047 PolarHBondContact O-N 2.83Å; Q1044-K1047 PolarHBondContact O-N 3.1Å; K1047-M1050 PolarHBondContact O-N 3.41Å; K1047-I1051 WeakPolarHBondContact O-CD1 3.32Å; K1047-I1051 VanDerWaalsContact O-CG1 3.28Å; K1047-I1051 WeakPolarHBondContact O-CG1 3.46Å; K1047-I1051 PolarHBondContact O-N 3.07Å
1048A91Very high89.6Confident58 Ų58106.3 Ų106.348%0.47952%0.515SS..Hα-helixtrans-65.9-38.3178.200000112.6Q1044 E1045 L1046 I1051 K1052Q1044-A1048 WeakPolarHBondContact O-CB 3.44Å; Q1044-A1048 PolarHBondContact O-N 3.28Å; E1045-A1048 PolarHBondContact O-N 2.87Å; L1046-A1048 VanDerWaalsContact C-N 3.34Å; L1046-A1048 PolarHBondContact O-N 3.15Å; A1048-I1051 PolarHBondContact O-N 2.69Å; A1048-K1052 WeakPolarHBondContact O-CB 3.43Å; A1048-K1052 PolarHBondContact O-N 2.71Å
1049M88.2Confident89.8Confident125 Ų125106.3 Ų106.362%0.61652%0.515SS*.Hα-helixtrans-67.2-41.2175.3-168.5-172.6-61.300111.6E1045 L1046 K1052 H1053E1045-M1049 WeakPolarHBondContact O-CB 3.28Å; E1045-M1049 PolarHBondContact O-N 2.79Å; L1046-M1049 PolarHBondContact O-N 2.9Å; M1049-K1052 PolarHBondContact O-N 2.64Å; M1049-H1053 WeakPolarHBondContact O-CB 3.21Å; M1049-H1053 PolarHBondContact O-N 3.1Å
1050M88.4Confident89.9Confident107 Ų107105.8 Ų105.853%0.52752%0.518SS..Hα-helixtrans-60.8-49.4172.6-74.4-1796700111.3L1046 K1047 K1052 H1053 E1054L1046-M1050 WeakPolarHBondContact O-CB 3.38Å; L1046-M1050 WeakPolarHBondContact O-CG 3.39Å; L1046-M1050 PolarHBondContact O-N 3.24Å; K1047-M1050 PolarHBondContact O-N 3.41Å; M1050-K1052 VanDerWaalsContact C-N 3.29Å; M1050-K1052 PolarHBondContact O-N 2.86Å; M1050-H1053 PolarHBondContact O-N 2.75Å; M1050-H1053 VanDerWaalsContact O-N 3.15Å; M1050-E1054 WeakPolarHBondContact O-CB 3.33Å; M1050-E1054 WeakPolarHBondContact O-CG 3.4Å; M1050-E1054 PolarHBondContact O-N 3.39Å
1051I90.9Very high90Very high113 Ų113107 Ų10758%0.57953%0.525SS*.Hα-helixtrans-60.5-38.9177.2-68.9164.1000111.3K1047 A1048 K1055K1047-I1051 WeakPolarHBondContact O-CD1 3.32Å; K1047-I1051 VanDerWaalsContact O-CG1 3.28Å; K1047-I1051 WeakPolarHBondContact O-CG1 3.46Å; K1047-I1051 PolarHBondContact O-N 3.07Å; A1048-I1051 PolarHBondContact O-N 2.69Å; I1051-K1055 WeakPolarHBondContact O-CB 3.4Å; I1051-K1055 PolarHBondContact O-N 3.17Å
1052K93Very high89.9Confident124 Ų124104.3 Ų104.354%0.53952%0.518SS..Hα-helixtrans-62.4-49.4173.4-179.4-172.8165.5-171.90111.2A1048 M1049 M1050 E1054 K1055 E1056A1048-K1052 WeakPolarHBondContact O-CB 3.43Å; A1048-K1052 PolarHBondContact O-N 2.71Å; M1049-K1052 PolarHBondContact O-N 2.64Å; M1050-K1052 VanDerWaalsContact C-N 3.29Å; M1050-K1052 PolarHBondContact O-N 2.86Å; K1052-E1054 PolarHBondContact O-N 3.2Å; K1052-K1055 WeakPolarHBondContact O-CB 3.4Å; K1052-K1055 PolarHBondContact O-N 3.47Å; K1052-E1056 VanDerWaalsContact CE-CD 3.44Å; K1052-E1056 WeakPolarHBondContact CE-OE1 3.34Å; K1052-E1056 IonicContact NZ-OE1 3Å; K1052-E1056 WeakPolarHBondContact O-CG 3.37Å; K1052-E1056 PolarHBondContact O-N 3.28Å
1053H90.5Very high89.8Confident123 Ų123107.8 Ų107.857%0.56952%0.522SS*.Hα-helixtrans-66.6-36.2-179.2-178.2-105.9000112.4M1049 M1050 E1056 K1057M1049-H1053 WeakPolarHBondContact O-CB 3.21Å; M1049-H1053 PolarHBondContact O-N 3.1Å; M1050-H1053 PolarHBondContact O-N 2.75Å; M1050-H1053 VanDerWaalsContact O-N 3.15Å; H1053-E1056 PolarHBondContact O-N 3.08Å; H1053-K1057 WeakPolarHBondContact O-CB 3.16Å; H1053-K1057 PolarHBondContact O-N 2.93Å
1054E91.3Very high89.6Confident118 Ų118106.4 Ų106.455%0.55152%0.524SS*.Hα-helixtrans-64.2-40.2171.5-74.3-179.2161.500111.9M1050 K1052 A1058M1050-E1054 WeakPolarHBondContact O-CB 3.33Å; M1050-E1054 WeakPolarHBondContact O-CG 3.4Å; M1050-E1054 PolarHBondContact O-N 3.39Å; K1052-E1054 PolarHBondContact O-N 3.2Å; E1054-A1058 VanDerWaalsContact O-CB 3.28Å; E1054-A1058 WeakPolarHBondContact O-CB 3.48Å; E1054-A1058 PolarHBondContact O-N 3.15Å
1055K92.1Very high89.1Confident150 Ų150105.9 Ų105.965%0.65253%0.525SS*.Hα-helixtrans-65.9-43.3174-176-176.6176.3-173.50112.3I1051 K1052 A1058 E1059I1051-K1055 WeakPolarHBondContact O-CB 3.4Å; I1051-K1055 PolarHBondContact O-N 3.17Å; K1052-K1055 WeakPolarHBondContact O-CB 3.4Å; K1052-K1055 PolarHBondContact O-N 3.47Å; K1055-A1058 PolarHBondContact O-N 2.85Å; K1055-E1059 PolarHBondContact O-N 3.09Å
1056E91.2Very high88.6Confident90 Ų90107.1 Ų107.142%0.42153%0.528SS..Hα-helixtrans-66.7-40.5176.9-73.9172.916400111.2K1052 H1053 E1059 L1060K1052-E1056 VanDerWaalsContact CE-CD 3.44Å; K1052-E1056 WeakPolarHBondContact CE-OE1 3.34Å; K1052-E1056 IonicContact NZ-OE1 3Å; K1052-E1056 WeakPolarHBondContact O-CG 3.37Å; K1052-E1056 PolarHBondContact O-N 3.28Å; H1053-E1056 PolarHBondContact O-N 3.08Å; E1056-E1059 PolarHBondContact O-N 3.13Å; E1056-L1060 WeakPolarHBondContact O-CB 3.41Å; E1056-L1060 VanDerWaalsContact O-CG 3.32Å; E1056-L1060 WeakPolarHBondContact O-CG 3.44Å; E1056-L1060 PolarHBondContact O-N 2.91Å
1057K92Very high87.4Confident125 Ų125104.8 Ų104.854%0.54353%0.528SS..Hα-helixtrans-60.6-44.5170.7-178.9-179.5177.8-176.50111.9H1053 E1059 L1060 I1061H1053-K1057 WeakPolarHBondContact O-CB 3.16Å; H1053-K1057 PolarHBondContact O-N 2.93Å; K1057-E1059 VanDerWaalsContact C-N 3.35Å; K1057-L1060 PolarHBondContact O-N 3Å; K1057-I1061 HydrophobicContact CG-CD1 4.09Å; K1057-I1061 VanDerWaalsContact O-CG1 3.29Å; K1057-I1061 WeakPolarHBondContact O-CG1 2.84Å; K1057-I1061 PolarHBondContact O-N 3.03Å
1058A90.8Very high85.9Confident57 Ų57105.6 Ų105.647%0.47154%0.538SS..Hα-helixtrans-64.9-37.3176.100000112.1E1054 K1055 A1062E1054-A1058 VanDerWaalsContact O-CB 3.28Å; E1054-A1058 WeakPolarHBondContact O-CB 3.48Å; E1054-A1058 PolarHBondContact O-N 3.15Å; K1055-A1058 PolarHBondContact O-N 2.85Å; A1058-A1062 VanDerWaalsContact O-CB 3.29Å; A1058-A1062 WeakPolarHBondContact O-CB 3.39Å; A1058-A1062 PolarHBondContact O-N 3.14Å
1059E91.9Very high84.2Confident91 Ų91108.3 Ų108.343%0.42555%0.548SS..Hα-helixtrans-69.7-39.1174.3-164.2-179.1152.900112.1K1055 E1056 K1057 A1062 R1063K1055-E1059 PolarHBondContact O-N 3.09Å; E1056-E1059 PolarHBondContact O-N 3.13Å; K1057-E1059 VanDerWaalsContact C-N 3.35Å; E1059-A1062 CarbonylContact O-C 3.57Å; E1059-A1062 PolarHBondContact O-N 2.94Å; E1059-R1063 HydrophobicContact CG-CG 4.49Å; E1059-R1063 WeakPolarHBondContact O-CB 3.33Å; E1059-R1063 VanDerWaalsContact O-CG 3.24Å; E1059-R1063 WeakPolarHBondContact O-CG 3.47Å; E1059-R1063 PolarHBondContact O-N 3.22Å; E1059-R1063 IonicContact OE1-CZ 3.9Å; E1059-R1063 IonicContact OE1-NE 2.89Å; E1059-R1063 PolarHBondContact OE1-NE 3.38Å; E1059-R1063 IonicContact OE1-NH2 2.66Å; E1059-R1063 PolarHBondContact OE1-NH2 3.18Å
1060L88.8Confident82.5Confident110 Ų110108.7 Ų108.758%0.57656%0.557SS**Hα-helixtrans-63.3-42.2174.3-74.3170.2000112E1056 K1057 R1063 L1064E1056-L1060 WeakPolarHBondContact O-CB 3.41Å; E1056-L1060 VanDerWaalsContact O-CG 3.32Å; E1056-L1060 WeakPolarHBondContact O-CG 3.44Å; E1056-L1060 PolarHBondContact O-N 2.91Å; K1057-L1060 PolarHBondContact O-N 3Å; L1060-R1063 PolarHBondContact O-N 2.81Å; L1060-L1064 PolarHBondContact O-N 2.96Å
1061I88.1Confident80.7Confident83 Ų83106.8 Ų106.843%0.42656%0.559SS.*Hα-helixtrans-60.5-50.5171.7-68.6164.5000109.9K1057 R1063 L1064 D1065K1057-I1061 HydrophobicContact CG-CD1 4.09Å; K1057-I1061 VanDerWaalsContact O-CG1 3.29Å; K1057-I1061 WeakPolarHBondContact O-CG1 2.84Å; K1057-I1061 PolarHBondContact O-N 3.03Å; I1061-R1063 PolarHBondContact O-N 2.89Å; I1061-R1063 VanDerWaalsContact O-N 3.14Å; I1061-L1064 WeakPolarHBondContact O-CB 3.32Å; I1061-L1064 PolarHBondContact O-N 2.95Å; I1061-L1064 VanDerWaalsContact O-N 3.07Å; I1061-D1065 PolarHBondContact O-N 2.87Å
1062A86.4Confident78.7Confident38 Ų38106.9 Ų106.931%0.31457%0.569SS.*Hα-helixtrans-65.5-16.8178.400000114.5A1058 E1059 K1066A1058-A1062 VanDerWaalsContact O-CB 3.29Å; A1058-A1062 WeakPolarHBondContact O-CB 3.39Å; A1058-A1062 PolarHBondContact O-N 3.14Å; E1059-A1062 CarbonylContact O-C 3.57Å; E1059-A1062 PolarHBondContact O-N 2.94Å; A1062-K1066 VanDerWaalsContact O-CD 3.24Å; A1062-K1066 WeakPolarHBondContact O-CD 3.36Å; A1062-K1066 VanDerWaalsContact O-CG 3.23Å; A1062-K1066 WeakPolarHBondContact O-CG 3.35Å
1063R86.3Confident76.1Confident157 Ų157105.1 Ų105.159%0.59258%0.578SS**Hα-helixtrans-85.4-40.2170.2-74.9171.3180-1457.1111.5E1059 L1060 I1061 K1066 G1067E1059-R1063 HydrophobicContact CG-CG 4.49Å; E1059-R1063 WeakPolarHBondContact O-CB 3.33Å; E1059-R1063 VanDerWaalsContact O-CG 3.24Å; E1059-R1063 WeakPolarHBondContact O-CG 3.47Å; E1059-R1063 PolarHBondContact O-N 3.22Å; E1059-R1063 IonicContact OE1-CZ 3.9Å; E1059-R1063 IonicContact OE1-NE 2.89Å; E1059-R1063 PolarHBondContact OE1-NE 3.38Å; E1059-R1063 IonicContact OE1-NH2 2.66Å; E1059-R1063 PolarHBondContact OE1-NH2 3.18Å; L1060-R1063 PolarHBondContact O-N 2.81Å; I1061-R1063 PolarHBondContact O-N 2.89Å; I1061-R1063 VanDerWaalsContact O-N 3.14Å; R1063-K1066 PolarHBondContact O-N 3.39Å; R1063-G1067 PolarHBondContact O-N 2.95Å
1064L82.4Confident73.7Confident108 Ų108104.3 Ų104.357%0.56559%0.586SS**Hα-helixtrans-61.6-46.5173-84.3160.1000111.7L1060 I1061 K1066 G1067 N1068L1060-L1064 PolarHBondContact O-N 2.96Å; I1061-L1064 WeakPolarHBondContact O-CB 3.32Å; I1061-L1064 PolarHBondContact O-N 2.95Å; I1061-L1064 VanDerWaalsContact O-N 3.07Å; L1064-K1066 PolarHBondContact O-N 3.08Å; L1064-G1067 PolarHBondContact O-N 2.95Å; L1064-N1068 PolarHBondContact O-N 2.94Å
1065D80.2Confident71.5Confident102 Ų102109.8 Ų109.855%0.54560%0.602SS.*Hα-helixtrans-61.4-33.5176.4-69.1-23.2000112.1I1061 V1069I1061-D1065 PolarHBondContact O-N 2.87Å; D1065-V1069 WeakPolarHBondContact O-CG2 3.49Å
1066K76.4Confident69.1Low160 Ų160108.6 Ų108.670%0.69661%0.607SS**Hα-helixtrans-76.8-29.1173.8-74172.8-171.3168.20113.2A1062 R1063 L1064A1062-K1066 VanDerWaalsContact O-CD 3.24Å; A1062-K1066 WeakPolarHBondContact O-CD 3.36Å; A1062-K1066 VanDerWaalsContact O-CG 3.23Å; A1062-K1066 WeakPolarHBondContact O-CG 3.35Å; R1063-K1066 PolarHBondContact O-N 3.39Å; L1064-K1066 PolarHBondContact O-N 3.08Å
1067G65.4Low67Low50 Ų50112.8 Ų112.852%0.51563%0.629SS.*Hα-helixtrans-71.7-44.8177.300000112.9R1063 L1064 V1069R1063-G1067 PolarHBondContact O-N 2.95Å; L1064-G1067 PolarHBondContact O-N 2.95Å; G1067-V1069 VanDerWaalsContact C-N 3.3Å; G1067-V1069 PolarHBondContact O-N 3.29Å
1068N59.1Low64.7Low128 Ų128115 Ų11568%0.68464%0.641SS**Hα-helixtrans-74.7-12.5-173.5-76.5-17.6000114.9L1064L1064-N1068 PolarHBondContact O-N 2.94Å
1069V54Low62.3Low116 Ų116122.5 Ų122.570%0.70366%0.657SS**THydrogen-bonded Turntrans-94.36.8-173.3176.70000113.4D1065 G1067D1065-V1069 WeakPolarHBondContact O-CG2 3.49Å; G1067-V1069 VanDerWaalsContact C-N 3.3Å; G1067-V1069 PolarHBondContact O-N 3.29Å
1070V54.2Low59.8Low132 Ų132123.9 Ų123.980%0.868%0.677SS**THydrogen-bonded Turntrans-86.5-9.9173.3-174.50000112.5
1071A50.3Low57.4Low68 Ų68125.1 Ų125.156%0.56269%0.689SS**SBendtrans-86.4140.8164.300000110.8
1072S47.8Very low55.1Low114 Ų114126.6 Ų126.680%0.79771%0.706SS**SBendtrans50.778.7179.547.90000115.1
1073A39.3Very low53.1Low88 Ų88131.2 Ų131.273%0.72773%0.731SS**  70.6101.681.200000116.6
1074S40.1Very low51.4Low105 Ų105129.2 Ų129.273%0.73474%0.738SS**  trans77.9127.3136.7-540000121.4
1075R45.4Very low49.8Very low234 Ų234130 Ų13088%0.88375%0.75SS**  trans75145.9160.7-54.4170.6-170.8-1703115.7
1076T41.9Very low47.8Very low125 Ų125133.5 Ų133.577%0.76776%0.763SS**  cis-157.9130.4-16.214.50000109.8
1077M46.3Very low46.8Very low177 Ų177132 Ų13287%0.87277%0.77SS**  trans44.3153.9131.6-135.8164.6-172.600123.2
1078E43.9Very low45.5Very low171 Ų171135.6 Ų135.680%0.79978%0.782SS**  trans79.1148.9172.2-52.1-158.1145.800117.2
1079R39.6Very low44.8Very low216 Ų216134.2 Ų134.282%0.81579%0.788SS**  cis159.4110.1-35.4166-170.4179.3-172.81.2107.3
1080S40.2Very low44.1Very low120 Ų120135.6 Ų135.684%0.83979%0.791SS**  trans176.3152.4138.1-830000113.7
1081T39.1Very low43.5Very low136 Ų136138.1 Ų138.183%0.83480%0.795SS**  trans-95142.8179.645.20000113.1
1082S39.5Very low42.9Very low113 Ų113138.3 Ų138.379%0.7980%0.803SS**  178.9127.813055.30000115.4
1083V44Very low42.7Very low136 Ų136138.9 Ų138.982%0.82480%0.804SS**  trans14.7137.5139.6-170.70000120.4
1084P49.6Very low42.8Very low115 Ų115140.1 Ų140.175%0.74781%0.807SS**  trans-97174.3-178.340.8-38.5000115.5
1085P48.9Very low42.7Very low125 Ų125142.3 Ų142.381%0.81281%0.811SS**  trans-135.6164.9148.639.4-26.6000115.1
1086E38.4Very low42.5Very low174 Ų174137.3 Ų137.381%0.81381%0.812SS**  trans-77.1162.4165.2-61.4170.4106.100112.5
1087P55.5Low42.2Very low130 Ų130135.9 Ų135.984%0.84481%0.812SS**  trans-107.2133.5155.535.2-25.8000112.5
1088T39.5Very low41.8Very low125 Ų125134.1 Ų134.177%0.76781%0.812SS**  trans-111.2147.1177.446.40000112.8
1089A43.4Very low41.4Very low99 Ų99132.5 Ų132.582%0.81881%0.814SS**  trans-168.3117.1160.900000107.6
1090N40.3Very low41.3Very low145 Ų145128.1 Ų128.178%0.77582%0.816SS**  cis82146.913.9-15231.2000116.7
1091E41.5Very low41.1Very low185 Ų185127 Ų12786%0.86481%0.814SS**  trans69.8142.2-175.8-53.6179.7-159.600115.3
1092G37.2Very low41.3Very low71 Ų71127.1 Ų127.173%0.73282%0.815SS**  cis167145.8-1.600000109.8
1093P43.6Very low41.4Very low127 Ų127127 Ų12783%0.82581%0.814SS**  trans-102.4153.4-166.137.6-35000115.4
1094S41.8Very low41.4Very low113 Ų113128.9 Ų128.979%0.7981%0.814SS**  trans-173.3139.7139.938.20000115.9
1095N37.5Very low41.6Very low152 Ų152130.3 Ų130.381%0.81382%0.815SS**  trans6129.2150.4-50.9-18.2000120.4
1096S41.1Very low41.6Very low129 Ų129131.2 Ų131.290%0.90280%0.803SS**  -176159.498.942.50000112.1
1097A35.6Very low42.3Very low95 Ų95131 Ų13179%0.78580%0.8SS**  trans-97.9152.7-176.600000112.7
1098T37.3Very low42.6Very low140 Ų140131.7 Ų131.786%0.85979%0.792SS**  trans-155.5145.5144.1-70.30000108.7
1099T35.2Very low44.1Very low137 Ų137132.5 Ų132.584%0.8478%0.781SS**  trans-86139.2-172.749.50000113.7
1100S38.8Very low45.3Very low123 Ų123130.4 Ų130.486%0.8676%0.755SS**  trans-149.5118.4150.359.50000109.5
1101A35.7Very low46.6Very low97 Ų97130.1 Ų130.180%0.80275%0.747SS**  trans-107.8142.7-178.200000111.2
1102T43.6Very low47.7Very low139 Ų139126.7 Ų126.785%0.85374%0.735SS**  trans-157.4114.4158.315.30000112.4
1103S40.3Very low49.2Very low109 Ų109127.4 Ų127.476%0.76273%0.725SS**  trans46.587.3134.8-177.40000119.1
1104Q44.1Very low50.2Low176 Ų176127.7 Ų127.782%0.82272%0.718SS**SBendtrans-135.9-11.4156.7-158.2135.6-11.100115.8
1105D53.5Low51.2Low145 Ų145126 Ų12678%0.77571%0.707SS**THydrogen-bonded Turntrans-90.1-3.1-176.4-52.4-52.4000115.6F1107D1105-F1107 VanDerWaalsContact C-N 3.29Å; D1105-F1107 PolarHBondContact O-N 3.24Å
1106Y50.2Low51.4Low145 Ų145121 Ų12157%0.56969%0.69SS**Hα-helixtrans-72.8-20.4-173.9-155.8-118.6000113.5W1109 I1110Y1106-W1109 HydrophobicContact CD2-CE3 4.06Å; Y1106-W1109 AromaticContact CE2-CE3 3.64Å; Y1106-W1109 HydrophobicContact CE2-CE3 3.64Å; Y1106-W1109 AromaticContact CE2-CZ3 3.68Å; Y1106-W1109 HydrophobicContact CE2-CZ3 3.68Å; Y1106-W1109 AromaticContact CZ-CZ3 3.81Å; Y1106-I1110 HydrophobicContact CD1-CD1 3.58Å; Y1106-I1110 HydrophobicContact CD1-CG1 4.3Å; Y1106-I1110 HydrophobicContact CE1-CD1 3.61Å; Y1106-I1110 HydrophobicContact CE1-CG1 4.28Å; Y1106-I1110 HydrophobicContact CG-CD1 4.48Å; Y1106-I1110 WeakPolarHBondContact O-CB 3.5Å; Y1106-I1110 VanDerWaalsContact O-CG1 3.31Å; Y1106-I1110 WeakPolarHBondContact O-CG1 3.46Å; Y1106-I1110 PolarHBondContact O-N 3.26Å; Y1106-I1110 VanDerWaalsContact O-N 3.12Å
1107F52.6Low51.6Low169 Ų169123.6 Ų123.674%0.74169%0.688SS**Hα-helixtrans-80.9-33.9-177.6-98.7-82.4000114.2D1105 K1111D1105-F1107 VanDerWaalsContact C-N 3.29Å; D1105-F1107 PolarHBondContact O-N 3.24Å; F1107-K1111 WeakPolarHBondContact O-CB 3.35Å; F1107-K1111 PolarHBondContact O-N 3.37Å
1108E62.2Low51.7Low144 Ų144123.8 Ų123.867%0.67369%0.69SS**Hα-helixtrans-70.8-41.8172.8-62.3-148.1129.100110.7I1110 K1111 D1112E1108-I1110 VanDerWaalsContact C-N 3.33Å; E1108-I1110 PolarHBondContact O-N 3.28Å; E1108-K1111 WeakPolarHBondContact O-CA 3.46Å; E1108-K1111 VanDerWaalsContact O-CB 3.28Å; E1108-K1111 WeakPolarHBondContact O-CB 3.33Å; E1108-K1111 PolarHBondContact O-N 3.01Å; E1108-D1112 PolarHBondContact O-N 3.34Å
1109W69.7Low52.1Low142 Ų142126.1 Ų126.154%0.53869%0.688SS.*Hα-helixtrans-59.6-40.9173.7-177.271.9000113Y1106 K1111 D1112 V1113Y1106-W1109 HydrophobicContact CD2-CE3 4.06Å; Y1106-W1109 AromaticContact CE2-CE3 3.64Å; Y1106-W1109 HydrophobicContact CE2-CE3 3.64Å; Y1106-W1109 AromaticContact CE2-CZ3 3.68Å; Y1106-W1109 HydrophobicContact CE2-CZ3 3.68Å; Y1106-W1109 AromaticContact CZ-CZ3 3.81Å; W1109-K1111 VanDerWaalsContact C-N 3.32Å; W1109-K1111 PolarHBondContact O-N 3.38Å; W1109-D1112 PolarHBondContact O-N 2.91Å; W1109-V1113 HydrophobicContact CD2-CG2 4.12Å; W1109-V1113 HydrophobicContact CH2-CG2 4.36Å; W1109-V1113 HydrophobicContact CZ2-CG2 3.85Å; W1109-V1113 WeakPolarHBondContact O-CB 3.38Å; W1109-V1113 VanDerWaalsContact O-CG2 3.25Å; W1109-V1113 WeakPolarHBondContact O-CG2 3.49Å; W1109-V1113 PolarHBondContact O-N 3.18Å
1110I70Confident52.3Low55 Ų55124.9 Ų124.928%0.28269%0.685SS.*Hα-helixtrans-62.8-38.4172.2-78.7173.4000111.7Y1106 E1108 V1113 I1114Y1106-I1110 HydrophobicContact CD1-CD1 3.58Å; Y1106-I1110 HydrophobicContact CD1-CG1 4.3Å; Y1106-I1110 HydrophobicContact CE1-CD1 3.61Å; Y1106-I1110 HydrophobicContact CE1-CG1 4.28Å; Y1106-I1110 HydrophobicContact CG-CD1 4.48Å; Y1106-I1110 WeakPolarHBondContact O-CB 3.5Å; Y1106-I1110 VanDerWaalsContact O-CG1 3.31Å; Y1106-I1110 WeakPolarHBondContact O-CG1 3.46Å; Y1106-I1110 PolarHBondContact O-N 3.26Å; Y1106-I1110 VanDerWaalsContact O-N 3.12Å; E1108-I1110 VanDerWaalsContact C-N 3.33Å; E1108-I1110 PolarHBondContact O-N 3.28Å; I1110-V1113 PolarHBondContact O-N 2.92Å; I1110-I1114 HydrophobicContact CG2-CD1 3.59Å; I1110-I1114 HydrophobicContact CG2-CG1 4.29Å; I1110-I1114 WeakPolarHBondContact O-CB 3.4Å; I1110-I1114 VanDerWaalsContact O-CG1 3.29Å; I1110-I1114 WeakPolarHBondContact O-CG1 3.46Å; I1110-I1114 PolarHBondContact O-N 2.91Å
1111K66.3Low52.3Low139 Ų139124.2 Ų124.260%0.60468%0.678SS**Hα-helixtrans-63.3-43.2178.6-165.5-177.8179-170.40111.4F1107 E1108 W1109 I1114 S1115F1107-K1111 WeakPolarHBondContact O-CB 3.35Å; F1107-K1111 PolarHBondContact O-N 3.37Å; E1108-K1111 WeakPolarHBondContact O-CA 3.46Å; E1108-K1111 VanDerWaalsContact O-CB 3.28Å; E1108-K1111 WeakPolarHBondContact O-CB 3.33Å; E1108-K1111 PolarHBondContact O-N 3.01Å; W1109-K1111 VanDerWaalsContact C-N 3.32Å; W1109-K1111 PolarHBondContact O-N 3.38Å; K1111-I1114 PolarHBondContact O-N 3.3Å; K1111-S1115 WeakPolarHBondContact O-CB 3.3Å; K1111-S1115 PolarHBondContact O-N 2.84Å; K1111-S1115 PolarHBondContact O-OG 3.35Å
1112D66.3Low52.5Low114 Ų114127 Ų12761%0.6168%0.678SS**Hα-helixtrans-68.1-41.6176.4-67.8-9.3000111.9E1108 W1109 I1114 S1115 G1116E1108-D1112 PolarHBondContact O-N 3.34Å; W1109-D1112 PolarHBondContact O-N 2.91Å; D1112-I1114 PolarHBondContact O-N 3.45Å; D1112-S1115 PolarHBondContact O-N 2.65Å; D1112-G1116 PolarHBondContact O-N 3.12Å
1113V68.4Low52.6Low85 Ų85127.1 Ų127.152%0.51568%0.679SS.*Hα-helixtrans-65.5-35.7177.11690000112.2W1109 I1110W1109-V1113 HydrophobicContact CD2-CG2 4.12Å; W1109-V1113 HydrophobicContact CH2-CG2 4.36Å; W1109-V1113 HydrophobicContact CZ2-CG2 3.85Å; W1109-V1113 WeakPolarHBondContact O-CB 3.38Å; W1109-V1113 VanDerWaalsContact O-CG2 3.25Å; W1109-V1113 WeakPolarHBondContact O-CG2 3.49Å; W1109-V1113 PolarHBondContact O-N 3.18Å; I1110-V1113 PolarHBondContact O-N 2.92Å
1114I63.7Low53.3Low134 Ų134126 Ų12669%0.68767%0.671SS**Hα-helixtrans-75.4-29.7174.5-70.5174.7000111.7I1110 K1111 D1112 G1116I1110-I1114 HydrophobicContact CG2-CD1 3.59Å; I1110-I1114 HydrophobicContact CG2-CG1 4.29Å; I1110-I1114 WeakPolarHBondContact O-CB 3.4Å; I1110-I1114 VanDerWaalsContact O-CG1 3.29Å; I1110-I1114 WeakPolarHBondContact O-CG1 3.46Å; I1110-I1114 PolarHBondContact O-N 2.91Å; K1111-I1114 PolarHBondContact O-N 3.3Å; D1112-I1114 PolarHBondContact O-N 3.45Å; I1114-G1116 PolarHBondContact O-N 3.38Å
1115S63.2Low53.4Low78 Ų78123.2 Ų123.255%0.54566%0.658SS.*Hα-helixtrans-71.4-14.2179.8-59.50000113.9K1111 D1112 E1117K1111-S1115 WeakPolarHBondContact O-CB 3.3Å; K1111-S1115 PolarHBondContact O-N 2.84Å; K1111-S1115 PolarHBondContact O-OG 3.35Å; D1112-S1115 PolarHBondContact O-N 2.65Å; S1115-E1117 VanDerWaalsContact C-N 3.33Å; S1115-E1117 PolarHBondContact O-N 2.92Å
1116G41.6Very low53.3Low46 Ų46120 Ų12047%0.47465%0.651SS.*  trans76.24.3158.700000117.7D1112 I1114 A1118D1112-G1116 PolarHBondContact O-N 3.12Å; I1114-G1116 PolarHBondContact O-N 3.38Å; G1116-A1118 VanDerWaalsContact C-N 3.3Å; G1116-A1118 PolarHBondContact O-N 3Å
1117E45.8Very low53.5Low184 Ų184117.6 Ų117.686%0.8666%0.656SS**  trans-76.7-10.7-177.6-62.4-159118.700114.5S1115 K1119S1115-E1117 VanDerWaalsContact C-N 3.33Å; S1115-E1117 PolarHBondContact O-N 2.92Å; E1117-K1119 PolarHBondContact O-N 2.75Å
1118A36.5Very low54Low99 Ų99115.4 Ų115.482%0.81865%0.646SS**  trans-73.591.7178.900000112.6G1116G1116-A1118 VanDerWaalsContact C-N 3.3Å; G1116-A1118 PolarHBondContact O-N 3Å
1119K46.4Very low54Low188 Ų188115 Ų11582%0.81764%0.638SS**  trans-124.4126.8170.4-76.6177.2-178.4163.20112.8E1117E1117-K1119 PolarHBondContact O-N 2.75Å
1120S40Very low54Low111 Ų111115.7 Ų115.778%0.77665%0.645SS**  trans-66.9148.1179.152.90000112.9
1121P37.6Very low53.9Low110 Ų110118.4 Ų118.471%0.71466%0.659SS**  trans-71.6-177.7171.233-36.6000112
1122I41.2Very low54.2Low156 Ų156115.6 Ų115.680%0.865%0.649SS**SBendtrans76.775175.1-43.9167.7000114
1123T45.3Very low54.5Low141 Ų141115.6 Ų115.687%0.86565%0.645SS**SBendtrans167-24132.134.40000113.9
1124S54Low54.9Low86 Ų86114.9 Ų114.960%0.60164%0.641SS**THydrogen-bonded Turntrans-86.5-9.4-16461.20000117.4A1126 S1127 K1128S1124-A1126 VanDerWaalsContact C-N 3.3Å; S1124-A1126 PolarHBondContact O-N 3.05Å; S1124-S1127 PolarHBondContact O-N 3.24Å; S1124-K1128 PolarHBondContact O-N 2.93Å; S1124-K1128 VanDerWaalsContact O-N 3.13Å
1125E47.3Very low55.5Low116 Ų116111.1 Ų111.154%0.54262%0.624SS.*Hα-helixtrans-57.4-35.5-171.6-73.4-15712900114.8S1127 K1128 R1129E1125-S1127 VanDerWaalsContact C-N 3.33Å; E1125-S1127 PolarHBondContact O-N 3.49Å; E1125-K1128 PolarHBondContact O-N 3.33Å; E1125-R1129 WeakPolarHBondContact O-CG 3.42Å; E1125-R1129 PolarHBondContact O-N 2.69Å; E1125-R1129 IonicContact OE1-CZ 3.18Å; E1125-R1129 IonicContact OE1-NH1 2.75Å; E1125-R1129 IonicContact OE1-NH2 3.43Å; E1125-R1129 PolarHBondContact OE1-NH2 3.45Å; E1125-R1129 IonicContact OE2-CZ 2.74Å; E1125-R1129 VanDerWaalsContact OE2-CZ 3.25Å; E1125-R1129 IonicContact OE2-NH1 3.27Å; E1125-R1129 PolarHBondContact OE2-NH1 3.28Å; E1125-R1129 IonicContact OE2-NH2 3.46Å; E1125-R1129 PolarHBondContact OE2-NH2 2.89Å
1126A50.7Low56.3Low77 Ų77111.2 Ų111.264%0.63662%0.621SS**Hα-helixtrans-64.6-39.1-176.500000112S1124 K1130S1124-A1126 VanDerWaalsContact C-N 3.3Å; S1124-A1126 PolarHBondContact O-N 3.05Å; A1126-K1130 PolarHBondContact O-N 3.29Å
1127S54.8Low58.1Low96 Ų96114.2 Ų114.267%0.67162%0.623SS**Hα-helixtrans-75-36173.9-57.40000111.8S1124 E1125 K1130 L1131S1124-S1127 PolarHBondContact O-N 3.24Å; E1125-S1127 VanDerWaalsContact C-N 3.33Å; E1125-S1127 PolarHBondContact O-N 3.49Å; S1127-K1130 PolarHBondContact O-N 2.82Å; S1127-L1131 WeakPolarHBondContact O-CB 3.41Å; S1127-L1131 PolarHBondContact O-N 2.9Å
1128K63Low59.6Low122 Ų122110 Ų11053%0.5361%0.606SS.*Hα-helixtrans-62.5-48.4176.2-163.4178.4-172.5-88.70111.3S1124 E1125 K1130 L1131 E1132S1124-K1128 PolarHBondContact O-N 2.93Å; S1124-K1128 VanDerWaalsContact O-N 3.13Å; E1125-K1128 PolarHBondContact O-N 3.33Å; K1128-K1130 VanDerWaalsContact C-N 3.3Å; K1128-K1130 PolarHBondContact O-N 3.15Å; K1128-L1131 WeakPolarHBondContact O-CB 3.49Å; K1128-L1131 PolarHBondContact O-N 2.82Å; K1128-L1131 VanDerWaalsContact O-N 3.13Å; K1128-E1132 HydrophobicContact CG-CG 4.44Å; K1128-E1132 IonicContact NZ-OE1 3.45Å; K1128-E1132 PolarHBondContact NZ-OE1 2.89Å; K1128-E1132 WeakPolarHBondContact O-CB 3.39Å; K1128-E1132 VanDerWaalsContact O-CG 3.27Å; K1128-E1132 WeakPolarHBondContact O-CG 3.29Å; K1128-E1132 PolarHBondContact O-N 2.86Å
1129R62.2Low61.7Low137 Ų137111 Ų11152%0.51759%0.594SS.*Hα-helixtrans-61.4-35.5176.4-72-178-178.8110.913.3113.2E1125 E1132 Q1133E1125-R1129 WeakPolarHBondContact O-CG 3.42Å; E1125-R1129 PolarHBondContact O-N 2.69Å; E1125-R1129 IonicContact OE1-CZ 3.18Å; E1125-R1129 IonicContact OE1-NH1 2.75Å; E1125-R1129 IonicContact OE1-NH2 3.43Å; E1125-R1129 PolarHBondContact OE1-NH2 3.45Å; E1125-R1129 IonicContact OE2-CZ 2.74Å; E1125-R1129 VanDerWaalsContact OE2-CZ 3.25Å; E1125-R1129 IonicContact OE2-NH1 3.27Å; E1125-R1129 PolarHBondContact OE2-NH1 3.28Å; E1125-R1129 IonicContact OE2-NH2 3.46Å; E1125-R1129 PolarHBondContact OE2-NH2 2.89Å; R1129-E1132 WeakPolarHBondContact CA-OE2 3.47Å; R1129-Q1133 WeakPolarHBondContact O-CB 3.41Å; R1129-Q1133 PolarHBondContact O-N 3.18Å
1130K70.2Confident63.5Low155 Ų155108 Ų10867%0.67458%0.58SS**Hα-helixtrans-72.9-32.9176.8-158.1170.8-173.2178.80112.3A1126 S1127 K1128 T1134A1126-K1130 PolarHBondContact O-N 3.29Å; S1127-K1130 PolarHBondContact O-N 2.82Å; K1128-K1130 VanDerWaalsContact C-N 3.3Å; K1128-K1130 PolarHBondContact O-N 3.15Å; K1130-T1134 PolarHBondContact O-N 2.9Å; K1130-T1134 VanDerWaalsContact O-N 3.15Å; K1130-T1134 PolarHBondContact O-OG1 3.49Å; K1130-T1134 VanDerWaalsContact O-OG1 3.06Å
1131L67.3Low65.4Low112 Ų112106.2 Ų106.259%0.58657%0.567SS**Hα-helixtrans-68.1-48.2170.7-173.164.5000110.9S1127 K1128 Q1133 T1134 T1135S1127-L1131 WeakPolarHBondContact O-CB 3.41Å; S1127-L1131 PolarHBondContact O-N 2.9Å; K1128-L1131 WeakPolarHBondContact O-CB 3.49Å; K1128-L1131 PolarHBondContact O-N 2.82Å; K1128-L1131 VanDerWaalsContact O-N 3.13Å; L1131-Q1133 VanDerWaalsContact C-N 3.32Å; L1131-Q1133 PolarHBondContact O-N 3.04Å; L1131-T1134 WeakPolarHBondContact CA-OG1 3.37Å; L1131-T1134 CarbonylContact O-C 3.54Å; L1131-T1134 PolarHBondContact O-N 3.44Å; L1131-T1134 VanDerWaalsContact O-N 3.08Å; L1131-T1134 PolarHBondContact O-OG1 2.95Å; L1131-T1135 PolarHBondContact O-N 3.34Å; L1131-T1135 PolarHBondContact O-OG1 3.2Å
1132E71.8Confident67.5Low81 Ų81103.9 Ų103.938%0.37955%0.551SS.*Hα-helixtrans-57.2-41.7176.5-71.9164.1162.100112.3K1128 R1129 T1135 T1136K1128-E1132 HydrophobicContact CG-CG 4.44Å; K1128-E1132 IonicContact NZ-OE1 3.45Å; K1128-E1132 PolarHBondContact NZ-OE1 2.89Å; K1128-E1132 WeakPolarHBondContact O-CB 3.39Å; K1128-E1132 VanDerWaalsContact O-CG 3.27Å; K1128-E1132 WeakPolarHBondContact O-CG 3.29Å; K1128-E1132 PolarHBondContact O-N 2.86Å; R1129-E1132 WeakPolarHBondContact CA-OE2 3.47Å; E1132-T1135 WeakPolarHBondContact CA-OG1 3.48Å; E1132-T1135 PolarHBondContact O-N 2.77Å; E1132-T1135 PolarHBondContact O-OG1 2.97Å; E1132-T1136 PolarHBondContact O-N 3.04Å; E1132-T1136 PolarHBondContact O-OG1 3.34Å; E1132-T1136 VanDerWaalsContact O-OG1 3.08Å
1133Q74.2Confident69.5Low113 Ų11399.9 Ų99.953%0.52853%0.529SS..Hα-helixtrans-63.6-46.6172.9-172.6175.5-1000111.7R1129 L1131 T1135 T1136 E1137R1129-Q1133 WeakPolarHBondContact O-CB 3.41Å; R1129-Q1133 PolarHBondContact O-N 3.18Å; L1131-Q1133 VanDerWaalsContact C-N 3.32Å; L1131-Q1133 PolarHBondContact O-N 3.04Å; Q1133-T1135 VanDerWaalsContact C-N 3.34Å; Q1133-T1135 PolarHBondContact O-N 2.9Å; Q1133-T1136 PolarHBondContact O-N 3.43Å; Q1133-T1136 PolarHBondContact O-OG1 3.26Å; Q1133-E1137 PolarHBondContact NE2-OE1 2.82Å; Q1133-E1137 WeakPolarHBondContact O-CG 3.26Å; Q1133-E1137 PolarHBondContact O-N 3.37Å
1134T75.5Confident71.2Confident70 Ų7097.7 Ų97.743%0.42951%0.509SS..Hα-helixtrans-69.2-26.7177.551.50000113.9K1130 L1131 L1138K1130-T1134 PolarHBondContact O-N 2.9Å; K1130-T1134 VanDerWaalsContact O-N 3.15Å; K1130-T1134 PolarHBondContact O-OG1 3.49Å; K1130-T1134 VanDerWaalsContact O-OG1 3.06Å; L1131-T1134 WeakPolarHBondContact CA-OG1 3.37Å; L1131-T1134 CarbonylContact O-C 3.54Å; L1131-T1134 PolarHBondContact O-N 3.44Å; L1131-T1134 VanDerWaalsContact O-N 3.08Å; L1131-T1134 PolarHBondContact O-OG1 2.95Å; T1134-L1138 VanDerWaalsContact O-CB 3.25Å; T1134-L1138 WeakPolarHBondContact O-CB 3.44Å; T1134-L1138 PolarHBondContact O-N 3.24Å
1135T77.1Confident72.5Confident56 Ų5696.4 Ų96.434%0.34449%0.492SS..Hα-helixtrans-72.1-41.5171.151.80000110.9L1131 E1132 Q1133 E1137 L1138 E1139L1131-T1135 PolarHBondContact O-N 3.34Å; L1131-T1135 PolarHBondContact O-OG1 3.2Å; E1132-T1135 WeakPolarHBondContact CA-OG1 3.48Å; E1132-T1135 PolarHBondContact O-N 2.77Å; E1132-T1135 PolarHBondContact O-OG1 2.97Å; Q1133-T1135 VanDerWaalsContact C-N 3.34Å; Q1133-T1135 PolarHBondContact O-N 2.9Å; T1135-E1137 VanDerWaalsContact C-N 3.35Å; T1135-E1137 PolarHBondContact O-N 2.87Å; T1135-L1138 CarbonylContact O-C 3.57Å; T1135-L1138 PolarHBondContact O-N 3.14Å; T1135-L1138 VanDerWaalsContact O-N 3.16Å; T1135-E1139 WeakPolarHBondContact O-CB 3.48Å; T1135-E1139 VanDerWaalsContact O-CG 3.26Å; T1135-E1139 WeakPolarHBondContact O-CG 3.32Å; T1135-E1139 PolarHBondContact O-N 3.19Å
1136T79.3Confident74.1Confident79 Ų7995 Ų9549%0.48548%0.482SS..Hα-helixtrans-65.3-34.7174.749.90000113.6E1132 Q1133 K1140E1132-T1136 PolarHBondContact O-N 3.04Å; E1132-T1136 PolarHBondContact O-OG1 3.34Å; E1132-T1136 VanDerWaalsContact O-OG1 3.08Å; Q1133-T1136 PolarHBondContact O-N 3.43Å; Q1133-T1136 PolarHBondContact O-OG1 3.26Å; T1136-K1140 WeakPolarHBondContact O-CB 3.48Å; T1136-K1140 PolarHBondContact O-N 3.46Å
1137E79.8Confident75.6Confident109 Ų10996.3 Ų96.351%0.50947%0.473SS..Hα-helixtrans-68-37.7171.3-72.9170.2-169.100111.7Q1133 T1135 C1141Q1133-E1137 PolarHBondContact NE2-OE1 2.82Å; Q1133-E1137 WeakPolarHBondContact O-CG 3.26Å; Q1133-E1137 PolarHBondContact O-N 3.37Å; T1135-E1137 VanDerWaalsContact C-N 3.35Å; T1135-E1137 PolarHBondContact O-N 2.87Å; E1137-C1141 WeakPolarHBondContact O-CB 3.18Å; E1137-C1141 PolarHBondContact O-N 3.24Å
1138L78.5Confident76.8Confident95 Ų9597.1 Ų97.150%0.49747%0.47SS..Hα-helixtrans-69.9-42.1175.6-171.469.7000112.4T1134 T1135 C1141 V1142T1134-L1138 VanDerWaalsContact O-CB 3.25Å; T1134-L1138 WeakPolarHBondContact O-CB 3.44Å; T1134-L1138 PolarHBondContact O-N 3.24Å; T1135-L1138 CarbonylContact O-C 3.57Å; T1135-L1138 PolarHBondContact O-N 3.14Å; T1135-L1138 VanDerWaalsContact O-N 3.16Å; L1138-C1141 CarbonylContact O-C 3.6Å; L1138-C1141 PolarHBondContact O-N 2.83Å; L1138-V1142 WeakPolarHBondContact O-CB 3.21Å; L1138-V1142 WeakPolarHBondContact O-CG2 3.41Å; L1138-V1142 PolarHBondContact O-N 2.93Å
1139E80Confident77.5Confident122 Ų12293.6 Ų93.657%0.5746%0.456SS*.Hα-helixtrans-60.1-45.2174.6-76.5164.2175.800110.6T1135 C1141 V1142 E1143T1135-E1139 WeakPolarHBondContact O-CB 3.48Å; T1135-E1139 VanDerWaalsContact O-CG 3.26Å; T1135-E1139 WeakPolarHBondContact O-CG 3.32Å; T1135-E1139 PolarHBondContact O-N 3.19Å; E1139-C1141 VanDerWaalsContact C-N 3.33Å; E1139-C1141 PolarHBondContact O-N 2.83Å; E1139-V1142 PolarHBondContact O-N 3.46Å; E1139-E1143 VanDerWaalsContact O-CB 3.22Å; E1139-E1143 WeakPolarHBondContact O-CB 3.3Å; E1139-E1143 PolarHBondContact O-N 3.47Å
1140K83.3Confident78.3Confident123 Ų12391.5 Ų91.554%0.53546%0.455SS..Hα-helixtrans-60.3-41.5173.3-176.3176.4177.8-64.90112.1T1136 E1143 E1144T1136-K1140 WeakPolarHBondContact O-CB 3.48Å; T1136-K1140 PolarHBondContact O-N 3.46Å; K1140-E1143 PolarHBondContact O-N 2.82Å; K1140-E1144 WeakPolarHBondContact CE-OE1 3.42Å; K1140-E1144 IonicContact NZ-OE1 3.8Å; K1140-E1144 PolarHBondContact NZ-OE1 2.64Å; K1140-E1144 IonicContact NZ-OE2 2.65Å; K1140-E1144 PolarHBondContact NZ-OE2 2.98Å; K1140-E1144 WeakPolarHBondContact O-CB 3.49Å; K1140-E1144 WeakPolarHBondContact O-CG 3.49Å; K1140-E1144 PolarHBondContact O-N 2.79Å
1141C80.8Confident78.5Confident74 Ų7487.9 Ų87.950%0.544%0.44SS..Hα-helixtrans-69.4-37.7177.6-171.30000112.7E1137 L1138 E1139 E1144 K1145E1137-C1141 WeakPolarHBondContact O-CB 3.18Å; E1137-C1141 PolarHBondContact O-N 3.24Å; L1138-C1141 CarbonylContact O-C 3.6Å; L1138-C1141 PolarHBondContact O-N 2.83Å; E1139-C1141 VanDerWaalsContact C-N 3.33Å; E1139-C1141 PolarHBondContact O-N 2.83Å; C1141-E1144 PolarHBondContact O-N 3.35Å; C1141-K1145 WeakPolarHBondContact O-CB 3.22Å; C1141-K1145 PolarHBondContact O-N 3.16Å
1142V81.2Confident79.2Confident62 Ų6286.5 Ų86.538%0.37643%0.433SS..Hα-helixtrans-65.6-41172.71670000110.8L1138 E1139 K1145 R1146L1138-V1142 WeakPolarHBondContact O-CB 3.21Å; L1138-V1142 WeakPolarHBondContact O-CG2 3.41Å; L1138-V1142 PolarHBondContact O-N 2.93Å; E1139-V1142 PolarHBondContact O-N 3.46Å; V1142-K1145 PolarHBondContact O-N 3.21Å; V1142-R1146 WeakPolarHBondContact O-CB 3.38Å; V1142-R1146 PolarHBondContact O-N 3.38Å
1143E82.4Confident79.4Confident72 Ų7286.3 Ų86.334%0.33644%0.435SS..Hα-helixtrans-71.9-30.7178.3-17657.3-158.300112.7E1139 K1140 R1146 K1147E1139-E1143 VanDerWaalsContact O-CB 3.22Å; E1139-E1143 WeakPolarHBondContact O-CB 3.3Å; E1139-E1143 PolarHBondContact O-N 3.47Å; K1140-E1143 PolarHBondContact O-N 2.82Å; E1143-R1146 IonicContact OE2-CZ 2.8Å; E1143-R1146 IonicContact OE2-NH1 3.86Å; E1143-R1146 PolarHBondContact OE2-NH1 2.97Å; E1143-K1147 WeakPolarHBondContact O-CG 3.38Å; E1143-K1147 PolarHBondContact O-N 3.31Å; E1143-K1147 IonicContact OE1-NZ 2.82Å; E1143-K1147 PolarHBondContact OE1-NZ 3.34Å
1144E81Confident79.4Confident94 Ų9486.5 Ų86.544%0.43944%0.436SS..Hα-helixtrans-71-39.7167.9-77.5169.6176.700111.6K1140 C1141 K1147 L1148K1140-E1144 WeakPolarHBondContact CE-OE1 3.42Å; K1140-E1144 IonicContact NZ-OE1 3.8Å; K1140-E1144 PolarHBondContact NZ-OE1 2.64Å; K1140-E1144 IonicContact NZ-OE2 2.65Å; K1140-E1144 PolarHBondContact NZ-OE2 2.98Å; K1140-E1144 WeakPolarHBondContact O-CB 3.49Å; K1140-E1144 WeakPolarHBondContact O-CG 3.49Å; K1140-E1144 PolarHBondContact O-N 2.79Å; C1141-E1144 PolarHBondContact O-N 3.35Å; E1144-K1147 PolarHBondContact O-N 2.88Å; E1144-L1148 WeakPolarHBondContact O-CG 3.47Å; E1144-L1148 PolarHBondContact O-N 3.21Å
1145K83.1Confident79.5Confident59 Ų5989.2 Ų89.226%0.25744%0.443SS..Hα-helixtrans-64.9-39.9172.5-177.9177.9177.8-88.10112.3L574 C1141 V1142 L1148 M1149L574-K1145 HydrophobicContact CD2-CD 3.59Å; C1141-K1145 WeakPolarHBondContact O-CB 3.22Å; C1141-K1145 PolarHBondContact O-N 3.16Å; V1142-K1145 PolarHBondContact O-N 3.21Å; K1145-L1148 PolarHBondContact O-N 3.34Å; K1145-M1149 PolarHBondContact NZ-SD 3.07Å; K1145-M1149 PolarHBondContact O-N 2.9Å
1146R80Confident79.5Confident87 Ų8791.1 Ų91.133%0.32845%0.447SS..Hα-helixtrans-56-55.4174.6173.7175.6-691214.3109.7E581 V1142 E1143 L1148 M1149 D1150E581-R1146 IonicContact OE1-CZ 2.71Å; E581-R1146 IonicContact OE1-NE 2.64Å; E581-R1146 PolarHBondContact OE1-NE 3.12Å; E581-R1146 IonicContact OE1-NH2 3.64Å; E581-R1146 PolarHBondContact OE1-NH2 3.36Å; V1142-R1146 WeakPolarHBondContact O-CB 3.38Å; V1142-R1146 PolarHBondContact O-N 3.38Å; E1143-R1146 IonicContact OE2-CZ 2.8Å; E1143-R1146 IonicContact OE2-NH1 3.86Å; E1143-R1146 PolarHBondContact OE2-NH1 2.97Å; R1146-L1148 VanDerWaalsContact C-N 3.28Å; R1146-L1148 PolarHBondContact O-N 2.99Å; R1146-M1149 CarbonylContact O-C 3.57Å; R1146-M1149 WeakPolarHBondContact O-CA 3.4Å; R1146-M1149 WeakPolarHBondContact O-CB 3.41Å; R1146-M1149 PolarHBondContact O-N 3.15Å; R1146-D1150 WeakPolarHBondContact CG-OD2 3.27Å; R1146-D1150 VanDerWaalsContact O-CG 3.26Å; R1146-D1150 PolarHBondContact O-N 3.06Å
1147K83.2Confident79.3Confident104 Ų10489.9 Ų89.945%0.45245%0.445SS..Hα-helixtrans-55.7-38.5176.4-72.3176.3171.277.90113.4E1143 E1144 Q1151E1143-K1147 WeakPolarHBondContact O-CG 3.38Å; E1143-K1147 PolarHBondContact O-N 3.31Å; E1143-K1147 IonicContact OE1-NZ 2.82Å; E1143-K1147 PolarHBondContact OE1-NZ 3.34Å; E1144-K1147 PolarHBondContact O-N 2.88Å; K1147-Q1151 WeakPolarHBondContact O-CB 3.3Å; K1147-Q1151 VanDerWaalsContact O-CG 3.24Å; K1147-Q1151 WeakPolarHBondContact O-CG 3.44Å; K1147-Q1151 PolarHBondContact O-N 2.98Å
1148L79.9Confident79.3Confident114 Ų11489.8 Ų89.860%0.59745%0.447SS*.Hα-helixtrans-70.2-29.6174.4-72.8168.1000113.3E1144 K1145 R1146 L1152E1144-L1148 WeakPolarHBondContact O-CG 3.47Å; E1144-L1148 PolarHBondContact O-N 3.21Å; K1145-L1148 PolarHBondContact O-N 3.34Å; R1146-L1148 VanDerWaalsContact C-N 3.28Å; R1146-L1148 PolarHBondContact O-N 2.99Å; L1148-L1152 WeakPolarHBondContact O-CB 3.37Å; L1148-L1152 PolarHBondContact O-N 3.36Å; L1148-L1152 VanDerWaalsContact O-N 3.13Å
1149M76.9Confident79.1Confident48 Ų4889.6 Ų89.624%0.23645%0.45CS..Hα-helixtrans-76.3-42172-82.5-168.353.800112.2Q578 K1145 R1146 Q1151 L1152 D1153Q578-M1149 HydrophobicContact CG-CE 4.48Å; Q578-M1149 HydrophobicContact CG-SD 4.28Å; Q578-M1149 PolarHBondContact NE2-SD 2.87Å; K1145-M1149 PolarHBondContact NZ-SD 3.07Å; K1145-M1149 PolarHBondContact O-N 2.9Å; R1146-M1149 CarbonylContact O-C 3.57Å; R1146-M1149 WeakPolarHBondContact O-CA 3.4Å; R1146-M1149 WeakPolarHBondContact O-CB 3.41Å; R1146-M1149 PolarHBondContact O-N 3.15Å; M1149-Q1151 VanDerWaalsContact C-N 3.3Å; M1149-Q1151 PolarHBondContact O-N 3.32Å; M1149-L1152 PolarHBondContact O-N 3.15Å; M1149-L1152 VanDerWaalsContact O-N 3.1Å; M1149-D1153 PolarHBondContact O-N 3.12Å
1150D78Confident79.1Confident92 Ų9290.4 Ų90.449%0.49245%0.454SS..Hα-helixtrans-56.1-47.2173.2-60-36.7000110R1146 L1152 D1153 E1154R1146-D1150 WeakPolarHBondContact CG-OD2 3.27Å; R1146-D1150 VanDerWaalsContact O-CG 3.26Å; R1146-D1150 PolarHBondContact O-N 3.06Å; D1150-L1152 PolarHBondContact O-N 3.3Å; D1150-D1153 PolarHBondContact O-N 3.47Å; D1150-E1154 VanDerWaalsContact O-CB 3.28Å; D1150-E1154 WeakPolarHBondContact O-CB 3.4Å; D1150-E1154 PolarHBondContact O-N 2.68Å
1151Q75.6Confident79Confident79 Ų7987.8 Ų87.837%0.36945%0.451SS..Hα-helixtrans-61.8-39.2174.4-76.3177.5-28.800113.3K1147 M1149 Q1155K1147-Q1151 WeakPolarHBondContact O-CB 3.3Å; K1147-Q1151 VanDerWaalsContact O-CG 3.24Å; K1147-Q1151 WeakPolarHBondContact O-CG 3.44Å; K1147-Q1151 PolarHBondContact O-N 2.98Å; M1149-Q1151 VanDerWaalsContact C-N 3.3Å; M1149-Q1151 PolarHBondContact O-N 3.32Å; Q1151-Q1155 WeakPolarHBondContact O-CB 3.39Å; Q1151-Q1155 WeakPolarHBondContact O-CG 3.46Å; Q1151-Q1155 PolarHBondContact O-N 2.93Å
1152L81.5Confident78.8Confident83 Ų8388.4 Ų88.444%0.43545%0.449SS..Hα-helixtrans-69.2-36.5178179.162.8000111.9L1148 M1149 D1150 K1156L1148-L1152 WeakPolarHBondContact O-CB 3.37Å; L1148-L1152 PolarHBondContact O-N 3.36Å; L1148-L1152 VanDerWaalsContact O-N 3.13Å; M1149-L1152 PolarHBondContact O-N 3.15Å; M1149-L1152 VanDerWaalsContact O-N 3.1Å; D1150-L1152 PolarHBondContact O-N 3.3Å; L1152-K1156 VanDerWaalsContact O-CG 3.32Å; L1152-K1156 WeakPolarHBondContact O-CG 3.41Å; L1152-K1156 PolarHBondContact O-N 2.76Å
1153D76.3Confident78.8Confident77 Ų7788.7 Ų88.741%0.41245%0.451SS..Hα-helixtrans-79.2-30.6177.8-72.6-14.9000111.9M1149 D1150 K1156 A1157M1149-D1153 PolarHBondContact O-N 3.12Å; D1150-D1153 PolarHBondContact O-N 3.47Å; D1153-K1156 PolarHBondContact O-N 2.92Å; D1153-K1156 WeakPolarHBondContact OD1-CD 3.49Å; D1153-K1156 WeakPolarHBondContact OD1-CE 3.19Å; D1153-K1156 IonicContact OD1-NZ 3.93Å; D1153-K1156 PolarHBondContact OD1-NZ 3.49Å; D1153-A1157 WeakPolarHBondContact O-CB 3.15Å; D1153-A1157 PolarHBondContact O-N 2.83Å
1154E75.1Confident78.4Confident118 Ų11886.7 Ų86.755%0.55145%0.449SS*.Hα-helixtrans-64.4-43.2166.9-173.8169-136.200111.5D1150 K1156 A1157 L1158D1150-E1154 VanDerWaalsContact O-CB 3.28Å; D1150-E1154 WeakPolarHBondContact O-CB 3.4Å; D1150-E1154 PolarHBondContact O-N 2.68Å; E1154-K1156 PolarHBondContact O-N 3.25Å; E1154-A1157 PolarHBondContact O-N 3.3Å; E1154-L1158 PolarHBondContact O-N 3.09Å
1155Q75.6Confident78.1Confident126 Ų12687 Ų8759%0.58945%0.45SS*.Hα-helixtrans-62.5-40.9171.5-78.7-172.4-5.700112.4Q1151 A1157 L1158 V1159Q1151-Q1155 WeakPolarHBondContact O-CB 3.39Å; Q1151-Q1155 WeakPolarHBondContact O-CG 3.46Å; Q1151-Q1155 PolarHBondContact O-N 2.93Å; Q1155-A1157 VanDerWaalsContact C-N 3.35Å; Q1155-L1158 PolarHBondContact O-N 3.31Å; Q1155-V1159 WeakPolarHBondContact O-CG2 3.33Å; Q1155-V1159 PolarHBondContact O-N 2.91Å
1156K77.1Confident77.5Confident96 Ų9689.5 Ų89.542%0.41747%0.466SS..Hα-helixtrans-61.9-42.4172.6-72.6168.1-160.9154.20111.5L1152 D1153 E1154 V1159 Q1160L1152-K1156 VanDerWaalsContact O-CG 3.32Å; L1152-K1156 WeakPolarHBondContact O-CG 3.41Å; L1152-K1156 PolarHBondContact O-N 2.76Å; D1153-K1156 PolarHBondContact O-N 2.92Å; D1153-K1156 WeakPolarHBondContact OD1-CD 3.49Å; D1153-K1156 WeakPolarHBondContact OD1-CE 3.19Å; D1153-K1156 IonicContact OD1-NZ 3.93Å; D1153-K1156 PolarHBondContact OD1-NZ 3.49Å; E1154-K1156 PolarHBondContact O-N 3.25Å; K1156-V1159 PolarHBondContact O-N 2.98Å; K1156-Q1160 WeakPolarHBondContact O-CB 3.4Å; K1156-Q1160 VanDerWaalsContact O-CG 3.23Å; K1156-Q1160 WeakPolarHBondContact O-CG 3.43Å; K1156-Q1160 PolarHBondContact O-N 2.84Å
1157A76.4Confident77.4Confident54 Ų5490.5 Ų90.545%0.44648%0.477SS..Hα-helixtrans-63.1-41.5177.700000111.6D1153 E1154 Q1155 Q1160 S1161D1153-A1157 WeakPolarHBondContact O-CB 3.15Å; D1153-A1157 PolarHBondContact O-N 2.83Å; E1154-A1157 PolarHBondContact O-N 3.3Å; Q1155-A1157 VanDerWaalsContact C-N 3.35Å; A1157-Q1160 PolarHBondContact O-N 3.24Å; A1157-S1161 VanDerWaalsContact O-CB 3.3Å; A1157-S1161 WeakPolarHBondContact O-CB 3.29Å; A1157-S1161 PolarHBondContact O-N 3.46Å
1158L80.3Confident76.9Confident107 Ų10788.9 Ų88.956%0.5647%0.473SS*.Hα-helixtrans-63.4-47.2174.5-177.662.7000111.9E1154 Q1155 Q1160 S1161 L1162E1154-L1158 PolarHBondContact O-N 3.09Å; Q1155-L1158 PolarHBondContact O-N 3.31Å; L1158-Q1160 VanDerWaalsContact C-N 3.34Å; L1158-Q1160 PolarHBondContact O-N 3.19Å; L1158-S1161 WeakPolarHBondContact O-CB 3.16Å; L1158-S1161 PolarHBondContact O-N 2.87Å; L1158-L1162 HydrophobicContact CD1-CD1 4.26Å; L1158-L1162 HydrophobicContact CD1-CG 4.41Å; L1158-L1162 HydrophobicContact CG-CD1 4.12Å; L1158-L1162 WeakPolarHBondContact O-CG 3.23Å; L1158-L1162 PolarHBondContact O-N 3.2Å
1159V74.2Confident76.3Confident90 Ų9091.3 Ų91.355%0.54548%0.475SS..Hα-helixtrans-63.5-39.1177.2170.50000111.6Q1155 K1156 T1163Q1155-V1159 WeakPolarHBondContact O-CG2 3.33Å; Q1155-V1159 PolarHBondContact O-N 2.91Å; K1156-V1159 PolarHBondContact O-N 2.98Å; V1159-T1163 VanDerWaalsContact O-CB 3.24Å; V1159-T1163 WeakPolarHBondContact O-CB 3.5Å; V1159-T1163 PolarHBondContact O-N 3.09Å; V1159-T1163 PolarHBondContact O-OG1 2.91Å
1160Q78.4Confident76.1Confident140 Ų14097.2 Ų97.265%0.65450%0.495SS*.Hα-helixtrans-67.3-39.4174.1-73.717517.500112K1156 A1157 L1158 T1163 G1164K1156-Q1160 WeakPolarHBondContact O-CB 3.4Å; K1156-Q1160 VanDerWaalsContact O-CG 3.23Å; K1156-Q1160 WeakPolarHBondContact O-CG 3.43Å; K1156-Q1160 PolarHBondContact O-N 2.84Å; A1157-Q1160 PolarHBondContact O-N 3.24Å; L1158-Q1160 VanDerWaalsContact C-N 3.34Å; L1158-Q1160 PolarHBondContact O-N 3.19Å; Q1160-T1163 PolarHBondContact O-N 2.88Å; Q1160-G1164 PolarHBondContact O-N 3.08Å
1161S82.9Confident75.8Confident67 Ų6795 Ų9547%0.46949%0.49SS..Hα-helixtrans-61.4-53.5175-1700000111.2A1157 L1158 T1163 G1164 E1165A1157-S1161 VanDerWaalsContact O-CB 3.3Å; A1157-S1161 WeakPolarHBondContact O-CB 3.29Å; A1157-S1161 PolarHBondContact O-N 3.46Å; L1158-S1161 WeakPolarHBondContact O-CB 3.16Å; L1158-S1161 PolarHBondContact O-N 2.87Å; S1161-T1163 VanDerWaalsContact C-N 3.32Å; S1161-T1163 PolarHBondContact O-N 2.97Å; S1161-G1164 CarbonylContact O-C 3.53Å; S1161-G1164 WeakPolarHBondContact O-CA 3.42Å; S1161-G1164 PolarHBondContact O-N 3.08Å; S1161-E1165 PolarHBondContact O-N 3.24Å
1162L75.4Confident75.5Confident88 Ų8894.3 Ų94.346%0.46149%0.486SS..Hα-helixtrans-60.9-38.2177-70.5169.6000112.4L1158 E1165 L1166L1158-L1162 HydrophobicContact CD1-CD1 4.26Å; L1158-L1162 HydrophobicContact CD1-CG 4.41Å; L1158-L1162 HydrophobicContact CG-CD1 4.12Å; L1158-L1162 WeakPolarHBondContact O-CG 3.23Å; L1158-L1162 PolarHBondContact O-N 3.2Å; L1162-E1165 PolarHBondContact O-N 3.48Å; L1162-L1166 WeakPolarHBondContact O-CB 3.36Å; L1162-L1166 VanDerWaalsContact O-CG 3.31Å; L1162-L1166 WeakPolarHBondContact O-CG 3.24Å; L1162-L1166 PolarHBondContact O-N 2.81Å
1163T81.4Confident74.8Confident68 Ų6893.3 Ų93.342%0.41748%0.479SS..Hα-helixtrans-64-41.6173.3-60.10000111.1V1159 Q1160 S1161 L1166 I1167V1159-T1163 VanDerWaalsContact O-CB 3.24Å; V1159-T1163 WeakPolarHBondContact O-CB 3.5Å; V1159-T1163 PolarHBondContact O-N 3.09Å; V1159-T1163 PolarHBondContact O-OG1 2.91Å; Q1160-T1163 PolarHBondContact O-N 2.88Å; S1161-T1163 VanDerWaalsContact C-N 3.32Å; S1161-T1163 PolarHBondContact O-N 2.97Å; T1163-L1166 PolarHBondContact O-N 3.38Å; T1163-I1167 HydrophobicContact CG2-CD1 4Å; T1163-I1167 WeakPolarHBondContact O-CB 3.45Å; T1163-I1167 WeakPolarHBondContact O-CD1 3.24Å; T1163-I1167 VanDerWaalsContact O-CG1 3.25Å; T1163-I1167 WeakPolarHBondContact O-CG1 3.44Å; T1163-I1167 PolarHBondContact O-N 2.83Å
1164G74.3Confident74.8Confident29 Ų2991 Ų9130%0.29947%0.473SS..Hα-helixtrans-61-46.7173.600000112.4Q1160 S1161 I1167 L1168Q1160-G1164 PolarHBondContact O-N 3.08Å; S1161-G1164 CarbonylContact O-C 3.53Å; S1161-G1164 WeakPolarHBondContact O-CA 3.42Å; S1161-G1164 PolarHBondContact O-N 3.08Å; G1164-I1167 PolarHBondContact O-N 3.06Å; G1164-L1168 WeakPolarHBondContact O-CB 3.46Å; G1164-L1168 VanDerWaalsContact O-CG 3.22Å; G1164-L1168 WeakPolarHBondContact O-CG 3.24Å; G1164-L1168 PolarHBondContact O-N 2.9Å
1165E74.4Confident74.5Confident101 Ų10188.8 Ų88.847%0.47246%0.46SS..Hα-helixtrans-63.3-44.2176.2-68.1-161.4143.500112.3S1161 L1162 I1167 L1168 Y1169S1161-E1165 PolarHBondContact O-N 3.24Å; L1162-E1165 PolarHBondContact O-N 3.48Å; E1165-I1167 VanDerWaalsContact C-N 3.31Å; E1165-I1167 PolarHBondContact O-N 3.09Å; E1165-L1168 CarbonylContact O-C 3.58Å; E1165-L1168 WeakPolarHBondContact O-CA 3.37Å; E1165-L1168 WeakPolarHBondContact O-CB 3.33Å; E1165-L1168 PolarHBondContact O-N 2.98Å; E1165-Y1169 WeakPolarHBondContact O-CD2 3.39Å; E1165-Y1169 PolarHBondContact O-N 3.36Å
1166L70.4Confident74.4Confident111 Ų11185 Ų8558%0.58145%0.446SS*.Hα-helixtrans-60.9-38.2175.2-75.3167.9000112.6L1162 T1163 R1170L1162-L1166 WeakPolarHBondContact O-CB 3.36Å; L1162-L1166 VanDerWaalsContact O-CG 3.31Å; L1162-L1166 WeakPolarHBondContact O-CG 3.24Å; L1162-L1166 PolarHBondContact O-N 2.81Å; T1163-L1166 PolarHBondContact O-N 3.38Å; L1166-R1170 WeakPolarHBondContact O-CB 3.41Å; L1166-R1170 PolarHBondContact O-N 2.94Å; L1166-R1170 VanDerWaalsContact O-N 3.12Å
1167I77.4Confident74.3Confident108 Ų10883.5 Ų83.555%0.55444%0.444SS*.Hα-helixtrans-65.5-40.1172.5-71166.5000110.8T1163 G1164 E1165 R1170 A1171T1163-I1167 HydrophobicContact CG2-CD1 4Å; T1163-I1167 WeakPolarHBondContact O-CB 3.45Å; T1163-I1167 WeakPolarHBondContact O-CD1 3.24Å; T1163-I1167 VanDerWaalsContact O-CG1 3.25Å; T1163-I1167 WeakPolarHBondContact O-CG1 3.44Å; T1163-I1167 PolarHBondContact O-N 2.83Å; G1164-I1167 PolarHBondContact O-N 3.06Å; E1165-I1167 VanDerWaalsContact C-N 3.31Å; E1165-I1167 PolarHBondContact O-N 3.09Å; I1167-R1170 PolarHBondContact O-N 3.13Å; I1167-A1171 WeakPolarHBondContact O-CB 3.32Å; I1167-A1171 PolarHBondContact O-N 3.17Å
1168L73.3Confident74.2Confident70 Ų7087.7 Ų87.737%0.36645%0.449SS..Hα-helixtrans-67.2-41.8177.6-72.9166.1000113G1164 E1165 R1170 A1171 E1172 R1615G1164-L1168 WeakPolarHBondContact O-CB 3.46Å; G1164-L1168 VanDerWaalsContact O-CG 3.22Å; G1164-L1168 WeakPolarHBondContact O-CG 3.24Å; G1164-L1168 PolarHBondContact O-N 2.9Å; E1165-L1168 CarbonylContact O-C 3.58Å; E1165-L1168 WeakPolarHBondContact O-CA 3.37Å; E1165-L1168 WeakPolarHBondContact O-CB 3.33Å; E1165-L1168 PolarHBondContact O-N 2.98Å; L1168-R1170 VanDerWaalsContact C-N 3.33Å; L1168-R1170 PolarHBondContact O-N 3.26Å; L1168-A1171 PolarHBondContact O-N 3.38Å; L1168-E1172 PolarHBondContact O-N 2.89Å; L1168-R1615 VanDerWaalsContact CD2-NH1 3.33Å
1169Y68.1Low74Confident165 Ų16588 Ų8865%0.64744%0.442SS*.Hα-helixtrans-60.1-44172.9-83.9-70.7000111.3E1165 E1172 E1173E1165-Y1169 WeakPolarHBondContact O-CD2 3.39Å; E1165-Y1169 PolarHBondContact O-N 3.36Å; Y1169-E1172 PolarHBondContact O-N 3Å; Y1169-E1173 WeakPolarHBondContact O-CB 3.47Å; Y1169-E1173 PolarHBondContact O-N 2.84Å
1170R72.7Confident73.9Confident172 Ų17285.9 Ų85.965%0.64943%0.428SS*.Hα-helixtrans-67.9-32.3177.1-163176.7-170.7166.81.3113.1L1166 I1167 L1168 G1174L1166-R1170 WeakPolarHBondContact O-CB 3.41Å; L1166-R1170 PolarHBondContact O-N 2.94Å; L1166-R1170 VanDerWaalsContact O-N 3.12Å; I1167-R1170 PolarHBondContact O-N 3.13Å; L1168-R1170 VanDerWaalsContact C-N 3.33Å; L1168-R1170 PolarHBondContact O-N 3.26Å; R1170-G1174 PolarHBondContact O-N 3.08Å; R1170-G1174 VanDerWaalsContact O-N 3.12Å
1171A71Confident73.6Confident47 Ų4784.5 Ų84.539%0.38842%0.421SS..Hα-helixtrans-71.2-37.6172.700000111.9I1167 L1168 G1174 R1175I1167-A1171 WeakPolarHBondContact O-CB 3.32Å; I1167-A1171 PolarHBondContact O-N 3.17Å; L1168-A1171 PolarHBondContact O-N 3.38Å; A1171-G1174 CarbonylContact O-C 3.59Å; A1171-G1174 PolarHBondContact O-N 3.48Å; A1171-R1175 WeakPolarHBondContact O-CG 3.49Å; A1171-R1175 PolarHBondContact O-N 2.8Å
1172E69.4Low73.2Confident64 Ų6487.6 Ų87.630%0.29943%0.428SS..Hα-helixtrans-73.7-38.1176.1-167.560.1-16500112.2L1168 Y1169 G1174 R1175 V1176 R1179L1168-E1172 PolarHBondContact O-N 2.89Å; Y1169-E1172 PolarHBondContact O-N 3Å; E1172-G1174 VanDerWaalsContact C-N 3.28Å; E1172-G1174 PolarHBondContact O-N 2.98Å; E1172-R1175 CarbonylContact O-C 3.58Å; E1172-R1175 PolarHBondContact O-N 3.38Å; E1172-R1175 IonicContact OE2-CZ 2.6Å; E1172-R1175 VanDerWaalsContact OE2-CZ 3.23Å; E1172-R1175 IonicContact OE2-NE 3.48Å; E1172-R1175 PolarHBondContact OE2-NE 2.89Å; E1172-R1175 IonicContact OE2-NH2 3.19Å; E1172-R1175 PolarHBondContact OE2-NH2 3.23Å; E1172-V1176 HydrophobicContact CG-CG2 4.29Å; E1172-V1176 WeakPolarHBondContact O-CB 3.46Å; E1172-V1176 WeakPolarHBondContact O-CG2 3.38Å; E1172-V1176 PolarHBondContact O-N 3.42Å; E1172-R1179 IonicContact OE1-CZ 2.68Å; E1172-R1179 IonicContact OE1-NH2 3.93Å; E1172-R1179 PolarHBondContact OE1-NH2 3.39Å; E1172-R1179 IonicContact OE2-NH2 2.73Å
1173E67.5Low73.1Confident61 Ų6189.3 Ų89.329%0.28543%0.434SS..Hα-helixtrans-47.9-53.3164.3-178-171.3-168.100109.5Y1169 R1175 V1176 V1177 R1242Y1169-E1173 WeakPolarHBondContact O-CB 3.47Å; Y1169-E1173 PolarHBondContact O-N 2.84Å; E1173-R1175 VanDerWaalsContact C-N 3.29Å; E1173-R1175 PolarHBondContact O-N 3.44Å; E1173-V1176 PolarHBondContact O-N 2.84Å; E1173-V1177 WeakPolarHBondContact O-CB 3.39Å; E1173-V1177 WeakPolarHBondContact O-CG2 3.34Å; E1173-V1177 PolarHBondContact O-N 3.35Å; E1173-R1242 IonicContact OE1-CZ 2.74Å; E1173-R1242 IonicContact OE1-NH1 3.98Å; E1173-R1242 PolarHBondContact OE1-NH1 3.03Å; E1173-R1242 IonicContact OE2-NH1 3.02Å
1174G75.9Confident72.5Confident28 Ų2890.8 Ų90.829%0.28944%0.439SS..Hα-helixtrans-68.5-11176.200000116.7R1170 A1171 E1172 R1178R1170-G1174 PolarHBondContact O-N 3.08Å; R1170-G1174 VanDerWaalsContact O-N 3.12Å; A1171-G1174 CarbonylContact O-C 3.59Å; A1171-G1174 PolarHBondContact O-N 3.48Å; E1172-G1174 VanDerWaalsContact C-N 3.28Å; E1172-G1174 PolarHBondContact O-N 2.98Å; G1174-R1178 PolarHBondContact O-NE 2.79Å; G1174-R1178 PolarHBondContact O-NH2 2.97Å
1175R69.4Low72.4Confident72 Ų7291.8 Ų91.827%0.27244%0.441SS..Hα-helixtrans-101.5-25.2171.6-74.2-166.6-57.8-160.31.4113A1171 E1172 E1173 R1179 E1618A1171-R1175 WeakPolarHBondContact O-CG 3.49Å; A1171-R1175 PolarHBondContact O-N 2.8Å; E1172-R1175 CarbonylContact O-C 3.58Å; E1172-R1175 PolarHBondContact O-N 3.38Å; E1172-R1175 IonicContact OE2-CZ 2.6Å; E1172-R1175 VanDerWaalsContact OE2-CZ 3.23Å; E1172-R1175 IonicContact OE2-NE 3.48Å; E1172-R1175 PolarHBondContact OE2-NE 2.89Å; E1172-R1175 IonicContact OE2-NH2 3.19Å; E1172-R1175 PolarHBondContact OE2-NH2 3.23Å; E1173-R1175 VanDerWaalsContact C-N 3.29Å; E1173-R1175 PolarHBondContact O-N 3.44Å; R1175-R1179 WeakPolarHBondContact O-CB 3.19Å; R1175-R1179 PolarHBondContact O-N 2.96Å; R1175-R1179 VanDerWaalsContact O-N 3.12Å; R1175-R1179 PolarHBondContact O-NE 2.91Å; R1175-R1179 PolarHBondContact O-NH2 3.07Å; R1175-E1618 IonicContact CZ-OE2 3.37Å; R1175-E1618 IonicContact NH1-OE2 3.46Å; R1175-E1618 PolarHBondContact NH1-OE2 3.33Å
1176V72.4Confident72.2Confident47 Ų4790.2 Ų90.229%0.28545%0.445SS..Hα-helixtrans-74.1-46.2170.9171.30000109.2E1172 E1173 R1178 R1179 L1180E1172-V1176 HydrophobicContact CG-CG2 4.29Å; E1172-V1176 WeakPolarHBondContact O-CB 3.46Å; E1172-V1176 WeakPolarHBondContact O-CG2 3.38Å; E1172-V1176 PolarHBondContact O-N 3.42Å; E1173-V1176 PolarHBondContact O-N 2.84Å; V1176-R1178 PolarHBondContact O-N 2.96Å; V1176-R1179 PolarHBondContact O-N 3.2Å; V1176-L1180 HydrophobicContact CG1-CD1 3.95Å; V1176-L1180 HydrophobicContact CG1-CG 4.48Å; V1176-L1180 WeakPolarHBondContact O-CB 3.43Å; V1176-L1180 VanDerWaalsContact O-CG 3.29Å; V1176-L1180 WeakPolarHBondContact O-CG 3.14Å; V1176-L1180 PolarHBondContact O-N 3.28Å
1177V74.8Confident71.8Confident64 Ų6488.7 Ų88.739%0.38844%0.441SS..Hα-helixtrans-56.3-51.1172.8171.80000110.6E1173 R1179 L1180 E1181E1173-V1177 WeakPolarHBondContact O-CB 3.39Å; E1173-V1177 WeakPolarHBondContact O-CG2 3.34Å; E1173-V1177 PolarHBondContact O-N 3.35Å; V1177-R1179 PolarHBondContact O-N 3.07Å; V1177-L1180 CarbonylContact O-C 3.56Å; V1177-L1180 WeakPolarHBondContact O-CB 3.46Å; V1177-L1180 PolarHBondContact O-N 3.07Å; V1177-L1180 VanDerWaalsContact O-N 3.16Å; V1177-E1181 HydrophobicContact CG1-CG 4.29Å; V1177-E1181 WeakPolarHBondContact O-CG 3.36Å; V1177-E1181 PolarHBondContact O-N 3.08Å
1178R75.7Confident70.9Confident143 Ų14391 Ų9154%0.5445%0.447SS..Hα-helixtrans-62.5-41.4178.9-82.3-176.3-70.4159.5-2.5114.1G1174 V1176 L1180 E1181 E1182G1174-R1178 PolarHBondContact O-NE 2.79Å; G1174-R1178 PolarHBondContact O-NH2 2.97Å; V1176-R1178 PolarHBondContact O-N 2.96Å; R1178-L1180 VanDerWaalsContact C-N 3.31Å; R1178-L1180 PolarHBondContact O-N 2.77Å; R1178-E1181 PolarHBondContact O-N 3.45Å; R1178-E1182 WeakPolarHBondContact O-CB 3.36Å; R1178-E1182 WeakPolarHBondContact O-CG 3.36Å; R1178-E1182 PolarHBondContact O-N 3.22Å
1179R75.7Confident70Confident113 Ų11395.6 Ų95.643%0.42647%0.466SS..Hα-helixtrans-63.6-37.2174-85.5174.3-70.1176.1-3.2112.2E1172 R1175 V1176 V1177 Q1183E1172-R1179 IonicContact OE1-CZ 2.68Å; E1172-R1179 IonicContact OE1-NH2 3.93Å; E1172-R1179 PolarHBondContact OE1-NH2 3.39Å; E1172-R1179 IonicContact OE2-NH2 2.73Å; R1175-R1179 WeakPolarHBondContact O-CB 3.19Å; R1175-R1179 PolarHBondContact O-N 2.96Å; R1175-R1179 VanDerWaalsContact O-N 3.12Å; R1175-R1179 PolarHBondContact O-NE 2.91Å; R1175-R1179 PolarHBondContact O-NH2 3.07Å; V1176-R1179 PolarHBondContact O-N 3.2Å; V1177-R1179 PolarHBondContact O-N 3.07Å; R1179-Q1183 WeakPolarHBondContact O-CB 3.27Å; R1179-Q1183 VanDerWaalsContact O-CG 3.23Å; R1179-Q1183 WeakPolarHBondContact O-CG 3.42Å; R1179-Q1183 PolarHBondContact O-N 3.03Å
1180L70.7Confident69.2Low46 Ų4692.5 Ų92.524%0.24146%0.46CS..Hα-helixtrans-68.3-39.1173.7-71.1172.8000111.4V1176 V1177 R1178 Q1183 L1184 L1228V1176-L1180 HydrophobicContact CG1-CD1 3.95Å; V1176-L1180 HydrophobicContact CG1-CG 4.48Å; V1176-L1180 WeakPolarHBondContact O-CB 3.43Å; V1176-L1180 VanDerWaalsContact O-CG 3.29Å; V1176-L1180 WeakPolarHBondContact O-CG 3.14Å; V1176-L1180 PolarHBondContact O-N 3.28Å; V1177-L1180 CarbonylContact O-C 3.56Å; V1177-L1180 WeakPolarHBondContact O-CB 3.46Å; V1177-L1180 PolarHBondContact O-N 3.07Å; V1177-L1180 VanDerWaalsContact O-N 3.16Å; R1178-L1180 VanDerWaalsContact C-N 3.31Å; R1178-L1180 PolarHBondContact O-N 2.77Å; L1180-Q1183 PolarHBondContact O-N 3.23Å; L1180-L1184 WeakPolarHBondContact O-CB 3.47Å; L1180-L1184 WeakPolarHBondContact O-CD1 3.1Å; L1180-L1184 WeakPolarHBondContact O-CG 3.37Å; L1180-L1184 PolarHBondContact O-N 3.38Å; L1180-L1228 HydrophobicContact CD2-CD2 3.67Å
1181E73.1Confident68.3Low110 Ų11086.3 Ų86.351%0.51444%0.443SS..Hα-helixtrans-67-38.6174.5-73-178.1131.500112.7V1177 R1178 S1185V1177-E1181 HydrophobicContact CG1-CG 4.29Å; V1177-E1181 WeakPolarHBondContact O-CG 3.36Å; V1177-E1181 PolarHBondContact O-N 3.08Å; R1178-E1181 PolarHBondContact O-N 3.45Å; E1181-S1185 WeakPolarHBondContact O-CB 3.43Å; E1181-S1185 PolarHBondContact O-N 2.97Å; E1181-S1185 PolarHBondContact O-OG 3.03Å
1182E74.4Confident67.2Low133 Ų13392 Ų9262%0.62146%0.459SS*.Hα-helixtrans-66.8-45.1173.3-75.6178.514600111.3R1178 S1185 A1186R1178-E1182 WeakPolarHBondContact O-CB 3.36Å; R1178-E1182 WeakPolarHBondContact O-CG 3.36Å; R1178-E1182 PolarHBondContact O-N 3.22Å; E1182-S1185 PolarHBondContact O-N 2.99Å; E1182-S1185 VanDerWaalsContact O-N 3.14Å; E1182-A1186 WeakPolarHBondContact O-CB 3.09Å; E1182-A1186 PolarHBondContact O-N 3.22Å
1183Q72.8Confident66.7Low124 Ų12493.8 Ų93.858%0.57948%0.475SS*.Hα-helixtrans-64.7-39.5174.8-73.6175.8-3.200112R1179 L1180 S1185 T1187R1179-Q1183 WeakPolarHBondContact O-CB 3.27Å; R1179-Q1183 VanDerWaalsContact O-CG 3.23Å; R1179-Q1183 WeakPolarHBondContact O-CG 3.42Å; R1179-Q1183 PolarHBondContact O-N 3.03Å; L1180-Q1183 PolarHBondContact O-N 3.23Å; Q1183-S1185 VanDerWaalsContact C-N 3.3Å; Q1183-S1185 PolarHBondContact O-N 3.4Å; Q1183-T1187 WeakPolarHBondContact O-CB 3.39Å; Q1183-T1187 WeakPolarHBondContact O-CG2 3.44Å; Q1183-T1187 PolarHBondContact O-N 3Å; Q1183-T1187 PolarHBondContact O-OG1 3.08Å
1184L69.7Low66.3Low99 Ų9994.7 Ų94.752%0.51848%0.482SS..Hα-helixtrans-68.3-27172.5-75.3166.7000112.4L1180 T1187 K1188L1180-L1184 WeakPolarHBondContact O-CB 3.47Å; L1180-L1184 WeakPolarHBondContact O-CD1 3.1Å; L1180-L1184 WeakPolarHBondContact O-CG 3.37Å; L1180-L1184 PolarHBondContact O-N 3.38Å; L1184-T1187 WeakPolarHBondContact CA-OG1 3.37Å; L1184-T1187 PolarHBondContact O-OG1 3.03Å; L1184-K1188 WeakPolarHBondContact O-CB 3.42Å; L1184-K1188 WeakPolarHBondContact O-CD 3.42Å; L1184-K1188 WeakPolarHBondContact O-CG 3.28Å; L1184-K1188 PolarHBondContact O-N 2.66Å
1185S72.7Confident65.4Low50 Ų5098.4 Ų98.435%0.3550%0.495SS..Hα-helixtrans-83.5-40.6177.9-59.30000111.9E1181 E1182 Q1183 T1187 K1188 H1189E1181-S1185 WeakPolarHBondContact O-CB 3.43Å; E1181-S1185 PolarHBondContact O-N 2.97Å; E1181-S1185 PolarHBondContact O-OG 3.03Å; E1182-S1185 PolarHBondContact O-N 2.99Å; E1182-S1185 VanDerWaalsContact O-N 3.14Å; Q1183-S1185 VanDerWaalsContact C-N 3.3Å; Q1183-S1185 PolarHBondContact O-N 3.4Å; S1185-T1187 VanDerWaalsContact C-N 3.27Å; S1185-T1187 PolarHBondContact O-N 3.22Å; S1185-K1188 PolarHBondContact O-N 2.93Å; S1185-H1189 PolarHBondContact O-CD2 2.81Å; S1185-H1189 PolarHBondContact O-N 3.49Å
1186A68.3Low65Low68 Ų6899.4 Ų99.456%0.56251%0.505SS*.Hα-helixtrans-58.6-38.8168.900000111.8E1182E1182-A1186 WeakPolarHBondContact O-CB 3.09Å; E1182-A1186 PolarHBondContact O-N 3.22Å
1187T63Low64.2Low79 Ų79100.3 Ų100.349%0.48551%0.513SS..Hα-helixtrans-79.3-24175.450.60000114.3Q1183 L1184 S1185 H1189 L1190Q1183-T1187 WeakPolarHBondContact O-CB 3.39Å; Q1183-T1187 WeakPolarHBondContact O-CG2 3.44Å; Q1183-T1187 PolarHBondContact O-N 3Å; Q1183-T1187 PolarHBondContact O-OG1 3.08Å; L1184-T1187 WeakPolarHBondContact CA-OG1 3.37Å; L1184-T1187 PolarHBondContact O-OG1 3.03Å; S1185-T1187 VanDerWaalsContact C-N 3.27Å; S1185-T1187 PolarHBondContact O-N 3.22Å; T1187-H1189 PolarHBondContact O-N 3.14Å; T1187-L1190 PolarHBondContact O-N 2.82Å; T1187-L1190 VanDerWaalsContact O-N 3.15Å
1188K59.3Low63.3Low156 Ų156102 Ų10268%0.67852%0.523SS*.Hα-helixtrans-62.6-20.6169-82.9164.1-163165.60113.5L1184 S1185L1184-K1188 WeakPolarHBondContact O-CB 3.42Å; L1184-K1188 WeakPolarHBondContact O-CD 3.42Å; L1184-K1188 WeakPolarHBondContact O-CG 3.28Å; L1184-K1188 PolarHBondContact O-N 2.66Å; S1185-K1188 PolarHBondContact O-N 2.93Å
1189H53Low62.3Low166 Ų166100 Ų10077%0.76953%0.527SS*.THydrogen-bonded Turntrans-86.2-9.7175.4-71.1-66.9000114.3S1185 T1187 S1191S1185-H1189 PolarHBondContact O-CD2 2.81Å; S1185-H1189 PolarHBondContact O-N 3.49Å; T1187-H1189 PolarHBondContact O-N 3.14Å; H1189-S1191 PolarHBondContact O-N 2.79Å
1190L52Low61Low100 Ų100101.2 Ų101.252%0.52454%0.542SS..SBendtrans-80107.4165.3-73.7163.8000108.1T1187T1187-L1190 PolarHBondContact O-N 2.82Å; T1187-L1190 VanDerWaalsContact O-N 3.15Å
1191S53.6Low60.1Low42 Ų42105.5 Ų105.529%0.29457%0.57SS.*  trans-68.7150.6-177.980.60000110.7H1189 T1193 D1194 L1195H1189-S1191 PolarHBondContact O-N 2.79Å; S1191-T1193 WeakPolarHBondContact CB-OG1 3.33Å; S1191-T1193 PolarHBondContact O-N 2.8Å; S1191-T1193 VanDerWaalsContact O-N 3.13Å; S1191-T1193 PolarHBondContact OG-OG1 3.44Å; S1191-D1194 WeakPolarHBondContact CB-OD2 3.13Å; S1191-D1194 PolarHBondContact N-OD2 3.22Å; S1191-D1194 PolarHBondContact O-N 3.36Å; S1191-D1194 PolarHBondContact OG-N 3.44Å; S1191-D1194 VanDerWaalsContact OG-N 3.16Å; S1191-D1194 PolarHBondContact OG-OD2 3.16Å; S1191-L1195 PolarHBondContact O-N 2.92Å
1192F47.3Very low59.2Low166 Ų166102.5 Ų102.573%0.72857%0.569SS**Hα-helixtrans-57.8-28.5175.2-164.2-104000111.6L1196F1192-L1196 HydrophobicContact CD1-CD1 3.76Å; F1192-L1196 HydrophobicContact CE1-CD1 3.75Å; F1192-L1196 VanDerWaalsContact O-CG 3.31Å; F1192-L1196 WeakPolarHBondContact O-CG 3.43Å; F1192-L1196 PolarHBondContact O-N 3.12Å
1193T59.1Low58.2Low102 Ų102102.4 Ų102.463%0.62658%0.579SS**Hα-helixtrans-65.7-39.7170.815.90000113.8S1191 L1196 S1197S1191-T1193 WeakPolarHBondContact CB-OG1 3.33Å; S1191-T1193 PolarHBondContact O-N 2.8Å; S1191-T1193 VanDerWaalsContact O-N 3.13Å; S1191-T1193 PolarHBondContact OG-OG1 3.44Å; T1193-L1196 PolarHBondContact O-N 3Å; T1193-S1197 PolarHBondContact O-N 2.97Å
1194D59.8Low57.3Low81 Ų81103.1 Ų103.143%0.43359%0.587SS.*Hα-helixtrans-67.4-42.9179.7-58.3-50.4000110.8S1191 L1196 S1197S1191-D1194 WeakPolarHBondContact CB-OD2 3.13Å; S1191-D1194 PolarHBondContact N-OD2 3.22Å; S1191-D1194 PolarHBondContact O-N 3.36Å; S1191-D1194 PolarHBondContact OG-N 3.44Å; S1191-D1194 VanDerWaalsContact OG-N 3.16Å; S1191-D1194 PolarHBondContact OG-OD2 3.16Å; D1194-L1196 VanDerWaalsContact C-N 3.26Å; D1194-L1196 PolarHBondContact O-N 3.17Å; D1194-S1197 WeakPolarHBondContact O-CB 3.43Å; D1194-S1197 PolarHBondContact O-N 3.31Å; D1194-S1197 PolarHBondContact O-OG 3.16Å
1195L56.9Low56.3Low106 Ų106101.7 Ų101.756%0.55560%0.596SS**Hα-helixtrans-63-29.4175-82161.7000113.2S1191S1191-L1195 PolarHBondContact O-N 2.92Å
1196L60Low55.3Low92 Ų92110 Ų11048%0.48262%0.62SS.*Hα-helixtrans-82.3-29.2174.7-72.2171000113.2F1192 T1193 D1194 V1198 T1199F1192-L1196 HydrophobicContact CD1-CD1 3.76Å; F1192-L1196 HydrophobicContact CE1-CD1 3.75Å; F1192-L1196 VanDerWaalsContact O-CG 3.31Å; F1192-L1196 WeakPolarHBondContact O-CG 3.43Å; F1192-L1196 PolarHBondContact O-N 3.12Å; T1193-L1196 PolarHBondContact O-N 3Å; D1194-L1196 VanDerWaalsContact C-N 3.26Å; D1194-L1196 PolarHBondContact O-N 3.17Å; L1196-V1198 PolarHBondContact O-N 2.86Å; L1196-V1198 VanDerWaalsContact O-N 3.13Å; L1196-T1199 PolarHBondContact O-N 2.82Å; L1196-T1199 VanDerWaalsContact O-N 3.14Å; L1196-T1199 PolarHBondContact O-OG1 3.39Å
1197S56.5Low54.2Low67 Ų67113 Ų11347%0.46963%0.634SS.*Hα-helixtrans-56.9-30.7-177.876.30000113.7T1193 D1194 T1199 N1200T1193-S1197 PolarHBondContact O-N 2.97Å; D1194-S1197 WeakPolarHBondContact O-CB 3.43Å; D1194-S1197 PolarHBondContact O-N 3.31Å; D1194-S1197 PolarHBondContact O-OG 3.16Å; S1197-T1199 PolarHBondContact O-N 2.84Å; S1197-N1200 PolarHBondContact O-N 3.46Å
1198V55.7Low53.6Low98 Ų98113.1 Ų113.159%0.59464%0.643SS**THydrogen-bonded Turntrans-64.8-9.7-178.9-174.20000113.1L1196L1196-V1198 PolarHBondContact O-N 2.86Å; L1196-V1198 VanDerWaalsContact O-N 3.13Å
1199T53.9Low53.5Low101 Ų101115.6 Ų115.662%0.6265%0.654SS**THydrogen-bonded Turntrans-97-7.5-177.262.50000115.5L1196 S1197 V1201L1196-T1199 PolarHBondContact O-N 2.82Å; L1196-T1199 VanDerWaalsContact O-N 3.14Å; L1196-T1199 PolarHBondContact O-OG1 3.39Å; S1197-T1199 PolarHBondContact O-N 2.84Å; T1199-V1201 PolarHBondContact O-N 3.01Å
1200N49.2Very low53.7Low139 Ų139110.8 Ų110.874%0.74364%0.639SS**  trans-80.8106.1-175.8-76.2-38.2000112.6S1197 G1202S1197-N1200 PolarHBondContact O-N 3.46Å; N1200-G1202 PolarHBondContact O-N 3.23Å
1201V52Low53.9Low137 Ų137110 Ų11083%0.8364%0.642SS**  trans-73.2114.8174.51790000110.1T1199T1199-V1201 PolarHBondContact O-N 3.01Å
1202G53.5Low54.4Low47 Ų47118.3 Ų118.349%0.48567%0.667SS.*  trans-66.5151172.100000112.6N1200 D1204N1200-G1202 PolarHBondContact O-N 3.23Å; G1202-D1204 PolarHBondContact O-N 2.86Å; G1202-D1204 VanDerWaalsContact O-N 3.12Å
1203P54.6Low55.4Low130 Ų130115.8 Ų115.884%0.84466%0.661SS**THydrogen-bonded Turntrans-66-17.5-168.225.8-35.4000115.4G1205P1203-G1205 VanDerWaalsContact C-N 3.28Å; P1203-G1205 PolarHBondContact O-N 3.4Å
1204D54Low55.9Low139 Ų139113.2 Ų113.274%0.74365%0.647SS**THydrogen-bonded Turntrans-83.56.4-170.3-57.5-41000115.1G1202 R1206G1202-D1204 PolarHBondContact O-N 2.86Å; G1202-D1204 VanDerWaalsContact O-N 3.12Å; D1204-R1206 PolarHBondContact O-N 3.2Å
1205G48Very low56.5Low69 Ų69114.7 Ų114.771%0.71166%0.655SS**  trans666.2164.900000117.4P1203P1203-G1205 VanDerWaalsContact C-N 3.28Å; P1203-G1205 PolarHBondContact O-N 3.4Å
1206R52Low57.4Low225 Ų225115.3 Ų115.385%0.84966%0.658SS**  trans-95.6123.3179.9-67179.9-172.2-117.32.2111.2D1204 A1208D1204-R1206 PolarHBondContact O-N 3.2Å; R1206-A1208 PolarHBondContact O-N 2.9Å
1207P45.4Very low58.1Low130 Ų130116 Ų11684%0.84466%0.662SS**  trans-71.9102.9178.728.4-33.6000111
1208A49.4Very low59Low83 Ų83122.2 Ų122.269%0.68668%0.675SS**  trans-63.5155.1171.800000111.5R1206 S1210R1206-A1208 PolarHBondContact O-N 2.9Å; A1208-S1210 PolarHBondContact O-N 2.86Å
1209K56.5Low60.1Low207 Ų207123 Ų12390%0.967%0.671SS**THydrogen-bonded Turntrans-67.39.6-167.4-61.7177.5179.9175.90115.9S1211K1209-S1211 PolarHBondContact O-N 3.31Å
1210S57.3Low61.2Low66 Ų66121.6 Ų121.646%0.46266%0.663SS.*THydrogen-bonded Turntrans-71.5-21.1-173.9-165.10000114.9A1208 R1212 N1213 S1214A1208-S1210 PolarHBondContact O-N 2.86Å; S1210-R1212 VanDerWaalsContact C-N 3.26Å; S1210-R1212 PolarHBondContact O-N 2.94Å; S1210-N1213 PolarHBondContact O-N 3.45Å; S1210-S1214 PolarHBondContact O-N 3.27Å; S1210-S1214 VanDerWaalsContact O-N 3.11Å
1211S56.5Low62.6Low84 Ų84120.4 Ų120.459%0.58766%0.656SS**Hα-helixtrans-54.8-38.1-178-178.10000113.6K1209 N1213 S1214 L1215K1209-S1211 PolarHBondContact O-N 3.31Å; S1211-N1213 VanDerWaalsContact C-N 3.31Å; S1211-N1213 PolarHBondContact O-N 3.14Å; S1211-S1214 PolarHBondContact O-N 2.93Å; S1211-S1214 PolarHBondContact O-OG 3.32Å; S1211-L1215 PolarHBondContact O-N 3.03Å; S1211-L1215 VanDerWaalsContact O-N 3.09Å
1212R64Low64.1Low215 Ų215118 Ų11881%0.81164%0.639SS**Hα-helixtrans-67.7-32.6-180-149.1171.2-168148.82.8112.3S1210 L1216S1210-R1212 VanDerWaalsContact C-N 3.26Å; S1210-R1212 PolarHBondContact O-N 2.94Å; R1212-L1216 WeakPolarHBondContact O-CB 3.45Å; R1212-L1216 PolarHBondContact O-N 3.36Å; R1212-L1216 VanDerWaalsContact O-N 3.16Å
1213N69.7Low65.3Low113 Ų113118.5 Ų118.560%0.60463%0.63SS**Hα-helixtrans-76.4-39.4177.9-67.57.8000111.4S1210 S1211 L1215 L1216 L1217S1210-N1213 PolarHBondContact O-N 3.45Å; S1211-N1213 VanDerWaalsContact C-N 3.31Å; S1211-N1213 PolarHBondContact O-N 3.14Å; N1213-L1215 VanDerWaalsContact C-N 3.34Å; N1213-L1215 PolarHBondContact O-N 3.2Å; N1213-L1216 PolarHBondContact O-N 3.36Å; N1213-L1217 VanDerWaalsContact O-CB 3.27Å; N1213-L1217 WeakPolarHBondContact O-CB 3.34Å; N1213-L1217 PolarHBondContact O-N 3.29Å
1214S68.6Low66.4Low49 Ų49115.4 Ų115.434%0.34361%0.609SS.*Hα-helixtrans-70-30.5177.369.90000112.9S1210 S1211 R1218S1210-S1214 PolarHBondContact O-N 3.27Å; S1210-S1214 VanDerWaalsContact O-N 3.11Å; S1211-S1214 PolarHBondContact O-N 2.93Å; S1211-S1214 PolarHBondContact O-OG 3.32Å; S1214-R1218 WeakPolarHBondContact O-CB 3.29Å; S1214-R1218 WeakPolarHBondContact O-CG 3.49Å; S1214-R1218 PolarHBondContact O-N 2.91Å
1215L73.3Confident67.5Low112 Ų112111.9 Ų111.959%0.58659%0.594SS**Hα-helixtrans-70.2-43.8172.5-131.3170.6000111.7S1211 N1213 R1218 H1219S1211-L1215 PolarHBondContact O-N 3.03Å; S1211-L1215 VanDerWaalsContact O-N 3.09Å; N1213-L1215 VanDerWaalsContact C-N 3.34Å; N1213-L1215 PolarHBondContact O-N 3.2Å; L1215-R1218 PolarHBondContact O-N 2.86Å; L1215-H1219 PolarHBondContact O-N 2.85Å
1216L75.3Confident69.1Low119 Ų119116.2 Ų116.262%0.62359%0.589SS**Hα-helixtrans-61.6-45.2174.5-171.270.2000111.5R1212 N1213 R1218 H1219 T1220R1212-L1216 WeakPolarHBondContact O-CB 3.45Å; R1212-L1216 PolarHBondContact O-N 3.36Å; R1212-L1216 VanDerWaalsContact O-N 3.16Å; N1213-L1216 PolarHBondContact O-N 3.36Å; L1216-R1218 PolarHBondContact O-N 3.42Å; L1216-H1219 PolarHBondContact O-N 2.91Å; L1216-T1220 PolarHBondContact O-N 3.48Å; L1216-T1220 PolarHBondContact O-OG1 2.98Å
1217L73.7Confident70.5Confident107 Ų107111.3 Ų111.356%0.5658%0.576SS**Hα-helixtrans-63.5-38.3177.4-165.374.3000112N1213 H1219 T1220 L1221N1213-L1217 VanDerWaalsContact O-CB 3.27Å; N1213-L1217 WeakPolarHBondContact O-CB 3.34Å; N1213-L1217 PolarHBondContact O-N 3.29Å; L1217-H1219 VanDerWaalsContact C-N 3.35Å; L1217-T1220 PolarHBondContact O-OG1 2.74Å; L1217-L1221 VanDerWaalsContact O-CB 3.25Å; L1217-L1221 WeakPolarHBondContact O-CB 3.41Å; L1217-L1221 PolarHBondContact O-N 3.38Å
1218R76.6Confident72Confident197 Ų197109.2 Ų109.274%0.74356%0.557SS**Hα-helixtrans-64.6-36.9173-85.4-178.5169.9-172.3-2.3112.8S1214 L1215 L1216 N1222S1214-R1218 WeakPolarHBondContact O-CB 3.29Å; S1214-R1218 WeakPolarHBondContact O-CG 3.49Å; S1214-R1218 PolarHBondContact O-N 2.91Å; L1215-R1218 PolarHBondContact O-N 2.86Å; L1216-R1218 PolarHBondContact O-N 3.42Å; R1218-N1222 WeakPolarHBondContact O-CB 3.31Å; R1218-N1222 PolarHBondContact O-N 3.12Å; R1218-N1222 VanDerWaalsContact O-N 3.07Å
1219H79Confident73.6Confident113 Ų113110 Ų11052%0.52355%0.553SS.*Hα-helixtrans-68.6-50.9178.7-144.5-63.3000110.6L1215 L1216 L1217 L1221 N1222 D1223L1215-H1219 PolarHBondContact O-N 2.85Å; L1216-H1219 PolarHBondContact O-N 2.91Å; L1217-H1219 VanDerWaalsContact C-N 3.35Å; H1219-L1221 VanDerWaalsContact C-N 3.3Å; H1219-L1221 PolarHBondContact O-N 2.88Å; H1219-N1222 PolarHBondContact O-N 3.07Å; H1219-N1222 VanDerWaalsContact O-N 3.08Å; H1219-D1223 IonicContact CE1-OD2 3.55Å; H1219-D1223 PolarHBondContact CE1-OD2 3.21Å; H1219-D1223 IonicContact CG-OD2 3.53Å; H1219-D1223 IonicContact ND1-OD1 3.14Å; H1219-D1223 IonicContact ND1-OD2 2.67Å; H1219-D1223 PolarHBondContact ND1-OD2 2.89Å; H1219-D1223 PolarHBondContact O-N 3.21Å; H1219-D1223 VanDerWaalsContact O-OD2 3.11Å
1220T76.6Confident74.8Confident73 Ų73105 Ų10545%0.44854%0.536SS..Hα-helixtrans-62.1-34.617751.30000112.9L1216 L1217 T1224L1216-T1220 PolarHBondContact O-N 3.48Å; L1216-T1220 PolarHBondContact O-OG1 2.98Å; L1217-T1220 PolarHBondContact O-OG1 2.74Å; T1220-T1224 WeakPolarHBondContact O-CB 3.29Å; T1220-T1224 WeakPolarHBondContact O-CG2 3.37Å; T1220-T1224 PolarHBondContact O-N 2.69Å; T1220-T1224 PolarHBondContact O-OG1 2.87Å
1221L79.3Confident75.7Confident114 Ų114105.6 Ų105.660%0.59753%0.533SS*.Hα-helixtrans-65.6-40.1172.8-159.889.1000112.3L1217 H1219 T1224 C1225L1217-L1221 VanDerWaalsContact O-CB 3.25Å; L1217-L1221 WeakPolarHBondContact O-CB 3.41Å; L1217-L1221 PolarHBondContact O-N 3.38Å; H1219-L1221 VanDerWaalsContact C-N 3.3Å; H1219-L1221 PolarHBondContact O-N 2.88Å; L1221-T1224 WeakPolarHBondContact CA-OG1 3.4Å; L1221-T1224 PolarHBondContact O-OG1 3.15Å; L1221-T1224 VanDerWaalsContact O-OG1 3.06Å; L1221-C1225 WeakPolarHBondContact O-CB 3.47Å; L1221-C1225 PolarHBondContact O-N 2.83Å; L1221-C1225 PolarHBondContact O-SG 3.38Å
1222N83.5Confident77Confident87 Ų87109.4 Ų109.447%0.46554%0.535SS..Hα-helixtrans-68.9-43.6177.9-166.8-5.6000111.4R1218 H1219 C1225 R1226R1218-N1222 WeakPolarHBondContact O-CB 3.31Å; R1218-N1222 PolarHBondContact O-N 3.12Å; R1218-N1222 VanDerWaalsContact O-N 3.07Å; H1219-N1222 PolarHBondContact O-N 3.07Å; H1219-N1222 VanDerWaalsContact O-N 3.08Å; N1222-C1225 PolarHBondContact O-N 3.43Å; N1222-R1226 WeakPolarHBondContact O-CG 3.39Å; N1222-R1226 PolarHBondContact O-N 2.73Å
1223D78.2Confident77.9Confident57 Ų57105.5 Ų105.531%0.30553%0.526SS..Hα-helixtrans-67-38.8178.2-65-41.4000112.1H1219 R1226 Q1227H1219-D1223 IonicContact CE1-OD2 3.55Å; H1219-D1223 PolarHBondContact CE1-OD2 3.21Å; H1219-D1223 IonicContact CG-OD2 3.53Å; H1219-D1223 IonicContact ND1-OD1 3.14Å; H1219-D1223 IonicContact ND1-OD2 2.67Å; H1219-D1223 PolarHBondContact ND1-OD2 2.89Å; H1219-D1223 PolarHBondContact O-N 3.21Å; H1219-D1223 VanDerWaalsContact O-OD2 3.11Å; D1223-R1226 PolarHBondContact O-N 3.5Å; D1223-Q1227 WeakPolarHBondContact O-CG 3.47Å; D1223-Q1227 PolarHBondContact O-N 2.79Å
1224T76.9Confident78.3Confident64 Ų64107.2 Ų107.239%0.39353%0.528SS..Hα-helixtrans-67.1-40.4171.948.50000112.1T1220 L1221 R1226 Q1227 L1228T1220-T1224 WeakPolarHBondContact O-CB 3.29Å; T1220-T1224 WeakPolarHBondContact O-CG2 3.37Å; T1220-T1224 PolarHBondContact O-N 2.69Å; T1220-T1224 PolarHBondContact O-OG1 2.87Å; L1221-T1224 WeakPolarHBondContact CA-OG1 3.4Å; L1221-T1224 PolarHBondContact O-OG1 3.15Å; L1221-T1224 VanDerWaalsContact O-OG1 3.06Å; T1224-R1226 VanDerWaalsContact C-N 3.34Å; T1224-R1226 PolarHBondContact O-N 3.06Å; T1224-Q1227 PolarHBondContact O-N 3.49Å; T1224-L1228 WeakPolarHBondContact O-CB 3.33Å; T1224-L1228 VanDerWaalsContact O-CG 3.29Å; T1224-L1228 WeakPolarHBondContact O-CG 3.29Å; T1224-L1228 PolarHBondContact O-N 3.44Å
1225C78Confident78.8Confident65 Ų65108.9 Ų108.944%0.43953%0.529SS..Hα-helixtrans-59.7-41.3171.5-76.30000112.6L1221 N1222 L1228 V1229L1221-C1225 WeakPolarHBondContact O-CB 3.47Å; L1221-C1225 PolarHBondContact O-N 2.83Å; L1221-C1225 PolarHBondContact O-SG 3.38Å; N1222-C1225 PolarHBondContact O-N 3.43Å; C1225-L1228 PolarHBondContact O-N 2.78Å; C1225-V1229 WeakPolarHBondContact O-CG2 3.3Å; C1225-V1229 PolarHBondContact O-N 2.89Å
1226R80.8Confident79.1Confident160 Ų160107.2 Ų107.260%0.60452%0.521SS*.Hα-helixtrans-63.6-43.3175-76.1173.9165-160.8-8.2112.2N1222 D1223 T1224 V1229 L1230N1222-R1226 WeakPolarHBondContact O-CG 3.39Å; N1222-R1226 PolarHBondContact O-N 2.73Å; D1223-R1226 PolarHBondContact O-N 3.5Å; T1224-R1226 VanDerWaalsContact C-N 3.34Å; T1224-R1226 PolarHBondContact O-N 3.06Å; R1226-V1229 PolarHBondContact O-N 3.48Å; R1226-L1230 WeakPolarHBondContact O-CG 3.49Å; R1226-L1230 PolarHBondContact O-N 3.07Å; R1226-L1230 VanDerWaalsContact O-N 3.07Å
1227Q81.2Confident79.4Confident123 Ų123106.7 Ų106.758%0.57552%0.515SS*.Hα-helixtrans-64.1-39.6175.2-71.3175.820.100111.9D1223 T1224 L1230 L1231D1223-Q1227 WeakPolarHBondContact O-CG 3.47Å; D1223-Q1227 PolarHBondContact O-N 2.79Å; T1224-Q1227 PolarHBondContact O-N 3.49Å; Q1227-L1230 PolarHBondContact O-N 3.41Å; Q1227-L1231 WeakPolarHBondContact O-CB 3.48Å; Q1227-L1231 VanDerWaalsContact O-CG 3.31Å; Q1227-L1231 WeakPolarHBondContact O-CG 3.27Å; Q1227-L1231 PolarHBondContact O-N 3.22Å
1228L77.9Confident79.6Confident86 Ų86106.6 Ų106.645%0.4552%0.515SS..Hα-helixtrans-63.5-39.7175.3-74.6168.2000112.7L1180 T1224 C1225 L1231 R1232L1180-L1228 HydrophobicContact CD2-CD2 3.67Å; T1224-L1228 WeakPolarHBondContact O-CB 3.33Å; T1224-L1228 VanDerWaalsContact O-CG 3.29Å; T1224-L1228 WeakPolarHBondContact O-CG 3.29Å; T1224-L1228 PolarHBondContact O-N 3.44Å; C1225-L1228 PolarHBondContact O-N 2.78Å; L1228-L1231 PolarHBondContact O-N 3.29Å; L1228-R1232 VanDerWaalsContact O-CB 3.29Å; L1228-R1232 WeakPolarHBondContact O-CB 3.45Å; L1228-R1232 PolarHBondContact O-N 3.45Å
1229V82.3Confident79.7Confident99 Ų99101.8 Ų101.860%0.650%0.501SS*.Hα-helixtrans-66.4-42.5175.2171.10000111.4C1225 R1226 R1232 Q1233C1225-V1229 WeakPolarHBondContact O-CG2 3.3Å; C1225-V1229 PolarHBondContact O-N 2.89Å; R1226-V1229 PolarHBondContact O-N 3.48Å; V1229-R1232 WeakPolarHBondContact O-CB 3.42Å; V1229-R1232 PolarHBondContact O-N 3.28Å; V1229-Q1233 PolarHBondContact O-N 3.21Å
1230L81.4Confident79.7Confident103 Ų10399 Ų9954%0.53950%0.498SS..Hα-helixtrans-68.3-35.9176.5-70.9170.1000112.7R1226 Q1227 K1234R1226-L1230 WeakPolarHBondContact O-CG 3.49Å; R1226-L1230 PolarHBondContact O-N 3.07Å; R1226-L1230 VanDerWaalsContact O-N 3.07Å; Q1227-L1230 PolarHBondContact O-N 3.41Å; L1230-K1234 WeakPolarHBondContact O-CG 3.36Å; L1230-K1234 PolarHBondContact O-N 3.14Å; L1230-K1234 VanDerWaalsContact O-N 3.1Å
1231L77.9Confident79.8Confident77 Ų7798.7 Ų98.740%0.40349%0.493SS..Hα-helixtrans-66.8-40.1171.9-77.4168.3000111.3Q1227 L1228 K1234 F1235Q1227-L1231 WeakPolarHBondContact O-CB 3.48Å; Q1227-L1231 VanDerWaalsContact O-CG 3.31Å; Q1227-L1231 WeakPolarHBondContact O-CG 3.27Å; Q1227-L1231 PolarHBondContact O-N 3.22Å; L1228-L1231 PolarHBondContact O-N 3.29Å; L1231-K1234 PolarHBondContact O-N 2.92Å; L1231-F1235 WeakPolarHBondContact O-CB 3.38Å; L1231-F1235 PolarHBondContact O-N 2.98Å
1232R82.7Confident79.7Confident164 Ų16497.2 Ų97.262%0.61948%0.479SS*.Hα-helixtrans-60.3-50.9175.2-176.962.3-174.1-1033.3111.1L1228 V1229 K1234 F1235 D1236L1228-R1232 VanDerWaalsContact O-CB 3.29Å; L1228-R1232 WeakPolarHBondContact O-CB 3.45Å; L1228-R1232 PolarHBondContact O-N 3.45Å; V1229-R1232 WeakPolarHBondContact O-CB 3.42Å; V1229-R1232 PolarHBondContact O-N 3.28Å; R1232-K1234 VanDerWaalsContact C-N 3.29Å; R1232-K1234 PolarHBondContact O-N 3.03Å; R1232-F1235 WeakPolarHBondContact O-CB 3.49Å; R1232-F1235 PolarHBondContact O-N 3.48Å; R1232-D1236 IonicContact CZ-OD1 3.24Å; R1232-D1236 IonicContact NE-OD1 2.7Å; R1232-D1236 PolarHBondContact NE-OD1 3.13Å; R1232-D1236 IonicContact NE-OD2 3.29Å; R1232-D1236 IonicContact NH2-OD1 3.94Å; R1232-D1236 PolarHBondContact O-N 3.31Å
1233Q83.4Confident79.4Confident134 Ų13495.7 Ų95.763%0.62648%0.479SS*.Hα-helixtrans-60.4-36.9178.2-170.31787.100112.6V1229 Q1237V1229-Q1233 PolarHBondContact O-N 3.21Å; Q1233-Q1237 WeakPolarHBondContact O-CB 3.29Å; Q1233-Q1237 PolarHBondContact O-N 2.98Å; Q1233-Q1237 VanDerWaalsContact O-N 3.16Å
1234K78.1Confident79.6Confident148 Ų14898.8 Ų98.864%0.64349%0.49SS*.Hα-helixtrans-71.2-33.6173.3-75.1-174.6175.8-1690113.3L1230 L1231 R1232 L1238L1230-K1234 WeakPolarHBondContact O-CG 3.36Å; L1230-K1234 PolarHBondContact O-N 3.14Å; L1230-K1234 VanDerWaalsContact O-N 3.1Å; L1231-K1234 PolarHBondContact O-N 2.92Å; R1232-K1234 VanDerWaalsContact C-N 3.29Å; R1232-K1234 PolarHBondContact O-N 3.03Å; K1234-L1238 WeakPolarHBondContact O-CB 3.31Å; K1234-L1238 VanDerWaalsContact O-CG 3.3Å; K1234-L1238 WeakPolarHBondContact O-CG 3.38Å; K1234-L1238 PolarHBondContact O-N 3.25Å
1235F77.9Confident79.6Confident85 Ų8599.8 Ų99.837%0.37349%0.492SS..Hα-helixtrans-69-47.1175.2-171.2-85.6000111L1231 R1232 Q1237 L1238 E1239L1231-F1235 WeakPolarHBondContact O-CB 3.38Å; L1231-F1235 PolarHBondContact O-N 2.98Å; R1232-F1235 WeakPolarHBondContact O-CB 3.49Å; R1232-F1235 PolarHBondContact O-N 3.48Å; F1235-Q1237 PolarHBondContact O-N 3.17Å; F1235-L1238 PolarHBondContact O-N 3.21Å; F1235-L1238 VanDerWaalsContact O-N 3.17Å; F1235-E1239 WeakPolarHBondContact O-CB 3.32Å; F1235-E1239 PolarHBondContact O-N 3Å
1236D80.2Confident79.5Confident77 Ų77103 Ų10341%0.41250%0.495SS..Hα-helixtrans-59.9-36.6177.7-57.1-31.2000110.8R1232 A1240R1232-D1236 IonicContact CZ-OD1 3.24Å; R1232-D1236 IonicContact NE-OD1 2.7Å; R1232-D1236 PolarHBondContact NE-OD1 3.13Å; R1232-D1236 IonicContact NE-OD2 3.29Å; R1232-D1236 IonicContact NH2-OD1 3.94Å; R1232-D1236 PolarHBondContact O-N 3.31Å; D1236-A1240 PolarHBondContact O-N 3.01Å
1237Q82.4Confident79.3Confident107 Ų107103.6 Ų103.650%0.550%0.498SS..Hα-helixtrans-66.5-50.6171.4178.761.849.800112.6Q1233 F1235 E1239 A1240 D1241Q1233-Q1237 WeakPolarHBondContact O-CB 3.29Å; Q1233-Q1237 PolarHBondContact O-N 2.98Å; Q1233-Q1237 VanDerWaalsContact O-N 3.16Å; F1235-Q1237 PolarHBondContact O-N 3.17Å; Q1237-E1239 PolarHBondContact O-N 3.38Å; Q1237-A1240 WeakPolarHBondContact O-CB 3.4Å; Q1237-A1240 PolarHBondContact O-N 2.8Å; Q1237-A1240 VanDerWaalsContact O-N 3.09Å; Q1237-D1241 VanDerWaalsContact NE2-CG 3.27Å; Q1237-D1241 PolarHBondContact NE2-OD1 3.32Å; Q1237-D1241 VanDerWaalsContact NE2-OD1 3.09Å; Q1237-D1241 PolarHBondContact NE2-OD2 2.72Å; Q1237-D1241 PolarHBondContact O-N 3.47Å
1238L76.5Confident79.1Confident105 Ų105101.7 Ų101.755%0.5549%0.489SS..Hα-helixtrans-63.4-29.7179.1-75.7169.9000112.7K1234 F1235 R1242K1234-L1238 WeakPolarHBondContact O-CB 3.31Å; K1234-L1238 VanDerWaalsContact O-CG 3.3Å; K1234-L1238 WeakPolarHBondContact O-CG 3.38Å; K1234-L1238 PolarHBondContact O-N 3.25Å; F1235-L1238 PolarHBondContact O-N 3.21Å; F1235-L1238 VanDerWaalsContact O-N 3.17Å; L1238-R1242 WeakPolarHBondContact O-CB 3.49Å; L1238-R1242 PolarHBondContact O-N 3.48Å
1239E79.7Confident78.7Confident97 Ų97102.3 Ų102.345%0.45349%0.492SS..Hα-helixtrans-72.7-34.8173.8-172.2150.4-129.500111.8F1235 Q1237 A1243F1235-E1239 WeakPolarHBondContact O-CB 3.32Å; F1235-E1239 PolarHBondContact O-N 3Å; Q1237-E1239 PolarHBondContact O-N 3.38Å; E1239-A1243 VanDerWaalsContact O-CB 3.32Å; E1239-A1243 WeakPolarHBondContact O-CB 3.39Å; E1239-A1243 PolarHBondContact O-N 3.31Å
1240A78.1Confident78.2Confident55 Ų55102.5 Ų102.546%0.45549%0.49SS..Hα-helixtrans-65.7-46.1169.800000112.2D1236 Q1237 R1242 A1243 K1244D1236-A1240 PolarHBondContact O-N 3.01Å; Q1237-A1240 WeakPolarHBondContact O-CB 3.4Å; Q1237-A1240 PolarHBondContact O-N 2.8Å; Q1237-A1240 VanDerWaalsContact O-N 3.09Å; A1240-R1242 VanDerWaalsContact C-N 3.33Å; A1240-R1242 PolarHBondContact O-N 2.86Å; A1240-A1243 WeakPolarHBondContact O-CB 3.39Å; A1240-A1243 PolarHBondContact O-N 3.49Å; A1240-A1243 VanDerWaalsContact O-N 3.15Å; A1240-K1244 PolarHBondContact O-N 3.36Å
1241D79.1Confident77.6Confident65 Ų65100.8 Ų100.835%0.34848%0.484SS..Hα-helixtrans-64.4-38.2177-65.2-38.3000111.4Q1237 K1244 I1245Q1237-D1241 VanDerWaalsContact NE2-CG 3.27Å; Q1237-D1241 PolarHBondContact NE2-OD1 3.32Å; Q1237-D1241 VanDerWaalsContact NE2-OD1 3.09Å; Q1237-D1241 PolarHBondContact NE2-OD2 2.72Å; Q1237-D1241 PolarHBondContact O-N 3.47Å; D1241-K1244 WeakPolarHBondContact O-CB 3.49Å; D1241-K1244 PolarHBondContact O-N 2.84Å; D1241-I1245 WeakPolarHBondContact O-CG1 3.45Å; D1241-I1245 PolarHBondContact O-N 3.31Å
1242R77.3Confident76.9Confident83 Ų83103 Ų10331%0.31350%0.495SS..Hα-helixtrans-69.6-29173.4-177.3-178.1-176.71736.9113.1E1173 L1238 A1240 R1246E1173-R1242 IonicContact OE1-CZ 2.74Å; E1173-R1242 IonicContact OE1-NH1 3.98Å; E1173-R1242 PolarHBondContact OE1-NH1 3.03Å; E1173-R1242 IonicContact OE2-NH1 3.02Å; L1238-R1242 WeakPolarHBondContact O-CB 3.49Å; L1238-R1242 PolarHBondContact O-N 3.48Å; A1240-R1242 VanDerWaalsContact C-N 3.33Å; A1240-R1242 PolarHBondContact O-N 2.86Å; R1242-R1246 WeakPolarHBondContact O-CB 3.37Å; R1242-R1246 PolarHBondContact O-N 2.85Å
1243A76.9Confident76.1Confident56 Ų56100.3 Ų100.346%0.46349%0.488SS..Hα-helixtrans-72.1-40.2171.500000110.9E1239 A1240 R1246 Y1247E1239-A1243 VanDerWaalsContact O-CB 3.32Å; E1239-A1243 WeakPolarHBondContact O-CB 3.39Å; E1239-A1243 PolarHBondContact O-N 3.31Å; A1240-A1243 WeakPolarHBondContact O-CB 3.39Å; A1240-A1243 PolarHBondContact O-N 3.49Å; A1240-A1243 VanDerWaalsContact O-N 3.15Å; A1243-R1246 PolarHBondContact O-N 3.04Å; A1243-Y1247 WeakPolarHBondContact O-CB 3.2Å; A1243-Y1247 PolarHBondContact O-N 3.48Å
1244K83.5Confident74.4Confident122 Ų12295.3 Ų95.353%0.5347%0.472SS..Hα-helixtrans-60.8-51.9172.1-178.4-174166.1-171.80111.6A1240 D1241 R1246 Y1247 E1248A1240-K1244 PolarHBondContact O-N 3.36Å; D1241-K1244 WeakPolarHBondContact O-CB 3.49Å; D1241-K1244 PolarHBondContact O-N 2.84Å; K1244-R1246 VanDerWaalsContact C-N 3.28Å; K1244-R1246 PolarHBondContact O-N 3.35Å; K1244-Y1247 WeakPolarHBondContact O-CB 3.29Å; K1244-Y1247 PolarHBondContact O-N 3.32Å; K1244-Y1247 VanDerWaalsContact O-N 3.07Å; K1244-E1248 WeakPolarHBondContact CE-OE1 3.34Å; K1244-E1248 IonicContact NZ-OE1 2.81Å; K1244-E1248 WeakPolarHBondContact O-CG 3.39Å; K1244-E1248 PolarHBondContact O-N 2.8Å
1245I75.4Confident72.8Confident85 Ų8594.2 Ų94.244%0.43647%0.474SS..Hα-helixtrans-62.3-34.8178-68.2165.2000111.4D1241 L1249D1241-I1245 WeakPolarHBondContact O-CG1 3.45Å; D1241-I1245 PolarHBondContact O-N 3.31Å; I1245-L1249 HydrophobicContact CG2-CD1 3.98Å; I1245-L1249 HydrophobicContact CG2-CG 4.48Å; I1245-L1249 WeakPolarHBondContact O-CB 3.42Å; I1245-L1249 WeakPolarHBondContact O-CG 3.46Å; I1245-L1249 PolarHBondContact O-N 3Å
1246R75.9Confident71.1Confident132 Ų13299.8 Ų99.850%0.49849%0.494SS..Hα-helixtrans-66.3-43.9171.1-88.8-165.5-99.2-176.4-3.6112.5R1242 A1243 K1244 E1248 L1249 D1250R1242-R1246 WeakPolarHBondContact O-CB 3.37Å; R1242-R1246 PolarHBondContact O-N 2.85Å; A1243-R1246 PolarHBondContact O-N 3.04Å; K1244-R1246 VanDerWaalsContact C-N 3.28Å; K1244-R1246 PolarHBondContact O-N 3.35Å; R1246-E1248 VanDerWaalsContact C-N 3.33Å; R1246-E1248 PolarHBondContact O-N 3.1Å; R1246-L1249 PolarHBondContact O-N 2.97Å; R1246-D1250 VanDerWaalsContact O-CB 3.23Å; R1246-D1250 WeakPolarHBondContact O-CB 3.41Å; R1246-D1250 PolarHBondContact O-N 3.31Å
1247Y77.6Confident69.4Low172 Ų172102 Ų10268%0.67550%0.501SS*.Hα-helixtrans-60.4-43.3175.2176.9-94.1000111.7A1243 K1244 D1250 V1251A1243-Y1247 WeakPolarHBondContact O-CB 3.2Å; A1243-Y1247 PolarHBondContact O-N 3.48Å; K1244-Y1247 WeakPolarHBondContact O-CB 3.29Å; K1244-Y1247 PolarHBondContact O-N 3.32Å; K1244-Y1247 VanDerWaalsContact O-N 3.07Å; Y1247-D1250 PolarHBondContact O-N 2.81Å; Y1247-V1251 HydrophobicContact CD1-CG2 4.43Å; Y1247-V1251 HydrophobicContact CE1-CG2 4.09Å; Y1247-V1251 HydrophobicContact CE2-CG2 4.42Å; Y1247-V1251 WeakPolarHBondContact O-CB 3.41Å; Y1247-V1251 VanDerWaalsContact O-CG2 3.27Å; Y1247-V1251 WeakPolarHBondContact O-CG2 3.38Å; Y1247-V1251 PolarHBondContact O-N 3.34Å
1248E76.8Confident67.3Low83 Ų83104.4 Ų104.439%0.38852%0.515SS..Hα-helixtrans-64.7-42.4176.5-70.6166.8165.300111.8K1244 R1246 L1252K1244-E1248 WeakPolarHBondContact CE-OE1 3.34Å; K1244-E1248 IonicContact NZ-OE1 2.81Å; K1244-E1248 WeakPolarHBondContact O-CG 3.39Å; K1244-E1248 PolarHBondContact O-N 2.8Å; R1246-E1248 VanDerWaalsContact C-N 3.33Å; R1246-E1248 PolarHBondContact O-N 3.1Å; E1248-L1252 WeakPolarHBondContact O-CB 3.5Å; E1248-L1252 WeakPolarHBondContact O-CD1 3.44Å; E1248-L1252 VanDerWaalsContact O-CG 3.25Å; E1248-L1252 WeakPolarHBondContact O-CG 3.35Å; E1248-L1252 PolarHBondContact O-N 3.18Å
1249L70.2Confident65.7Low99 Ų99105.1 Ų105.152%0.51852%0.523SS..Hα-helixtrans-68-39.9173.7-77.7170.2000113.3I1245 R1246 V1251 L1252 K1253I1245-L1249 HydrophobicContact CG2-CD1 3.98Å; I1245-L1249 HydrophobicContact CG2-CG 4.48Å; I1245-L1249 WeakPolarHBondContact O-CB 3.42Å; I1245-L1249 WeakPolarHBondContact O-CG 3.46Å; I1245-L1249 PolarHBondContact O-N 3Å; R1246-L1249 PolarHBondContact O-N 2.97Å; L1249-V1251 VanDerWaalsContact C-N 3.32Å; L1249-L1252 PolarHBondContact O-N 3.49Å; L1249-K1253 WeakPolarHBondContact O-CB 3.42Å; L1249-K1253 PolarHBondContact O-N 3.33Å
1250D70.7Confident63.9Low103 Ų103106.7 Ų106.755%0.55154%0.54SS*.Hα-helixtrans-72.6-26.6179.8-71.3-28.9000111.2R1246 Y1247 G1254R1246-D1250 VanDerWaalsContact O-CB 3.23Å; R1246-D1250 WeakPolarHBondContact O-CB 3.41Å; R1246-D1250 PolarHBondContact O-N 3.31Å; Y1247-D1250 PolarHBondContact O-N 2.81Å; D1250-G1254 WeakPolarHBondContact O-CA 3.38Å; D1250-G1254 PolarHBondContact O-N 3.27Å
1251V68.7Low61.8Low67 Ų67112.2 Ų112.241%0.40656%0.561SS.*Hα-helixtrans-67.4-55.7164.8166.90000110.3Y1247 L1249 K1253 G1254 D1255Y1247-V1251 HydrophobicContact CD1-CG2 4.43Å; Y1247-V1251 HydrophobicContact CE1-CG2 4.09Å; Y1247-V1251 HydrophobicContact CE2-CG2 4.42Å; Y1247-V1251 WeakPolarHBondContact O-CB 3.41Å; Y1247-V1251 VanDerWaalsContact O-CG2 3.27Å; Y1247-V1251 WeakPolarHBondContact O-CG2 3.38Å; Y1247-V1251 PolarHBondContact O-N 3.34Å; L1249-V1251 VanDerWaalsContact C-N 3.32Å; V1251-K1253 PolarHBondContact O-N 2.86Å; V1251-G1254 PolarHBondContact O-N 2.95Å; V1251-G1254 VanDerWaalsContact O-N 3.13Å; V1251-D1255 PolarHBondContact O-N 2.97Å
1252L64.5Low59.8Low123 Ų123118.8 Ų118.864%0.64459%0.586SS**Hα-helixtrans-58.5-23.5178.4-72.3167.2000113.7E1248 L1249E1248-L1252 WeakPolarHBondContact O-CB 3.5Å; E1248-L1252 WeakPolarHBondContact O-CD1 3.44Å; E1248-L1252 VanDerWaalsContact O-CG 3.25Å; E1248-L1252 WeakPolarHBondContact O-CG 3.35Å; E1248-L1252 PolarHBondContact O-N 3.18Å; L1249-L1252 PolarHBondContact O-N 3.49Å
1253K64.9Low58Low109 Ų109119 Ų11947%0.47460%0.6SS.*Hα-helixtrans-96.3-29.5178.6-168.6170.8-179.5-73.90113L1249 V1251 D1255 Y1256 E1257L1249-K1253 WeakPolarHBondContact O-CB 3.42Å; L1249-K1253 PolarHBondContact O-N 3.33Å; V1251-K1253 PolarHBondContact O-N 2.86Å; K1253-D1255 VanDerWaalsContact C-N 3.26Å; K1253-D1255 PolarHBondContact O-N 3.39Å; K1253-Y1256 WeakPolarHBondContact O-CB 3.24Å; K1253-Y1256 PolarHBondContact O-N 2.91Å; K1253-E1257 IonicContact NZ-OE1 3.6Å; K1253-E1257 PolarHBondContact NZ-OE1 2.91Å; K1253-E1257 IonicContact NZ-OE2 3.78Å; K1253-E1257 PolarHBondContact O-N 3.31Å; K1253-E1257 VanDerWaalsContact O-N 3.17Å
1254G47.3Very low56.3Low28 Ų28123.5 Ų123.529%0.28961%0.612SS.*Hα-helixtrans-59.2-39.6171.600000111.9D1250 V1251 Y1256 E1257 M1258D1250-G1254 WeakPolarHBondContact O-CA 3.38Å; D1250-G1254 PolarHBondContact O-N 3.27Å; V1251-G1254 PolarHBondContact O-N 2.95Å; V1251-G1254 VanDerWaalsContact O-N 3.13Å; G1254-Y1256 PolarHBondContact O-N 3.38Å; G1254-E1257 PolarHBondContact O-N 3.44Å; G1254-E1257 VanDerWaalsContact O-N 3.16Å; G1254-M1258 WeakPolarHBondContact O-CG 3.39Å; G1254-M1258 PolarHBondContact O-N 3.17Å; G1254-M1258 VanDerWaalsContact O-N 3.1Å
1255D45.2Very low54.1Low126 Ų126124.6 Ų124.667%0.67462%0.624SS**Hα-helixtrans-64.9-15.6174.4-67.3-17.7000113.4V1251 K1253V1251-D1255 PolarHBondContact O-N 2.97Å; K1253-D1255 VanDerWaalsContact C-N 3.26Å; K1253-D1255 PolarHBondContact O-N 3.39Å
1256Y42.8Very low52.3Low201 Ų201127.6 Ų127.679%0.78864%0.641SS**Hα-helixtrans-98.3-19.6175-139.1-88.4000113.8K1253 G1254K1253-Y1256 WeakPolarHBondContact O-CB 3.24Å; K1253-Y1256 PolarHBondContact O-N 2.91Å; G1254-Y1256 PolarHBondContact O-N 3.38Å
1257E45Very low50.4Low124 Ų124125.9 Ų125.958%0.57965%0.649SS**Hα-helixtrans-103.6-9-177.8-72.5179.9-17000113.8K1253 G1254 T1259K1253-E1257 IonicContact NZ-OE1 3.6Å; K1253-E1257 PolarHBondContact NZ-OE1 2.91Å; K1253-E1257 IonicContact NZ-OE2 3.78Å; K1253-E1257 PolarHBondContact O-N 3.31Å; K1253-E1257 VanDerWaalsContact O-N 3.17Å; G1254-E1257 PolarHBondContact O-N 3.44Å; G1254-E1257 VanDerWaalsContact O-N 3.16Å; E1257-T1259 PolarHBondContact O-N 2.89Å
1258M36.6Very low48.4Very low158 Ų158129 Ų12978%0.77866%0.66SS**THydrogen-bonded Turntrans-72.17.1179.9-87.7-64.7-67.200116.3G1254G1254-M1258 WeakPolarHBondContact O-CG 3.39Å; G1254-M1258 PolarHBondContact O-N 3.17Å; G1254-M1258 VanDerWaalsContact O-N 3.1Å
1259T43.4Very low46.4Very low119 Ų119129.9 Ų129.973%0.7368%0.675SS**THydrogen-bonded Turntrans-121.842.217851.10000115.3E1257E1257-T1259 PolarHBondContact O-N 2.89Å
1260T42.2Very low44.7Very low130 Ų130130.5 Ų130.580%0.79868%0.683SS**SBendtrans-159.221.6159.63.20000120.1
1261L33Very low42.9Very low171 Ų171133.9 Ų133.990%0.89569%0.692SS**  trans-125104.8178.4-73.9178000116.6
1262K38.9Very low41.3Very low204 Ų204134 Ų13489%0.88770%0.7SS**  trans177.2131.8156.4-97153.5-175.4166.60106.5
1263S38.6Very low39.8Very low87 Ų87132.2 Ų132.261%0.60870%0.698SS**  cis-167.8-170.5-8.756.10000107.8
1264E40.5Very low38.4Very low151 Ų151132.2 Ų132.271%0.70671%0.707SS**  cis-158.2151.17.1-142.9100.8-117.200109.3
1265D37.8Very low37.9Very low145 Ų145138.2 Ų138.278%0.77573%0.731SS**  trans52.5145.3149.3-62.5-16.1000127.8
1266D37.8Very low37.6Very low148 Ų148137.3 Ų137.379%0.79173%0.732SS**  trans73.293.6141.2-93.1-12.7000125.8
1267S36.2Very low37.3Very low96 Ų96134 Ų13467%0.67173%0.733SS**  106.9132.6107.783.60000122.7
1268R35.3Very low36.9Very low238 Ų238136 Ų13690%0.89874%0.743SS**  trans63.9107.8145.7-70178.6177.9-166.90.7122.8
1269S33.9Very low37Very low101 Ų101133.6 Ų133.671%0.70674%0.739SS**  95.3118.3113.5-158.20000122.8
1270T34.4Very low36.7Very low112 Ų112133 Ų13369%0.68774%0.739SS**  trans73.4123.6137.5470000125
1271K34.9Very low36.3Very low174 Ų174133.1 Ų133.176%0.75774%0.74SS**  trans72.9164.7136.9-69.5-179.8177-177.10120.7H1689K1271-H1689 PolarHBondContact O-NE2 3.06Å
1272A34.6Very low36.6Very low68 Ų68130 Ų13056%0.56273%0.73SS**  cis-163.9129.1-46.500000111.7H1689A1272-H1689 VanDerWaalsContact CA-NE2 3.27Å; A1272-H1689 WeakPolarHBondContact CA-NE2 3.34Å; A1272-H1689 PolarHBondContact N-NE2 3.35Å
1273S32.7Very low36.5Very low86 Ų86128.5 Ų128.560%0.60173%0.726SS**  trans64.4128.5169.6-1700000119.1H1689S1273-H1689 PolarHBondContact N-CD2 2.88Å; S1273-H1689 PolarHBondContact N-ND1 3.37Å; S1273-H1689 VanDerWaalsContact N-ND1 3.13Å; S1273-H1689 PolarHBondContact O-CD2 3.47Å
1274T34.4Very low36.3Very low109 Ų109130.5 Ų130.567%0.66974%0.735SS**  168.1149.192.5-46.60000112.5H1689T1274-H1689 VanDerWaalsContact N-CG 3.27Å
1275I37.9Very low36.2Very low154 Ų154126 Ų12679%0.7973%0.729SS**  trans-91-162.6171.6-2.1175.6000110
1276P39.1Very low36.2Very low108 Ų108130.4 Ų130.470%0.70173%0.734SS**  cis-127.5-168.3-36.832.9-12.9000112.1
1277T35.5Very low36.1Very low130 Ų130134 Ų13480%0.79874%0.737SS**  158.4142.9112.8-520000113
1278E37.1Very low36.1Very low168 Ų168133.3 Ų133.379%0.78573%0.732SS**  trans-67.1178.7170.9-122.1-177-12300113
1279P39.2Very low36Very low107 Ų107131 Ų13170%0.69573%0.729SS**  -160.6-17953.244.3-21.2000120.7
1280S36.3Very low36.3Very low107 Ų107135 Ų13575%0.74873%0.733SS**  trans92.1132.7137.269.50000123.8
1281T34.2Very low36.1Very low131 Ų131140.3 Ų140.380%0.80474%0.741SS**  trans-88.2-178.7166.72.30000110.7
1282P39.4Very low36.1Very low107 Ų107139 Ų13970%0.69574%0.742SS**  cis-165.2173.648.946.8-23.1000122.7
1283Q35.8Very low36.1Very low172 Ų172141.8 Ų141.880%0.80475%0.747SS**  trans68.2137.2133.7-84.1-175.723.200127.9
1284V36.4Very low35.9Very low129 Ų129144.8 Ų144.878%0.78276%0.755SS**  trans76.8139.3136.51690000120.3
1285G37.3Very low35.9Very low57 Ų57144.6 Ų144.659%0.58876%0.755SS**  cis137.5157.6-13.200000117.3
1286R37.4Very low35.5Very low236 Ų236144.7 Ų144.789%0.89176%0.756SS**  trans71.5153.1174.7-60.4-176.4176.8-154.6-1.3114.7
1287R36.6Very low35.4Very low224 Ų224146.2 Ų146.285%0.84576%0.763SS**  cis-113.7-134.128-79.783.1-170.6-732.6116.4
1288S35.7Very low35.2Very low82 Ų82145 Ų14557%0.57376%0.759SS**  trans172.1168.6-141.650.90000114.9
1289F33.4Very low35Very low188 Ų188147.8 Ų147.883%0.82576%0.763SS**  trans87.9155.3171.8-56.5-55.5000114.2
1290K40Very low34.8Very low185 Ų185150.5 Ų150.580%0.80476%0.764SS**  cis-135.2-132.226.9-160.2167.1-76.4169.60114.8
1291R31.2Very low34.7Very low224 Ų224154.3 Ų154.385%0.84577%0.767SS**  trans-174.2149.1-166.2-69-175.6170.6-168.5-7.9110.6
1292L34.4Very low34.7Very low148 Ų148160 Ų16078%0.77577%0.774SS**  171.2116.6111.1-91.6170000115.6
1293N33.4Very low34.4Very low126 Ų126160.3 Ų160.367%0.67478%0.778SS**  trans51.4115.8140.2-62.811.8000124.2
1294I29.1Very low34.3Very low149 Ų149158.2 Ų158.276%0.76478%0.782SS**  50.2138.898.5-61.1160.2000117.7
1295P35.5Very low34.1Very low104 Ų104157.7 Ų157.768%0.67579%0.785SS**  cis-142.3168.119.832.1-8.3000120.3
1296I29.7Very low33.8Very low156 Ų156161.3 Ų161.380%0.880%0.8SS**  trans23127.4132.7-46.9163.8000120.6
1297V35.4Very low33.5Very low141 Ų141155.5 Ų155.586%0.85580%0.795SS**  -173.7151.7127.3140.10000111.5
1298S31.7Very low33.3Very low103 Ų103150.6 Ų150.672%0.7280%0.795SS**  trans-111.9157.2-167.950.50000115.4
1299R34.2Very low33.2Very low228 Ų228151 Ų15186%0.8680%0.798SS**  trans175.7119.8139.4-100167.7178.4-170.32.6118.3
1300K34.3Very low33.1Very low164 Ų164149.5 Ų149.571%0.71380%0.795SS**  80.2108110.8-165.8-178.6-176.7179.30122.7
1301K34.1Very low32.8Very low187 Ų187148.8 Ų148.881%0.81380%0.795SS**  trans62.8128.2141.7-66.7-171.6176.5-1600121
1302R34.7Very low32.9Very low250 Ų250147.7 Ų147.794%0.94380%0.796SS**  -160.5173.799.8-115.5176172.1172.5-3.8112.9
1303S31.4Very low32.9Very low114 Ų114145.7 Ų145.780%0.79780%0.801SS**  trans-142.6150.1-164.954.80000111.8
1304S35.2Very low32.9Very low127 Ų127144.2 Ų144.289%0.88880%0.801SS**  trans-150.9141.7162.351.70000111.3
1305S32.2Very low33.1Very low119 Ų119145.6 Ų145.683%0.83280%0.804SS**  trans-119.2155.2-173.453.10000111.8
1306C30.5Very low33Very low133 Ų133146.2 Ų146.290%0.89981%0.806SS**  trans-153.4159.1143.2-149.70000111.3
1307S30.5Very low33.3Very low113 Ų113147.2 Ų147.279%0.7981%0.807SS**  trans-158.9131.2-168.755.30000111.9
1308S33.5Very low33.5Very low122 Ų122147.7 Ų147.785%0.85381%0.811SS**  trans-174.7158.2166.5-170.30000110.2
1309S32.1Very low33.5Very low91 Ų91150 Ų15064%0.63682%0.815SS**  cis170.3109.7-46.7171.40000109
1310M31.7Very low33.6Very low155 Ų155149.5 Ų149.576%0.76481%0.813SS**  trans61.8174.1163.5-52.6-174.667.400114.7
1311E33.3Very low33.7Very low170 Ų170151.1 Ų151.179%0.79482%0.821SS**  cis-146.7176.16.6-162.3148.8-152.300112.2
1312K34.6Very low33.7Very low201 Ų201149.9 Ų149.987%0.87482%0.822SS**  trans-93.3146.7175.3-61.8175.8179.5177.80111.7
1313A34.1Very low34.1Very low107 Ų107146.3 Ų146.388%0.88482%0.816SS**  trans-149.7164.4156.200000110.6
1314S33.7Very low34.3Very low95 Ų95150.1 Ų150.166%0.66482%0.818SS**  trans-149.1151.7-167.956.90000112.9
1315Q33.7Very low34.4Very low177 Ų177151.2 Ų151.283%0.82782%0.815SS**  trans67.3157.1167-61.3172.8-4800114.1
1316T33.4Very low34.6Very low118 Ų118154.1 Ų154.172%0.72482%0.815SS**  cis-152.51804-12.80000110.2
1317E34.7Very low35.2Very low176 Ų176155.5 Ų155.582%0.82281%0.812SS**  trans64.3117.8158.2-69.9-179.4133.800120
1318T39.3Very low36Very low151 Ų151156.9 Ų156.993%0.92681%0.811SS**  -157.1142.31063.40000111.1
1319D32.3Very low36.5Very low153 Ų153157.1 Ų157.182%0.81881%0.812SS**  trans-121.8163.4-177.7-174.719.3000110.4
1320R36.8Very low37.8Very low216 Ų216156.7 Ų156.782%0.81581%0.806SS**  trans103.3110.3-179.2-59.9161.5-178.1-179.62.9115.5
1321F35.9Very low39.6Very low198 Ų198152.8 Ų152.887%0.86879%0.788SS**  -166.1122.196.5-114.8-81.4000111
1322L35.2Very low41.6Very low162 Ų162151.7 Ų151.785%0.84878%0.777SS**  trans-119.4122.4172.2-88.8171000110.1
1323Q41.2Very low43.5Very low174 Ų174148.7 Ų148.781%0.81376%0.764SS**  trans-128.9117.1163.2-102.9-174.5-5.300109.7
1324K35.8Very low45.6Very low194 Ų194147.3 Ų147.384%0.84374%0.744SS**  trans-75.6134.1172.4-73.3-179174-179.80109.8
1325N37.7Very low47.7Very low151 Ų151143.5 Ų143.581%0.80772%0.717SS**  trans-133.6142153.4-89.7-47000108.9L1327N1325-L1327 PolarHBondContact O-N 3.33Å
1326H36.2Very low49.9Very low180 Ų180137.7 Ų137.783%0.83370%0.696SS**  trans-79.4114.2-179.3-75-101.5000110.2
1327L44.4Very low52.4Low162 Ų162135.3 Ų135.385%0.84868%0.682SS**  trans-101.1125160.3-76.9167.6000108.3N1325N1325-L1327 PolarHBondContact O-N 3.33Å
1328N46.6Very low54.7Low142 Ų142129.1 Ų129.176%0.75966%0.656SS**  trans-74.4144.9-179.8-69.4-33.5000110.3T1330N1328-T1330 PolarHBondContact O-N 2.9Å
1329S44.6Very low56.9Low126 Ų126125 Ų12588%0.88163%0.627SS**  trans-56102.4178.8-1770000112.2D1331S1329-D1331 PolarHBondContact O-N 3.02Å
1330T58.8Low59.4Low83 Ų83121 Ų12151%0.50961%0.611SS.*  trans-83.8106.6169.9460000109.3N1328 W1332N1328-T1330 PolarHBondContact O-N 2.9Å; T1330-W1332 PolarHBondContact O-N 2.89Å
1331D70.6Confident61.8Low72 Ų72116.1 Ų116.139%0.38560%0.598SS.*  trans-55.3129.1178.5-173.1-19.1000110.7S1329 K1333 T1334S1329-D1331 PolarHBondContact O-N 3.02Å; D1331-K1333 PolarHBondContact O-N 3Å; D1331-K1333 WeakPolarHBondContact OD1-CB 3.28Å; D1331-K1333 VanDerWaalsContact OD1-CG 3.3Å; D1331-K1333 WeakPolarHBondContact OD1-CG 3.46Å; D1331-K1333 PolarHBondContact OD1-N 2.98Å; D1331-K1333 IonicContact OD1-NZ 2.82Å; D1331-K1333 PolarHBondContact OD1-NZ 3.23Å; D1331-K1333 IonicContact OD2-NZ 3.61Å; D1331-K1333 PolarHBondContact OD2-NZ 3.22Å; D1331-T1334 WeakPolarHBondContact O-CB 3.38Å; D1331-T1334 PolarHBondContact O-N 3.13Å; D1331-T1334 PolarHBondContact O-OG1 3Å
1332W73.4Confident64.3Low148 Ų148106.7 Ų106.756%0.56156%0.556SS**Hα-helixtrans-49.5-30.9176.2174.5-111.9000113T1330 T1334 V1335 S1336 E1397T1330-W1332 PolarHBondContact O-N 2.89Å; W1332-T1334 PolarHBondContact O-N 2.79Å; W1332-T1334 VanDerWaalsContact O-N 3.16Å; W1332-V1335 HydrophobicContact CE3-CB 4.29Å; W1332-V1335 HydrophobicContact CE3-CG2 4.47Å; W1332-V1335 HydrophobicContact CZ3-CG1 4.33Å; W1332-V1335 WeakPolarHBondContact O-CB 3.42Å; W1332-V1335 PolarHBondContact O-N 3.42Å; W1332-S1336 PolarHBondContact O-N 3.46Å; W1332-E1397 HydrophobicContact CH2-CG 4.5Å; W1332-E1397 WeakPolarHBondContact CH2-OE1 3.29Å; W1332-E1397 HydrophobicContact CZ3-CG 4.1Å
1333K76.3Confident66.7Low137 Ų137101.9 Ų101.960%0.59654%0.54SS*.Hα-helixtrans-54.7-32.6172.7-63.3-178-155.788.50112.8D1331 T1337D1331-K1333 PolarHBondContact O-N 3Å; D1331-K1333 WeakPolarHBondContact OD1-CB 3.28Å; D1331-K1333 VanDerWaalsContact OD1-CG 3.3Å; D1331-K1333 WeakPolarHBondContact OD1-CG 3.46Å; D1331-K1333 PolarHBondContact OD1-N 2.98Å; D1331-K1333 IonicContact OD1-NZ 2.82Å; D1331-K1333 PolarHBondContact OD1-NZ 3.23Å; D1331-K1333 IonicContact OD2-NZ 3.61Å; D1331-K1333 PolarHBondContact OD2-NZ 3.22Å; K1333-T1337 WeakPolarHBondContact O-CB 3.2Å; K1333-T1337 VanDerWaalsContact O-CG2 3.3Å; K1333-T1337 WeakPolarHBondContact O-CG2 3.22Å; K1333-T1337 PolarHBondContact O-N 2.92Å; K1333-T1337 PolarHBondContact O-OG1 3.19Å
1334T77.2Confident69Low78 Ų7899 Ų9948%0.47953%0.526SS..Hα-helixtrans-67.1-40.7177.6-36.30000111.6D1331 W1332 T1337 T1338D1331-T1334 WeakPolarHBondContact O-CB 3.38Å; D1331-T1334 PolarHBondContact O-N 3.13Å; D1331-T1334 PolarHBondContact O-OG1 3Å; W1332-T1334 PolarHBondContact O-N 2.79Å; W1332-T1334 VanDerWaalsContact O-N 3.16Å; T1334-T1337 PolarHBondContact O-OG1 3.45Å; T1334-T1338 WeakPolarHBondContact O-CB 3.35Å; T1334-T1338 PolarHBondContact O-N 3.45Å; T1334-T1338 VanDerWaalsContact O-N 3.13Å; T1334-T1338 PolarHBondContact O-OG1 2.9Å
1335V78.7Confident71.6Confident15 Ų1593.1 Ų93.19%0.09150%0.502CS..Hα-helixtrans-67.2-52.8177.8-173.40000109.2W1332 T1337 T1338 I1339 A1393 V1396W1332-V1335 HydrophobicContact CE3-CB 4.29Å; W1332-V1335 HydrophobicContact CE3-CG2 4.47Å; W1332-V1335 HydrophobicContact CZ3-CG1 4.33Å; W1332-V1335 WeakPolarHBondContact O-CB 3.42Å; W1332-V1335 PolarHBondContact O-N 3.42Å; V1335-T1337 PolarHBondContact O-N 3.34Å; V1335-T1338 PolarHBondContact O-N 3.25Å; V1335-I1339 HydrophobicContact CG1-CD1 4.24Å; V1335-I1339 WeakPolarHBondContact O-CG1 3.42Å; V1335-I1339 PolarHBondContact O-N 2.86Å; V1335-I1339 VanDerWaalsContact O-N 3.09Å; V1335-A1393 HydrophobicContact CG1-CB 3.73Å; V1335-V1396 HydrophobicContact CG2-CG1 4.27Å
1336S79.7Confident74.1Confident55 Ų5587.5 Ų87.539%0.38547%0.473SS..Hα-helixtrans-59.5-43.6179.41790000113.3W1332 I1339 S1340W1332-S1336 PolarHBondContact O-N 3.46Å; S1336-I1339 PolarHBondContact O-N 3.36Å; S1336-S1340 WeakPolarHBondContact O-CB 3.3Å; S1336-S1340 PolarHBondContact O-N 3.2Å; S1336-S1340 PolarHBondContact O-OG 3.3Å
1337T84.3Confident76.6Confident69 Ų6981.7 Ų81.742%0.42346%0.456SS..Hα-helixtrans-67.7-36.7177.147.90000112.6K1333 T1334 V1335 S1340 Q1341K1333-T1337 WeakPolarHBondContact O-CB 3.2Å; K1333-T1337 VanDerWaalsContact O-CG2 3.3Å; K1333-T1337 WeakPolarHBondContact O-CG2 3.22Å; K1333-T1337 PolarHBondContact O-N 2.92Å; K1333-T1337 PolarHBondContact O-OG1 3.19Å; T1334-T1337 PolarHBondContact O-OG1 3.45Å; V1335-T1337 PolarHBondContact O-N 3.34Å; T1337-S1340 PolarHBondContact O-N 2.95Å; T1337-Q1341 WeakPolarHBondContact O-CB 3.34Å; T1337-Q1341 VanDerWaalsContact O-CG 3.29Å; T1337-Q1341 WeakPolarHBondContact O-CG 3.31Å; T1337-Q1341 PolarHBondContact O-N 3.12Å
1338T83.8Confident78.9Confident45 Ų4579.3 Ų79.328%0.27644%0.439SS..Hα-helixtrans-63.6-42.9176.3-60.60000111.9T1334 V1335 S1342 R1389T1334-T1338 WeakPolarHBondContact O-CB 3.35Å; T1334-T1338 PolarHBondContact O-N 3.45Å; T1334-T1338 VanDerWaalsContact O-N 3.13Å; T1334-T1338 PolarHBondContact O-OG1 2.9Å; V1335-T1338 PolarHBondContact O-N 3.25Å; T1338-S1342 WeakPolarHBondContact O-CB 3.39Å; T1338-S1342 PolarHBondContact O-N 3.11Å; T1338-S1342 PolarHBondContact O-OG 3.27Å; T1338-R1389 HydrophobicContact CG2-CB 3.98Å; T1338-R1389 HydrophobicContact CG2-CG 4.34Å
1339I85.1Confident81Confident65 Ų6573.7 Ų73.733%0.33341%0.409SS..Hα-helixtrans-64.2-47.6174.4-64.7168.4000110V1335 S1336 Q1341 S1342 A1343 I1390 A1393V1335-I1339 HydrophobicContact CG1-CD1 4.24Å; V1335-I1339 WeakPolarHBondContact O-CG1 3.42Å; V1335-I1339 PolarHBondContact O-N 2.86Å; V1335-I1339 VanDerWaalsContact O-N 3.09Å; S1336-I1339 PolarHBondContact O-N 3.36Å; I1339-Q1341 PolarHBondContact O-N 3.07Å; I1339-S1342 WeakPolarHBondContact O-CB 3.49Å; I1339-S1342 PolarHBondContact O-N 3.05Å; I1339-A1343 PolarHBondContact O-N 3.45Å; I1339-I1390 HydrophobicContact CG1-CG1 4.47Å; I1339-A1393 HydrophobicContact CD1-CB 4.1Å; I1339-A1393 HydrophobicContact CG1-CB 4.08Å
1340S85.9Confident83.1Confident68 Ų6874.6 Ų74.648%0.47639%0.394SS..Hα-helixtrans-61-43.2-178.2-58.50000113.2S1336 T1337 S1342 A1343 Q1344S1336-S1340 WeakPolarHBondContact O-CB 3.3Å; S1336-S1340 PolarHBondContact O-N 3.2Å; S1336-S1340 PolarHBondContact O-OG 3.3Å; T1337-S1340 PolarHBondContact O-N 2.95Å; S1340-S1342 VanDerWaalsContact C-N 3.34Å; S1340-A1343 PolarHBondContact O-N 3Å; S1340-Q1344 WeakPolarHBondContact O-CB 3.38Å; S1340-Q1344 PolarHBondContact O-N 2.99Å
1341Q87.1Confident84.6Confident114 Ų11473.3 Ų73.353%0.53339%0.392SS..Hα-helixtrans-62.4-42.3175.5-74.1172.56.600111.5T1337 I1339 Q1344 E1345T1337-Q1341 WeakPolarHBondContact O-CB 3.34Å; T1337-Q1341 VanDerWaalsContact O-CG 3.29Å; T1337-Q1341 WeakPolarHBondContact O-CG 3.31Å; T1337-Q1341 PolarHBondContact O-N 3.12Å; I1339-Q1341 PolarHBondContact O-N 3.07Å; Q1341-Q1344 PolarHBondContact O-N 3.15Å; Q1341-E1345 PolarHBondContact O-N 3.06Å
1342S87.5Confident85.7Confident0 Ų075 Ų750%040%0.397CS..Hα-helixtrans-65.4-41.4-179.6-55.10000112.3T1338 I1339 S1340 Q1344 E1345 V1346 R1389T1338-S1342 WeakPolarHBondContact O-CB 3.39Å; T1338-S1342 PolarHBondContact O-N 3.11Å; T1338-S1342 PolarHBondContact O-OG 3.27Å; I1339-S1342 WeakPolarHBondContact O-CB 3.49Å; I1339-S1342 PolarHBondContact O-N 3.05Å; S1340-S1342 VanDerWaalsContact C-N 3.34Å; S1342-Q1344 VanDerWaalsContact C-N 3.35Å; S1342-E1345 PolarHBondContact O-N 3.49Å; S1342-V1346 PolarHBondContact O-N 3.28Å; S1342-R1389 WeakPolarHBondContact OG-CD 3.49Å; S1342-R1389 PolarHBondContact OG-NH1 2.92Å; S1342-R1389 VanDerWaalsContact OG-NH1 3.1Å
1343A86.1Confident86.5Confident61 Ų6168.9 Ų68.950%0.50438%0.375SS..Hα-helixtrans-63-40.3172.100000112I1339 S1340 E1345 V1346 A1347I1339-A1343 PolarHBondContact O-N 3.45Å; S1340-A1343 PolarHBondContact O-N 3Å; A1343-E1345 PolarHBondContact O-N 3.42Å; A1343-V1346 PolarHBondContact O-N 2.95Å; A1343-A1347 WeakPolarHBondContact O-CB 3.38Å; A1343-A1347 PolarHBondContact O-N 3.39Å
1344Q89.6Confident87.1Confident113 Ų11366.9 Ų66.953%0.52837%0.368SS..Hα-helixtrans-68.8-31.3-179.9-154.8-165.458.500113.2S1340 Q1341 S1342 K1348S1340-Q1344 WeakPolarHBondContact O-CB 3.38Å; S1340-Q1344 PolarHBondContact O-N 2.99Å; Q1341-Q1344 PolarHBondContact O-N 3.15Å; S1342-Q1344 VanDerWaalsContact C-N 3.35Å; Q1344-K1348 WeakPolarHBondContact O-CD 3.42Å; Q1344-K1348 VanDerWaalsContact O-CG 3.27Å; Q1344-K1348 WeakPolarHBondContact O-CG 3.48Å; Q1344-K1348 PolarHBondContact O-N 3.02Å
1345E89Confident87.7Confident72 Ų7265.5 Ų65.534%0.33637%0.365SS..Hα-helixtrans-67-45.7173.3-74.9172.4169.900111.7Q1341 S1342 A1343 K1348 L1349 R1389Q1341-E1345 PolarHBondContact O-N 3.06Å; S1342-E1345 PolarHBondContact O-N 3.49Å; A1343-E1345 PolarHBondContact O-N 3.42Å; E1345-K1348 PolarHBondContact O-N 3.37Å; E1345-L1349 PolarHBondContact O-N 3.36Å; E1345-R1389 IonicContact OE1-CZ 2.68Å; E1345-R1389 IonicContact OE1-NH1 3.72Å; E1345-R1389 IonicContact OE1-NH2 3.46Å; E1345-R1389 PolarHBondContact OE1-NH2 2.81Å; E1345-R1389 IonicContact OE2-CZ 3.23Å; E1345-R1389 IonicContact OE2-NH1 2.62Å; E1345-R1389 PolarHBondContact OE2-NH1 3.45Å; E1345-R1389 IonicContact OE2-NH2 2.69Å; E1345-R1389 PolarHBondContact OE2-NH2 2.72Å
1346V90.7Very high88.2Confident32 Ų3264.9 Ų64.919%0.19436%0.361CS..Hα-helixtrans-64.3-44.6177.5175.20000111.4S1342 A1343 K1348 L1349 Y1350 L1379 A1382 L1383 A1386S1342-V1346 PolarHBondContact O-N 3.28Å; A1343-V1346 PolarHBondContact O-N 2.95Å; V1346-K1348 VanDerWaalsContact C-N 3.32Å; V1346-K1348 PolarHBondContact O-N 3.31Å; V1346-L1349 PolarHBondContact O-N 3.43Å; V1346-Y1350 PolarHBondContact O-N 3.07Å; V1346-L1379 HydrophobicContact CG1-CD1 4.16Å; V1346-A1382 HydrophobicContact CG2-CB 4.37Å; V1346-L1383 HydrophobicContact CG1-CD2 3.79Å; V1346-L1383 HydrophobicContact CG1-CG 4.39Å; V1346-L1383 HydrophobicContact CG2-CD2 3.99Å; V1346-L1383 HydrophobicContact CG2-CG 4.39Å; V1346-A1386 HydrophobicContact CG2-CB 4.09Å
1347A89.1Confident88.6Confident58 Ų5867.1 Ų67.148%0.47936%0.361SS..Hα-helixtrans-60-38.9179.200000113A1343 L1349 Y1350 A1351A1343-A1347 WeakPolarHBondContact O-CB 3.38Å; A1343-A1347 PolarHBondContact O-N 3.39Å; A1347-L1349 PolarHBondContact O-N 2.86Å; A1347-Y1350 PolarHBondContact O-N 2.78Å; A1347-A1351 PolarHBondContact O-N 3.35Å
1348K91.8Very high88.7Confident112 Ų11268.9 Ų68.949%0.48737%0.365SS..Hα-helixtrans-62.8-39.8176.3-75.4165.9-173.71620112.4Q1344 E1345 V1346 Q1352Q1344-K1348 WeakPolarHBondContact O-CD 3.42Å; Q1344-K1348 VanDerWaalsContact O-CG 3.27Å; Q1344-K1348 WeakPolarHBondContact O-CG 3.48Å; Q1344-K1348 PolarHBondContact O-N 3.02Å; E1345-K1348 PolarHBondContact O-N 3.37Å; V1346-K1348 VanDerWaalsContact C-N 3.32Å; V1346-K1348 PolarHBondContact O-N 3.31Å; K1348-Q1352 WeakPolarHBondContact O-CG 3.37Å; K1348-Q1352 PolarHBondContact O-N 3.05Å; K1348-Q1352 VanDerWaalsContact O-N 3.12Å
1349L91Very high88.8Confident24 Ų2470.7 Ų70.713%0.12637%0.37CS..Hα-helixtrans-73.4-36.6178.9-76.3162.6000112.3E1345 V1346 A1347 Q1352 I1353 Q1378 L1379 A1382E1345-L1349 PolarHBondContact O-N 3.36Å; V1346-L1349 PolarHBondContact O-N 3.43Å; A1347-L1349 PolarHBondContact O-N 2.86Å; L1349-Q1352 PolarHBondContact O-N 2.98Å; L1349-I1353 WeakPolarHBondContact O-CG1 3.31Å; L1349-I1353 PolarHBondContact O-N 3.42Å; L1349-Q1378 HydrophobicContact CD1-CB 4.41Å; L1349-Q1378 HydrophobicContact CD2-CB 3.79Å; L1349-L1379 HydrophobicContact CB-CD1 3.99Å; L1349-A1382 HydrophobicContact CD1-CB 3.37Å
1350Y90Very high88.8Confident146 Ų14668.9 Ų68.957%0.57336%0.36SS*.Hα-helixtrans-60.6-46.9172.2-168.4-85.9000111.3V1346 A1347 Q1352 I1353 Q1354V1346-Y1350 PolarHBondContact O-N 3.07Å; A1347-Y1350 PolarHBondContact O-N 2.78Å; Y1350-Q1352 VanDerWaalsContact C-N 3.32Å; Y1350-Q1352 PolarHBondContact O-N 3.21Å; Y1350-I1353 PolarHBondContact O-N 2.89Å; Y1350-I1353 VanDerWaalsContact O-N 3.14Å; Y1350-Q1354 PolarHBondContact O-N 3.35Å
1351A90.4Very high88.4Confident56 Ų5671.6 Ų71.646%0.46337%0.37SS..Hα-helixtrans-60.6-37.6176.100000112.9A1347 Q1354 A1355A1347-A1351 PolarHBondContact O-N 3.35Å; A1351-Q1354 PolarHBondContact O-N 3.25Å; A1351-A1355 WeakPolarHBondContact O-CB 3.25Å; A1351-A1355 PolarHBondContact O-N 3.41Å
1352Q92.3Very high88.1Confident106 Ų10670 Ų7050%0.49538%0.376SS..Hα-helixtrans-67.1-35.3174.6-75.9-179.6-2.900113.3K1348 L1349 Y1350 Y1356 L1375K1348-Q1352 WeakPolarHBondContact O-CG 3.37Å; K1348-Q1352 PolarHBondContact O-N 3.05Å; K1348-Q1352 VanDerWaalsContact O-N 3.12Å; L1349-Q1352 PolarHBondContact O-N 2.98Å; Y1350-Q1352 VanDerWaalsContact C-N 3.32Å; Y1350-Q1352 PolarHBondContact O-N 3.21Å; Q1352-Y1356 WeakPolarHBondContact O-CB 3.42Å; Q1352-Y1356 PolarHBondContact O-N 2.73Å; Q1352-L1375 HydrophobicContact CB-CD2 4.28Å
1353I90.3Very high87.5Confident21 Ų2176 Ų7611%0.10840%0.403CS..Hα-helixtrans-68.2-46174.4-71163000110.3L1349 Y1350 Y1356 Y1357 L1375 L1379L1349-I1353 WeakPolarHBondContact O-CG1 3.31Å; L1349-I1353 PolarHBondContact O-N 3.42Å; Y1350-I1353 PolarHBondContact O-N 2.89Å; Y1350-I1353 VanDerWaalsContact O-N 3.14Å; I1353-Y1356 WeakPolarHBondContact O-CB 3.43Å; I1353-Y1356 PolarHBondContact O-N 3.47Å; I1353-Y1357 HydrophobicContact CG2-CD2 3.96Å; I1353-Y1357 HydrophobicContact CG2-CE2 3.82Å; I1353-Y1357 WeakPolarHBondContact O-CD2 3.28Å; I1353-Y1357 PolarHBondContact O-N 2.94Å; I1353-Y1357 VanDerWaalsContact O-N 3.09Å; I1353-L1375 HydrophobicContact CD1-CB 4.32Å; I1353-L1375 HydrophobicContact CG1-CB 3.68Å; I1353-L1375 HydrophobicContact CG1-CD1 4.39Å; I1353-L1379 HydrophobicContact CD1-CB 4Å; I1353-L1379 HydrophobicContact CD1-CD2 3.75Å; I1353-L1379 HydrophobicContact CD1-CG 4.38Å
1354Q89.8Confident86.4Confident94 Ų9483 Ų8344%0.43942%0.423SS..Hα-helixtrans-62.4-49.8179.1178.4169-18.500111.9Y1350 A1351 Y1356 Y1357 E1358Y1350-Q1354 PolarHBondContact O-N 3.35Å; A1351-Q1354 PolarHBondContact O-N 3.25Å; Q1354-Y1356 PolarHBondContact O-N 2.83Å; Q1354-Y1357 PolarHBondContact O-N 3.36Å; Q1354-E1358 WeakPolarHBondContact CG-OE1 3.37Å; Q1354-E1358 PolarHBondContact NE2-OE1 3.03Å; Q1354-E1358 PolarHBondContact O-N 3.43Å
1355A89.8Confident85.1Confident50 Ų5085.1 Ų85.141%0.41343%0.431SS..Hα-helixtrans-58.9-31.3176.100000112.7A1351 E1359A1351-A1355 WeakPolarHBondContact O-CB 3.25Å; A1351-A1355 PolarHBondContact O-N 3.41Å; A1355-E1359 VanDerWaalsContact O-CB 3.27Å; A1355-E1359 WeakPolarHBondContact O-CB 3.46Å; A1355-E1359 PolarHBondContact O-N 3.25Å
1356Y89.9Confident84.1Confident1 Ų193.1 Ų93.10%0.00446%0.458CS..Hα-helixtrans-71-36.4173.8177.3-110.2000113Q1352 I1353 Q1354 Q1360 P1367 S1368 R1371 L1372 L1375Q1352-Y1356 WeakPolarHBondContact O-CB 3.42Å; Q1352-Y1356 PolarHBondContact O-N 2.73Å; I1353-Y1356 WeakPolarHBondContact O-CB 3.43Å; I1353-Y1356 PolarHBondContact O-N 3.47Å; Q1354-Y1356 PolarHBondContact O-N 2.83Å; Y1356-Q1360 HydrophobicContact CD2-CG 4.24Å; Y1356-Q1360 HydrophobicContact CE1-CG 4.18Å; Y1356-Q1360 HydrophobicContact CE2-CG 3.76Å; Y1356-Q1360 VanDerWaalsContact O-CG 3.3Å; Y1356-Q1360 WeakPolarHBondContact O-CG 3.22Å; Y1356-Q1360 PolarHBondContact O-N 3.1Å; Y1356-P1367 HydrophobicContact CE1-CB 4.15Å; Y1356-S1368 PolarHBondContact OH-N 2.99Å; Y1356-S1368 PolarHBondContact OH-O 2.85Å; Y1356-S1368 PolarHBondContact OH-OG 3.15Å; Y1356-S1368 VanDerWaalsContact OH-OG 3.08Å; Y1356-R1371 HydrophobicContact CD2-CG 4.31Å; Y1356-R1371 HydrophobicContact CE2-CB 4.33Å; Y1356-R1371 HydrophobicContact CE2-CG 3.91Å; Y1356-L1372 HydrophobicContact CD1-CD1 4.27Å; Y1356-L1372 HydrophobicContact CE1-CB 3.97Å; Y1356-L1372 HydrophobicContact CE1-CD1 4.34Å; Y1356-L1375 HydrophobicContact CD1-CD1 4.27Å; Y1356-L1375 HydrophobicContact CG-CD1 4.15Å
1357Y87.2Confident83.2Confident102 Ų10293.8 Ų93.840%0.446%0.463SS..Hα-helixtrans-66.5-40.6172-84.8-75.4000112I1353 Q1354 Q1360 N1361 L1372I1353-Y1357 HydrophobicContact CG2-CD2 3.96Å; I1353-Y1357 HydrophobicContact CG2-CE2 3.82Å; I1353-Y1357 WeakPolarHBondContact O-CD2 3.28Å; I1353-Y1357 PolarHBondContact O-N 2.94Å; I1353-Y1357 VanDerWaalsContact O-N 3.09Å; Q1354-Y1357 PolarHBondContact O-N 3.36Å; Y1357-Q1360 PolarHBondContact O-N 2.92Å; Y1357-N1361 WeakPolarHBondContact O-CB 3.49Å; Y1357-N1361 PolarHBondContact O-N 2.81Å; Y1357-L1372 HydrophobicContact CE2-CD1 3.81Å
1358E87.1Confident82.8Confident107 Ų10794.2 Ų94.250%0.546%0.462SS..Hα-helixtrans-63-45.9175.4-68.5163.1-175.400111.1Q1354 Q1360 N1361 A1362Q1354-E1358 WeakPolarHBondContact CG-OE1 3.37Å; Q1354-E1358 PolarHBondContact NE2-OE1 3.03Å; Q1354-E1358 PolarHBondContact O-N 3.43Å; E1358-Q1360 VanDerWaalsContact C-N 3.35Å; E1358-Q1360 PolarHBondContact O-N 2.74Å; E1358-N1361 PolarHBondContact O-N 3.49Å; E1358-A1362 WeakPolarHBondContact O-CB 3.39Å; E1358-A1362 PolarHBondContact O-N 2.94Å
1359E86.1Confident82.4Confident83 Ų8397.7 Ų97.739%0.38848%0.477SS..Hα-helixtrans-58.5-39.1174-178.9-177.7-133.600112.9A1355 H1363 R1371A1355-E1359 VanDerWaalsContact O-CB 3.27Å; A1355-E1359 WeakPolarHBondContact O-CB 3.46Å; A1355-E1359 PolarHBondContact O-N 3.25Å; E1359-H1363 PolarHBondContact O-CD2 3.22Å; E1359-R1371 IonicContact OE1-NH1 2.75Å; E1359-R1371 IonicContact OE2-CZ 2.92Å; E1359-R1371 IonicContact OE2-NH1 3.86Å; E1359-R1371 PolarHBondContact OE2-NH1 3.38Å; E1359-R1371 IonicContact OE2-NH2 3.54Å; E1359-R1371 PolarHBondContact OE2-NH2 2.84Å
1360Q83.5Confident82Confident26 Ų26104.6 Ų104.612%0.12151%0.508CS..Hα-helixtrans-77-40178.5-66.7-59.4-73.800112.8Y1356 Y1357 E1358 A1362 H1363 F1364 P1367Y1356-Q1360 HydrophobicContact CD2-CG 4.24Å; Y1356-Q1360 HydrophobicContact CE1-CG 4.18Å; Y1356-Q1360 HydrophobicContact CE2-CG 3.76Å; Y1356-Q1360 VanDerWaalsContact O-CG 3.3Å; Y1356-Q1360 WeakPolarHBondContact O-CG 3.22Å; Y1356-Q1360 PolarHBondContact O-N 3.1Å; Y1357-Q1360 PolarHBondContact O-N 2.92Å; E1358-Q1360 VanDerWaalsContact C-N 3.35Å; E1358-Q1360 PolarHBondContact O-N 2.74Å; Q1360-A1362 VanDerWaalsContact C-N 3.32Å; Q1360-A1362 PolarHBondContact O-N 3.19Å; Q1360-H1363 PolarHBondContact O-N 2.75Å; Q1360-H1363 VanDerWaalsContact O-N 3.13Å; Q1360-F1364 PolarHBondContact O-N 3.44Å; Q1360-P1367 HydrophobicContact CB-CG 3.96Å; Q1360-P1367 HydrophobicContact CG-CB 4.1Å; Q1360-P1367 HydrophobicContact CG-CG 4Å
1361N79Confident81.8Confident125 Ų125103.1 Ų103.167%0.66850%0.502SS*.Hα-helixtrans-60.8-41.1176.4-78.5-11.3000111.5Y1357 E1358 H1363Y1357-N1361 WeakPolarHBondContact O-CB 3.49Å; Y1357-N1361 PolarHBondContact O-N 2.81Å; E1358-N1361 PolarHBondContact O-N 3.49Å; N1361-H1363 PolarHBondContact O-N 3.03Å
1362A80.4Confident81.8Confident80 Ų80102 Ų10266%0.66149%0.488SS*.THydrogen-bonded Turntrans-62.4-19.7176.600000114.4E1358 Q1360E1358-A1362 WeakPolarHBondContact O-CB 3.39Å; E1358-A1362 PolarHBondContact O-N 2.94Å; Q1360-A1362 VanDerWaalsContact C-N 3.32Å; Q1360-A1362 PolarHBondContact O-N 3.19Å
1363H74.4Confident81.7Confident126 Ų126100.1 Ų100.158%0.58349%0.486SS*.THydrogen-bonded Turntrans-112.92.1-173.6-77.3-41.9000115.4E1359 Q1360 N1361 K1365E1359-H1363 PolarHBondContact O-CD2 3.22Å; Q1360-H1363 PolarHBondContact O-N 2.75Å; Q1360-H1363 VanDerWaalsContact O-N 3.13Å; N1361-H1363 PolarHBondContact O-N 3.03Å; H1363-K1365 PolarHBondContact O-N 2.76Å
1364F62.1Low81.8Confident210 Ų210104.4 Ų104.492%0.92151%0.506SS*.THydrogen-bonded Turntrans54.214.5178.3-112.2-81000115.6Q1360Q1360-F1364 PolarHBondContact O-N 3.44Å
1365K63.2Low81.9Confident157 Ų157100.7 Ų100.768%0.68349%0.489SS*.PPolyproline II helixtrans-98.4142.5178.7-74.9172.2-178.1175.60109.2H1363H1363-K1365 PolarHBondContact O-N 2.76Å
1366R67.7Low82Confident239 Ų239102.3 Ų102.390%0.90249%0.49SS*.PPolyproline II helixtrans-63129.6175.8-80.4-178.2168.4173.9-3.1109.7S1368R1366-S1368 PolarHBondContact O-N 3.35Å
1367P72.2Confident82.1Confident47 Ų47108.4 Ų108.431%0.30552%0.519SS..PPolyproline II helixtrans-49.3130.5175.2-28.933.9000112.5Y1356 Q1360 K1369Y1356-P1367 HydrophobicContact CE1-CB 4.15Å; Q1360-P1367 HydrophobicContact CB-CG 3.96Å; Q1360-P1367 HydrophobicContact CG-CB 4.1Å; Q1360-P1367 HydrophobicContact CG-CG 4Å; P1367-K1369 PolarHBondContact O-N 3.37Å
1368S81.3Confident82.4Confident66 Ų66107.4 Ų107.446%0.46252%0.518SS..  trans-67.5104.9175.755.40000109.5Y1356 R1366 H1370 R1371 L1372Y1356-S1368 PolarHBondContact OH-N 2.99Å; Y1356-S1368 PolarHBondContact OH-O 2.85Å; Y1356-S1368 PolarHBondContact OH-OG 3.15Å; Y1356-S1368 VanDerWaalsContact OH-OG 3.08Å; R1366-S1368 PolarHBondContact O-N 3.35Å; S1368-H1370 PolarHBondContact O-N 3.04Å; S1368-R1371 PolarHBondContact O-N 3.29Å; S1368-L1372 PolarHBondContact O-N 3.19Å
1369K81.9Confident82.7Confident185 Ų185103.6 Ų103.680%0.80450%0.501SS*.Hα-helixtrans-47.7-34.6-173.2-68-173.9176.2-175.50113.7P1367 S1373P1367-K1369 PolarHBondContact O-N 3.37Å; K1369-S1373 WeakPolarHBondContact O-CB 3.04Å; K1369-S1373 PolarHBondContact O-N 2.98Å
1370H83.9Confident82.9Confident169 Ų169104.8 Ų104.878%0.78251%0.507SS*.Hα-helixtrans-64.1-45174.7-83.9-62.7000114.4S1368 S1373 H1374S1368-H1370 PolarHBondContact O-N 3.04Å; H1370-S1373 PolarHBondContact O-N 2.8Å; H1370-H1374 WeakPolarHBondContact O-CB 3.39Å; H1370-H1374 PolarHBondContact O-N 3.02Å
1371R86.1Confident83.3Confident115 Ų115108 Ų10843%0.43452%0.523SS..Hα-helixtrans-68.4-41-179.2-176.3167168.4-146.4-12.4110.8Y1356 E1359 S1368 H1374 L1375Y1356-R1371 HydrophobicContact CD2-CG 4.31Å; Y1356-R1371 HydrophobicContact CE2-CB 4.33Å; Y1356-R1371 HydrophobicContact CE2-CG 3.91Å; E1359-R1371 IonicContact OE1-NH1 2.75Å; E1359-R1371 IonicContact OE2-CZ 2.92Å; E1359-R1371 IonicContact OE2-NH1 3.86Å; E1359-R1371 PolarHBondContact OE2-NH1 3.38Å; E1359-R1371 IonicContact OE2-NH2 3.54Å; E1359-R1371 PolarHBondContact OE2-NH2 2.84Å; S1368-R1371 PolarHBondContact O-N 3.29Å; R1371-H1374 PolarHBondContact O-N 3.37Å; R1371-L1375 HydrophobicContact CG-CD1 4.48Å; R1371-L1375 WeakPolarHBondContact O-CG 3.33Å; R1371-L1375 PolarHBondContact O-N 2.86Å; R1371-L1375 VanDerWaalsContact O-N 3.12Å
1372L90.2Very high83.8Confident32 Ų32102.6 Ų102.617%0.16850%0.495CS..Hα-helixtrans-62-47.6172.8-17458.5000112Y1356 Y1357 S1368 H1374 L1375 L1376Y1356-L1372 HydrophobicContact CD1-CD1 4.27Å; Y1356-L1372 HydrophobicContact CE1-CB 3.97Å; Y1356-L1372 HydrophobicContact CE1-CD1 4.34Å; Y1357-L1372 HydrophobicContact CE2-CD1 3.81Å; S1368-L1372 PolarHBondContact O-N 3.19Å; L1372-H1374 VanDerWaalsContact C-N 3.31Å; L1372-H1374 PolarHBondContact O-N 3.49Å; L1372-L1375 PolarHBondContact O-N 3.39Å; L1372-L1376 HydrophobicContact CD1-CD1 4.11Å; L1372-L1376 HydrophobicContact CG-CD1 4.03Å; L1372-L1376 WeakPolarHBondContact O-CB 3.44Å; L1372-L1376 PolarHBondContact O-N 2.91Å
1373S89Confident84.3Confident67 Ų67102.1 Ų102.147%0.46948%0.481SS..Hα-helixtrans-62.3-36.6178.8-171.40000112.6K1369 H1370 Q1377K1369-S1373 WeakPolarHBondContact O-CB 3.04Å; K1369-S1373 PolarHBondContact O-N 2.98Å; H1370-S1373 PolarHBondContact O-N 2.8Å; S1373-Q1377 WeakPolarHBondContact O-CB 3.36Å; S1373-Q1377 PolarHBondContact O-N 3.17Å
1374H92.3Very high85Confident112 Ų112103.3 Ų103.352%0.51948%0.48SS..Hα-helixtrans-65.8-48.1176.4-175.9-83.1000111.5H1370 R1371 L1372 L1376 Q1377 Q1378H1370-H1374 WeakPolarHBondContact O-CB 3.39Å; H1370-H1374 PolarHBondContact O-N 3.02Å; R1371-H1374 PolarHBondContact O-N 3.37Å; L1372-H1374 VanDerWaalsContact C-N 3.31Å; L1372-H1374 PolarHBondContact O-N 3.49Å; H1374-L1376 PolarHBondContact O-N 3.4Å; H1374-Q1377 PolarHBondContact O-N 3.04Å; H1374-Q1378 PolarHBondContact CE1-OE1 3.41Å; H1374-Q1378 PolarHBondContact ND1-OE1 3.12Å; H1374-Q1378 WeakPolarHBondContact O-CG 3.2Å; H1374-Q1378 PolarHBondContact O-N 3.22Å
1375L93.1Very high86.3Confident16 Ų1695.5 Ų95.58%0.08445%0.45CS..Hα-helixtrans-62.2-41.7177.5-69.3169.6000111.9Q1352 I1353 Y1356 R1371 L1372 Q1377 Q1378 L1379Q1352-L1375 HydrophobicContact CB-CD2 4.28Å; I1353-L1375 HydrophobicContact CD1-CB 4.32Å; I1353-L1375 HydrophobicContact CG1-CB 3.68Å; I1353-L1375 HydrophobicContact CG1-CD1 4.39Å; Y1356-L1375 HydrophobicContact CD1-CD1 4.27Å; Y1356-L1375 HydrophobicContact CG-CD1 4.15Å; R1371-L1375 HydrophobicContact CG-CD1 4.48Å; R1371-L1375 WeakPolarHBondContact O-CG 3.33Å; R1371-L1375 PolarHBondContact O-N 2.86Å; R1371-L1375 VanDerWaalsContact O-N 3.12Å; L1372-L1375 PolarHBondContact O-N 3.39Å; L1375-Q1377 VanDerWaalsContact C-N 3.35Å; L1375-Q1377 PolarHBondContact O-N 3.38Å; L1375-Q1378 PolarHBondContact O-N 3.03Å; L1375-L1379 WeakPolarHBondContact O-CB 3.44Å; L1375-L1379 PolarHBondContact O-N 2.87Å
1376L91Very high87.5Confident83 Ų8388.3 Ų88.344%0.43542%0.42SS..Hα-helixtrans-61.4-40173.1-103.4139000112.6L1372 H1374 L1379 M1380L1372-L1376 HydrophobicContact CD1-CD1 4.11Å; L1372-L1376 HydrophobicContact CG-CD1 4.03Å; L1372-L1376 WeakPolarHBondContact O-CB 3.44Å; L1372-L1376 PolarHBondContact O-N 2.91Å; H1374-L1376 PolarHBondContact O-N 3.4Å; L1376-L1379 PolarHBondContact O-N 2.91Å; L1376-M1380 WeakPolarHBondContact O-CG 3.47Å; L1376-M1380 PolarHBondContact O-N 3.47Å
1377Q92.8Very high88.4Confident130 Ų13081.7 Ų81.761%0.60740%0.403SS*.Hα-helixtrans-69.3-37.4177.6-170.7167-1.800112S1373 H1374 L1375 M1380 E1381S1373-Q1377 WeakPolarHBondContact O-CB 3.36Å; S1373-Q1377 PolarHBondContact O-N 3.17Å; H1374-Q1377 PolarHBondContact O-N 3.04Å; L1375-Q1377 VanDerWaalsContact C-N 3.35Å; L1375-Q1377 PolarHBondContact O-N 3.38Å; Q1377-M1380 PolarHBondContact O-N 3.3Å; Q1377-E1381 PolarHBondContact O-N 3.02Å; Q1377-E1381 VanDerWaalsContact O-N 3.12Å
1378Q92.9Very high89.2Confident80 Ų8083.1 Ų83.137%0.37441%0.413SS..Hα-helixtrans-64.1-43.2171-70.1178.8-68.200111.9L1349 H1374 L1375 M1380 E1381 A1382L1349-Q1378 HydrophobicContact CD1-CB 4.41Å; L1349-Q1378 HydrophobicContact CD2-CB 3.79Å; H1374-Q1378 PolarHBondContact CE1-OE1 3.41Å; H1374-Q1378 PolarHBondContact ND1-OE1 3.12Å; H1374-Q1378 WeakPolarHBondContact O-CG 3.2Å; H1374-Q1378 PolarHBondContact O-N 3.22Å; L1375-Q1378 PolarHBondContact O-N 3.03Å; Q1378-M1380 PolarHBondContact O-N 2.55Å; Q1378-E1381 PolarHBondContact O-N 2.94Å; Q1378-A1382 WeakPolarHBondContact O-CB 3.43Å; Q1378-A1382 PolarHBondContact O-N 3.27Å
1379L92.8Very high89.6Confident28 Ų2883.4 Ų83.415%0.14740%0.404CS..Hα-helixtrans-60-44.9175.9-17867.7000111.5V1346 L1349 I1353 L1375 L1376 E1381 A1382 L1383V1346-L1379 HydrophobicContact CG1-CD1 4.16Å; L1349-L1379 HydrophobicContact CB-CD1 3.99Å; I1353-L1379 HydrophobicContact CD1-CB 4Å; I1353-L1379 HydrophobicContact CD1-CD2 3.75Å; I1353-L1379 HydrophobicContact CD1-CG 4.38Å; L1375-L1379 WeakPolarHBondContact O-CB 3.44Å; L1375-L1379 PolarHBondContact O-N 2.87Å; L1376-L1379 PolarHBondContact O-N 2.91Å; L1379-E1381 VanDerWaalsContact C-N 3.34Å; L1379-E1381 PolarHBondContact O-N 3.44Å; L1379-A1382 PolarHBondContact O-N 2.72Å; L1379-L1383 HydrophobicContact CD1-CD1 4.4Å; L1379-L1383 HydrophobicContact CG-CD1 4.02Å; L1379-L1383 WeakPolarHBondContact O-CB 3.42Å; L1379-L1383 VanDerWaalsContact O-CG 3.3Å; L1379-L1383 WeakPolarHBondContact O-CG 3.49Å; L1379-L1383 PolarHBondContact O-N 2.95Å
1380M91.5Very high89.7Confident107 Ų10777.6 Ų77.653%0.52738%0.381SS..Hα-helixtrans-63.7-36.2176.9-73.4-155.9-60.800113.2L1376 Q1377 Q1378 R1384L1376-M1380 WeakPolarHBondContact O-CG 3.47Å; L1376-M1380 PolarHBondContact O-N 3.47Å; Q1377-M1380 PolarHBondContact O-N 3.3Å; Q1378-M1380 PolarHBondContact O-N 2.55Å; M1380-R1384 WeakPolarHBondContact O-CB 3.4Å; M1380-R1384 PolarHBondContact O-N 3.16Å
1381E91.1Very high89.8Confident95 Ų9572.6 Ų72.644%0.44437%0.37SS..Hα-helixtrans-74.9-35.6178-16458.7-152.500112.3Q1377 Q1378 L1379 R1384 T1385Q1377-E1381 PolarHBondContact O-N 3.02Å; Q1377-E1381 VanDerWaalsContact O-N 3.12Å; Q1378-E1381 PolarHBondContact O-N 2.94Å; L1379-E1381 VanDerWaalsContact C-N 3.34Å; L1379-E1381 PolarHBondContact O-N 3.44Å; E1381-R1384 PolarHBondContact O-N 3.07Å; E1381-R1384 IonicContact OE2-CZ 3.61Å; E1381-R1384 IonicContact OE2-NH1 2.78Å; E1381-R1384 PolarHBondContact OE2-NH1 3.08Å; E1381-T1385 WeakPolarHBondContact O-CB 3.47Å; E1381-T1385 PolarHBondContact O-N 2.96Å; E1381-T1385 PolarHBondContact O-OG1 3.13Å
1382A89.6Confident89.7Confident11 Ų1170.7 Ų70.79%0.09137%0.374CS..Hα-helixtrans-64.5-43.4171.100000111.8V1346 L1349 Q1378 L1379 T1385 A1386V1346-A1382 HydrophobicContact CG2-CB 4.37Å; L1349-A1382 HydrophobicContact CD1-CB 3.37Å; Q1378-A1382 WeakPolarHBondContact O-CB 3.43Å; Q1378-A1382 PolarHBondContact O-N 3.27Å; L1379-A1382 PolarHBondContact O-N 2.72Å; A1382-T1385 PolarHBondContact O-N 3.26Å; A1382-A1386 VanDerWaalsContact O-CB 3.3Å; A1382-A1386 WeakPolarHBondContact O-CB 3.37Å; A1382-A1386 PolarHBondContact O-N 3.46Å
1383L90.6Very high89.3Confident70 Ų7069.5 Ų69.537%0.36637%0.369SS..Hα-helixtrans-62-42.5173.7-74.4167.4000112V1346 L1379 T1385 A1386 N1387V1346-L1383 HydrophobicContact CG1-CD2 3.79Å; V1346-L1383 HydrophobicContact CG1-CG 4.39Å; V1346-L1383 HydrophobicContact CG2-CD2 3.99Å; V1346-L1383 HydrophobicContact CG2-CG 4.39Å; L1379-L1383 HydrophobicContact CD1-CD1 4.4Å; L1379-L1383 HydrophobicContact CG-CD1 4.02Å; L1379-L1383 WeakPolarHBondContact O-CB 3.42Å; L1379-L1383 VanDerWaalsContact O-CG 3.3Å; L1379-L1383 WeakPolarHBondContact O-CG 3.49Å; L1379-L1383 PolarHBondContact O-N 2.95Å; L1383-T1385 VanDerWaalsContact C-N 3.33Å; L1383-T1385 PolarHBondContact O-N 3.33Å; L1383-A1386 PolarHBondContact O-N 3.17Å; L1383-N1387 WeakPolarHBondContact O-CB 3.3Å; L1383-N1387 VanDerWaalsContact O-CG 3.25Å; L1383-N1387 PolarHBondContact O-N 3.17Å
1384R90.2Very high88.9Confident150 Ų15069.2 Ų69.257%0.56636%0.364SS*.Hα-helixtrans-60.1-42174.1178.9176.1-70.6116.45.6112M1380 E1381 S1388M1380-R1384 WeakPolarHBondContact O-CB 3.4Å; M1380-R1384 PolarHBondContact O-N 3.16Å; E1381-R1384 PolarHBondContact O-N 3.07Å; E1381-R1384 IonicContact OE2-CZ 3.61Å; E1381-R1384 IonicContact OE2-NH1 2.78Å; E1381-R1384 PolarHBondContact OE2-NH1 3.08Å; R1384-S1388 PolarHBondContact O-N 2.91Å
1385T88.3Confident88.4Confident47 Ų4767.9 Ų67.929%0.28837%0.367SS..Hα-helixtrans-71.3-41.1178.4-57.20000112.2E1381 A1382 L1383 S1388 R1389E1381-T1385 WeakPolarHBondContact O-CB 3.47Å; E1381-T1385 PolarHBondContact O-N 2.96Å; E1381-T1385 PolarHBondContact O-OG1 3.13Å; A1382-T1385 PolarHBondContact O-N 3.26Å; L1383-T1385 VanDerWaalsContact C-N 3.33Å; L1383-T1385 PolarHBondContact O-N 3.33Å; T1385-S1388 PolarHBondContact O-N 2.9Å; T1385-S1388 PolarHBondContact O-OG 2.74Å; T1385-R1389 WeakPolarHBondContact O-CG 3.34Å; T1385-R1389 PolarHBondContact O-N 3.27Å; T1385-R1389 VanDerWaalsContact O-N 3.16Å
1386A88.5Confident87.8Confident5 Ų569.3 Ų69.34%0.04138%0.377CS..Hα-helixtrans-62.5-46.3175.400000111.1V1346 A1382 L1383 S1388 R1389 I1390V1346-A1386 HydrophobicContact CG2-CB 4.09Å; A1382-A1386 VanDerWaalsContact O-CB 3.3Å; A1382-A1386 WeakPolarHBondContact O-CB 3.37Å; A1382-A1386 PolarHBondContact O-N 3.46Å; L1383-A1386 PolarHBondContact O-N 3.17Å; A1386-S1388 PolarHBondContact O-N 2.94Å; A1386-R1389 PolarHBondContact O-N 3.02Å; A1386-I1390 WeakPolarHBondContact O-CB 3.49Å; A1386-I1390 VanDerWaalsContact O-CG1 3.26Å; A1386-I1390 WeakPolarHBondContact O-CG1 3.45Å; A1386-I1390 PolarHBondContact O-N 3.39Å
1387N88.1Confident87.1Confident101 Ų10169 Ų6954%0.5437%0.373SS..Hα-helixtrans-64.5-35.8179.9-72.9-4.2000112.8L1383 A1391L1383-N1387 WeakPolarHBondContact O-CB 3.3Å; L1383-N1387 VanDerWaalsContact O-CG 3.25Å; L1383-N1387 PolarHBondContact O-N 3.17Å; N1387-A1391 VanDerWaalsContact O-CB 3.31Å; N1387-A1391 WeakPolarHBondContact O-CB 3.27Å; N1387-A1391 PolarHBondContact O-N 2.94Å
1388S87.7Confident86.5Confident76 Ų7669.4 Ų69.453%0.53137%0.373SS..Hα-helixtrans-70.1-38.1175.770.50000112.4R1384 T1385 A1386 S1392R1384-S1388 PolarHBondContact O-N 2.91Å; T1385-S1388 PolarHBondContact O-N 2.9Å; T1385-S1388 PolarHBondContact O-OG 2.74Å; A1386-S1388 PolarHBondContact O-N 2.94Å; S1388-S1392 WeakPolarHBondContact O-CB 3.36Å; S1388-S1392 PolarHBondContact O-N 3.29Å; S1388-S1392 VanDerWaalsContact O-N 3.08Å
1389R89.2Confident85.7Confident72 Ų7268.2 Ų68.227%0.27237%0.373SS..Hα-helixtrans-65-42.7172.6-70.8174.2-175.6164.14112.1T1338 S1342 E1345 T1385 A1386 S1392 A1393T1338-R1389 HydrophobicContact CG2-CB 3.98Å; T1338-R1389 HydrophobicContact CG2-CG 4.34Å; S1342-R1389 WeakPolarHBondContact OG-CD 3.49Å; S1342-R1389 PolarHBondContact OG-NH1 2.92Å; S1342-R1389 VanDerWaalsContact OG-NH1 3.1Å; E1345-R1389 IonicContact OE1-CZ 2.68Å; E1345-R1389 IonicContact OE1-NH1 3.72Å; E1345-R1389 IonicContact OE1-NH2 3.46Å; E1345-R1389 PolarHBondContact OE1-NH2 2.81Å; E1345-R1389 IonicContact OE2-CZ 3.23Å; E1345-R1389 IonicContact OE2-NH1 2.62Å; E1345-R1389 PolarHBondContact OE2-NH1 3.45Å; E1345-R1389 IonicContact OE2-NH2 2.69Å; E1345-R1389 PolarHBondContact OE2-NH2 2.72Å; T1385-R1389 WeakPolarHBondContact O-CG 3.34Å; T1385-R1389 PolarHBondContact O-N 3.27Å; T1385-R1389 VanDerWaalsContact O-N 3.16Å; A1386-R1389 PolarHBondContact O-N 3.02Å; R1389-S1392 WeakPolarHBondContact O-CB 3.26Å; R1389-S1392 PolarHBondContact O-N 3Å; R1389-A1393 WeakPolarHBondContact O-CB 3.35Å; R1389-A1393 PolarHBondContact O-N 3.49Å
1390I84.8Confident84.9Confident63 Ų6370.4 Ų70.432%0.32339%0.387SS..Hα-helixtrans-66.3-43.6177.4-68.5163.9000111I1339 A1386 S1392 A1393 V1394I1339-I1390 HydrophobicContact CG1-CG1 4.47Å; A1386-I1390 WeakPolarHBondContact O-CB 3.49Å; A1386-I1390 VanDerWaalsContact O-CG1 3.26Å; A1386-I1390 WeakPolarHBondContact O-CG1 3.45Å; A1386-I1390 PolarHBondContact O-N 3.39Å; I1390-S1392 VanDerWaalsContact C-N 3.3Å; I1390-S1392 PolarHBondContact O-N 2.84Å; I1390-A1393 WeakPolarHBondContact O-CB 3.26Å; I1390-A1393 PolarHBondContact O-N 2.85Å; I1390-A1393 VanDerWaalsContact O-N 3.17Å; I1390-V1394 HydrophobicContact CG2-CG2 4.42Å; I1390-V1394 WeakPolarHBondContact O-CG2 3.44Å; I1390-V1394 PolarHBondContact O-N 2.81Å
1391A85.1Confident84.2Confident65 Ų6571.4 Ų71.454%0.53739%0.391SS..Hα-helixtrans-61.3-38.3175.500000112.4N1387 S1395N1387-A1391 VanDerWaalsContact O-CB 3.31Å; N1387-A1391 WeakPolarHBondContact O-CB 3.27Å; N1387-A1391 PolarHBondContact O-N 2.94Å; A1391-S1395 WeakPolarHBondContact O-CB 3.38Å; A1391-S1395 PolarHBondContact O-N 2.77Å; A1391-S1395 VanDerWaalsContact O-N 3.17Å
1392S83.9Confident83.7Confident75 Ų7573.1 Ų73.152%0.52440%0.4SS..Hα-helixtrans-64.7-44.5172.8-168.60000112S1388 R1389 I1390 S1395 V1396S1388-S1392 WeakPolarHBondContact O-CB 3.36Å; S1388-S1392 PolarHBondContact O-N 3.29Å; S1388-S1392 VanDerWaalsContact O-N 3.08Å; R1389-S1392 WeakPolarHBondContact O-CB 3.26Å; R1389-S1392 PolarHBondContact O-N 3Å; I1390-S1392 VanDerWaalsContact C-N 3.3Å; I1390-S1392 PolarHBondContact O-N 2.84Å; S1392-S1395 WeakPolarHBondContact O-CB 3.39Å; S1392-S1395 PolarHBondContact O-N 3.22Å; S1392-V1396 PolarHBondContact O-N 3.14Å; S1392-V1396 VanDerWaalsContact O-N 3.14Å
1393A82.8Confident83.3Confident7 Ų776 Ų766%0.05842%0.42CS..Hα-helixtrans-58.4-49.6176.800000112.7V1335 I1339 R1389 I1390 S1395 V1396 E1397V1335-A1393 HydrophobicContact CG1-CB 3.73Å; I1339-A1393 HydrophobicContact CD1-CB 4.1Å; I1339-A1393 HydrophobicContact CG1-CB 4.08Å; R1389-A1393 WeakPolarHBondContact O-CB 3.35Å; R1389-A1393 PolarHBondContact O-N 3.49Å; I1390-A1393 WeakPolarHBondContact O-CB 3.26Å; I1390-A1393 PolarHBondContact O-N 2.85Å; I1390-A1393 VanDerWaalsContact O-N 3.17Å; A1393-S1395 VanDerWaalsContact C-N 3.28Å; A1393-S1395 PolarHBondContact O-N 2.88Å; A1393-V1396 PolarHBondContact O-N 3.35Å; A1393-V1396 VanDerWaalsContact O-N 3.11Å; A1393-E1397 PolarHBondContact O-N 3.41Å
1394V81.3Confident82.7Confident60 Ų6079.5 Ų79.536%0.36443%0.429SS..Hα-helixtrans-64.6-31178.4173.60000112.1I1390 E1397 K1398I1390-V1394 HydrophobicContact CG2-CG2 4.42Å; I1390-V1394 WeakPolarHBondContact O-CG2 3.44Å; I1390-V1394 PolarHBondContact O-N 2.81Å; V1394-E1397 PolarHBondContact O-N 3.27Å; V1394-K1398 PolarHBondContact O-N 2.87Å; V1394-K1398 VanDerWaalsContact O-N 3.16Å
1395S80.8Confident82.2Confident85 Ų8576.4 Ų76.459%0.59442%0.421SS*.Hα-helixtrans-67.6-36.5173.5-167.10000112.5A1391 S1392 A1393 S1399A1391-S1395 WeakPolarHBondContact O-CB 3.38Å; A1391-S1395 PolarHBondContact O-N 2.77Å; A1391-S1395 VanDerWaalsContact O-N 3.17Å; S1392-S1395 WeakPolarHBondContact O-CB 3.39Å; S1392-S1395 PolarHBondContact O-N 3.22Å; A1393-S1395 VanDerWaalsContact C-N 3.28Å; A1393-S1395 PolarHBondContact O-N 2.88Å; S1395-S1399 PolarHBondContact O-N 2.91Å
1396V80.1Confident81.9Confident46 Ų4680.5 Ų80.528%0.27944%0.439SS..Hα-helixtrans-70.1-44.1173.2175.10000110.7V1335 S1392 A1393 K1398 S1399 V1400V1335-V1396 HydrophobicContact CG2-CG1 4.27Å; S1392-V1396 PolarHBondContact O-N 3.14Å; S1392-V1396 VanDerWaalsContact O-N 3.14Å; A1393-V1396 PolarHBondContact O-N 3.35Å; A1393-V1396 VanDerWaalsContact O-N 3.11Å; V1396-K1398 PolarHBondContact O-N 3.43Å; V1396-S1399 WeakPolarHBondContact O-CA 3.23Å; V1396-S1399 WeakPolarHBondContact O-CB 3.39Å; V1396-S1399 PolarHBondContact O-N 2.92Å; V1396-S1399 PolarHBondContact O-OG 2.84Å; V1396-V1400 HydrophobicContact CG1-CG2 4.48Å; V1396-V1400 PolarHBondContact O-N 3.5Å; V1396-V1400 VanDerWaalsContact O-N 3.07Å
1397E77.4Confident81.6Confident77 Ų7786.1 Ų86.136%0.3646%0.464SS..Hα-helixtrans-53.2-50177.9-176.3169.4-151.400112.4W1332 A1393 V1394 S1399 V1400 E1401W1332-E1397 HydrophobicContact CH2-CG 4.5Å; W1332-E1397 WeakPolarHBondContact CH2-OE1 3.29Å; W1332-E1397 HydrophobicContact CZ3-CG 4.1Å; A1393-E1397 PolarHBondContact O-N 3.41Å; V1394-E1397 PolarHBondContact O-N 3.27Å; E1397-S1399 PolarHBondContact O-N 2.84Å; E1397-V1400 PolarHBondContact O-N 3.02Å; E1397-E1401 PolarHBondContact O-N 2.9Å
1398K79.4Confident81.3Confident138 Ų13884.3 Ų84.360%0.645%0.453SS*.Hα-helixtrans-60.5-29.8175.1-72.3-170.8174.4-1690114V1394 V1396 M1402V1394-K1398 PolarHBondContact O-N 2.87Å; V1394-K1398 VanDerWaalsContact O-N 3.16Å; V1396-K1398 PolarHBondContact O-N 3.43Å; K1398-M1402 WeakPolarHBondContact O-CB 3.48Å; K1398-M1402 PolarHBondContact O-N 3.13Å
1399S76.7Confident81.1Confident54 Ų5484 Ų8438%0.37845%0.445SS..Hα-helixtrans-73.6-33.2175.578.40000112.5S1395 V1396 E1397 S1403S1395-S1399 PolarHBondContact O-N 2.91Å; V1396-S1399 WeakPolarHBondContact O-CA 3.23Å; V1396-S1399 WeakPolarHBondContact O-CB 3.39Å; V1396-S1399 PolarHBondContact O-N 2.92Å; V1396-S1399 PolarHBondContact O-OG 2.84Å; E1397-S1399 PolarHBondContact O-N 2.84Å; S1399-S1403 PolarHBondContact O-N 3.37Å; S1399-S1403 VanDerWaalsContact O-N 3.12Å
1400V76.2Confident80.9Confident74 Ų7483.4 Ų83.445%0.44845%0.452SS..Hα-helixtrans-73.2-43.7174.71760000110.6V1396 E1397 S1403 Y1404V1396-V1400 HydrophobicContact CG1-CG2 4.48Å; V1396-V1400 PolarHBondContact O-N 3.5Å; V1396-V1400 VanDerWaalsContact O-N 3.07Å; E1397-V1400 PolarHBondContact O-N 3.02Å; V1400-S1403 PolarHBondContact O-N 3.41Å; V1400-Y1404 PolarHBondContact O-N 2.74Å
1401E77.2Confident80.7Confident129 Ų12984.3 Ų84.360%0.60346%0.458SS*.Hα-helixtrans-56.1-50.2173.9-177.4-179.4-150.300111.4E1397 S1403 Y1404 Q1405E1397-E1401 PolarHBondContact O-N 2.9Å; E1401-S1403 VanDerWaalsContact C-N 3.33Å; E1401-S1403 PolarHBondContact O-N 2.87Å; E1401-Y1404 PolarHBondContact O-N 3.35Å; E1401-Y1404 VanDerWaalsContact O-N 3.13Å; E1401-Q1405 PolarHBondContact O-N 3.36Å
1402M80Confident80.5Confident130 Ų13087.7 Ų87.764%0.6446%0.457SS*.Hα-helixtrans-62.9-36.2177-173169.259.600112.7K1398 M1406K1398-M1402 WeakPolarHBondContact O-CB 3.48Å; K1398-M1402 PolarHBondContact O-N 3.13Å; M1402-M1406 WeakPolarHBondContact O-CG 3.5Å; M1402-M1406 PolarHBondContact O-N 3.31Å; M1402-M1406 VanDerWaalsContact O-N 3.12Å
1403S80Confident80.4Confident73 Ų7390.6 Ų90.651%0.5146%0.462SS..Hα-helixtrans-68.3-35.7173.3-170.10000112.8S1399 V1400 E1401 Q1407S1399-S1403 PolarHBondContact O-N 3.37Å; S1399-S1403 VanDerWaalsContact O-N 3.12Å; V1400-S1403 PolarHBondContact O-N 3.41Å; E1401-S1403 VanDerWaalsContact C-N 3.33Å; E1401-S1403 PolarHBondContact O-N 2.87Å; S1403-Q1407 PolarHBondContact O-N 2.97Å; S1403-Q1407 VanDerWaalsContact O-N 3.16Å
1404Y78.2Confident80.3Confident142 Ų14296.2 Ų96.256%0.55749%0.487SS*.Hα-helixtrans-68.8-41.8176.3-176.5-100.6000111V1400 E1401 M1406 Q1407 M1408V1400-Y1404 PolarHBondContact O-N 2.74Å; E1401-Y1404 PolarHBondContact O-N 3.35Å; E1401-Y1404 VanDerWaalsContact O-N 3.13Å; Y1404-M1406 PolarHBondContact O-N 3.47Å; Y1404-Q1407 WeakPolarHBondContact O-CB 3.43Å; Y1404-Q1407 PolarHBondContact O-N 3.48Å; Y1404-Q1407 VanDerWaalsContact O-N 3.1Å; Y1404-M1408 HydrophobicContact CD1-CG 4.06Å; Y1404-M1408 HydrophobicContact CE1-CG 3.66Å; Y1404-M1408 HydrophobicContact CE1-SD 4.33Å; Y1404-M1408 WeakPolarHBondContact O-CG 3.3Å; Y1404-M1408 PolarHBondContact O-N 2.92Å
1405Q80Confident80.1Confident85 Ų8598.2 Ų98.240%0.39750%0.495SS..Hα-helixtrans-58.8-46.6174.6-174.554.443.700111.7E1401 Q1407 M1408 D1409E1401-Q1405 PolarHBondContact O-N 3.36Å; Q1405-Q1407 VanDerWaalsContact C-N 3.27Å; Q1405-Q1407 PolarHBondContact O-N 2.84Å; Q1405-M1408 PolarHBondContact O-N 2.78Å; Q1405-D1409 VanDerWaalsContact NE2-CG 3.27Å; Q1405-D1409 PolarHBondContact NE2-OD1 3.36Å; Q1405-D1409 PolarHBondContact NE2-OD2 2.9Å; Q1405-D1409 PolarHBondContact O-N 2.96Å
1406M82.9Confident80.1Confident134 Ų134100.2 Ų100.266%0.6650%0.495SS*.Hα-helixtrans-60.7-33.7174.5-71.1-169.577.300113.2M1402 Y1404 S1410M1402-M1406 WeakPolarHBondContact O-CG 3.5Å; M1402-M1406 PolarHBondContact O-N 3.31Å; M1402-M1406 VanDerWaalsContact O-N 3.12Å; Y1404-M1406 PolarHBondContact O-N 3.47Å; M1406-S1410 WeakPolarHBondContact O-CB 3.4Å; M1406-S1410 PolarHBondContact O-N 3.33Å; M1406-S1410 VanDerWaalsContact O-N 3.12Å
1407Q82.7Confident80.1Confident122 Ų122102.8 Ų102.857%0.5751%0.505SS*.Hα-helixtrans-71.7-39.1175.6-173.1172.7-500111.8S1403 Y1404 Q1405 S1410 L1411S1403-Q1407 PolarHBondContact O-N 2.97Å; S1403-Q1407 VanDerWaalsContact O-N 3.16Å; Y1404-Q1407 WeakPolarHBondContact O-CB 3.43Å; Y1404-Q1407 PolarHBondContact O-N 3.48Å; Y1404-Q1407 VanDerWaalsContact O-N 3.1Å; Q1405-Q1407 VanDerWaalsContact C-N 3.27Å; Q1405-Q1407 PolarHBondContact O-N 2.84Å; Q1407-S1410 WeakPolarHBondContact O-CB 3.39Å; Q1407-S1410 PolarHBondContact O-N 2.95Å; Q1407-L1411 WeakPolarHBondContact O-CG 3.49Å; Q1407-L1411 PolarHBondContact O-N 3.17Å
1408M81.2Confident80Confident64 Ų64101.9 Ų101.932%0.31551%0.51SS..Hα-helixtrans-66.9-39.1175.4-72.9-59.6-6500112.6Y1404 Q1405 L1411 R1412Y1404-M1408 HydrophobicContact CD1-CG 4.06Å; Y1404-M1408 HydrophobicContact CE1-CG 3.66Å; Y1404-M1408 HydrophobicContact CE1-SD 4.33Å; Y1404-M1408 WeakPolarHBondContact O-CG 3.3Å; Y1404-M1408 PolarHBondContact O-N 2.92Å; Q1405-M1408 PolarHBondContact O-N 2.78Å; M1408-L1411 PolarHBondContact O-N 2.92Å; M1408-L1411 HydrophobicContact SD-CD1 4.35Å; M1408-R1412 WeakPolarHBondContact O-CG 3.43Å; M1408-R1412 PolarHBondContact O-N 2.89Å
1409D82.9Confident79.8Confident68 Ų68100.5 Ų100.536%0.36451%0.506SS..Hα-helixtrans-70.7-33.8176-69.2-37000112.6Q1405 R1412 Q1413Q1405-D1409 VanDerWaalsContact NE2-CG 3.27Å; Q1405-D1409 PolarHBondContact NE2-OD1 3.36Å; Q1405-D1409 PolarHBondContact NE2-OD2 2.9Å; Q1405-D1409 PolarHBondContact O-N 2.96Å; D1409-R1412 PolarHBondContact O-N 3.18Å; D1409-R1412 WeakPolarHBondContact OD1-CD 3.45Å; D1409-R1412 IonicContact OD1-CZ 3.99Å; D1409-R1412 IonicContact OD1-NE 2.68Å; D1409-R1412 IonicContact OD1-NH1 2.7Å; D1409-R1412 PolarHBondContact OD1-NH1 3.2Å; D1409-Q1413 PolarHBondContact O-N 2.93Å
1410S84.6Confident80.2Confident60 Ų60104 Ų10442%0.4251%0.512SS..Hα-helixtrans-61.3-43.6168.8-176.50000112.1M1406 Q1407 Q1413 Q1414M1406-S1410 WeakPolarHBondContact O-CB 3.4Å; M1406-S1410 PolarHBondContact O-N 3.33Å; M1406-S1410 VanDerWaalsContact O-N 3.12Å; Q1407-S1410 WeakPolarHBondContact O-CB 3.39Å; Q1407-S1410 PolarHBondContact O-N 2.95Å; S1410-Q1413 PolarHBondContact O-N 3.34Å; S1410-Q1414 PolarHBondContact O-N 2.99Å
1411L82.2Confident80.5Confident82 Ų82104.8 Ų104.843%0.42951%0.514SS..Hα-helixtrans-66-40.2175.3-74.4169.5000112.4Q1407 M1408 Q1413 Q1414 L1415Q1407-L1411 WeakPolarHBondContact O-CG 3.49Å; Q1407-L1411 PolarHBondContact O-N 3.17Å; M1408-L1411 PolarHBondContact O-N 2.92Å; M1408-L1411 HydrophobicContact SD-CD1 4.35Å; L1411-Q1413 VanDerWaalsContact C-N 3.31Å; L1411-Q1413 PolarHBondContact O-N 3.27Å; L1411-Q1414 PolarHBondContact O-N 3.03Å; L1411-L1415 PolarHBondContact O-N 3.17Å
1412R80.2Confident80.4Confident137 Ų137101.7 Ų101.752%0.51751%0.51SS..Hα-helixtrans-57.7-43.3172.4-74.2164.9172.2171.5-4.2111.5M1408 D1409 L1415 Q1416M1408-R1412 WeakPolarHBondContact O-CG 3.43Å; M1408-R1412 PolarHBondContact O-N 2.89Å; D1409-R1412 PolarHBondContact O-N 3.18Å; D1409-R1412 WeakPolarHBondContact OD1-CD 3.45Å; D1409-R1412 IonicContact OD1-CZ 3.99Å; D1409-R1412 IonicContact OD1-NE 2.68Å; D1409-R1412 IonicContact OD1-NH1 2.7Å; D1409-R1412 PolarHBondContact OD1-NH1 3.2Å; R1412-L1415 PolarHBondContact O-N 2.66Å; R1412-Q1416 WeakPolarHBondContact O-CG 3.46Å; R1412-Q1416 PolarHBondContact O-N 3.13Å
1413Q81.6Confident80.3Confident135 Ų13597.9 Ų97.963%0.63150%0.499SS*.Hα-helixtrans-67.2-35.6178.5-164.8175.536.300112.7D1409 S1410 L1411 M1417D1409-Q1413 PolarHBondContact O-N 2.93Å; S1410-Q1413 PolarHBondContact O-N 3.34Å; L1411-Q1413 VanDerWaalsContact C-N 3.31Å; L1411-Q1413 PolarHBondContact O-N 3.27Å; Q1413-M1417 PolarHBondContact O-N 2.88Å
1414Q80.5Confident80.3Confident125 Ų12598.2 Ų98.258%0.58449%0.493SS*.Hα-helixtrans-66.9-39.6171.9-70.4-177600112.2S1410 L1411 M1417 A1418S1410-Q1414 PolarHBondContact O-N 2.99Å; L1411-Q1414 PolarHBondContact O-N 3.03Å; Q1414-M1417 PolarHBondContact O-N 3.16Å; Q1414-A1418 PolarHBondContact O-N 3.04Å
1415L78.1Confident80.4Confident103 Ų10396.3 Ų96.354%0.53949%0.492SS..Hα-helixtrans-63.2-47176.1-117.2155.2000111.5L1411 R1412 M1417 A1418 E1419L1411-L1415 PolarHBondContact O-N 3.17Å; R1412-L1415 PolarHBondContact O-N 2.66Å; L1415-M1417 VanDerWaalsContact C-N 3.26Å; L1415-M1417 PolarHBondContact O-N 3.48Å; L1415-A1418 WeakPolarHBondContact O-CB 3.43Å; L1415-A1418 PolarHBondContact O-N 3.41Å; L1415-E1419 HydrophobicContact CD2-CG 4.41Å; L1415-E1419 WeakPolarHBondContact CD2-OE1 3.44Å; L1415-E1419 WeakPolarHBondContact O-CB 3.28Å; L1415-E1419 WeakPolarHBondContact O-CG 3.47Å; L1415-E1419 PolarHBondContact O-N 2.98Å
1416Q80.7Confident80.3Confident126 Ų12693.9 Ų93.959%0.58949%0.49SS*.Hα-helixtrans-58.2-36.2174.3-74.1-180-20.800113R1412 Y1420R1412-Q1416 WeakPolarHBondContact O-CG 3.46Å; R1412-Q1416 PolarHBondContact O-N 3.13Å; Q1416-Y1420 WeakPolarHBondContact O-CB 3.35Å; Q1416-Y1420 PolarHBondContact O-N 3.44Å
1417M80.5Confident80.1Confident101 Ų10192.6 Ų92.650%0.49848%0.478SS..Hα-helixtrans-68.9-37.6173.8-85.4-97.558.700112.8Q1413 Q1414 L1415 Y1420 N1421Q1413-M1417 PolarHBondContact O-N 2.88Å; Q1414-M1417 PolarHBondContact O-N 3.16Å; L1415-M1417 VanDerWaalsContact C-N 3.26Å; L1415-M1417 PolarHBondContact O-N 3.48Å; M1417-Y1420 HydrophobicContact CE-CD1 4.09Å; M1417-Y1420 HydrophobicContact CE-CG 4.44Å; M1417-N1421 PolarHBondContact O-N 3.02Å; M1417-N1421 VanDerWaalsContact O-N 3.14Å; M1417-N1421 PolarHBondContact O-ND2 3.5Å
1418A74.9Confident80Confident57 Ų5791.8 Ų91.847%0.47147%0.474SS..Hα-helixtrans-67.8-43.4174.300000111.8Q1414 L1415 N1421 A1422Q1414-A1418 PolarHBondContact O-N 3.04Å; L1415-A1418 WeakPolarHBondContact O-CB 3.43Å; L1415-A1418 PolarHBondContact O-N 3.41Å; A1418-N1421 PolarHBondContact O-N 3.34Å; A1418-A1422 WeakPolarHBondContact O-CB 3.28Å; A1418-A1422 PolarHBondContact O-N 2.91Å
1419E74.1Confident79.8Confident110 Ų11093.9 Ų93.951%0.51449%0.485SS..Hα-helixtrans-59.8-45.5174.6-71.5165179.400111.6L1415 N1421 A1422 A1423L1415-E1419 HydrophobicContact CD2-CG 4.41Å; L1415-E1419 WeakPolarHBondContact CD2-OE1 3.44Å; L1415-E1419 WeakPolarHBondContact O-CB 3.28Å; L1415-E1419 WeakPolarHBondContact O-CG 3.47Å; L1415-E1419 PolarHBondContact O-N 2.98Å; E1419-N1421 PolarHBondContact O-N 3.49Å; E1419-A1422 PolarHBondContact O-N 2.74Å; E1419-A1423 VanDerWaalsContact O-CB 3.29Å; E1419-A1423 WeakPolarHBondContact O-CB 3.4Å; E1419-A1423 PolarHBondContact O-N 3.3Å
1420Y85.6Confident79.6Confident127 Ų12794.6 Ų94.650%0.49849%0.486SS..Hα-helixtrans-58.4-46.1175.2179.1-87.2000112Q1416 M1417 A1423 Q1424Q1416-Y1420 WeakPolarHBondContact O-CB 3.35Å; Q1416-Y1420 PolarHBondContact O-N 3.44Å; M1417-Y1420 HydrophobicContact CE-CD1 4.09Å; M1417-Y1420 HydrophobicContact CE-CG 4.44Å; Y1420-A1423 PolarHBondContact O-N 2.82Å; Y1420-Q1424 PolarHBondContact O-N 3.18Å
1421N82.8Confident79.3Confident91 Ų9198.2 Ų98.249%0.48750%0.497SS..Hα-helixtrans-66.4-41.7179.3-69.9-22.8000111.9M1417 A1418 E1419 Q1424 L1425M1417-N1421 PolarHBondContact O-N 3.02Å; M1417-N1421 VanDerWaalsContact O-N 3.14Å; M1417-N1421 PolarHBondContact O-ND2 3.5Å; A1418-N1421 PolarHBondContact O-N 3.34Å; E1419-N1421 PolarHBondContact O-N 3.49Å; N1421-Q1424 PolarHBondContact O-N 3.06Å; N1421-L1425 PolarHBondContact O-N 3Å
1422A75.3Confident79.1Confident64 Ų64100.4 Ų100.453%0.52950%0.503SS..Hα-helixtrans-63.2-41.2174.300000111.9A1418 E1419 Q1424 L1425 G1426A1418-A1422 WeakPolarHBondContact O-CB 3.28Å; A1418-A1422 PolarHBondContact O-N 2.91Å; E1419-A1422 PolarHBondContact O-N 2.74Å; A1422-Q1424 VanDerWaalsContact C-N 3.26Å; A1422-Q1424 PolarHBondContact O-N 2.81Å; A1422-L1425 PolarHBondContact O-N 2.82Å; A1422-G1426 PolarHBondContact O-N 3.38Å
1423A76.7Confident79Confident49 Ų4999.5 Ų99.541%0.40550%0.5SS..Hα-helixtrans-68.6-21.4174.700000113.4E1419 Y1420 R1427E1419-A1423 VanDerWaalsContact O-CB 3.29Å; E1419-A1423 WeakPolarHBondContact O-CB 3.4Å; E1419-A1423 PolarHBondContact O-N 3.3Å; Y1420-A1423 PolarHBondContact O-N 2.82Å; A1423-R1427 PolarHBondContact O-NE 3.31Å
1424Q81.1Confident78.9Confident80 Ų8096 Ų9637%0.37448%0.484SS..Hα-helixtrans-76.4-50.4169.1-171.9171.2-37.600111.6Y1420 N1421 A1422 G1426 R1427 E1428Y1420-Q1424 PolarHBondContact O-N 3.18Å; N1421-Q1424 PolarHBondContact O-N 3.06Å; A1422-Q1424 VanDerWaalsContact C-N 3.26Å; A1422-Q1424 PolarHBondContact O-N 2.81Å; Q1424-G1426 VanDerWaalsContact C-N 3.26Å; Q1424-G1426 PolarHBondContact O-N 3.02Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.32Å; Q1424-R1427 PolarHBondContact O-N 3.08Å; Q1424-E1428 PolarHBondContact O-N 3.26Å
1425L79.4Confident79Confident102 Ų10296.5 Ų96.553%0.53449%0.487SS..Hα-helixtrans-58.5-38.5176.5-17168.9000112N1421 A1422 R1427 E1428 I1429N1421-L1425 PolarHBondContact O-N 3Å; A1422-L1425 PolarHBondContact O-N 2.82Å; L1425-R1427 PolarHBondContact O-N 3.36Å; L1425-E1428 PolarHBondContact O-N 2.62Å; L1425-I1429 HydrophobicContact CG-CD1 4.28Å; L1425-I1429 WeakPolarHBondContact O-CG1 3.48Å; L1425-I1429 PolarHBondContact O-N 2.7Å; L1425-I1429 VanDerWaalsContact O-N 3.12Å
1426G78.9Confident79.2Confident35 Ų3596.3 Ų96.336%0.36148%0.483SS..Hα-helixtrans-69.1-8.9174.100000115.5A1422 Q1424A1422-G1426 PolarHBondContact O-N 3.38Å; Q1424-G1426 VanDerWaalsContact C-N 3.26Å; Q1424-G1426 PolarHBondContact O-N 3.02Å
1427R78.1Confident79.2Confident106 Ų10695.3 Ų95.340%0.448%0.478SS..Hα-helixtrans-86.2-44.8166.7-79.3171.5-82.6-170.42110.7A1423 Q1424 L1425 I1429 E1430 E1431A1423-R1427 PolarHBondContact O-NE 3.31Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.32Å; Q1424-R1427 PolarHBondContact O-N 3.08Å; L1425-R1427 PolarHBondContact O-N 3.36Å; R1427-I1429 VanDerWaalsContact C-N 3.29Å; R1427-I1429 PolarHBondContact O-N 3.29Å; R1427-E1430 PolarHBondContact O-N 2.88Å; R1427-E1430 VanDerWaalsContact O-N 3.15Å; R1427-E1431 PolarHBondContact O-N 3.29Å
1428E81.2Confident79.2Confident105 Ų10598.9 Ų98.949%0.49149%0.486SS..Hα-helixtrans-60.3-37.4179.6-64.4171.2-164.700112.2Q1424 L1425 F1432Q1424-E1428 PolarHBondContact O-N 3.26Å; L1425-E1428 PolarHBondContact O-N 2.62Å; E1428-F1432 PolarHBondContact O-N 3.47Å
1429I76.9Confident79.6Confident108 Ų108103.7 Ų103.755%0.55449%0.493SS*.Hα-helixtrans-67.6-40.9175.2-66.7169.3000112.2L1425 R1427 F1432 R1433L1425-I1429 HydrophobicContact CG-CD1 4.28Å; L1425-I1429 WeakPolarHBondContact O-CG1 3.48Å; L1425-I1429 PolarHBondContact O-N 2.7Å; L1425-I1429 VanDerWaalsContact O-N 3.12Å; R1427-I1429 VanDerWaalsContact C-N 3.29Å; R1427-I1429 PolarHBondContact O-N 3.29Å; I1429-F1432 WeakPolarHBondContact O-CB 3.47Å; I1429-F1432 PolarHBondContact O-N 3.28Å; I1429-R1433 PolarHBondContact O-N 2.9Å
1430E78.1Confident79.7Confident83 Ų83104 Ų10439%0.38849%0.494SS..Hα-helixtrans-74-36.9-178.4-168.456-138.600111.8R1427 F1432 R1433 I1434R1427-E1430 PolarHBondContact O-N 2.88Å; R1427-E1430 VanDerWaalsContact O-N 3.15Å; E1430-F1432 PolarHBondContact O-N 3.42Å; E1430-R1433 PolarHBondContact O-N 3.1Å; E1430-R1433 VanDerWaalsContact O-N 3.15Å; E1430-I1434 HydrophobicContact CG-CD1 4.1Å; E1430-I1434 WeakPolarHBondContact O-CG1 3.23Å; E1430-I1434 PolarHBondContact O-N 2.89Å
1431E78.8Confident79.4Confident137 Ų137101 Ų10164%0.6449%0.491SS*.Hα-helixtrans-57.5-39.4171.1-73.7-176.9-171.200111.6R1427 Q1435R1427-E1431 PolarHBondContact O-N 3.29Å; E1431-Q1435 WeakPolarHBondContact O-CB 3.48Å; E1431-Q1435 PolarHBondContact O-N 2.89Å
1432F78.1Confident79.2Confident128 Ų12899 Ų9956%0.56149%0.487SS*.Hα-helixtrans-67.3-40.5174.6-172.4-106.5000112.9E1428 I1429 E1430 Q1435 Q1436E1428-F1432 PolarHBondContact O-N 3.47Å; I1429-F1432 WeakPolarHBondContact O-CB 3.47Å; I1429-F1432 PolarHBondContact O-N 3.28Å; E1430-F1432 PolarHBondContact O-N 3.42Å; F1432-Q1435 PolarHBondContact O-N 2.76Å; F1432-Q1436 PolarHBondContact O-N 3.33Å; F1432-Q1436 VanDerWaalsContact O-N 3.08Å
1433R78.7Confident79.3Confident118 Ų118103.2 Ų103.245%0.44549%0.489SS..Hα-helixtrans-61.4-48.6174.2-179.617416897.1-2.1111.3I1429 E1430 Q1435 Q1436 Q1437I1429-R1433 PolarHBondContact O-N 2.9Å; E1430-R1433 PolarHBondContact O-N 3.1Å; E1430-R1433 VanDerWaalsContact O-N 3.15Å; R1433-Q1435 VanDerWaalsContact C-N 3.28Å; R1433-Q1435 PolarHBondContact O-N 2.87Å; R1433-Q1436 PolarHBondContact O-N 2.86Å; R1433-Q1437 PolarHBondContact O-N 3.33Å
1434I78.6Confident79.1Confident61 Ų61107.3 Ų107.331%0.31350%0.498SS..Hα-helixtrans-60-38.5176.1-67.5167.3000111E1430 Q1437 R1438E1430-I1434 HydrophobicContact CG-CD1 4.1Å; E1430-I1434 WeakPolarHBondContact O-CG1 3.23Å; E1430-I1434 PolarHBondContact O-N 2.89Å; I1434-Q1437 PolarHBondContact O-N 3.38Å; I1434-R1438 HydrophobicContact CG2-CG 4.49Å; I1434-R1438 WeakPolarHBondContact O-CG 3.5Å; I1434-R1438 PolarHBondContact O-N 3.48Å
1435Q82.5Confident78.8Confident136 Ų136108.3 Ų108.364%0.63651%0.506SS*.Hα-helixtrans-66.3-38.6178.1-167.1171.816.600112.5E1431 F1432 R1433 Y1439E1431-Q1435 WeakPolarHBondContact O-CB 3.48Å; E1431-Q1435 PolarHBondContact O-N 2.89Å; F1432-Q1435 PolarHBondContact O-N 2.76Å; R1433-Q1435 VanDerWaalsContact C-N 3.28Å; R1433-Q1435 PolarHBondContact O-N 2.87Å; Q1435-Y1439 PolarHBondContact O-N 3.29Å
1436Q82.5Confident78.6Confident98 Ų98113 Ų11346%0.45852%0.516SS..Hα-helixtrans-65.6-44.8171.3-68.3-164.826.700112F1432 R1433 R1438 Y1439 F1440F1432-Q1436 PolarHBondContact O-N 3.33Å; F1432-Q1436 VanDerWaalsContact O-N 3.08Å; R1433-Q1436 PolarHBondContact O-N 2.86Å; Q1436-R1438 VanDerWaalsContact C-N 3.33Å; Q1436-R1438 PolarHBondContact O-N 2.81Å; Q1436-Y1439 WeakPolarHBondContact O-CA 3.22Å; Q1436-Y1439 WeakPolarHBondContact O-CB 3.38Å; Q1436-Y1439 PolarHBondContact O-N 2.97Å; Q1436-F1440 VanDerWaalsContact O-CD2 3.28Å; Q1436-F1440 WeakPolarHBondContact O-CD2 3.3Å; Q1436-F1440 PolarHBondContact O-N 2.84Å
1437Q80.4Confident78.3Confident105 Ų105116.4 Ų116.449%0.49153%0.526SS..Hα-helixtrans-61.2-42.5-178.2-157.1173.318.700111.4R1433 I1434 Y1439 F1440 S1441R1433-Q1437 PolarHBondContact O-N 3.33Å; I1434-Q1437 PolarHBondContact O-N 3.38Å; Q1437-Y1439 VanDerWaalsContact C-N 3.32Å; Q1437-Y1439 PolarHBondContact O-N 2.86Å; Q1437-F1440 PolarHBondContact O-N 3.49Å; Q1437-S1441 PolarHBondContact O-N 3.13Å; Q1437-S1441 PolarHBondContact O-OG 2.59Å
1438R81.4Confident77.7Confident177 Ų177118.7 Ų118.767%0.66854%0.541SS*.Hα-helixtrans-60.4-37172.2-72.5174.9179.8173.73.4113.2I1434 Q1436 A1442I1434-R1438 HydrophobicContact CG2-CG 4.49Å; I1434-R1438 WeakPolarHBondContact O-CG 3.5Å; I1434-R1438 PolarHBondContact O-N 3.48Å; Q1436-R1438 VanDerWaalsContact C-N 3.33Å; Q1436-R1438 PolarHBondContact O-N 2.81Å; R1438-A1442 VanDerWaalsContact O-CB 3.3Å; R1438-A1442 WeakPolarHBondContact O-CB 3.16Å; R1438-A1442 PolarHBondContact O-N 2.84Å; R1438-A1442 VanDerWaalsContact O-N 3.08Å
1439Y82.5Confident76.5Confident157 Ų157119.9 Ų119.962%0.61655%0.551SS**Hα-helixtrans-66.6-38.9176.1175.2-100.5000112.2Q1435 Q1436 Q1437 R1443Q1435-Y1439 PolarHBondContact O-N 3.29Å; Q1436-Y1439 WeakPolarHBondContact O-CA 3.22Å; Q1436-Y1439 WeakPolarHBondContact O-CB 3.38Å; Q1436-Y1439 PolarHBondContact O-N 2.97Å; Q1437-Y1439 VanDerWaalsContact C-N 3.32Å; Q1437-Y1439 PolarHBondContact O-N 2.86Å; Y1439-R1443 PolarHBondContact O-N 3.4Å
1440F76.7Confident75.3Confident118 Ų118120.3 Ų120.352%0.51855%0.553SS.*Hα-helixtrans-69.8-45.6175-77.1-71.9000112.8Q1436 Q1437 A1442 R1443 F1444Q1436-F1440 VanDerWaalsContact O-CD2 3.28Å; Q1436-F1440 WeakPolarHBondContact O-CD2 3.3Å; Q1436-F1440 PolarHBondContact O-N 2.84Å; Q1437-F1440 PolarHBondContact O-N 3.49Å; F1440-A1442 PolarHBondContact O-N 3.44Å; F1440-R1443 WeakPolarHBondContact O-CB 3.26Å; F1440-R1443 PolarHBondContact O-N 2.75Å; F1440-R1443 VanDerWaalsContact O-N 3.07Å; F1440-F1444 PolarHBondContact O-N 2.94Å
1441S79.2Confident73.9Confident64 Ų64121.6 Ų121.645%0.44857%0.569SS.*Hα-helixtrans-57.4-49.1175.7-57.10000111.8Q1437 R1443 F1444 D1445Q1437-S1441 PolarHBondContact O-N 3.13Å; Q1437-S1441 PolarHBondContact O-OG 2.59Å; S1441-R1443 PolarHBondContact O-N 3.06Å; S1441-R1443 VanDerWaalsContact O-N 3.07Å; S1441-F1444 PolarHBondContact O-N 3.28Å; S1441-D1445 PolarHBondContact O-N 3.41Å
1442A78.3Confident72.1Confident48 Ų48120.6 Ų120.640%0.39758%0.577SS.*Hα-helixtrans-66.9-10.4178.600000114.4R1438 F1440 R1446R1438-A1442 VanDerWaalsContact O-CB 3.3Å; R1438-A1442 WeakPolarHBondContact O-CB 3.16Å; R1438-A1442 PolarHBondContact O-N 2.84Å; R1438-A1442 VanDerWaalsContact O-N 3.08Å; F1440-A1442 PolarHBondContact O-N 3.44Å; A1442-R1446 WeakPolarHBondContact O-CG 3.45Å; A1442-R1446 PolarHBondContact O-NE 3.31Å
1443R76.8Confident70.4Confident152 Ų152120.4 Ų120.457%0.57459%0.591SS**Hα-helixtrans-88.3-38.8168.4-175.8177.1178177.2-1.8111.4Y1439 F1440 S1441 R1446Y1439-R1443 PolarHBondContact O-N 3.4Å; F1440-R1443 WeakPolarHBondContact O-CB 3.26Å; F1440-R1443 PolarHBondContact O-N 2.75Å; F1440-R1443 VanDerWaalsContact O-N 3.07Å; S1441-R1443 PolarHBondContact O-N 3.06Å; S1441-R1443 VanDerWaalsContact O-N 3.07Å; R1443-R1446 PolarHBondContact O-N 3.17Å
1444F73.7Confident68.5Low136 Ų136120.4 Ų120.460%0.59661%0.609SS**Hα-helixtrans-66.1-44.2177.2-130.3-84.9000111.9F1440 S1441 R1446 L1447 H1448F1440-F1444 PolarHBondContact O-N 2.94Å; S1441-F1444 PolarHBondContact O-N 3.28Å; F1444-R1446 PolarHBondContact O-N 3.14Å; F1444-R1446 VanDerWaalsContact O-N 3.13Å; F1444-L1447 PolarHBondContact O-N 2.81Å; F1444-H1448 PolarHBondContact O-N 3.11Å
1445D74.8Confident66.6Low101 Ų101123 Ų12354%0.5463%0.633SS.*Hα-helixtrans-57.3-29.9176.8-66.1-30.9000112.8S1441 N1449S1441-D1445 PolarHBondContact O-N 3.41Å; D1445-N1449 PolarHBondContact O-ND2 3.02Å
1446R73.7Confident64.6Low199 Ų199121.6 Ų121.675%0.75164%0.638SS**Hα-helixtrans-75.5-28.2177.3-68.1178.3-172.2-1530.3113.3A1442 R1443 F1444A1442-R1446 WeakPolarHBondContact O-CG 3.45Å; A1442-R1446 PolarHBondContact O-NE 3.31Å; R1443-R1446 PolarHBondContact O-N 3.17Å; F1444-R1446 PolarHBondContact O-N 3.14Å; F1444-R1446 VanDerWaalsContact O-N 3.13Å
1447L72.4Confident62.6Low108 Ų108123.9 Ų123.957%0.56565%0.653SS**Hα-helixtrans-77.5-37.6177.6-65.4172000110.9F1444 N1449 I1450F1444-L1447 PolarHBondContact O-N 2.81Å; L1447-N1449 PolarHBondContact O-N 3.42Å; L1447-I1450 WeakPolarHBondContact O-CG1 3.46Å
1448H65.4Low60.8Low153 Ų153124.6 Ų124.671%0.70867%0.665SS**Hα-helixtrans-71-13.7175.8-99.6-70000114.9F1444F1444-H1448 PolarHBondContact O-N 3.11Å
1449N57.9Low58.9Low130 Ų130120.8 Ų120.870%0.69566%0.663SS**THydrogen-bonded Turntrans-99.522.6-179.7-82.3-78.9000114D1445 L1447 P1451D1445-N1449 PolarHBondContact O-ND2 3.02Å; L1447-N1449 PolarHBondContact O-N 3.42Å; N1449-P1451 WeakPolarHBondContact O-CD 3.47Å
1450I51.2Low56.9Low117 Ų117121 Ų12160%0.667%0.674SS**  trans-78.1116.8171.9-62.4172.4000108.9L1447 S1452L1447-I1450 WeakPolarHBondContact O-CG1 3.46Å; I1450-S1452 PolarHBondContact O-N 3.18Å
1451P47.5Very low55.2Low111 Ų111122.8 Ų122.872%0.72168%0.684SS**  trans-79.6120.4-172.230.4-33.9000112.6N1449 S1453N1449-P1451 WeakPolarHBondContact O-CD 3.47Å; P1451-S1453 VanDerWaalsContact C-N 3.35Å; P1451-S1453 PolarHBondContact O-N 3.41Å
1452S41.6Very low53.5Low116 Ų116125.1 Ų125.181%0.81169%0.691SS**  trans-71.278.4177.8-46.60000112.8I1450 S1454I1450-S1452 PolarHBondContact O-N 3.18Å; S1452-S1454 PolarHBondContact O-N 3.09Å; S1452-S1454 VanDerWaalsContact O-N 3.15Å
1453S41.8Very low51.9Low123 Ų123129.7 Ų129.786%0.8671%0.708SS**  trans-64.3111.7178.458.10000111.9P1451P1451-S1453 VanDerWaalsContact C-N 3.35Å; P1451-S1453 PolarHBondContact O-N 3.41Å
1454S40.4Very low50.3Low119 Ų119127.9 Ų127.983%0.83272%0.716SS**  trans-122.6172.5178.648.30000112S1452S1452-S1454 PolarHBondContact O-N 3.09Å; S1452-S1454 VanDerWaalsContact O-N 3.15Å
1455S37.8Very low48.8Very low116 Ų116125.8 Ų125.881%0.81172%0.723SS**  trans-96.4154.7-147.853.70000118
1456S40.1Very low47.3Very low106 Ų106130.1 Ų130.174%0.74174%0.74SS**  trans-174.8149.7153.127.90000108.8
1457D40.9Very low45.7Very low145 Ų145124.1 Ų124.178%0.77574%0.74SS**  cis-167.2154.7-6.6-114.8-23.2000112.5
1458V42.9Very low44.2Very low120 Ų120128.8 Ų128.873%0.72776%0.756SS**  trans67.4144.5137.7164.30000120.8
1459P40.9Very low42.9Very low98 Ų98128 Ų12864%0.63676%0.757SS**  cis-150.9-178-27.443.7-23.7000118.6
1460L41.2Very low42Very low160 Ų160128.9 Ų128.984%0.83876%0.762SS**  trans84.9152139-92.2160000125.1
1461E40.3Very low41.5Very low157 Ų157127.4 Ų127.473%0.73477%0.767SS**  trans69.4131.5173.7-65.2-162.8-15300117.8
1462N43.1Very low41Very low112 Ų112127.4 Ų127.460%0.59977%0.77SS**  cis-159132.80.4-94.1-32.1000113.6
1463I45.9Very low41Very low145 Ų145127.1 Ų127.174%0.74477%0.766SS**  56.6139.2126-61.1170.1000120.7
1464P42.5Very low40.7Very low114 Ų114126 Ų12674%0.7476%0.758SS**  cis-148.2-173.1-2744-23.3000117.2
1465A41.9Very low40.4Very low92 Ų92125 Ų12576%0.7675%0.751SS**  trans68.7156.7147.900000120.5
1466E43.3Very low40.3Very low192 Ų192125.6 Ų125.690%0.89775%0.745SS**  cis-139.7150.38.3-68.8-178.6133.500113.4
1467G40.7Very low39.9Very low73 Ų73131.3 Ų131.375%0.75375%0.75SS**  trans70.3146152.200000119.9
1468F40.5Very low39.6Very low205 Ų205129 Ų12990%0.89975%0.745SS**  cis-154.8142.7-5.2-133-89.6000108.9
1469N38.7Very low39.3Very low137 Ų137130.7 Ų130.773%0.73375%0.75SS**  trans-90.1173173.6-61.5-16.7000110.1
1470D39.4Very low38.8Very low149 Ų149137.4 Ų137.480%0.79776%0.763SS**  174.1178.457.3-125.6-46.5000112.8
1471A40.7Very low38.7Very low85 Ų85134.9 Ų134.970%0.70276%0.756SS**  trans69.492.2152.400000122.6
1472S36.3Very low38.4Very low111 Ų111133 Ų13378%0.77676%0.76SS**  -27.1178122.4-54.60000118
1473P42.4Very low38.1Very low111 Ų111131.6 Ų131.672%0.72176%0.764SS**  cis-142.5-175.9-34.836.5-16.9000115.5
1474S34.3Very low37.7Very low99 Ų99134.2 Ų134.269%0.69277%0.77SS**  trans82.1131.6137.575.50000123.8
1475S34.1Very low37.3Very low98 Ų98132.9 Ų132.969%0.68576%0.76SS**  trans88.7149.1137.786.50000122
1476N35.4Very low36.9Very low129 Ų129131.5 Ų131.569%0.6974%0.74SS**  trans79.5106.5151.1-73.2-55.2000122.3
1477R33.3Very low36.5Very low226 Ų226126.4 Ų126.485%0.85372%0.716SS**  69.5113.9125.7-74.1-177.3164.7-155.9-4.3120.6
1478S33.1Very low36.5Very low97 Ų97126.6 Ų126.668%0.67870%0.699SS**  62.7105.4113.5-157.90000118.7
1479N36.6Very low36.2Very low155 Ų155123 Ų12383%0.82969%0.685SS**  -176.3148.1107.9-91.7-30.2000114.3
1480R31.8Very low36.2Very low238 Ų238124.3 Ų124.390%0.89868%0.68SS**  trans-78.3178.3160.3-119.5-176.8175-172.3-1108.5
1481P38.2Very low36Very low107 Ų107122.9 Ų122.970%0.69567%0.669SS**  cis-146.1-178.110.845.4-26.8000118.1
1482S33.4Very low36Very low118 Ų118126.1 Ų126.183%0.82567%0.667SS**  trans74.4157.1137.3-153.10000123.1
1483A37.1Very low36.1Very low82 Ų82125.6 Ų125.668%0.67866%0.663SS**  trans78.8113.6172.200000116.6
1484K37.5Very low35.8Very low201 Ų201126.2 Ų126.287%0.87466%0.656SS**  78.4141.369.8-76.8-156.8175.3-1630112.9
1485T34.2Very low36.1Very low85 Ų85124.4 Ų124.452%0.52164%0.644SS.*  cis-176.8148.3-2.8-95.60000108.8
1486D34.3Very low36.3Very low64 Ų64125.3 Ų125.334%0.34265%0.65SS.*  trans55.6156.1164.3-67.7-37.7000119.2E149 T150E149-D1486 PolarHBondContact N-OD1 3.15Å; E149-D1486 VanDerWaalsContact N-OD1 3.16Å; E149-D1486 PolarHBondContact O-N 3.12Å; T150-D1486 VanDerWaalsContact OG1-CA 3.3Å; T150-D1486 WeakPolarHBondContact OG1-CA 3.3Å; T150-D1486 PolarHBondContact OG1-N 3.08Å
1487Q35.3Very low36.6Very low85 Ų85122.8 Ų122.840%0.39766%0.655SS.*  cis-161.9157.5-9.1-118.7174.54500113.5E148 E149 T150E148-Q1487 HydrophobicContact CB-CG 4.27Å; E148-Q1487 VanDerWaalsContact CB-NE2 3.27Å; E148-Q1487 VanDerWaalsContact OE2-CD 3.27Å; E148-Q1487 PolarHBondContact OE2-NE2 3.15Å; E148-Q1487 PolarHBondContact OE2-OE1 2.89Å; E149-Q1487 HydrophobicContact CB-CG 4.26Å; T150-Q1487 VanDerWaalsContact CG2-CA 3.49Å
1488L39.1Very low36.8Very low76 Ų76118.3 Ų118.340%0.39865%0.653SS.*  trans21.2127.2133-94.3150.1000120.7E148 E149E148-L1488 HydrophobicContact CG-CD1 4.17Å; E148-L1488 VanDerWaalsContact OE1-CD1 3.31Å; E148-L1488 WeakPolarHBondContact OE1-CD1 3.41Å; E149-L1488 WeakPolarHBondContact OE2-CG 3.34Å; E149-L1488 PolarHBondContact OE2-N 2.9Å
1489E35.2Very low37Very low130 Ų130121.2 Ų121.261%0.60766%0.66SS**  174141.897.7-92.9-135130.100117
1490R38.9Very low36.9Very low165 Ų165119.1 Ų119.162%0.62365%0.653SS**  trans75.7120.6136.4-77.1-166.7150.992.121126.1
1491E35.7Very low37.1Very low119 Ų119114.7 Ų114.756%0.55665%0.646SS**  81.8153.2120-68.2-176.8172.500121.8
1492K39.8Very low37.1Very low152 Ų152116.9 Ų116.966%0.66165%0.647SS**  cis-166.8158.40.2-127.3168.5-165.9148.70116.2
1493S38.2Very low37.1Very low101 Ų101118.7 Ų118.771%0.70664%0.643SS**  trans64.5169.8137.574.50000120.6
1494E37.2Very low37.2Very low123 Ų123120.1 Ų120.158%0.57565%0.648SS**  cis-159.8-179.5-16-124.2-176.7-95.100105T170T170-E1494 PolarHBondContact N-OE2 3.24Å
1495S39.5Very low37.2Very low62 Ų62116.8 Ų116.843%0.43464%0.639SS.*  cis179.5161.2-2.649.40000106.7
1496S38.3Very low37.3Very low117 Ų117119.5 Ų119.582%0.81865%0.65SS**  cis-177.2157.9-21.1-76.60000108.3
1497G41.2Very low37.6Very low76 Ų76122.5 Ų122.578%0.78467%0.667SS**  trans-171142.9175.200000116.5
1498T38.4Very low37.8Very low131 Ų131126.7 Ų126.780%0.80469%0.686SS**  trans-158.2168.4-151.1-30.10000116.1
1499L38Very low37.7Very low158 Ų158126.8 Ų126.883%0.82771%0.705SS**  trans136174.8148.3-67.1-174.9000116
1500T34.6Very low37.8Very low112 Ų112128.2 Ų128.269%0.68772%0.717SS**  trans-160.5175.4-146.853.30000115.9
1501L35.6Very low38.4Very low145 Ų145124.8 Ų124.876%0.75972%0.716SS**  trans85.6160.4159.3-104.764.8000117.7
1502Q37.2Very low38.4Very low152 Ų152124.4 Ų124.471%0.7172%0.722SS**  cis-155.5173.216.7-155.5162.3-14.100115.7
1503Q35Very low38.1Very low157 Ų157123.3 Ų123.373%0.73473%0.728SS**  trans-37.9176.6178.5-62.2155.6-60.700119.9
1504S38.8Very low38.1Very low112 Ų112125.1 Ų125.178%0.78373%0.734SS**  cis-161.1-175.731.861.90000117.4
1505N36.2Very low37.9Very low131 Ų131124.9 Ų124.970%0.70175%0.746SS**  trans-56.7-167.4-177.8-39.52000118.7
1506D37.9Very low37.7Very low141 Ų141126.2 Ų126.275%0.75476%0.761SS**  cis-154.3-179.512.8-72.7-65.1000108.7
1507D38.7Very low37.4Very low127 Ų127127.6 Ų127.668%0.67976%0.759SS**  cis-173.1164.2-44.2-169.73.1000109.7
1508H40.4Very low37.1Very low174 Ų174130.5 Ų130.581%0.80676%0.756SS**  trans71.2152.2171.3-62.712.8000119.3
1509G36.7Very low36.9Very low77 Ų77129.9 Ų129.979%0.79475%0.748SS**  cis-170.6179.71.200000115.4
1510D38.4Very low36.7Very low161 Ų161129 Ų12986%0.86174%0.744SS**  trans-96.1-165.5-169.9-147.317.8000111.8
1511P49.8Very low36.6Very low93 Ų93127.7 Ų127.760%0.60475%0.745SS**  cis-147.9-175.8-5.138.3-14.1000119.8
1512T35.8Very low36.6Very low111 Ų111127.6 Ų127.668%0.68175%0.745SS**  trans80.7123.2139.443.90000127.4
1513T33.7Very low36.6Very low129 Ų129126.7 Ų126.779%0.79174%0.741SS**  trans69.8160.2139.460.90000120.3
1514V38.4Very low36.7Very low138 Ų138127.7 Ų127.784%0.83674%0.738SS**  cis-144.916826.6179.50000112.2
1515S33.9Very low36.4Very low118 Ų118129.3 Ų129.383%0.82573%0.734SS**  trans-101.5154.1-177.9-38.70000117
1516A35.6Very low36.4Very low90 Ų90128.2 Ų128.274%0.74473%0.733SS**  trans-174.1141.615200000109.8
1517N31.8Very low36.2Very low146 Ų146130.6 Ų130.678%0.78174%0.736SS**  73.4133.651.6-8013.3000113.6
1518L34.6Very low35.9Very low138 Ų138128.9 Ų128.972%0.72374%0.735SS**  cis-158.5160.15.6-89.9143.9000111.5
1519N34Very low35.7Very low118 Ų118128.2 Ų128.263%0.63174%0.736SS**  trans53.7146.4143.7-69.943.1000125.7
1520D32.8Very low35.5Very low140 Ų140129.1 Ų129.175%0.74973%0.729SS**  trans25.6153.5131.8-25.1-38000121.2
1521A33.8Very low35.2Very low84 Ų84129.2 Ų129.269%0.69472%0.724SS**  cis-159167.915.100000113.9
1522D34.3Very low34.4Very low143 Ų143132 Ų13277%0.76573%0.734SS**  trans51.1123.8138.4-79.7-26.3000125.6
1523E37.2Very low34.3Very low132 Ų132131.4 Ų131.462%0.61774%0.741SS**  75.9147.2126-83.9-156.311700125.8
1524R37.1Very low34.3Very low179 Ų179134.6 Ų134.668%0.67575%0.747SS**  trans82.1104.2147.3-75.2163.6-148.9-101.7-14.5121.9
1525M34.2Very low34.3Very low145 Ų145133.3 Ų133.371%0.71474%0.743SS**  98.594.1117.1-75.5-162.7-65.100122.5
1526T34.8Very low34.4Very low108 Ų108135.5 Ų135.566%0.66375%0.746SS**  71.6142.2119.362.40000123.2
1527K35.4Very low35.1Very low191 Ų191135.7 Ų135.783%0.8374%0.74SS**  trans66125.9149.7-72.7162.8179.8174.40116.1
1528S32.4Very low35.2Very low92 Ų92137.3 Ų137.364%0.64374%0.74SS**  cis159173.117.945.60000105.2
1529L34.4Very low35.4Very low159 Ų159138.1 Ų138.183%0.83274%0.74SS**  trans71.3153172.5-51.2167.8000115.2
1530C32.4Very low35.9Very low96 Ų96138.2 Ų138.265%0.64975%0.747SS**  cis-171.4157.9-38.9-111.50000108.3
1531E32.2Very low36.2Very low164 Ų164138.8 Ų138.877%0.76675%0.749SS**  trans58.4118.9150.6-64.8175.8112.700122.5
1532N33Very low36.4Very low151 Ų151140.1 Ų140.181%0.80775%0.751SS**  50.2100.2126.3-57.1-25.2000122.6
1533A34.9Very low36.3Very low99 Ų99139 Ų13982%0.81875%0.754SS**  -172.3136.4129.800000107.9
1534Q33.9Very low36.4Very low196 Ų196138.8 Ų138.892%0.91676%0.764SS**  cis80.968.221.1-154.8-178.719.400116.8
1535S38Very low36.3Very low110 Ų110135.5 Ų135.577%0.76977%0.768SS**  trans-166.7102.6151.155.70000113.6
1536D36.6Very low36.4Very low165 Ų165137.3 Ų137.388%0.88278%0.777SS**  46.8171.7125.6-109.52.4000122.1
1537P49.7Very low36.4Very low94 Ų94135.4 Ų135.461%0.6177%0.773SS**  trans-119.1-173.6-131.341.9-27000114.1
1538F34.3Very low36.4Very low179 Ų179133.5 Ų133.579%0.78577%0.771SS**  172.6152.2127-110.3-97.2000114.1
1539E37.3Very low36.5Very low155 Ų155137.4 Ų137.472%0.72478%0.784SS**  trans73.8123.5151.3-103.8163.6-134.800124.5
1540P45.3Very low36.6Very low121 Ų121134.5 Ų134.579%0.78678%0.777SS**  trans-113.5140.5170.339-29000114.6
1541I39.3Very low36.9Very low151 Ų151136.5 Ų136.577%0.77479%0.787SS**  trans-150.2164.4175.5-8.2177000110.7
1542P38Very low37.4Very low113 Ų113133.6 Ų133.673%0.73479%0.79SS**  -123.8168-88.641.3-28.9000115.2
1543S32.2Very low37.5Very low119 Ų119130 Ų13083%0.83279%0.79SS**PPolyproline II helixtrans-89.6131.1170.1-46.70000112.1
1544P39.7Very low37.8Very low128 Ų128135 Ų13583%0.83180%0.796SS**PPolyproline II helixtrans-83.3139.6172.832.7-33000112.1
1545S33.7Very low37.7Very low110 Ų110131.1 Ų131.177%0.76979%0.79SS**PPolyproline II helixtrans-78161.5169.669.60000111.7
1546M37.6Very low37.7Very low182 Ų182133.6 Ų133.690%0.89779%0.793SS**  -161.4132.4126.6-101.9-82.3-98.100111.9
1547A34.9Very low37.6Very low69 Ų69129.5 Ų129.557%0.5778%0.783SS**  trans-69.2175.2165.800000110.4
1548N35.5Very low37Very low150 Ų150134.7 Ų134.780%0.80280%0.796SS**  cis-162.5152.916.5-112.6-33.7000108
1549L34.8Very low37.3Very low175 Ų175136.5 Ų136.592%0.91680%0.799SS**  176.2160.4117.9-95.5163.9000112
1550S35.8Very low37.2Very low98 Ų98132.5 Ų132.569%0.68579%0.788SS**  trans-141.2153.5-166170.20000110.9
1551T39.3Very low37.5Very low138 Ų138131.8 Ų131.885%0.84779%0.785SS**  -170136.9129.912.60000113.5
1552A41.2Very low37.9Very low102 Ų102131.9 Ų131.984%0.84379%0.787SS**  trans40.8129.715300000121.4
1553G35.7Very low38.4Very low77 Ų77130.6 Ų130.679%0.79478%0.781SS**  cis137.2119.8-14.100000115.2
1554E40.5Very low39.1Very low202 Ų202130.7 Ų130.794%0.94477%0.771SS**  trans-144.2145.1152.5-114.4170.4-158.700106.5
1555S31.8Very low39.7Very low115 Ų115133.1 Ų133.180%0.80478%0.777SS**  trans-136.7124.1-160.9-173.60000113.2
1556I37.9Very low41.3Very low162 Ų162132.1 Ų132.183%0.83176%0.763SS**  trans-110.2118.6166.3-62.6177.4000106.9F1558I1556-F1558 PolarHBondContact O-N 3.39Å
1557A34.3Very low43.5Very low80 Ų80126 Ų12666%0.66174%0.738SS**PPolyproline II helixtrans-77.9121.3-173.100000112.1
1558F37.7Very low45.4Very low203 Ų203127.4 Ų127.489%0.8974%0.742SS**PPolyproline II helixtrans-79.4137.3158.9-94.9-96000109.9I1556I1556-F1558 PolarHBondContact O-N 3.39Å
1559Y41.3Very low47.4Very low216 Ų216128 Ų12885%0.84774%0.74SS**PPolyproline II helixtrans-72.7142.6-178.6-82.3-109000111.5
1560S35.7Very low49.6Very low71 Ų71123 Ų12350%0.49772%0.715SS.*PPolyproline II helixtrans-75.5140.6168.2-167.10000111.4D1562 S1563S1560-D1562 WeakPolarHBondContact CB-OD2 3.21Å; S1560-D1562 PolarHBondContact O-N 2.83Å; S1560-D1562 VanDerWaalsContact OG-CG 3.27Å; S1560-D1562 PolarHBondContact OG-OD2 3.23Å; S1560-S1563 PolarHBondContact O-OG 2.89Å; S1560-S1563 VanDerWaalsContact O-OG 3.12Å
1561C50.2Low51.6Low106 Ų106122.1 Ų122.172%0.71671%0.705SS**G310 helixtrans-67.4-10.1177.1-64.90000113.9S1563 L1564C1561-S1563 PolarHBondContact O-N 3.06Å; C1561-L1564 PolarHBondContact O-N 3.34Å
1562D47.5Very low53.6Low153 Ų153120.6 Ų120.682%0.81869%0.692SS**G310 helixtrans-60.21.6178.7-52.2-49.9000114.9S1560S1560-D1562 WeakPolarHBondContact CB-OD2 3.21Å; S1560-D1562 PolarHBondContact O-N 2.83Å; S1560-D1562 VanDerWaalsContact OG-CG 3.27Å; S1560-D1562 PolarHBondContact OG-OD2 3.23Å
1563S48.4Very low55.7Low86 Ų86122.8 Ų122.860%0.60168%0.679SS**G310 helixtrans-113-0-17556.70000114.6S1560 C1561S1560-S1563 PolarHBondContact O-OG 2.89Å; S1560-S1563 VanDerWaalsContact O-OG 3.12Å; C1561-S1563 PolarHBondContact O-N 3.06Å
1564L48.5Very low58Low121 Ų121123.4 Ų123.463%0.63466%0.664SS**  trans-107.3107.9178.3-65.5178.3000111.7C1561 L1566C1561-L1564 PolarHBondContact O-N 3.34Å; L1564-L1566 HydrophobicContact CB-CG 4.4Å; L1564-L1566 PolarHBondContact O-N 2.85Å
1565N51.8Low60.1Low179 Ų179119.4 Ų119.496%0.95765%0.645SS**  trans-72.373.5168.8-76.6-32.4000110.7
1566L67.6Low62.6Low90 Ų90120.1 Ų120.147%0.47164%0.635SS.*  trans-76.2145.3165.5-70.1164.8000109.5L1564 D1570 V1571 L1574L1564-L1566 HydrophobicContact CB-CG 4.4Å; L1564-L1566 PolarHBondContact O-N 2.85Å; L1566-D1570 HydrophobicContact CB-CB 4.09Å; L1566-D1570 HydrophobicContact CD2-CB 4.02Å; L1566-V1571 HydrophobicContact CB-CG2 4.46Å; L1566-L1574 HydrophobicContact CD1-CD1 4.22Å
1567S82.9Confident64.9Low53 Ų53116 Ų11637%0.37162%0.615SS.*  trans-76.1165.5176.374.90000111.4E1569 D1570 V1571S1567-E1569 PolarHBondContact O-N 3.16Å; S1567-E1569 PolarHBondContact OG-N 3.1Å; S1567-D1570 WeakPolarHBondContact CA-OD2 3.36Å; S1567-D1570 VanDerWaalsContact CB-OD2 3.23Å; S1567-D1570 WeakPolarHBondContact CB-OD2 3.42Å; S1567-D1570 PolarHBondContact N-OD2 3.39Å; S1567-D1570 PolarHBondContact O-N 3.46Å; S1567-D1570 VanDerWaalsContact O-N 3.17Å; S1567-D1570 VanDerWaalsContact OG-CG 3.25Å; S1567-D1570 PolarHBondContact OG-N 3.03Å; S1567-D1570 PolarHBondContact OG-OD2 3.39Å; S1567-V1571 WeakPolarHBondContact O-CG2 3.28Å; S1567-V1571 PolarHBondContact O-N 2.83Å; S1567-V1571 VanDerWaalsContact O-N 3.13Å
1568C74.8Confident67.4Low98 Ų98116.1 Ų116.166%0.66260%0.604SS**Hα-helixtrans-59.5-35.3174.3-160.80000111.7V1571 D1572C1568-V1571 PolarHBondContact O-N 2.82Å; C1568-D1572 PolarHBondContact O-N 2.95Å
1569E76.8Confident69.7Low162 Ų162111.2 Ų111.276%0.75758%0.584SS**Hα-helixtrans-67.6-36.8177.5-59.6-178.5164.700111.6S1567 V1571 Y1573S1567-E1569 PolarHBondContact O-N 3.16Å; S1567-E1569 PolarHBondContact OG-N 3.1Å; E1569-V1571 VanDerWaalsContact C-N 3.34Å; E1569-Y1573 VanDerWaalsContact O-CB 3.26Å; E1569-Y1573 WeakPolarHBondContact O-CB 3.45Å; E1569-Y1573 PolarHBondContact O-N 3.34Å
1570D82.2Confident71.7Confident71 Ų71105.4 Ų105.438%0.3857%0.567SS.*Hα-helixtrans-65.9-36.3173.7-61.3-63.5000112L1566 S1567 L1574L1566-D1570 HydrophobicContact CB-CB 4.09Å; L1566-D1570 HydrophobicContact CD2-CB 4.02Å; S1567-D1570 WeakPolarHBondContact CA-OD2 3.36Å; S1567-D1570 VanDerWaalsContact CB-OD2 3.23Å; S1567-D1570 WeakPolarHBondContact CB-OD2 3.42Å; S1567-D1570 PolarHBondContact N-OD2 3.39Å; S1567-D1570 PolarHBondContact O-N 3.46Å; S1567-D1570 VanDerWaalsContact O-N 3.17Å; S1567-D1570 VanDerWaalsContact OG-CG 3.25Å; S1567-D1570 PolarHBondContact OG-N 3.03Å; S1567-D1570 PolarHBondContact OG-OD2 3.39Å; D1570-L1574 WeakPolarHBondContact O-CB 3.31Å; D1570-L1574 PolarHBondContact O-N 3.28Å
1571V78.3Confident74.1Confident80 Ų80107.3 Ų107.349%0.48557%0.568SS.*Hα-helixtrans-71.2-44.3178.7174.90000111.2L1566 S1567 C1568 E1569 Y1573 L1574 H1575L1566-V1571 HydrophobicContact CB-CG2 4.46Å; S1567-V1571 WeakPolarHBondContact O-CG2 3.28Å; S1567-V1571 PolarHBondContact O-N 2.83Å; S1567-V1571 VanDerWaalsContact O-N 3.13Å; C1568-V1571 PolarHBondContact O-N 2.82Å; E1569-V1571 VanDerWaalsContact C-N 3.34Å; V1571-Y1573 VanDerWaalsContact C-N 3.33Å; V1571-L1574 PolarHBondContact O-N 3.37Å; V1571-H1575 WeakPolarHBondContact O-CB 3.48Å; V1571-H1575 PolarHBondContact O-N 2.97Å
1572D81.3Confident75.7Confident106 Ų106110.2 Ų110.257%0.56756%0.564SS**Hα-helixtrans-64.2-39.3174.6-75.1-31.8000111.3C1568 H1575 Q1576C1568-D1572 PolarHBondContact O-N 2.95Å; D1572-H1575 PolarHBondContact O-N 3.05Å; D1572-Q1576 WeakPolarHBondContact O-CB 3.42Å; D1572-Q1576 PolarHBondContact O-N 3.03Å
1573Y83.7Confident77.4Confident148 Ų148108 Ų10858%0.5855%0.549SS*.Hα-helixtrans-63-45.5173.4-176.5-104000112E1569 V1571 H1575 Q1576 L1577E1569-Y1573 VanDerWaalsContact O-CB 3.26Å; E1569-Y1573 WeakPolarHBondContact O-CB 3.45Å; E1569-Y1573 PolarHBondContact O-N 3.34Å; V1571-Y1573 VanDerWaalsContact C-N 3.33Å; Y1573-H1575 PolarHBondContact O-N 2.79Å; Y1573-Q1576 PolarHBondContact O-N 2.85Å; Y1573-L1577 WeakPolarHBondContact O-CB 3.37Å; Y1573-L1577 PolarHBondContact O-N 3.25Å
1574L84.2Confident79Confident89 Ų89113.1 Ų113.147%0.46656%0.555SS.*Hα-helixtrans-60-42.3173.9-95160.8000112.2L1566 D1570 V1571 L1577 L1578L1566-L1574 HydrophobicContact CD1-CD1 4.22Å; D1570-L1574 WeakPolarHBondContact O-CB 3.31Å; D1570-L1574 PolarHBondContact O-N 3.28Å; V1571-L1574 PolarHBondContact O-N 3.37Å; L1574-L1577 PolarHBondContact O-N 3.25Å; L1574-L1578 VanDerWaalsContact O-CB 3.26Å; L1574-L1578 WeakPolarHBondContact O-CB 3.42Å; L1574-L1578 PolarHBondContact O-N 2.77Å
1575H84.6Confident80.6Confident119 Ų119114.1 Ų114.155%0.55155%0.554SS**Hα-helixtrans-66-40.3177.7-165.9-70.7000111.6V1571 D1572 Y1573 L1578 Q1579V1571-H1575 WeakPolarHBondContact O-CB 3.48Å; V1571-H1575 PolarHBondContact O-N 2.97Å; D1572-H1575 PolarHBondContact O-N 3.05Å; Y1573-H1575 PolarHBondContact O-N 2.79Å; H1575-L1578 PolarHBondContact O-N 2.91Å; H1575-Q1579 WeakPolarHBondContact O-CB 3.31Å; H1575-Q1579 PolarHBondContact O-N 2.87Å
1576Q85.5Confident82.1Confident129 Ų129112.3 Ų112.360%0.60354%0.538SS*.Hα-helixtrans-67.6-38.8176.4-169.3168.292.400111.9D1572 Y1573 Q1579 L1580D1572-Q1576 WeakPolarHBondContact O-CB 3.42Å; D1572-Q1576 PolarHBondContact O-N 3.03Å; Y1573-Q1576 PolarHBondContact O-N 2.85Å; Q1576-Q1579 PolarHBondContact O-N 2.86Å; Q1576-L1580 WeakPolarHBondContact O-CG 3.45Å; Q1576-L1580 PolarHBondContact O-N 3.37Å
1577L86.4Confident82.7Confident76 Ų76112.5 Ų112.540%0.39854%0.538SS..Hα-helixtrans-63.5-46.8174.1-156.680.1000111.4Y1573 L1574 Q1579 L1580 E1581Y1573-L1577 WeakPolarHBondContact O-CB 3.37Å; Y1573-L1577 PolarHBondContact O-N 3.25Å; L1574-L1577 PolarHBondContact O-N 3.25Å; L1577-Q1579 VanDerWaalsContact C-N 3.28Å; L1577-Q1579 PolarHBondContact O-N 2.83Å; L1577-L1580 WeakPolarHBondContact O-CB 3.41Å; L1577-L1580 PolarHBondContact O-N 3.25Å; L1577-L1580 VanDerWaalsContact O-N 3.17Å; L1577-E1581 PolarHBondContact O-N 3.32Å
1578L86.5Confident82.7Confident82 Ų82114.5 Ų114.543%0.42955%0.548SS..Hα-helixtrans-68.2-27.9-179.5-161.7149.2000112L1574 H1575 R1582L1574-L1578 VanDerWaalsContact O-CB 3.26Å; L1574-L1578 WeakPolarHBondContact O-CB 3.42Å; L1574-L1578 PolarHBondContact O-N 2.77Å; H1575-L1578 PolarHBondContact O-N 2.91Å; L1578-R1582 WeakPolarHBondContact O-CG 3.37Å; L1578-R1582 PolarHBondContact O-N 2.88Å; L1578-R1582 VanDerWaalsContact O-N 3.12Å
1579Q84.7Confident82.9Confident101 Ų101116.3 Ų116.347%0.47255%0.547SS..Hα-helixtrans-72.7-40.5170.6-172.2161-22.500112.4H1575 Q1576 L1577 E1581 R1582 E1583H1575-Q1579 WeakPolarHBondContact O-CB 3.31Å; H1575-Q1579 PolarHBondContact O-N 2.87Å; Q1576-Q1579 PolarHBondContact O-N 2.86Å; L1577-Q1579 VanDerWaalsContact C-N 3.28Å; L1577-Q1579 PolarHBondContact O-N 2.83Å; Q1579-E1581 VanDerWaalsContact C-N 3.32Å; Q1579-E1581 PolarHBondContact O-N 3.16Å; Q1579-R1582 PolarHBondContact O-N 3.04Å; Q1579-E1583 PolarHBondContact O-N 3.22Å
1580L84.3Confident83.2Confident94 Ų94114.7 Ų114.749%0.49254%0.539SS..Hα-helixtrans-64.1-34.4172.1-73.1168.3000112.5Q1576 L1577 R1584Q1576-L1580 WeakPolarHBondContact O-CG 3.45Å; Q1576-L1580 PolarHBondContact O-N 3.37Å; L1577-L1580 WeakPolarHBondContact O-CB 3.41Å; L1577-L1580 PolarHBondContact O-N 3.25Å; L1577-L1580 VanDerWaalsContact O-N 3.17Å; L1580-R1584 WeakPolarHBondContact O-CB 3.23Å; L1580-R1584 WeakPolarHBondContact O-CG 3.3Å; L1580-R1584 PolarHBondContact O-N 3.33Å
1581E85.3Confident83.1Confident110 Ų110117.7 Ų117.751%0.51455%0.549SS..Hα-helixtrans-66.3-41.2171.7-72.5-166.2147.700112.1L1577 Q1579 E1583 R1584 F1585L1577-E1581 PolarHBondContact O-N 3.32Å; Q1579-E1581 VanDerWaalsContact C-N 3.32Å; Q1579-E1581 PolarHBondContact O-N 3.16Å; E1581-E1583 PolarHBondContact O-N 3.05Å; E1581-R1584 WeakPolarHBondContact O-CB 3.41Å; E1581-R1584 PolarHBondContact O-N 3.04Å; E1581-F1585 WeakPolarHBondContact O-CD2 3.17Å; E1581-F1585 PolarHBondContact O-N 2.65Å
1582R85.2Confident83.2Confident168 Ų168116.5 Ų116.563%0.63455%0.547SS*.Hα-helixtrans-61.5-42.1174.3-75172.5178.5177.32.2112.7L1578 Q1579 F1585 K1586L1578-R1582 WeakPolarHBondContact O-CG 3.37Å; L1578-R1582 PolarHBondContact O-N 2.88Å; L1578-R1582 VanDerWaalsContact O-N 3.12Å; Q1579-R1582 PolarHBondContact O-N 3.04Å; R1582-F1585 PolarHBondContact O-N 2.95Å; R1582-K1586 PolarHBondContact O-N 3.16Å
1583E82.6Confident83.2Confident107 Ų107114.1 Ų114.150%0.554%0.543SS..Hα-helixtrans-65.6-39.6175.3-72-179.7-179.600111.8Q1579 E1581 K1586 I1587Q1579-E1583 PolarHBondContact O-N 3.22Å; E1581-E1583 PolarHBondContact O-N 3.05Å; E1583-K1586 PolarHBondContact O-N 2.95Å; E1583-I1587 WeakPolarHBondContact O-CG1 3.36Å; E1583-I1587 PolarHBondContact O-N 3.07Å; E1583-I1587 VanDerWaalsContact O-N 3.12Å
1584R81Confident83.1Confident192 Ų192112.4 Ų112.473%0.72554%0.54SS*.Hα-helixtrans-61.6-45.7172.3-81.1177.7153.1-150-7.1112.8L1580 E1581 K1586 I1587 V1588L1580-R1584 WeakPolarHBondContact O-CB 3.23Å; L1580-R1584 WeakPolarHBondContact O-CG 3.3Å; L1580-R1584 PolarHBondContact O-N 3.33Å; E1581-R1584 WeakPolarHBondContact O-CB 3.41Å; E1581-R1584 PolarHBondContact O-N 3.04Å; R1584-K1586 PolarHBondContact O-N 3.49Å; R1584-I1587 PolarHBondContact O-N 3.24Å; R1584-V1588 WeakPolarHBondContact O-CG2 3.09Å; R1584-V1588 PolarHBondContact O-N 2.95Å
1585F81.8Confident82.9Confident142 Ų142113.1 Ų113.162%0.62354%0.544SS*.Hα-helixtrans-60.3-44.4176.8-94.8-75.9000111.6E1581 R1582 I1587 V1588 E1589E1581-F1585 WeakPolarHBondContact O-CD2 3.17Å; E1581-F1585 PolarHBondContact O-N 2.65Å; R1582-F1585 PolarHBondContact O-N 2.95Å; F1585-I1587 VanDerWaalsContact C-N 3.34Å; F1585-I1587 PolarHBondContact O-N 2.96Å; F1585-V1588 WeakPolarHBondContact O-CB 3.3Å; F1585-V1588 PolarHBondContact O-N 3.38Å; F1585-E1589 PolarHBondContact O-N 3.01Å
1586K83.4Confident82.8Confident142 Ų142114.1 Ų114.162%0.61755%0.549SS*.Hα-helixtrans-58.5-42.9176.5-171.7-176.9176.2-170.40112.6R1582 E1583 R1584 V1588 E1589 E1590R1582-K1586 PolarHBondContact O-N 3.16Å; E1583-K1586 PolarHBondContact O-N 2.95Å; R1584-K1586 PolarHBondContact O-N 3.49Å; K1586-V1588 VanDerWaalsContact C-N 3.3Å; K1586-V1588 PolarHBondContact O-N 3.22Å; K1586-E1589 PolarHBondContact O-N 3.03Å; K1586-E1590 WeakPolarHBondContact O-CB 3.2Å; K1586-E1590 PolarHBondContact O-N 3.25Å
1587I80.9Confident82.8Confident93 Ų93115 Ų11548%0.47755%0.55SS.*Hα-helixtrans-66.3-32.5176.9-67.3165.9000111.5E1583 R1584 F1585 K1591E1583-I1587 WeakPolarHBondContact O-CG1 3.36Å; E1583-I1587 PolarHBondContact O-N 3.07Å; E1583-I1587 VanDerWaalsContact O-N 3.12Å; R1584-I1587 PolarHBondContact O-N 3.24Å; F1585-I1587 VanDerWaalsContact C-N 3.34Å; F1585-I1587 PolarHBondContact O-N 2.96Å; I1587-K1591 WeakPolarHBondContact O-CB 3.11Å; I1587-K1591 WeakPolarHBondContact O-CG 3.24Å; I1587-K1591 PolarHBondContact O-N 3.06Å; I1587-K1591 VanDerWaalsContact O-N 3.11Å
1588V83.6Confident82.4Confident95 Ų95115.1 Ų115.158%0.57655%0.549SS*.Hα-helixtrans-71.3-42.1174.9171.10000111.4R1584 F1585 K1586 K1591 A1592R1584-V1588 WeakPolarHBondContact O-CG2 3.09Å; R1584-V1588 PolarHBondContact O-N 2.95Å; F1585-V1588 WeakPolarHBondContact O-CB 3.3Å; F1585-V1588 PolarHBondContact O-N 3.38Å; K1586-V1588 VanDerWaalsContact C-N 3.3Å; K1586-V1588 PolarHBondContact O-N 3.22Å; V1588-K1591 PolarHBondContact O-N 2.83Å; V1588-A1592 WeakPolarHBondContact O-CB 3.4Å; V1588-A1592 PolarHBondContact O-N 2.84Å
1589E79.4Confident82.3Confident137 Ų137114.7 Ų114.764%0.6455%0.55SS*.Hα-helixtrans-63.2-44.5174.7-70.7-177.6145.700112F1585 K1586 K1591 A1592 A1593F1585-E1589 PolarHBondContact O-N 3.01Å; K1586-E1589 PolarHBondContact O-N 3.03Å; E1589-K1591 PolarHBondContact O-N 2.88Å; E1589-A1592 PolarHBondContact O-N 3.38Å; E1589-A1593 PolarHBondContact O-N 2.57Å
1590E81.6Confident82.1Confident128 Ų128113.3 Ų113.360%0.59855%0.551SS**Hα-helixtrans-62-41.7177.8-172.3165.5-159.800111.7K1586 Q1594K1586-E1590 WeakPolarHBondContact O-CB 3.2Å; K1586-E1590 PolarHBondContact O-N 3.25Å; E1590-Q1594 PolarHBondContact O-N 2.84Å
1591K80.8Confident82Confident133 Ų133113.5 Ų113.558%0.57855%0.551SS**Hα-helixtrans-70.3-33.7173.4-75-172.3175.3-166.50113.7I1587 V1588 E1589 Q1594 L1595I1587-K1591 WeakPolarHBondContact O-CB 3.11Å; I1587-K1591 WeakPolarHBondContact O-CG 3.24Å; I1587-K1591 PolarHBondContact O-N 3.06Å; I1587-K1591 VanDerWaalsContact O-N 3.11Å; V1588-K1591 PolarHBondContact O-N 2.83Å; E1589-K1591 PolarHBondContact O-N 2.88Å; K1591-Q1594 PolarHBondContact O-N 3.29Å; K1591-L1595 WeakPolarHBondContact O-CB 3.38Å; K1591-L1595 WeakPolarHBondContact O-CG 3.45Å; K1591-L1595 PolarHBondContact O-N 2.8Å
1592A81.3Confident81.8Confident55 Ų55113.4 Ų113.446%0.45555%0.553SS.*Hα-helixtrans-65.7-44.517500000111.1V1588 E1589 Q1594 L1595 E1596V1588-A1592 WeakPolarHBondContact O-CB 3.4Å; V1588-A1592 PolarHBondContact O-N 2.84Å; E1589-A1592 PolarHBondContact O-N 3.38Å; A1592-Q1594 VanDerWaalsContact C-N 3.35Å; A1592-Q1594 PolarHBondContact O-N 3.43Å; A1592-L1595 PolarHBondContact O-N 2.84Å; A1592-E1596 WeakPolarHBondContact O-CB 3.2Å; A1592-E1596 PolarHBondContact O-N 2.96Å
1593A80.9Confident81.5Confident57 Ų57110.1 Ų110.147%0.47155%0.548SS..Hα-helixtrans-64.3-37.2175.200000112.5E1589 K1597E1589-A1593 PolarHBondContact O-N 2.57Å; A1593-K1597 WeakPolarHBondContact O-CB 3.4Å; A1593-K1597 PolarHBondContact O-N 3.06Å
1594Q81.2Confident81.6Confident111 Ų111111.5 Ų111.552%0.51955%0.553SS.*Hα-helixtrans-64.9-46172.5-179.3169.2-10.200111.8E1590 K1591 A1592 E1596 K1597 E1598E1590-Q1594 PolarHBondContact O-N 2.84Å; K1591-Q1594 PolarHBondContact O-N 3.29Å; A1592-Q1594 VanDerWaalsContact C-N 3.35Å; A1592-Q1594 PolarHBondContact O-N 3.43Å; Q1594-E1596 VanDerWaalsContact C-N 3.33Å; Q1594-E1596 PolarHBondContact O-N 2.79Å; Q1594-K1597 WeakPolarHBondContact O-CB 3.28Å; Q1594-K1597 PolarHBondContact O-N 2.83Å; Q1594-E1598 HydrophobicContact CG-CG 4.44Å; Q1594-E1598 VanDerWaalsContact CG-OE1 3.27Å; Q1594-E1598 WeakPolarHBondContact CG-OE1 3.26Å; Q1594-E1598 PolarHBondContact NE2-OE1 3.19Å; Q1594-E1598 WeakPolarHBondContact O-CG 3.29Å; Q1594-E1598 PolarHBondContact O-N 3.12Å
1595L80.4Confident81.5Confident104 Ų104106.9 Ų106.955%0.54554%0.54SS..Hα-helixtrans-63.6-35.7176.4-76.5169.4000112.6K1591 A1592 E1598 T1599K1591-L1595 WeakPolarHBondContact O-CB 3.38Å; K1591-L1595 WeakPolarHBondContact O-CG 3.45Å; K1591-L1595 PolarHBondContact O-N 2.8Å; A1592-L1595 PolarHBondContact O-N 2.84Å; L1595-E1598 PolarHBondContact O-N 3.37Å; L1595-T1599 WeakPolarHBondContact O-CB 3.43Å; L1595-T1599 PolarHBondContact O-N 2.68Å; L1595-T1599 PolarHBondContact O-OG1 3Å
1596E82.2Confident81.5Confident140 Ų140104 Ų10465%0.65453%0.53SS*.Hα-helixtrans-65.5-40.6174.1-174.5173.5-162.100111.4A1592 Q1594 S1600A1592-E1596 WeakPolarHBondContact O-CB 3.2Å; A1592-E1596 PolarHBondContact O-N 2.96Å; Q1594-E1596 VanDerWaalsContact C-N 3.33Å; Q1594-E1596 PolarHBondContact O-N 2.79Å; E1596-S1600 VanDerWaalsContact O-CB 3.27Å; E1596-S1600 WeakPolarHBondContact O-CB 3.33Å; E1596-S1600 PolarHBondContact O-N 2.85Å; E1596-S1600 PolarHBondContact O-OG 3.12Å
1597K84.3Confident81.4Confident148 Ų14898.5 Ų98.564%0.64351%0.513SS*.Hα-helixtrans-64.9-45174.5-174.8-177.9178.1-174.40112.2A1593 Q1594 S1600 M1601A1593-K1597 WeakPolarHBondContact O-CB 3.4Å; A1593-K1597 PolarHBondContact O-N 3.06Å; Q1594-K1597 WeakPolarHBondContact O-CB 3.28Å; Q1594-K1597 PolarHBondContact O-N 2.83Å; K1597-S1600 PolarHBondContact O-N 2.93Å; K1597-M1601 WeakPolarHBondContact O-CB 3.48Å; K1597-M1601 PolarHBondContact O-N 3.27Å
1598E79.4Confident81.4Confident79 Ų7998.4 Ų98.437%0.36951%0.512SS..Hα-helixtrans-66-43.2177.1-72.8170.7-171.700111.4Q1594 L1595 S1600 M1601 L1602Q1594-E1598 HydrophobicContact CG-CG 4.44Å; Q1594-E1598 VanDerWaalsContact CG-OE1 3.27Å; Q1594-E1598 WeakPolarHBondContact CG-OE1 3.26Å; Q1594-E1598 PolarHBondContact NE2-OE1 3.19Å; Q1594-E1598 WeakPolarHBondContact O-CG 3.29Å; Q1594-E1598 PolarHBondContact O-N 3.12Å; L1595-E1598 PolarHBondContact O-N 3.37Å; E1598-S1600 VanDerWaalsContact C-N 3.31Å; E1598-S1600 PolarHBondContact O-N 2.82Å; E1598-M1601 WeakPolarHBondContact O-CB 3.12Å; E1598-M1601 PolarHBondContact O-N 3.24Å; E1598-L1602 WeakPolarHBondContact O-CB 3.38Å; E1598-L1602 WeakPolarHBondContact O-CG 3.41Å; E1598-L1602 PolarHBondContact O-N 3.04Å
1599T83.2Confident81.1Confident73 Ų7399.1 Ų99.145%0.44851%0.512SS..Hα-helixtrans-64.3-36175.1-56.70000111.7L1595 N1603L1595-T1599 WeakPolarHBondContact O-CB 3.43Å; L1595-T1599 PolarHBondContact O-N 2.68Å; L1595-T1599 PolarHBondContact O-OG1 3Å; T1599-N1603 WeakPolarHBondContact O-CB 3.43Å; T1599-N1603 PolarHBondContact O-N 3.44Å; T1599-N1603 PolarHBondContact O-ND2 2.67Å
1600S80.4Confident81Confident71 Ų71100.2 Ų100.250%0.49751%0.512SS..Hα-helixtrans-67.6-39.8174.4-62.80000112.2E1596 K1597 E1598 N1603 F1604E1596-S1600 VanDerWaalsContact O-CB 3.27Å; E1596-S1600 WeakPolarHBondContact O-CB 3.33Å; E1596-S1600 PolarHBondContact O-N 2.85Å; E1596-S1600 PolarHBondContact O-OG 3.12Å; K1597-S1600 PolarHBondContact O-N 2.93Å; E1598-S1600 VanDerWaalsContact C-N 3.31Å; E1598-S1600 PolarHBondContact O-N 2.82Å; S1600-N1603 PolarHBondContact O-N 2.82Å; S1600-F1604 PolarHBondContact O-N 3.36Å
1601M82.5Confident80.5Confident98 Ų98100.2 Ų100.248%0.48351%0.506SS..Hα-helixtrans-64.2-49.4175.1-165-174.2-47.500111.2K1597 E1598 N1603 F1604 E1605K1597-M1601 WeakPolarHBondContact O-CB 3.48Å; K1597-M1601 PolarHBondContact O-N 3.27Å; E1598-M1601 WeakPolarHBondContact O-CB 3.12Å; E1598-M1601 PolarHBondContact O-N 3.24Å; M1601-N1603 VanDerWaalsContact C-N 3.33Å; M1601-N1603 PolarHBondContact O-N 3.34Å; M1601-F1604 WeakPolarHBondContact O-CB 3.3Å; M1601-F1604 PolarHBondContact O-N 3.19Å; M1601-F1604 VanDerWaalsContact O-N 3.08Å; M1601-E1605 WeakPolarHBondContact O-CG 3.31Å; M1601-E1605 PolarHBondContact O-N 3.15Å
1602L80.8Confident80.5Confident109 Ų109100 Ų10057%0.57150%0.502SS*.Hα-helixtrans-60.3-39.5176.5-72.3169.1000112.2E1598 E1605 L1606E1598-L1602 WeakPolarHBondContact O-CB 3.38Å; E1598-L1602 WeakPolarHBondContact O-CG 3.41Å; E1598-L1602 PolarHBondContact O-N 3.04Å; L1602-E1605 PolarHBondContact O-N 2.76Å; L1602-L1606 WeakPolarHBondContact O-CB 3.38Å; L1602-L1606 PolarHBondContact O-N 3.08Å
1603N79.9Confident80.5Confident99 Ų9998.4 Ų98.453%0.52949%0.485SS..Hα-helixtrans-66.3-35.6174.3-82.4-56000112.7T1599 S1600 M1601 G1607T1599-N1603 WeakPolarHBondContact O-CB 3.43Å; T1599-N1603 PolarHBondContact O-N 3.44Å; T1599-N1603 PolarHBondContact O-ND2 2.67Å; S1600-N1603 PolarHBondContact O-N 2.82Å; M1601-N1603 VanDerWaalsContact C-N 3.33Å; M1601-N1603 PolarHBondContact O-N 3.34Å; N1603-G1607 PolarHBondContact O-N 3.41Å
1604F83.7Confident80.4Confident136 Ų13699 Ų9960%0.59649%0.485SS*.Hα-helixtrans-66.4-46.2173.9177.5-94.4000111.7S1600 M1601 G1607 M1608S1600-F1604 PolarHBondContact O-N 3.36Å; M1601-F1604 WeakPolarHBondContact O-CB 3.3Å; M1601-F1604 PolarHBondContact O-N 3.19Å; M1601-F1604 VanDerWaalsContact O-N 3.08Å; F1604-G1607 CarbonylContact O-C 3.58Å; F1604-G1607 PolarHBondContact O-N 2.93Å; F1604-M1608 HydrophobicContact CD1-CG 4.35Å; F1604-M1608 HydrophobicContact CE1-CG 3.99Å; F1604-M1608 HydrophobicContact CZ-CG 4.23Å; F1604-M1608 WeakPolarHBondContact O-CG 3.4Å; F1604-M1608 PolarHBondContact O-N 3.35Å
1605E80.7Confident79.9Confident95 Ų9597.2 Ų97.244%0.44447%0.474SS..Hα-helixtrans-61.8-45.5175.3-71.1-179.5168.600112M1601 L1602 G1607 M1608 L1609M1601-E1605 WeakPolarHBondContact O-CG 3.31Å; M1601-E1605 PolarHBondContact O-N 3.15Å; L1602-E1605 PolarHBondContact O-N 2.76Å; E1605-G1607 VanDerWaalsContact C-N 3.27Å; E1605-G1607 PolarHBondContact O-N 2.96Å; E1605-M1608 CarbonylContact O-C 3.59Å; E1605-M1608 WeakPolarHBondContact O-CA 3.28Å; E1605-M1608 WeakPolarHBondContact O-CB 3.33Å; E1605-M1608 PolarHBondContact O-N 3.49Å; E1605-L1609 WeakPolarHBondContact O-CG 3.22Å; E1605-L1609 PolarHBondContact O-N 3.27Å
1606L79.9Confident79.8Confident82 Ų8294.4 Ų94.443%0.42946%0.458SS..Hα-helixtrans-60.2-39.2175.5-160.771.5000111.4L1602 L1609 Y1610L1602-L1606 WeakPolarHBondContact O-CB 3.38Å; L1602-L1606 PolarHBondContact O-N 3.08Å; L1606-L1609 PolarHBondContact O-N 3.05Å; L1606-Y1610 WeakPolarHBondContact O-CB 3.31Å; L1606-Y1610 PolarHBondContact O-N 3.25Å
1607G83.1Confident79.8Confident25 Ų2593.6 Ų93.626%0.25845%0.449SS..Hα-helixtrans-65.9-35171.900000113.2N1603 F1604 E1605 R1611N1603-G1607 PolarHBondContact O-N 3.41Å; F1604-G1607 CarbonylContact O-C 3.58Å; F1604-G1607 PolarHBondContact O-N 2.93Å; E1605-G1607 VanDerWaalsContact C-N 3.27Å; E1605-G1607 PolarHBondContact O-N 2.96Å; G1607-R1611 WeakPolarHBondContact O-CB 3.47Å; G1607-R1611 VanDerWaalsContact O-CG 3.26Å; G1607-R1611 WeakPolarHBondContact O-CG 3.18Å; G1607-R1611 PolarHBondContact O-N 3.42Å; G1607-R1611 PolarHBondContact O-NE 3.46Å
1608M79.2Confident79.5Confident91 Ų9191 Ų9145%0.44844%0.439SS..Hα-helixtrans-68.9-44.4172.8-73-64.4-80.300111.9F1604 E1605 R1611 R1612F1604-M1608 HydrophobicContact CD1-CG 4.35Å; F1604-M1608 HydrophobicContact CE1-CG 3.99Å; F1604-M1608 HydrophobicContact CZ-CG 4.23Å; F1604-M1608 WeakPolarHBondContact O-CG 3.4Å; F1604-M1608 PolarHBondContact O-N 3.35Å; E1605-M1608 CarbonylContact O-C 3.59Å; E1605-M1608 WeakPolarHBondContact O-CA 3.28Å; E1605-M1608 WeakPolarHBondContact O-CB 3.33Å; E1605-M1608 PolarHBondContact O-N 3.49Å; M1608-R1611 CarbonylContact O-C 3.59Å; M1608-R1611 PolarHBondContact O-N 3.44Å; M1608-R1611 PolarHBondContact SD-NH2 3.38Å; M1608-R1611 VanDerWaalsContact SD-NH2 3.38Å; M1608-R1612 PolarHBondContact O-N 2.78Å
1609L77.4Confident79.6Confident111 Ų11192.5 Ų92.558%0.58145%0.449SS*.Hα-helixtrans-62.2-46.6176.5-71.9171.7000112E1605 L1606 R1611 R1612 Q1613E1605-L1609 WeakPolarHBondContact O-CG 3.22Å; E1605-L1609 PolarHBondContact O-N 3.27Å; L1606-L1609 PolarHBondContact O-N 3.05Å; L1609-R1611 VanDerWaalsContact C-N 3.28Å; L1609-R1611 PolarHBondContact O-N 3.07Å; L1609-R1612 WeakPolarHBondContact O-CA 3.41Å; L1609-R1612 WeakPolarHBondContact O-CB 3.25Å; L1609-R1612 PolarHBondContact O-N 3.44Å; L1609-Q1613 PolarHBondContact O-N 3.32Å
1610Y78.2Confident79.6Confident160 Ų16092.2 Ų92.263%0.62744%0.444SS*.Hα-helixtrans-62.2-36.6176.1-165.1-102.6000112L1606 R1612 S1614L1606-Y1610 WeakPolarHBondContact O-CB 3.31Å; L1606-Y1610 PolarHBondContact O-N 3.25Å; Y1610-R1612 VanDerWaalsContact C-N 3.31Å; Y1610-R1612 PolarHBondContact O-N 3.09Å; Y1610-S1614 VanDerWaalsContact O-CB 3.24Å; Y1610-S1614 WeakPolarHBondContact O-CB 3.2Å; Y1610-S1614 PolarHBondContact O-N 2.74Å
1611R70.5Confident79.9Confident127 Ų12795.2 Ų95.248%0.47945%0.449SS..Hα-helixtrans-70.9-21.6172-74.8176.5-68.7-161.31.8113.2G1607 M1608 L1609 R1615G1607-R1611 WeakPolarHBondContact O-CB 3.47Å; G1607-R1611 VanDerWaalsContact O-CG 3.26Å; G1607-R1611 WeakPolarHBondContact O-CG 3.18Å; G1607-R1611 PolarHBondContact O-N 3.42Å; G1607-R1611 PolarHBondContact O-NE 3.46Å; M1608-R1611 CarbonylContact O-C 3.59Å; M1608-R1611 PolarHBondContact O-N 3.44Å; M1608-R1611 PolarHBondContact SD-NH2 3.38Å; M1608-R1611 VanDerWaalsContact SD-NH2 3.38Å; L1609-R1611 VanDerWaalsContact C-N 3.28Å; L1609-R1611 PolarHBondContact O-N 3.07Å; R1611-R1615 PolarHBondContact O-NE 2.92Å; R1611-R1615 PolarHBondContact O-NH2 2.74Å
1612R81.2Confident79.9Confident129 Ų12994.2 Ų94.249%0.48745%0.448SS..Hα-helixtrans-79.5-54.4172.2177.7174.8172.9160.51.3110.8M1608 L1609 Y1610 S1614 R1615 E1616M1608-R1612 PolarHBondContact O-N 2.78Å; L1609-R1612 WeakPolarHBondContact O-CA 3.41Å; L1609-R1612 WeakPolarHBondContact O-CB 3.25Å; L1609-R1612 PolarHBondContact O-N 3.44Å; Y1610-R1612 VanDerWaalsContact C-N 3.31Å; Y1610-R1612 PolarHBondContact O-N 3.09Å; R1612-S1614 VanDerWaalsContact C-N 3.27Å; R1612-S1614 PolarHBondContact O-N 3.43Å; R1612-R1615 WeakPolarHBondContact O-CA 3.22Å; R1612-R1615 WeakPolarHBondContact O-CB 3.47Å; R1612-R1615 PolarHBondContact O-N 3.41Å; R1612-E1616 WeakPolarHBondContact CG-OE1 3.4Å; R1612-E1616 IonicContact CZ-OE1 3.57Å; R1612-E1616 IonicContact NE-OE1 3.97Å; R1612-E1616 PolarHBondContact NE-OE1 2.93Å; R1612-E1616 IonicContact NH2-OE1 3.48Å; R1612-E1616 PolarHBondContact NH2-OE1 3.29Å; R1612-E1616 PolarHBondContact O-N 2.65Å
1613Q81.1Confident80.1Confident22 Ų2294.2 Ų94.210%0.10345%0.445CS..Hα-helixtrans-55.2-40.1177.9-173.4-173.448.500112.6D795 N798 L1609 R1615 E1616 R1617D795-Q1613 PolarHBondContact OD1-NE2 3.23Å; N798-Q1613 HydrophobicContact CB-CG 4.49Å; N798-Q1613 PolarHBondContact OD1-NE2 2.9Å; L1609-Q1613 PolarHBondContact O-N 3.32Å; Q1613-R1615 VanDerWaalsContact C-N 3.34Å; Q1613-R1615 PolarHBondContact O-N 3.28Å; Q1613-E1616 PolarHBondContact O-N 2.85Å; Q1613-R1617 WeakPolarHBondContact O-CG 3.47Å; Q1613-R1617 PolarHBondContact O-N 2.97Å
1614S78.3Confident80.3Confident68 Ų6893.6 Ų93.648%0.47644%0.442SS..Hα-helixtrans-63.5-37.3175.3-172.90000112.8Y1610 R1612 E1618Y1610-S1614 VanDerWaalsContact O-CB 3.24Å; Y1610-S1614 WeakPolarHBondContact O-CB 3.2Å; Y1610-S1614 PolarHBondContact O-N 2.74Å; R1612-S1614 VanDerWaalsContact C-N 3.27Å; R1612-S1614 PolarHBondContact O-N 3.43Å; S1614-E1618 PolarHBondContact O-N 2.71Å; S1614-E1618 VanDerWaalsContact O-N 3.08Å
1615R72.2Confident80.4Confident75 Ų7591.1 Ų91.128%0.28343%0.432SS..Hα-helixtrans-70-40.7173.4-80.2176.9-80.6-177.3-3.1112.1L1168 R1611 R1612 Q1613 E1618 L1619L1168-R1615 VanDerWaalsContact CD2-NH1 3.33Å; R1611-R1615 PolarHBondContact O-NE 2.92Å; R1611-R1615 PolarHBondContact O-NH2 2.74Å; R1612-R1615 WeakPolarHBondContact O-CA 3.22Å; R1612-R1615 WeakPolarHBondContact O-CB 3.47Å; R1612-R1615 PolarHBondContact O-N 3.41Å; Q1613-R1615 VanDerWaalsContact C-N 3.34Å; Q1613-R1615 PolarHBondContact O-N 3.28Å; R1615-E1618 PolarHBondContact O-N 3.26Å; R1615-L1619 WeakPolarHBondContact O-CB 3.43Å; R1615-L1619 WeakPolarHBondContact O-CG 3.39Å; R1615-L1619 PolarHBondContact O-N 3.39Å
1616E78.2Confident80.8Confident44 Ų4494 Ų9421%0.20644%0.439CS..Hα-helixtrans-62.8-42.2177.1-72.2161.6168.300111.1R1612 Q1613 L1619 L1620R1612-E1616 WeakPolarHBondContact CG-OE1 3.4Å; R1612-E1616 IonicContact CZ-OE1 3.57Å; R1612-E1616 IonicContact NE-OE1 3.97Å; R1612-E1616 PolarHBondContact NE-OE1 2.93Å; R1612-E1616 IonicContact NH2-OE1 3.48Å; R1612-E1616 PolarHBondContact NH2-OE1 3.29Å; R1612-E1616 PolarHBondContact O-N 2.65Å; Q1613-E1616 PolarHBondContact O-N 2.85Å; E1616-L1619 PolarHBondContact O-N 3.27Å; E1616-L1620 WeakPolarHBondContact O-CB 3.48Å; E1616-L1620 WeakPolarHBondContact O-CG 3.06Å; E1616-L1620 PolarHBondContact O-N 2.8Å
1617R82.1Confident81.1Confident123 Ų12394.1 Ų94.146%0.46444%0.439SS..Hα-helixtrans-62.7-41.6171.4-73-178.1180-1651113.7Q1613 L1620 K1621Q1613-R1617 WeakPolarHBondContact O-CG 3.47Å; Q1613-R1617 PolarHBondContact O-N 2.97Å; R1617-L1620 PolarHBondContact O-N 2.93Å; R1617-K1621 WeakPolarHBondContact O-CB 3.25Å; R1617-K1621 PolarHBondContact O-N 3.35Å
1618E77.8Confident81.3Confident93 Ų9398.6 Ų98.644%0.43545%0.453SS..Hα-helixtrans-69.7-36.2179.3-164.8168.4-143.100111.3R1175 S1614 R1615 K1621 T1622R1175-E1618 IonicContact CZ-OE2 3.37Å; R1175-E1618 IonicContact NH1-OE2 3.46Å; R1175-E1618 PolarHBondContact NH1-OE2 3.33Å; S1614-E1618 PolarHBondContact O-N 2.71Å; S1614-E1618 VanDerWaalsContact O-N 3.08Å; R1615-E1618 PolarHBondContact O-N 3.26Å; E1618-K1621 PolarHBondContact O-N 3.06Å; E1618-T1622 WeakPolarHBondContact O-CG2 3.3Å; E1618-T1622 PolarHBondContact O-N 3.03Å; E1618-T1622 PolarHBondContact O-OG1 3.41Å
1619L81.6Confident81.7Confident111 Ų111100.7 Ų100.758%0.58146%0.46SS*.Hα-helixtrans-61.7-52.7170-75.4169.7000111.4R1615 E1616 K1621 T1622 E1623R1615-L1619 WeakPolarHBondContact O-CB 3.43Å; R1615-L1619 WeakPolarHBondContact O-CG 3.39Å; R1615-L1619 PolarHBondContact O-N 3.39Å; E1616-L1619 PolarHBondContact O-N 3.27Å; L1619-K1621 PolarHBondContact O-N 2.97Å; L1619-T1622 CarbonylContact O-C 3.6Å; L1619-T1622 PolarHBondContact O-N 2.76Å; L1619-T1622 PolarHBondContact O-OG1 3.37Å; L1619-E1623 PolarHBondContact O-N 2.91Å
1620L82Confident82.3Confident68 Ų6899.8 Ų99.836%0.35645%0.453SS..Hα-helixtrans-58.1-33.1177-75.4167.8000112.5E1616 R1617 N1624E1616-L1620 WeakPolarHBondContact O-CB 3.48Å; E1616-L1620 WeakPolarHBondContact O-CG 3.06Å; E1616-L1620 PolarHBondContact O-N 2.8Å; R1617-L1620 PolarHBondContact O-N 2.93Å; L1620-N1624 WeakPolarHBondContact O-CB 3.4Å; L1620-N1624 PolarHBondContact O-N 3.02Å; L1620-N1624 PolarHBondContact O-ND2 2.7Å
1621K86.6Confident82.8Confident134 Ų13495.9 Ų95.958%0.58345%0.445SS*.Hα-helixtrans-66.6-49171-172-175.6176.3-166.10111.4R1617 E1618 L1619 E1623 N1624 E1625R1617-K1621 WeakPolarHBondContact O-CB 3.25Å; R1617-K1621 PolarHBondContact O-N 3.35Å; E1618-K1621 PolarHBondContact O-N 3.06Å; L1619-K1621 PolarHBondContact O-N 2.97Å; K1621-E1623 VanDerWaalsContact C-N 3.29Å; K1621-E1623 PolarHBondContact O-N 3.31Å; K1621-N1624 PolarHBondContact O-N 3.04Å; K1621-E1625 VanDerWaalsContact CE-OE1 3.22Å; K1621-E1625 WeakPolarHBondContact CE-OE1 3.41Å; K1621-E1625 IonicContact NZ-OE1 3.94Å; K1621-E1625 WeakPolarHBondContact O-CG 3.37Å; K1621-E1625 PolarHBondContact O-N 2.75Å
1622T83.8Confident83.7Confident76 Ų7694.1 Ų94.147%0.46645%0.445SS..Hα-helixtrans-65.8-30.417858.80000113.3E1618 L1619 R1626E1618-T1622 WeakPolarHBondContact O-CG2 3.3Å; E1618-T1622 PolarHBondContact O-N 3.03Å; E1618-T1622 PolarHBondContact O-OG1 3.41Å; L1619-T1622 CarbonylContact O-C 3.6Å; L1619-T1622 PolarHBondContact O-N 2.76Å; L1619-T1622 PolarHBondContact O-OG1 3.37Å; T1622-R1626 WeakPolarHBondContact O-CB 3.2Å; T1622-R1626 PolarHBondContact O-N 3.37Å
1623E85.4Confident84.1Confident109 Ų10992.6 Ų92.651%0.50944%0.444SS..Hα-helixtrans-75.2-40.2175.4-173154.8-14500111.4L1619 K1621 R1626 L1627L1619-E1623 PolarHBondContact O-N 2.91Å; K1621-E1623 VanDerWaalsContact C-N 3.29Å; K1621-E1623 PolarHBondContact O-N 3.31Å; E1623-R1626 CarbonylContact O-C 3.54Å; E1623-R1626 WeakPolarHBondContact O-CB 3.5Å; E1623-R1626 PolarHBondContact O-N 3.34Å; E1623-L1627 HydrophobicContact CG-CD1 4.18Å; E1623-L1627 HydrophobicContact CG-CG 4.43Å; E1623-L1627 WeakPolarHBondContact O-CB 3.4Å; E1623-L1627 VanDerWaalsContact O-CG 3.32Å; E1623-L1627 WeakPolarHBondContact O-CG 3.39Å; E1623-L1627 PolarHBondContact O-N 2.85Å
1624N83.5Confident84.4Confident87 Ų8796.6 Ų96.647%0.46547%0.465SS..Hα-helixtrans-61.8-42.2168.3-87.8-66.9000112.4L1620 K1621 R1626 L1627 H1628L1620-N1624 WeakPolarHBondContact O-CB 3.4Å; L1620-N1624 PolarHBondContact O-N 3.02Å; L1620-N1624 PolarHBondContact O-ND2 2.7Å; K1621-N1624 PolarHBondContact O-N 3.04Å; N1624-R1626 VanDerWaalsContact C-N 3.26Å; N1624-R1626 PolarHBondContact O-N 3.45Å; N1624-L1627 PolarHBondContact O-N 3.4Å; N1624-H1628 WeakPolarHBondContact O-CB 3.37Å; N1624-H1628 PolarHBondContact O-CD2 3.17Å; N1624-H1628 PolarHBondContact O-N 2.75Å
1625E86Confident84.9Confident84 Ų8497 Ų9739%0.39346%0.462SS..Hα-helixtrans-62.6-33.6174-76.2-178.7-15300112.3K1621 K1629K1621-E1625 VanDerWaalsContact CE-OE1 3.22Å; K1621-E1625 WeakPolarHBondContact CE-OE1 3.41Å; K1621-E1625 IonicContact NZ-OE1 3.94Å; K1621-E1625 WeakPolarHBondContact O-CG 3.37Å; K1621-E1625 PolarHBondContact O-N 2.75Å; E1625-K1629 WeakPolarHBondContact O-CB 3.47Å; E1625-K1629 VanDerWaalsContact O-CD 3.29Å; E1625-K1629 WeakPolarHBondContact O-CD 3.19Å; E1625-K1629 WeakPolarHBondContact O-CG 3.49Å; E1625-K1629 PolarHBondContact O-N 2.95Å; E1625-K1629 VanDerWaalsContact O-N 3.13Å
1626R87.8Confident85.7Confident156 Ų15697 Ų9759%0.58947%0.467SS*.Hα-helixtrans-70.8-46.1172.6171.5-179.9163.9153.9-6.3111.6T1622 E1623 N1624 K1629 Q1630T1622-R1626 WeakPolarHBondContact O-CB 3.2Å; T1622-R1626 PolarHBondContact O-N 3.37Å; E1623-R1626 CarbonylContact O-C 3.54Å; E1623-R1626 WeakPolarHBondContact O-CB 3.5Å; E1623-R1626 PolarHBondContact O-N 3.34Å; N1624-R1626 VanDerWaalsContact C-N 3.26Å; N1624-R1626 PolarHBondContact O-N 3.45Å; R1626-K1629 CarbonylContact O-C 3.6Å; R1626-K1629 WeakPolarHBondContact O-CB 2.93Å; R1626-K1629 PolarHBondContact O-N 2.68Å; R1626-K1629 VanDerWaalsContact O-N 3.15Å; R1626-Q1630 HydrophobicContact CG-CG 4.47Å; R1626-Q1630 WeakPolarHBondContact O-CG 3.1Å; R1626-Q1630 PolarHBondContact O-N 2.69Å
1627L87.1Confident86.2Confident84 Ų84102.3 Ų102.344%0.4449%0.485SS..Hα-helixtrans-64.5-42.8179.3-73170.8000110.8E1623 N1624 K1629 Q1630 V1631E1623-L1627 HydrophobicContact CG-CD1 4.18Å; E1623-L1627 HydrophobicContact CG-CG 4.43Å; E1623-L1627 WeakPolarHBondContact O-CB 3.4Å; E1623-L1627 VanDerWaalsContact O-CG 3.32Å; E1623-L1627 WeakPolarHBondContact O-CG 3.39Å; E1623-L1627 PolarHBondContact O-N 2.85Å; N1624-L1627 PolarHBondContact O-N 3.4Å; L1627-K1629 VanDerWaalsContact C-N 3.34Å; L1627-K1629 PolarHBondContact O-N 3.04Å; L1627-Q1630 PolarHBondContact O-N 2.72Å; L1627-Q1630 VanDerWaalsContact O-N 3.16Å; L1627-V1631 WeakPolarHBondContact O-CB 3.39Å; L1627-V1631 VanDerWaalsContact O-CG2 3.32Å; L1627-V1631 WeakPolarHBondContact O-CG2 3.42Å; L1627-V1631 PolarHBondContact O-N 3.3Å
1628H86.7Confident86.3Confident118 Ų118101.7 Ų101.755%0.54649%0.491SS..Hα-helixtrans-58.5-42169.9-87.2-70.9000112.2N1624 N1632N1624-H1628 WeakPolarHBondContact O-CB 3.37Å; N1624-H1628 PolarHBondContact O-CD2 3.17Å; N1624-H1628 PolarHBondContact O-N 2.75Å; H1628-N1632 WeakPolarHBondContact O-CB 3.2Å; H1628-N1632 PolarHBondContact O-N 3.32Å; H1628-N1632 PolarHBondContact O-OD1 2.68Å
1629K88.7Confident86.7Confident135 Ų135103 Ų10359%0.58750%0.496SS*.Hα-helixtrans-63-41.2173.9-75.7162.5-172.9154.60112.1E1625 R1626 L1627 E1633E1625-K1629 WeakPolarHBondContact O-CB 3.47Å; E1625-K1629 VanDerWaalsContact O-CD 3.29Å; E1625-K1629 WeakPolarHBondContact O-CD 3.19Å; E1625-K1629 WeakPolarHBondContact O-CG 3.49Å; E1625-K1629 PolarHBondContact O-N 2.95Å; E1625-K1629 VanDerWaalsContact O-N 3.13Å; R1626-K1629 CarbonylContact O-C 3.6Å; R1626-K1629 WeakPolarHBondContact O-CB 2.93Å; R1626-K1629 PolarHBondContact O-N 2.68Å; R1626-K1629 VanDerWaalsContact O-N 3.15Å; L1627-K1629 VanDerWaalsContact C-N 3.34Å; L1627-K1629 PolarHBondContact O-N 3.04Å; K1629-E1633 WeakPolarHBondContact O-CB 3.28Å; K1629-E1633 PolarHBondContact O-N 3.05Å
1630Q88.7Confident86.8Confident92 Ų92103 Ų10343%0.4349%0.492SS..Hα-helixtrans-70.4-39.8178.1-68.6-172.2-8100112.6R1626 L1627 E1633 L1634R1626-Q1630 HydrophobicContact CG-CG 4.47Å; R1626-Q1630 WeakPolarHBondContact O-CG 3.1Å; R1626-Q1630 PolarHBondContact O-N 2.69Å; L1627-Q1630 PolarHBondContact O-N 2.72Å; L1627-Q1630 VanDerWaalsContact O-N 3.16Å; Q1630-E1633 PolarHBondContact O-N 3.07Å; Q1630-L1634 WeakPolarHBondContact O-CB 3.46Å; Q1630-L1634 PolarHBondContact O-N 2.73Å
1631V88.9Confident86.9Confident78 Ų78102.4 Ų102.447%0.47350%0.497SS..Hα-helixtrans-64.8-46.7173.8168.20000110.2L1627 E1633 L1634 I1635L1627-V1631 WeakPolarHBondContact O-CB 3.39Å; L1627-V1631 VanDerWaalsContact O-CG2 3.32Å; L1627-V1631 WeakPolarHBondContact O-CG2 3.42Å; L1627-V1631 PolarHBondContact O-N 3.3Å; V1631-E1633 VanDerWaalsContact C-N 3.35Å; V1631-E1633 PolarHBondContact O-N 3.29Å; V1631-L1634 CarbonylContact O-C 3.55Å; V1631-L1634 PolarHBondContact O-N 2.73Å; V1631-L1634 VanDerWaalsContact O-N 3.11Å; V1631-I1635 HydrophobicContact CG1-CD1 3.88Å; V1631-I1635 HydrophobicContact CG1-CG1 4.49Å; V1631-I1635 WeakPolarHBondContact O-CG1 3.4Å; V1631-I1635 PolarHBondContact O-N 3.39Å
1632N89Confident86.6Confident90 Ų9099 Ų9948%0.48149%0.493SS..Hα-helixtrans-62.3-41.4176-69.82.9000111.1H1628 L1634 I1635 D1636H1628-N1632 WeakPolarHBondContact O-CB 3.2Å; H1628-N1632 PolarHBondContact O-N 3.32Å; H1628-N1632 PolarHBondContact O-OD1 2.68Å; N1632-L1634 VanDerWaalsContact C-N 3.28Å; N1632-L1634 PolarHBondContact O-N 3.37Å; N1632-I1635 PolarHBondContact O-N 3.36Å; N1632-D1636 WeakPolarHBondContact O-CB 2.9Å; N1632-D1636 PolarHBondContact O-N 2.85Å
1633E90Very high86.4Confident98 Ų98100.6 Ų100.646%0.45850%0.503SS..Hα-helixtrans-64.2-32.5174.5-157-163.7155.600112.4K1629 Q1630 V1631 D1636 R1637K1629-E1633 WeakPolarHBondContact O-CB 3.28Å; K1629-E1633 PolarHBondContact O-N 3.05Å; Q1630-E1633 PolarHBondContact O-N 3.07Å; V1631-E1633 VanDerWaalsContact C-N 3.35Å; V1631-E1633 PolarHBondContact O-N 3.29Å; E1633-D1636 WeakPolarHBondContact O-CB 2.97Å; E1633-R1637 WeakPolarHBondContact O-CB 3.37Å; E1633-R1637 WeakPolarHBondContact O-CD 3.24Å; E1633-R1637 WeakPolarHBondContact O-CG 3.42Å; E1633-R1637 PolarHBondContact O-N 3.2Å; E1633-R1637 IonicContact OE1-CZ 3.58Å; E1633-R1637 VanDerWaalsContact OE1-CZ 3.28Å; E1633-R1637 IonicContact OE1-NE 2.69Å; E1633-R1637 PolarHBondContact OE1-NE 3.3Å; E1633-R1637 VanDerWaalsContact OE1-NE 3.14Å; E1633-R1637 IonicContact OE1-NH2 3.81Å; E1633-R1637 PolarHBondContact OE1-NH2 3.17Å; E1633-R1637 IonicContact OE2-NH2 3.33Å
1634L87.2Confident85.7Confident106 Ų106103.3 Ų103.356%0.55552%0.516SS*.Hα-helixtrans-74.3-38.5176.6-153157.9000111.3Q1630 V1631 N1632 R1637 L1638Q1630-L1634 WeakPolarHBondContact O-CB 3.46Å; Q1630-L1634 PolarHBondContact O-N 2.73Å; V1631-L1634 CarbonylContact O-C 3.55Å; V1631-L1634 PolarHBondContact O-N 2.73Å; V1631-L1634 VanDerWaalsContact O-N 3.11Å; N1632-L1634 VanDerWaalsContact C-N 3.28Å; N1632-L1634 PolarHBondContact O-N 3.37Å; L1634-R1637 PolarHBondContact O-N 3Å; L1634-L1638 HydrophobicContact CD2-CD1 3.67Å; L1634-L1638 HydrophobicContact CD2-CG 4.1Å; L1634-L1638 WeakPolarHBondContact O-CB 3.21Å; L1634-L1638 WeakPolarHBondContact O-CG 3.4Å; L1634-L1638 PolarHBondContact O-N 3.31Å
1635I89.4Confident84.3Confident77 Ų77109.2 Ų109.240%0.39553%0.531SS..Hα-helixtrans-60.1-50.3168.4-67.9165.7000109.7V1631 N1632 R1637 L1638 E1639V1631-I1635 HydrophobicContact CG1-CD1 3.88Å; V1631-I1635 HydrophobicContact CG1-CG1 4.49Å; V1631-I1635 WeakPolarHBondContact O-CG1 3.4Å; V1631-I1635 PolarHBondContact O-N 3.39Å; N1632-I1635 PolarHBondContact O-N 3.36Å; I1635-R1637 VanDerWaalsContact C-N 3.26Å; I1635-R1637 PolarHBondContact O-N 2.68Å; I1635-L1638 CarbonylContact O-C 3.59Å; I1635-L1638 WeakPolarHBondContact O-CA 3.46Å; I1635-L1638 WeakPolarHBondContact O-CB 3.05Å; I1635-L1638 PolarHBondContact O-N 2.73Å; I1635-E1639 HydrophobicContact CG2-CG 4.29Å; I1635-E1639 PolarHBondContact O-N 3.38Å
1636D89Confident82.5Confident73 Ų73109.4 Ų109.439%0.3954%0.542SS..Hα-helixtrans-51.5-44.4175.1-122.554.4000111.9N1632 E1633 K1640N1632-D1636 WeakPolarHBondContact O-CB 2.9Å; N1632-D1636 PolarHBondContact O-N 2.85Å; E1633-D1636 WeakPolarHBondContact O-CB 2.97Å; D1636-K1640 VanDerWaalsContact O-CB 3.3Å; D1636-K1640 WeakPolarHBondContact O-CB 2.99Å; D1636-K1640 VanDerWaalsContact O-CD 3.27Å; D1636-K1640 WeakPolarHBondContact O-CD 3.27Å; D1636-K1640 WeakPolarHBondContact O-CG 2.93Å; D1636-K1640 PolarHBondContact O-N 2.69Å; D1636-K1640 IonicContact OD2-NZ 3.73Å; D1636-K1640 PolarHBondContact OD2-NZ 3.26Å
1637R87.8Confident80.5Confident156 Ų156108.2 Ų108.259%0.58955%0.554SS**Hα-helixtrans-69-37.2177-72.2163.3-178.4-147.86.5112E1633 L1634 I1635 A1641E1633-R1637 WeakPolarHBondContact O-CB 3.37Å; E1633-R1637 WeakPolarHBondContact O-CD 3.24Å; E1633-R1637 WeakPolarHBondContact O-CG 3.42Å; E1633-R1637 PolarHBondContact O-N 3.2Å; E1633-R1637 IonicContact OE1-CZ 3.58Å; E1633-R1637 VanDerWaalsContact OE1-CZ 3.28Å; E1633-R1637 IonicContact OE1-NE 2.69Å; E1633-R1637 PolarHBondContact OE1-NE 3.3Å; E1633-R1637 VanDerWaalsContact OE1-NE 3.14Å; E1633-R1637 IonicContact OE1-NH2 3.81Å; E1633-R1637 PolarHBondContact OE1-NH2 3.17Å; E1633-R1637 IonicContact OE2-NH2 3.33Å; L1634-R1637 PolarHBondContact O-N 3Å; I1635-R1637 VanDerWaalsContact C-N 3.26Å; I1635-R1637 PolarHBondContact O-N 2.68Å; R1637-A1641 VanDerWaalsContact O-CB 3.28Å; R1637-A1641 WeakPolarHBondContact O-CB 3.38Å; R1637-A1641 PolarHBondContact O-N 3.37Å
1638L84.6Confident78.8Confident111 Ų111109.8 Ų109.858%0.58157%0.567SS**Hα-helixtrans-70.2-39.9175.3-74.6170.1000112.1L1634 I1635 A1641 A1642L1634-L1638 HydrophobicContact CD2-CD1 3.67Å; L1634-L1638 HydrophobicContact CD2-CG 4.1Å; L1634-L1638 WeakPolarHBondContact O-CB 3.21Å; L1634-L1638 WeakPolarHBondContact O-CG 3.4Å; L1634-L1638 PolarHBondContact O-N 3.31Å; I1635-L1638 CarbonylContact O-C 3.59Å; I1635-L1638 WeakPolarHBondContact O-CA 3.46Å; I1635-L1638 WeakPolarHBondContact O-CB 3.05Å; I1635-L1638 PolarHBondContact O-N 2.73Å; L1638-A1641 CarbonylContact O-C 3.58Å; L1638-A1641 PolarHBondContact O-N 2.82Å; L1638-A1642 WeakPolarHBondContact O-CB 3.32Å; L1638-A1642 PolarHBondContact O-N 3.35Å
1639E85.9Confident76.6Confident119 Ų119108.6 Ų108.656%0.55657%0.572SS**Hα-helixtrans-67.8-40174.6-70.7-169.2172.500111.7I1635 A1641 A1642 T1643I1635-E1639 HydrophobicContact CG2-CG 4.29Å; I1635-E1639 PolarHBondContact O-N 3.38Å; E1639-A1641 VanDerWaalsContact C-N 3.34Å; E1639-A1642 PolarHBondContact O-N 2.61Å; E1639-T1643 WeakPolarHBondContact O-CB 2.98Å; E1639-T1643 WeakPolarHBondContact O-CG2 3.18Å; E1639-T1643 PolarHBondContact O-N 3.2Å; E1639-T1643 PolarHBondContact O-OG1 2.97Å
1640K85.6Confident74.5Confident113 Ų113110 Ų11049%0.49158%0.584SS.*Hα-helixtrans-63-39.3170.5-73.4161.5-173.8161.80111.6D1636 T1643 H1644D1636-K1640 VanDerWaalsContact O-CB 3.3Å; D1636-K1640 WeakPolarHBondContact O-CB 2.99Å; D1636-K1640 VanDerWaalsContact O-CD 3.27Å; D1636-K1640 WeakPolarHBondContact O-CD 3.27Å; D1636-K1640 WeakPolarHBondContact O-CG 2.93Å; D1636-K1640 PolarHBondContact O-N 2.69Å; D1636-K1640 IonicContact OD2-NZ 3.73Å; D1636-K1640 PolarHBondContact OD2-NZ 3.26Å; K1640-T1643 WeakPolarHBondContact CA-OG1 3.43Å; K1640-T1643 PolarHBondContact O-OG1 3.47Å; K1640-H1644 WeakPolarHBondContact O-CB 3.26Å; K1640-H1644 PolarHBondContact O-CD2 3.41Å; K1640-H1644 PolarHBondContact O-N 3.33Å; K1640-H1644 VanDerWaalsContact O-N 3.11Å
1641A82.9Confident72.2Confident55 Ų55110.8 Ų110.846%0.45560%0.598SS.*Hα-helixtrans-69.1-31.7174.200000113.4R1637 L1638 E1639R1637-A1641 VanDerWaalsContact O-CB 3.28Å; R1637-A1641 WeakPolarHBondContact O-CB 3.38Å; R1637-A1641 PolarHBondContact O-N 3.37Å; L1638-A1641 CarbonylContact O-C 3.58Å; L1638-A1641 PolarHBondContact O-N 2.82Å; E1639-A1641 VanDerWaalsContact C-N 3.34Å
1642A79.6Confident69.8Low62 Ų62110 Ų11051%0.51261%0.606SS.*Hα-helixtrans-73.8-47.7175.600000111.7L1638 E1639 H1644 R1645L1638-A1642 WeakPolarHBondContact O-CB 3.32Å; L1638-A1642 PolarHBondContact O-N 3.35Å; E1639-A1642 PolarHBondContact O-N 2.61Å; A1642-H1644 VanDerWaalsContact C-N 3.34Å; A1642-H1644 PolarHBondContact O-N 3.28Å; A1642-R1645 PolarHBondContact O-N 2.81Å; A1642-R1645 VanDerWaalsContact O-N 3.08Å
1643T79.5Confident67.6Low109 Ų109116.5 Ų116.567%0.66962%0.624SS**Hα-helixtrans-67.4-29.9-179.849.30000113.3E1639 K1640 R1645E1639-T1643 WeakPolarHBondContact O-CB 2.98Å; E1639-T1643 WeakPolarHBondContact O-CG2 3.18Å; E1639-T1643 PolarHBondContact O-N 3.2Å; E1639-T1643 PolarHBondContact O-OG1 2.97Å; K1640-T1643 WeakPolarHBondContact CA-OG1 3.43Å; K1640-T1643 PolarHBondContact O-OG1 3.47Å; T1643-R1645 VanDerWaalsContact C-N 3.28Å; T1643-R1645 PolarHBondContact O-N 3.32Å
1644H70.9Confident65.2Low167 Ų167122 Ų12277%0.77364%0.64SS**THydrogen-bonded Turntrans-75.9-6.9171.5-77.5-54.9000114.7K1640 A1642 S1646K1640-H1644 WeakPolarHBondContact O-CB 3.26Å; K1640-H1644 PolarHBondContact O-CD2 3.41Å; K1640-H1644 PolarHBondContact O-N 3.33Å; K1640-H1644 VanDerWaalsContact O-N 3.11Å; A1642-H1644 VanDerWaalsContact C-N 3.34Å; A1642-H1644 PolarHBondContact O-N 3.28Å; H1644-S1646 PolarHBondContact O-N 2.74Å
1645R55.6Low63.2Low211 Ų211129 Ų12980%0.79666%0.659SS**SBendtrans-87.190.5172.2-76.8-177.4173-158.7-1.2111.2A1642 T1643A1642-R1645 PolarHBondContact O-N 2.81Å; A1642-R1645 VanDerWaalsContact O-N 3.08Å; T1643-R1645 VanDerWaalsContact C-N 3.28Å; T1643-R1645 PolarHBondContact O-N 3.32Å
1646S47.4Very low61Low88 Ų88136.7 Ų136.762%0.61568%0.683SS**  trans-51136171.561.50000111.7H1644 T1648H1644-S1646 PolarHBondContact O-N 2.74Å; S1646-T1648 VanDerWaalsContact C-N 3.33Å; S1646-T1648 PolarHBondContact O-N 3.11Å
1647P46.1Very low58.8Low131 Ų131141.2 Ų141.285%0.85171%0.706SS**  trans-76.673.9-164.231-37.8000113.8C1649P1647-C1649 PolarHBondContact O-N 3.22Å; P1647-C1649 VanDerWaalsContact O-N 3.13Å
1648T51Low56.5Low116 Ų116139.3 Ų139.371%0.71272%0.716SS**  trans-8385.4170.4-510000109.1S1646 I1650S1646-T1648 VanDerWaalsContact C-N 3.33Å; S1646-T1648 PolarHBondContact O-N 3.11Å; T1648-I1650 PolarHBondContact O-N 3.17Å; T1648-I1650 VanDerWaalsContact O-N 3.07Å
1649C39.9Very low54.3Low94 Ų94138.8 Ų138.864%0.63573%0.728SS**  trans-57.8108.1-178.2165.50000112.6P1647 C1651P1647-C1649 PolarHBondContact O-N 3.22Å; P1647-C1649 VanDerWaalsContact O-N 3.13Å; C1649-C1651 WeakPolarHBondContact CB-SG 3.02Å; C1649-C1651 PolarHBondContact O-N 3.22Å; C1649-C1651 WeakPolarHBondContact SG-CB 3.42Å; C1649-C1651 PolarHBondContact SG-N 2.95Å; C1649-C1651 VanDerWaalsContact SG-N 3.43Å; C1649-C1651 CovalentContact SG-SG 2.04Å; C1649-C1651 PolarHBondContact SG-SG 3.03Å
1650I45.2Very low52.2Low165 Ų165144.5 Ų144.585%0.84675%0.745SS**  trans-9852162.7-48.9-175.2000108.4T1648 G1652T1648-I1650 PolarHBondContact O-N 3.17Å; T1648-I1650 VanDerWaalsContact O-N 3.07Å; I1650-G1652 PolarHBondContact O-N 3.41Å
1651C41.7Very low49.9Very low107 Ų107144 Ų14472%0.72376%0.755SS**  trans-90.892.5-176.2-27.50000110.4C1649C1649-C1651 WeakPolarHBondContact CB-SG 3.02Å; C1649-C1651 PolarHBondContact O-N 3.22Å; C1649-C1651 WeakPolarHBondContact SG-CB 3.42Å; C1649-C1651 PolarHBondContact SG-N 2.95Å; C1649-C1651 VanDerWaalsContact SG-N 3.43Å; C1649-C1651 CovalentContact SG-SG 2.04Å; C1649-C1651 PolarHBondContact SG-SG 3.03Å
1652G37.8Very low47.9Very low62 Ų62149.1 Ų149.164%0.63977%0.774SS**  trans142155.5157.700000117.6I1650I1650-G1652 PolarHBondContact O-N 3.41Å
1653R42.4Very low46.1Very low227 Ų227150.8 Ų150.886%0.85778%0.782SS**  trans82.3125.8-173.4-54175.4-178.7-163.50.8113
1654R40.2Very low44.3Very low214 Ų214150.5 Ų150.581%0.80879%0.79SS**  cis-155.8113.30.7-112.9167.7-174.8-163.40.4111.9
1655R44.7Very low42.9Very low251 Ų251147.8 Ų147.895%0.94779%0.79SS**  trans-110.598.1143.8-80.2-168.7-177.8-1723.1108.3
1656R43.8Very low42.4Very low240 Ų240141.6 Ų141.691%0.90678%0.784SS**  trans-149.3119.1156.3-78.2-157179.4-179.70.6109.1
1657I42.9Very low42.3Very low168 Ų168147.3 Ų147.386%0.86279%0.792SS**  trans-83.7146.8171.9-70.6169.1000108.6
1658S39.8Very low42.3Very low115 Ų115148.4 Ų148.480%0.80479%0.786SS**  trans45.1100.2162.2-161.40000119.5
1659A38.4Very low41.9Very low101 Ų101147.2 Ų147.284%0.83578%0.782SS**  trans-155.3152.4138.900000109.9
1660R40Very low42Very low239 Ų239147.4 Ų147.490%0.90278%0.784SS**  trans-81.3162-164.6-72173.3165.1173.4-5.8115.6
1661S38.6Very low41.9Very low101 Ų101144.4 Ų144.471%0.70678%0.778SS**  trans82.7124141.160.40000122.5
1662L40.7Very low42Very low164 Ų164145.8 Ų145.886%0.85977%0.774SS**  trans66.2147.3144.6-58.5165.5000118.9
1663S41.1Very low42.2Very low97 Ų97152.8 Ų152.868%0.67878%0.781SS**  cis-174150.7-20.550.80000110.7
1664A41.5Very low42.2Very low102 Ų102146.2 Ų146.284%0.84378%0.776SS**  trans65.1156.3162.900000117.8
1665S42.3Very low42.2Very low110 Ų110141.1 Ų141.177%0.76977%0.772SS**  cis-166.6162.6-19.8-179.60000110.4
1666A45.2Very low42.2Very low81 Ų81136.3 Ų136.367%0.66976%0.764SS**  trans72.3149.9154.300000121
1667R46.3Very low42Very low208 Ų208130.3 Ų130.379%0.78576%0.759SS**  cis-166.9144.7-14.2-108.5174.8-175.1-162.31.2112.4
1668H45.7Very low42.1Very low154 Ų154127.7 Ų127.771%0.71375%0.753SS**  trans60155.5142.3-60.1-33.5000123
1669S42.6Very low42.2Very low92 Ų92130 Ų13064%0.64375%0.753SS**  cis-174.4170.6-25.258.70000113.4
1670S42.2Very low42.4Very low97 Ų97129.3 Ų129.368%0.67874%0.742SS**  trans66.4128.6148.344.50000120
1671S42.4Very low42.5Very low102 Ų102127 Ų12771%0.71374%0.739SS**  81.6140.954.3-84.70000114
1672E43.3Very low42.5Very low136 Ų136126.8 Ų126.864%0.63674%0.737SS**  cis-168.1168.3-12-127176.8120.400111.7
1673R42.5Very low42.5Very low209 Ų209126.8 Ų126.879%0.78973%0.732SS**  trans52.7106150.8-68.5-176.8-157.2-129-6.6122.9
1674A42Very low42.6Very low90 Ų90132 Ų13274%0.74474%0.738SS**  83.6145.2102.300000124
1675S40.9Very low42.6Very low106 Ų106130.9 Ų130.974%0.74173%0.729SS**  trans110.9154.4137.278.90000120
1676I43.7Very low42.6Very low150 Ų150133.5 Ų133.577%0.76973%0.729SS**  trans83.990.7163.2-55.2171.7000118.2
1677S40.1Very low42.3Very low115 Ų115139.4 Ų139.480%0.80473%0.734SS**  66.7163.6123.1-76.30000122.8
1678P45.7Very low42.1Very low112 Ų112134.3 Ų134.373%0.72773%0.726SS**  trans-115.6-179.4-155.743.5-34.1000114.1
1679M40.3Very low41.8Very low165 Ų165134.7 Ų134.781%0.81373%0.728SS**  -179.9149.9126.7-88.7-118.675.400113.4
1680S43.2Very low41.8Very low86 Ų86136.8 Ų136.860%0.60173%0.732SS**  trans50.5121.3143.867.40000123
1681K42.1Very low41.8Very low191 Ų191138.9 Ų138.983%0.8374%0.735SS**  71.6110.6124.4-69.6-173.4175.1-174.40120.8
1682S39.5Very low41.7Very low95 Ų95140.9 Ų140.966%0.66474%0.736SS**  90.5132.2111.371.10000121.8
1683E40.7Very low41.6Very low164 Ų164141.2 Ų141.277%0.76674%0.742SS**  trans95.7150.6131.7-102.3165.4-125.500121
1684Y41.8Very low41.6Very low206 Ų206137 Ų13781%0.80874%0.739SS**  trans5873172.9-73.5-80.1000120.4
1685A42.4Very low41.6Very low79 Ų79140.1 Ų140.165%0.65374%0.739SS**  36.4149.7104.700000122
1686H41.2Very low41.6Very low166 Ų166142.6 Ų142.677%0.76974%0.738SS**  trans73.1145.1168.9-68.1-34.8000116.3
1687R39Very low41.5Very low204 Ų204142 Ų14277%0.7774%0.736SS**  cis-154.3140.64.7-126.6167.8-161.2-165.13.5110.6
1688V43.8Very low41.6Very low102 Ų102144.3 Ų144.362%0.61873%0.73SS**  trans48.7102.6147.2176.60000116.7
1689H39.3Very low41.2Very low161 Ų161147.2 Ų147.275%0.74573%0.731SS**  -138.20101.6-124.4-70.7000112.7K1271 A1272 S1273 T1274K1271-H1689 PolarHBondContact O-NE2 3.06Å; A1272-H1689 VanDerWaalsContact CA-NE2 3.27Å; A1272-H1689 WeakPolarHBondContact CA-NE2 3.34Å; A1272-H1689 PolarHBondContact N-NE2 3.35Å; S1273-H1689 PolarHBondContact N-CD2 2.88Å; S1273-H1689 PolarHBondContact N-ND1 3.37Å; S1273-H1689 VanDerWaalsContact N-ND1 3.13Å; S1273-H1689 PolarHBondContact O-CD2 3.47Å; T1274-H1689 VanDerWaalsContact N-CG 3.27Å

Retrieved 1,689 of 1,689 residues in 1225.3 ms (Link to these results)