A0A087YJW3_POEFO Loading...

MSL complex subunit 1b

AlphaFold DB , UniProt , Accession A0A087YJW3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 527 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.5Very low35Very low246 Ų246170.5 Ų170.5100%1.21287%0.866SS**  01320-87.3176149.500108.4
2T33.1Very low34.6Very low140 Ų140162.8 Ų162.886%0.85986%0.861SS**PPolyproline II helixtrans-88.6133.5-167.9-38.90000111.5
3L35.2Very low34.1Very low173 Ų173166.3 Ų166.391%0.90687%0.865SS**PPolyproline II helixtrans-79.2120.4171.5-68.1173.8000109.8
4R35.8Very low34.3Very low231 Ų231169.4 Ų169.487%0.87287%0.868SS**PPolyproline II helixtrans-86.9119.2173.2-90.1-178.3165.6177.5-5.1110
5S31.7Very low34.1Very low125 Ų125174.1 Ų174.187%0.87487%0.871SS**PPolyproline II helixtrans-81.3141.3159.6-156.80000109.5
6K39Very low33.7Very low174 Ų174176.4 Ų176.476%0.75787%0.874SS**  trans-117.4124.9174.5-80.9-167.8175.7-173.90109.5
7Q30.7Very low33.5Very low191 Ų191170.9 Ų170.989%0.89386%0.863SS**  trans-118.9136.6176.1-150.5167.88.900106.9
8F32Very low33.4Very low183 Ų183170.9 Ų170.980%0.80387%0.866SS**  trans-125.5151.3175-90.9-81000109.9
9P43.5Very low33.3Very low116 Ų116168.3 Ų168.375%0.75386%0.859SS**PPolyproline II helixtrans-97.7159.2-159.837.5-35.2000115.2
10Q30.1Very low33.2Very low180 Ų180169.8 Ų169.884%0.84186%0.862SS**PPolyproline II helixtrans-73.8140.3167.1-72.2-83.27.500111.5
11P36.7Very low33.1Very low117 Ų117168.2 Ų168.276%0.7686%0.856SS**PPolyproline II helixtrans-87.6143.8166.534.1-31000111.9
12G30.7Very low32.8Very low78 Ų78167 Ų16780%0.80484%0.844SS**PPolyproline II helixtrans-93.8165.3-17200000116.4
13F28.2Very low32.6Very low208 Ų208164 Ų16491%0.91284%0.841SS**PPolyproline II helixtrans-59.4147.6174.1-92.3-110.6000114.1
14K36.2Very low32.6Very low210 Ų210162 Ų16291%0.91384%0.836SS**  trans-136.5138.6148.2-78.1-161.7174.2-174.80111.1
15R31.7Very low32.4Very low239 Ų239158.9 Ų158.990%0.90284%0.837SS**  trans-96.2142.5168-73.9179.4173.1172.8-3.4110
16K27.5Very low32.4Very low212 Ų212158 Ų15892%0.92283%0.831SS**  trans-139.3146.2147.2-91.5-72.1-173.2165.80106.8
17A29.9Very low32.2Very low83 Ų83156.8 Ų156.869%0.68684%0.837SS**  trans-116.8155.1176.600000108
18D31.2Very low32.4Very low171 Ų171150.6 Ų150.691%0.91483%0.825SS**  trans-153160.8150-84.3-44.2000108.3
19T32.1Very low32.9Very low120 Ų120147.9 Ų147.974%0.73683%0.825SS**  trans-119.1142.3-160.2-58.70000110.9
20E31.4Very low32.2Very low198 Ų198148.6 Ų148.693%0.92583%0.827SS**  trans-151.8151.5141.9-78-145.5148.600110.9
21D31.2Very low32.1Very low138 Ų138145.6 Ų145.674%0.73883%0.827SS**  trans-87.1161.2-174-79.1-58.1000113.8
22F32.2Very low32Very low219 Ų219146.8 Ų146.896%0.96183%0.825SS**  170142.7123.3-95.3-66000112.7
23G28.8Very low31.9Very low77 Ų77152.3 Ų152.379%0.79483%0.827SS**  trans102.992149.400000118
24V33.9Very low32.1Very low132 Ų132149.9 Ų149.980%0.882%0.823SS**  trans-85.2135.3169.6171.20000111
25N32.5Very low31.9Very low166 Ų166148.7 Ų148.789%0.88882%0.821SS**  trans-166.6153.9130.9-98.9-17.9000113.4
26S31.8Very low32.2Very low106 Ų106143.4 Ų143.474%0.74182%0.818SS**  trans-117139.5-159.1172.90000113.3
27V34.3Very low32.2Very low148 Ų148138.8 Ų138.890%0.89781%0.811SS**  trans-145.3141.2142.1-174.40000109
28G35.3Very low32.2Very low61 Ų61142.3 Ų142.363%0.62982%0.818SS**  trans-95.4-161.2-169.700000117.7
29P41.2Very low32.1Very low126 Ų126143.1 Ų143.182%0.81881%0.814SS**  trans-123.8161.4-139.241.8-31.4000116.3
30V29.5Very low32Very low131 Ų131142.1 Ų142.179%0.79482%0.818SS**  trans-142.8129157.6179.80000110.5I32V30-I32 HydrophobicContact CG1-CD1 4.09Å; V30-I32 HydrophobicContact CG1-CG1 3.88Å
31S27.9Very low31.9Very low118 Ų118140.4 Ų140.483%0.82581%0.813SS**  trans-135.6120.4167179.30000108.1
32I34Very low31.7Very low142 Ų142140.6 Ų140.673%0.72882%0.815SS**  trans-108.9132.8-178.7-65174.8000109V30V30-I32 HydrophobicContact CG1-CD1 4.09Å; V30-I32 HydrophobicContact CG1-CG1 3.88Å
33K29.7Very low31.7Very low194 Ų194135.5 Ų135.584%0.84380%0.801SS**  trans-90.6143.4176-58.8174.3178.7179.40109.4
34N31.2Very low31.7Very low156 Ų156139.5 Ų139.583%0.83480%0.799SS**  trans-117.9123.8166.2-70.4-12.1000109.6
35E31.9Very low31.5Very low186 Ų186140.5 Ų140.587%0.86980%0.8SS**  trans-108.6154.3160.9-79.3-169.5154.100109.2
36P37.8Very low31.4Very low128 Ų128139.5 Ų139.583%0.83180%0.8SS**  trans-87.4148.4175.635.5-32.9000111.5
37C28.6Very low31.3Very low114 Ų114142.5 Ų142.577%0.7780%0.802SS**  trans-149.7128.2167.8-140.40000111.1
38D29.3Very low30.8Very low158 Ų158147.2 Ų147.285%0.84580%0.803SS**  trans-73.7143.4171.2-67.8-58.8000111
39F29.1Very low30.4Very low187 Ų187147.4 Ų147.482%0.8281%0.805SS**  trans-142.3126.2161.6-91.5-80.4000111.5
40A29.7Very low29.7Very low100 Ų100150.8 Ų150.883%0.82681%0.81SS**  trans-101.3139.5164.900000109.3
41I30.3Very low29.7Very low161 Ų161152.2 Ų152.283%0.82681%0.812SS**  trans-138.1128.8168.8-62-177.4000108.5
42D26.5Very low30.4Very low143 Ų143151.8 Ų151.877%0.76581%0.806SS**  trans-102.4157.2166.4170.835.1000108.9
43V31.7Very low30.1Very low112 Ų112149.7 Ų149.768%0.67980%0.804SS**  trans164.8110.4146.8151.80000114
44Q29.9Very low30.1Very low161 Ų161151.6 Ų151.675%0.75281%0.806SS**  trans72.7111.6136-62175.229.600125.3
45N28.6Very low30.1Very low153 Ų153148.8 Ų148.882%0.81880%0.799SS**  38.2124.6117.2-78.7-22.2000123.7
46V30.6Very low30.5Very low145 Ų145149.7 Ų149.788%0.87980%0.8SS**  trans-147.6113.6136.6179.70000113.3
47Q29.9Very low30.3Very low169 Ų169150.8 Ų150.879%0.7980%0.798SS**  trans32.8142.1139.6-138.2712.500125.8
48R25.2Very low30.7Very low246 Ų246153.4 Ų153.493%0.92880%0.804SS**  trans96.2130.5150.3-161.8-167.9-58-102.83.5116.6
49G26.6Very low30.8Very low65 Ų65151.8 Ų151.867%0.6780%0.795SS**  cis172156.1-8.700000113.3
50E25.1Very low31.1Very low197 Ų197150.5 Ų150.592%0.92179%0.792SS**  trans72.5160165.7-62.1-170.3157.200122
51I30.5Very low31.1Very low161 Ų161149.1 Ų149.183%0.82678%0.776SS**  trans-159.4156.3-161.16.2170.2000107.2
52P43.2Very low31.1Very low110 Ų110151.3 Ų151.371%0.71478%0.78SS**  -161.3177.664.243-20.9000119.8
53S26.4Very low31.3Very low98 Ų98152.4 Ų152.469%0.68578%0.783SS**  112.6144127.280.30000122.8
54R30.2Very low31.2Very low234 Ų234153.7 Ų153.788%0.88379%0.791SS**  trans79.3132164.4-58.4-170.4-178.4-159.1-1.1117.8
55S31.5Very low31.3Very low96 Ų96151.4 Ų151.467%0.67179%0.793SS**  cis156.2127.1-19.547.40000105.9
56K40.2Very low31.5Very low206 Ų206153.8 Ų153.890%0.89680%0.796SS**  trans-180112.9141.8-104.3167.3-176-176.80110.3
57D33.8Very low31.6Very low150 Ų150153.7 Ų153.780%0.80280%0.795SS**  trans-79.5150.9169.2-52.9-71.4000111.2
58L35.9Very low31.6Very low170 Ų170149.8 Ų149.889%0.8979%0.792SS**  trans-161.5102.5134.3-135.973.7000111.4
59D32.9Very low31.9Very low123 Ų123146.7 Ų146.766%0.65879%0.793SS**  trans2.5150.9134.3-79.914.4000119
60Q34.2Very low32Very low161 Ų161148.2 Ų148.275%0.75280%0.799SS**  cis-163.8148.623.2-132.6159.858.700114.2
61S30.5Very low32.2Very low71 Ų71143.5 Ų143.550%0.49779%0.794SS.*  trans45123138.8170.90000122.3
62F29.5Very low32.1Very low207 Ų207142.8 Ų142.891%0.90880%0.797SS**  -149.1156111.7-90.9-62.8000112.3
63M30.6Very low31.4Very low166 Ų166141.9 Ų141.982%0.81880%0.799SS**  trans-82143.7-159.1-65.8-86.297.900115.3
64T29.6Very low32.2Very low138 Ų138142.3 Ų142.385%0.84780%0.799SS**  trans-119.1127.2156.751.80000110
65S31.7Very low31.9Very low114 Ų114139.4 Ų139.480%0.79780%0.796SS**  trans-88.3129.2175.2-179.10000110.5
66K34.4Very low31.8Very low202 Ų202140.7 Ų140.788%0.87880%0.799SS**  trans-128.5130.6162.5-85-173175.5179.40109.2
67V30.8Very low31.3Very low143 Ų143137.7 Ų137.787%0.86780%0.798SS**  trans-85.9137169.6175.60000108.6
68A30.4Very low31Very low87 Ų87139.6 Ų139.672%0.71980%0.802SS**  trans-85.8161.5-17900000112.5
69L31.3Very low30.6Very low182 Ų182134.7 Ų134.795%0.95379%0.793SS**  trans-156.4152.4131.7-107.9167000110.2
70A29.9Very low30.4Very low96 Ų96137.2 Ų137.279%0.79381%0.807SS**  trans-95.7166.3-159.300000114.5
71A28.2Very low30.5Very low98 Ų98139.1 Ų139.181%0.8181%0.812SS**  trans-85.6163-179.400000113.7
72T29.6Very low31.4Very low147 Ų147141 Ų14190%0.90282%0.823SS**  trans-140.5134.815412.40000110.1
73A27.1Very low31.6Very low90 Ų90139.1 Ų139.174%0.74482%0.821SS**  trans-135178.8171.400000106.1
74P43.2Very low31.5Very low108 Ų108134.8 Ų134.870%0.70182%0.82SS**  cis-118.3-149.9734.9-11.8000110.6
75E25Very low31.7Very low173 Ų173135.5 Ų135.581%0.80882%0.816SS**  cis-155-165.57.9-150.8158.789.200111.8
76T30.2Very low31.7Very low122 Ų122136.9 Ų136.975%0.74882%0.82SS**  trans-127.9150.4-173.544.70000112.7
77V28.2Very low31.5Very low144 Ų144132.4 Ų132.487%0.87382%0.815SS**  trans-141.6145.5158.8-1720000111.4
78Q27.8Very low32.7Very low189 Ų189130.7 Ų130.788%0.88381%0.806SS**  trans-64173.3171.6-67.6148.7-71.700112.5
79G27.1Very low32.6Very low68 Ų68132.7 Ų132.770%0.70181%0.809SS**  cis167-175.8200000111.1
80D28.7Very low33.1Very low176 Ų176135.1 Ų135.194%0.94181%0.806SS**  trans79.1154.8166.7-60.9-21000122.5
81K37.8Very low34.1Very low201 Ų201136.6 Ų136.687%0.87481%0.807SS**  trans-124.2166.8-162.1-92.6177.3-177.2174.50108.4
82P49.6Very low34.6Very low109 Ų109141.1 Ų141.171%0.70881%0.814SS**  -163.4177.157.745.1-22000121.5
83L33.6Very low34.8Very low168 Ų168138 Ų13888%0.8881%0.812SS**  trans69.7131.9152.3-73159.5000121.9
84G27.8Very low35.2Very low76 Ų76137.3 Ų137.378%0.78481%0.813SS**  trans168.1126.5167.800000111.8
85I33.4Very low35.1Very low152 Ų152142.1 Ų142.178%0.77983%0.826SS**  trans-115.9140.3-165.6-57.5165.1000110.9
86T32.4Very low35.4Very low143 Ų143137.7 Ų137.788%0.87783%0.826SS**  trans160.2166.113441.30000112.7
87S29.6Very low35.6Very low109 Ų109138.2 Ų138.276%0.76283%0.83SS**  trans-147.3-165.3-169.2-154.10000106.8
88P55.9Low36.4Very low107 Ų107136.9 Ų136.970%0.69582%0.824SS**  cis-127.3-159.4-40.217.77.2000112.4
89V27.8Very low36.8Very low128 Ų128134.3 Ų134.378%0.77682%0.821SS**  trans104.4122.8144-173.20000119.2
90R42.3Very low37Very low234 Ų234141.4 Ų141.488%0.88383%0.832SS**  trans-95.4159.2155.6-65.2177.4171.2-172.9-2.8109.5
91P51.6Low37.1Very low127 Ų127136.5 Ų136.583%0.82582%0.823SS**  -147.7176.9114.635-17.6000116.2
92M37.2Very low37Very low192 Ų192136.7 Ų136.795%0.94682%0.824SS**  trans-93.8165.6177.4-58.4-110.1-66.800112.2
93G34.4Very low37.1Very low83 Ų83136.7 Ų136.786%0.85682%0.824SS**  trans179.1149.5165.700000111.7
94G35.8Very low37Very low74 Ų74136.4 Ų136.476%0.76382%0.822SS**  trans-154.1-165.6-174.700000115.8
95E41.7Very low37Very low210 Ų210137.7 Ų137.798%0.98182%0.819SS**  trans85.6137.3-179.1-58-150.2151.700119.5
96G31.3Very low37.2Very low79 Ų79136.8 Ų136.881%0.81482%0.821SS**  trans149103.9172.200000114.7
97T33.9Very low37.1Very low134 Ų134136.8 Ų136.882%0.82282%0.815SS**  trans-126.8150.7169.6-20.20000108.9
98P45.4Very low37.3Very low115 Ų115137.2 Ų137.275%0.74781%0.809SS**  -153.3144.288.335.9-15.4000118.5
99V34.9Very low36.4Very low136 Ų136140.3 Ų140.382%0.82482%0.816SS**  trans53.3118.6134.2-175.40000121.9
100K30.8Very low36.6Very low217 Ų217140.7 Ų140.794%0.94381%0.814SS**  -164.3131.6124.8-152.5171-175.8177.30112.6
101G31.5Very low36.3Very low73 Ų73136.4 Ų136.475%0.75381%0.809SS**  trans143.2123.4166.500000116.8
102K36.1Very low36.1Very low205 Ų205135.1 Ų135.189%0.89180%0.8SS**  trans-165.1162.2172.1-91.3-172179.8-178.40107.4
103P51.4Low35.7Very low109 Ų109134.6 Ų134.671%0.70880%0.796SS**  cis-130.9-140.9-25.440-20.8000110.7
104L31.3Very low35.7Very low161 Ų161139.6 Ų139.684%0.84380%0.799SS**  trans85.7145.1175.9-51.3-179.4000115.5
105S28.8Very low35.5Very low103 Ų103140.6 Ų140.672%0.7280%0.8SS**  cis-157.5153.9-27.3-165.20000107.9
106V36.7Very low35.1Very low134 Ų134137 Ų13781%0.81279%0.792SS**  trans-103.6124.3172.6169.50000109.1
107D30.7Very low35.1Very low142 Ų142141 Ų14176%0.75980%0.795SS**  trans-158.5118.6153-85.7-50.1000105.6
108N34.3Very low35Very low119 Ų119141 Ų14164%0.63679%0.79SS**  76.911262.2-170.119.1000112.6
109M36.1Very low34.5Very low171 Ų171142.8 Ų142.884%0.84279%0.793SS**  trans-161.3117153-91.2-46-66.100111.2
110D33.1Very low35.5Very low136 Ų136141.4 Ų141.473%0.72779%0.787SS**  trans-84.3162.3166.4-84.9-62.5000112.8
111N35Very low35.5Very low144 Ų144140.1 Ų140.177%0.7778%0.781SS**  trans-58.8146.7168.4178.719.8000112.4Q113N111-Q113 PolarHBondContact OD1-N 3.44Å
112P46.7Very low35.5Very low100 Ų100143.1 Ų143.165%0.64978%0.78SS**  -147.8132120.734.7-17.7000117.9
113Q30Very low35.4Very low182 Ų182138.1 Ų138.185%0.8578%0.777SS**  69.7156.1128.1-65.6-170-40.400122.9N111N111-Q113 PolarHBondContact OD1-N 3.44Å
114M35.2Very low34.2Very low188 Ų188136.6 Ų136.693%0.92678%0.781SS**  trans-108.3150.3-178.1-49.3-143.1-65.300111.9
115A31.4Very low34.3Very low94 Ų94133.3 Ų133.378%0.77778%0.777SS**  trans-170.1116.714600000114.6
116V33.5Very low34.4Very low136 Ų136137.5 Ų137.582%0.82479%0.785SS**  trans28.4120.3132.9-170.90000120.3
117N29.3Very low34.3Very low162 Ų162137.6 Ų137.687%0.86678%0.782SS**  -156.9159.6126.1-151.4-2.9000112.8
118N33.3Very low34.3Very low135 Ų135134.7 Ų134.772%0.72277%0.772SS**  trans-119.6161.5-174.4-81-66.7000113.9
119N34.2Very low34.2Very low152 Ų152134.7 Ų134.781%0.81378%0.777SS**  trans88.4159.3145.3-103.97.1000120.5
120P55.3Low34.4Very low107 Ų107136.3 Ų136.370%0.69578%0.779SS**  -138.7-175.9-120.841.7-20.6000115.4
121K32.5Very low34.2Very low190 Ų190133.5 Ų133.583%0.82678%0.782SS**  trans146.1157.8159.5-93.1-167.7162.2-173.80110.9
122D31.4Very low34.1Very low135 Ų135133.3 Ų133.372%0.72279%0.786SS**  cis-170.7157.4-22.6-154.3-18.4000108.2
123A32.3Very low33.6Very low101 Ų101135 Ų13584%0.83579%0.794SS**  trans55.1150.3173.300000118.1
124G28Very low34.1Very low76 Ų76132.2 Ų132.278%0.78479%0.792SS**  cis-177.6-173.9-3.900000106.5
125A32.1Very low33.9Very low93 Ų93126.6 Ų126.677%0.76978%0.782SS**  cis-166.9134.8-14.900000108.4
126E32.1Very low33.9Very low190 Ų190128.3 Ų128.389%0.88878%0.782SS**  trans59.3159.6163-45.1-157.716600118.3
127D33.2Very low34.1Very low137 Ų137129.3 Ų129.373%0.73378%0.782SS**  cis-150.417015.8178.537.2000112.5
128S31.1Very low34.2Very low80 Ų80124.6 Ų124.656%0.55977%0.772SS**  trans10478.4143.2-104.20000123
129T33.4Very low34.3Very low119 Ų119125.4 Ų125.473%0.7378%0.782SS**  71.7145.6128.575.60000124.4
130K38.5Very low34.2Very low206 Ų206122.6 Ų122.690%0.89678%0.78SS**  trans78.188.1161.4-56.9-166-176.2178.80118.3
131G29Very low33.2Very low77 Ų77122.4 Ų122.479%0.79478%0.781SS**  trans-80.5178.7173.800000117.3
132V32.9Very low33.5Very low140 Ų140121.2 Ų121.285%0.84878%0.782SS**  trans-159.1143143.1145.50000105.6
133V36.7Very low33.7Very low136 Ų136123.1 Ų123.182%0.82479%0.787SS**  trans-121.2131.7-179.9172.30000107.7
134P40.3Very low34Very low122 Ų122126.3 Ų126.379%0.79279%0.789SS**  -142.3138.8105.528.8-9.9000115.3
135G30.5Very low34.2Very low70 Ų70128.2 Ų128.272%0.72279%0.79SS**  trans-84.2-177-16700000119.4
136V32Very low35.1Very low130 Ų130129.5 Ų129.579%0.78879%0.793SS**  trans-141.5104.3173.5179.80000105.1
137L38.2Very low35.4Very low158 Ų158128.1 Ų128.183%0.82779%0.787SS**  50.2110.9102.8-72151.1000112.1
138G31.9Very low36.1Very low63 Ų63125.8 Ų125.865%0.64980%0.795SS**  cis89.588.830.700000108.9A140G138-A140 PolarHBondContact O-N 3.41Å
139T34.4Very low36.8Very low151 Ų151130 Ų13093%0.92680%0.803SS**  trans-70.593.9179.848.50000110.1
140A32.1Very low37.2Very low93 Ų93136 Ų13677%0.76981%0.813SS**  trans-76.6144.1179.400000112.2G138G138-A140 PolarHBondContact O-N 3.41Å
141S34.1Very low37.6Very low104 Ų104135.9 Ų135.973%0.72781%0.807SS**  trans-52.2149.3172.8-51.70000113.1E143S141-E143 PolarHBondContact O-N 3.08Å; S141-E143 VanDerWaalsContact O-N 3.1Å
142I40.4Very low38.4Very low164 Ų164139.4 Ų139.484%0.84181%0.807SS**  trans-73.898162.9-67.2172.9000107.6
143E34.1Very low39.1Very low176 Ų176138.7 Ų138.782%0.82280%0.797SS**  trans-82.7122.7166-69.6-170.3162.100110S141 S145S141-E143 PolarHBondContact O-N 3.08Å; S141-E143 VanDerWaalsContact O-N 3.1Å; E143-S145 PolarHBondContact O-N 3.39Å; E143-S145 VanDerWaalsContact O-N 3.13Å
144L39.9Very low40Very low168 Ų168143.2 Ų143.288%0.8880%0.8SS**  trans-74.996.7171-74.4165.1000108.9S146L144-S146 PolarHBondContact O-N 3.23Å
145S30.8Very low40.9Very low116 Ų116146.1 Ų146.181%0.81180%0.8SS**  trans-69.8117.7176.3-170.90000111E143 E147E143-S145 PolarHBondContact O-N 3.39Å; E143-S145 VanDerWaalsContact O-N 3.13Å; S145-E147 PolarHBondContact O-N 3.11Å; S145-E147 VanDerWaalsContact O-N 3.09Å
146S51Low42.1Very low119 Ų119148.8 Ų148.883%0.83280%0.802SS**  trans-8175.1177.959.80000111.9L144L144-S146 PolarHBondContact O-N 3.23Å
147E39.7Very low43.4Very low162 Ų162148 Ų14876%0.75780%0.8SS**  trans-152.8125.8156.9-131.3-172.3-166.700112.6S145 K149S145-E147 PolarHBondContact O-N 3.11Å; S145-E147 VanDerWaalsContact O-N 3.09Å; E147-K149 PolarHBondContact O-N 3.18Å
148G47.8Very low44.6Very low87 Ų87143.7 Ų143.790%0.89779%0.787SS**  trans-75.761.3-175.500000113.8
149K44.6Very low46.8Very low168 Ų168144.1 Ų144.173%0.7378%0.78SS**  trans-124.5102.9179.5-152.1145.6-172.4169.40111.2E147 R151E147-K149 PolarHBondContact O-N 3.18Å; K149-R151 PolarHBondContact O-N 2.92Å
150W43.3Very low49.2Very low247 Ų247142 Ų14294%0.93677%0.769SS**  trans-63.775.8173.9-70.683000111.1N152W150-N152 PolarHBondContact O-N 3.31Å; W150-N152 VanDerWaalsContact O-N 3.15Å
151R46.7Very low51.9Low203 Ų203143 Ų14377%0.76676%0.757SS**  trans-69.9108165.860.1-163.4-61.3-98.52.7107.1K149 I153K149-R151 PolarHBondContact O-N 2.92Å; R151-I153 VanDerWaalsContact C-N 3.28Å; R151-I153 PolarHBondContact O-N 3.25Å
152N45.1Very low54.5Low150 Ų150140.4 Ų140.480%0.80274%0.742SS**  trans-56.294.8170.7-81-63.4000108.8W150 R154W150-N152 PolarHBondContact O-N 3.31Å; W150-N152 VanDerWaalsContact O-N 3.15Å; N152-R154 PolarHBondContact O-N 3.22Å
153I47.9Very low56.9Low125 Ų125138.2 Ų138.264%0.64173%0.728SS**  trans-65.794.3165-60.6172.4000104.3R151 K155R151-I153 VanDerWaalsContact C-N 3.28Å; R151-I153 PolarHBondContact O-N 3.25Å; I153-K155 HydrophobicContact CG2-CG 4.21Å; I153-K155 PolarHBondContact O-N 2.98Å
154R54.7Low59.8Low232 Ų232131.5 Ų131.588%0.87570%0.703SS**  trans-59.987.6157.4-78.8-171.6-79.8-138.4-1.5105.4N152 T156N152-R154 PolarHBondContact O-N 3.22Å; R154-T156 PolarHBondContact O-N 3.2Å
155K58.8Low62.4Low183 Ų183126.8 Ų126.880%0.79668%0.679SS**  trans-50.9111.5170.1-67.3176.1-179.4177.20104.5I153I153-K155 HydrophobicContact CG2-CG 4.21Å; I153-K155 PolarHBondContact O-N 2.98Å
156T57.3Low65.4Low125 Ų125124.6 Ų124.677%0.76766%0.663SS**PPolyproline II helixtrans-50.7134.2169.231.30000106.7R154 A158R154-T156 PolarHBondContact O-N 3.2Å; T156-A158 PolarHBondContact O-N 3.46Å; T156-A158 VanDerWaalsContact O-N 3.11Å
157P59.1Low67.6Low114 Ų114123.9 Ų123.974%0.7465%0.649SS**PPolyproline II helixtrans-53.7128.3-176.922.3-32.5000107.7S159P157-S159 PolarHBondContact O-N 3.47Å
158A63.3Low70.3Confident68 Ų68123.2 Ų123.256%0.56264%0.64SS**PPolyproline II helixtrans-50.3138.6175.300000107.8T156T156-A158 PolarHBondContact O-N 3.46Å; T156-A158 VanDerWaalsContact O-N 3.11Å
159S78.7Confident72.7Confident72 Ų72125.9 Ų125.950%0.50363%0.629SS.*  trans-38.5132.1-176.9167.70000110.3P157 H161 A162 Q163P157-S159 PolarHBondContact O-N 3.47Å; S159-H161 CarbonylContact O-C 3.58Å; S159-H161 PolarHBondContact O-N 3.16Å; S159-A162 WeakPolarHBondContact O-CA 3.17Å; S159-A162 WeakPolarHBondContact O-CB 3.41Å; S159-A162 PolarHBondContact O-N 3.32Å; S159-Q163 PolarHBondContact O-N 2.92Å
160P84.4Confident75.2Confident106 Ų106121.6 Ų121.669%0.68861%0.613SS**Hα-helixtrans-55.5-26.6-175.521-32.8000111.9A164P160-A164 VanDerWaalsContact O-CB 3.31Å; P160-A164 WeakPolarHBondContact O-CB 3.45Å; P160-A164 PolarHBondContact O-N 3.35Å
161H87.7Confident77.8Confident113 Ų113114.6 Ų114.652%0.52359%0.593SS.*Hα-helixtrans-68.3-39.8171.7-166.8-1.8000113.6S159 A164 N165S159-H161 CarbonylContact O-C 3.58Å; S159-H161 PolarHBondContact O-N 3.16Å; H161-A164 PolarHBondContact O-N 3.31Å; H161-N165 PolarHBondContact CE1-ND2 2.78Å; H161-N165 PolarHBondContact CE1-OD1 3.05Å; H161-N165 PolarHBondContact ND1-ND2 3.21Å; H161-N165 PolarHBondContact ND1-OD1 2.93Å; H161-N165 WeakPolarHBondContact O-CB 3.22Å; H161-N165 PolarHBondContact O-N 2.88Å; H161-N165 PolarHBondContact O-ND2 3.27Å; H161-N165 PolarHBondContact O-OD1 2.98Å
162A89.9Confident80.2Confident50 Ų50109.6 Ų109.641%0.41358%0.582SS.*Hα-helixtrans-67.7-39.3174.800000111.7S159 N165 C166S159-A162 WeakPolarHBondContact O-CA 3.17Å; S159-A162 WeakPolarHBondContact O-CB 3.41Å; S159-A162 PolarHBondContact O-N 3.32Å; A162-N165 PolarHBondContact O-N 3.33Å; A162-C166 PolarHBondContact O-N 3.04Å
163Q90.9Very high82.8Confident118 Ų118108.2 Ų108.255%0.55157%0.573SS**Hα-helixtrans-64-43.6172.4-170.6177.89.100111.5S159 N165 C166 L167S159-Q163 PolarHBondContact O-N 2.92Å; Q163-N165 VanDerWaalsContact C-N 3.32Å; Q163-N165 PolarHBondContact O-N 3.35Å; Q163-C166 WeakPolarHBondContact O-CB 3.34Å; Q163-C166 PolarHBondContact O-N 2.99Å; Q163-L167 HydrophobicContact CG-CD1 4.5Å; Q163-L167 WeakPolarHBondContact O-CG 3.47Å; Q163-L167 PolarHBondContact O-N 3.1Å
164A93.8Very high85.1Confident36 Ų36107.2 Ų107.230%0.29857%0.566SS.*Hα-helixtrans-61.5-38.3174.700000112.6P160 H161 L167 R168P160-A164 VanDerWaalsContact O-CB 3.31Å; P160-A164 WeakPolarHBondContact O-CB 3.45Å; P160-A164 PolarHBondContact O-N 3.35Å; H161-A164 PolarHBondContact O-N 3.31Å; A164-L167 PolarHBondContact O-N 2.76Å; A164-R168 VanDerWaalsContact O-CG 3.27Å; A164-R168 WeakPolarHBondContact O-CG 3.37Å; A164-R168 PolarHBondContact O-N 2.75Å
165N94.6Very high87.2Confident68 Ų68100.8 Ų100.836%0.36455%0.549SS..Hα-helixtrans-68-39.2175.5-68.6-12.4000111.9H161 A162 Q163 R168 Q169H161-N165 PolarHBondContact CE1-ND2 2.78Å; H161-N165 PolarHBondContact CE1-OD1 3.05Å; H161-N165 PolarHBondContact ND1-ND2 3.21Å; H161-N165 PolarHBondContact ND1-OD1 2.93Å; H161-N165 WeakPolarHBondContact O-CB 3.22Å; H161-N165 PolarHBondContact O-N 2.88Å; H161-N165 PolarHBondContact O-ND2 3.27Å; H161-N165 PolarHBondContact O-OD1 2.98Å; A162-N165 PolarHBondContact O-N 3.33Å; Q163-N165 VanDerWaalsContact C-N 3.32Å; Q163-N165 PolarHBondContact O-N 3.35Å; N165-R168 PolarHBondContact O-N 2.7Å; N165-R168 PolarHBondContact OD1-NH1 3.37Å; N165-Q169 PolarHBondContact O-N 3.36Å
166C94.2Very high89.1Confident71 Ų7196.6 Ų96.648%0.4854%0.535SS..Hα-helixtrans-60.5-45.7172.7-175.10000111.9A162 Q163 R168 Q169 I170A162-C166 PolarHBondContact O-N 3.04Å; Q163-C166 WeakPolarHBondContact O-CB 3.34Å; Q163-C166 PolarHBondContact O-N 2.99Å; C166-R168 VanDerWaalsContact C-N 3.35Å; C166-R168 PolarHBondContact O-N 3.13Å; C166-Q169 WeakPolarHBondContact O-CB 3.46Å; C166-Q169 PolarHBondContact O-N 3.29Å; C166-I170 WeakPolarHBondContact O-CG1 3.45Å; C166-I170 PolarHBondContact O-N 3.47Å
167L97.4Very high91.1Very high104 Ų10494.8 Ų94.855%0.54552%0.52SS..Hα-helixtrans-63.4-37.9176.4-69.2171.3000112.6Q163 A164 I170 L171Q163-L167 HydrophobicContact CG-CD1 4.5Å; Q163-L167 WeakPolarHBondContact O-CG 3.47Å; Q163-L167 PolarHBondContact O-N 3.1Å; A164-L167 PolarHBondContact O-N 2.76Å; L167-I170 PolarHBondContact O-N 3.32Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 PolarHBondContact O-N 2.9Å
168R96.6Very high92.9Very high148 Ų14894.3 Ų94.356%0.55851%0.51SS*.Hα-helixtrans-62.3-42.3172.2-72.2164.8179.1167.5-6.6112A164 N165 C166 L171 L172A164-R168 VanDerWaalsContact O-CG 3.27Å; A164-R168 WeakPolarHBondContact O-CG 3.37Å; A164-R168 PolarHBondContact O-N 2.75Å; N165-R168 PolarHBondContact O-N 2.7Å; N165-R168 PolarHBondContact OD1-NH1 3.37Å; C166-R168 VanDerWaalsContact C-N 3.35Å; C166-R168 PolarHBondContact O-N 3.13Å; R168-L171 PolarHBondContact O-N 2.85Å; R168-L172 WeakPolarHBondContact O-CG 3.38Å; R168-L172 PolarHBondContact O-N 3.01Å
169Q97.1Very high94.6Very high143 Ų14396.5 Ų96.567%0.66851%0.509SS*.Hα-helixtrans-61-44.6176.8-16289.142.600111.4N165 C166 L172 L173N165-Q169 PolarHBondContact O-N 3.36Å; C166-Q169 WeakPolarHBondContact O-CB 3.46Å; C166-Q169 PolarHBondContact O-N 3.29Å; Q169-L172 PolarHBondContact O-N 2.84Å; Q169-L173 PolarHBondContact O-N 2.95Å
170I97.4Very high95.5Very high78 Ų7898.3 Ų98.340%0.451%0.509SS..Hα-helixtrans-65.4-42.4177.2-66.6165.9000110.9C166 L167 L173 Q174C166-I170 WeakPolarHBondContact O-CG1 3.45Å; C166-I170 PolarHBondContact O-N 3.47Å; L167-I170 PolarHBondContact O-N 3.32Å; I170-L173 PolarHBondContact O-N 2.72Å; I170-Q174 HydrophobicContact CG2-CG 4.42Å; I170-Q174 WeakPolarHBondContact O-CB 3.16Å; I170-Q174 WeakPolarHBondContact O-CG 3.27Å; I170-Q174 PolarHBondContact O-N 3.21Å
171L97.9Very high96.2Very high99 Ų9998.1 Ų98.152%0.51850%0.499SS..Hα-helixtrans-63.6-41.4178.6-173.769000112L167 R168 Q174 L175L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 PolarHBondContact O-N 2.9Å; R168-L171 PolarHBondContact O-N 2.85Å; L171-Q174 PolarHBondContact O-N 3.22Å; L171-L175 WeakPolarHBondContact O-CG 3.4Å; L171-L175 PolarHBondContact O-N 3.18Å
172L98Very high96.7Very high99 Ų9997.2 Ų97.252%0.51850%0.495SS..Hα-helixtrans-61-48.6173.4-73.2167.8000111.1R168 Q169 Q174 L175 D176R168-L172 WeakPolarHBondContact O-CG 3.38Å; R168-L172 PolarHBondContact O-N 3.01Å; Q169-L172 PolarHBondContact O-N 2.84Å; L172-Q174 VanDerWaalsContact C-N 3.25Å; L172-Q174 PolarHBondContact O-N 3.09Å; L172-L175 WeakPolarHBondContact O-CB 3.31Å; L172-L175 PolarHBondContact O-N 3.33Å; L172-D176 VanDerWaalsContact O-CG 3.32Å; L172-D176 PolarHBondContact O-N 2.76Å
173L98.3Very high97.1Very high120 Ų12099.8 Ų99.863%0.62850%0.499SS*.Hα-helixtrans-60.4-34.5177.4-168.572.6000112.8Q169 I170 L177Q169-L173 PolarHBondContact O-N 2.95Å; I170-L173 PolarHBondContact O-N 2.72Å; L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 PolarHBondContact O-N 3.22Å
174Q97.8Very high97.4Very high105 Ų10599.9 Ų99.949%0.49150%0.499SS..Hα-helixtrans-68.7-39.2173.8-76.1175.7-18.200112.3I170 L171 L172 I178I170-Q174 HydrophobicContact CG2-CG 4.42Å; I170-Q174 WeakPolarHBondContact O-CB 3.16Å; I170-Q174 WeakPolarHBondContact O-CG 3.27Å; I170-Q174 PolarHBondContact O-N 3.21Å; L171-Q174 PolarHBondContact O-N 3.22Å; L172-Q174 VanDerWaalsContact C-N 3.25Å; L172-Q174 PolarHBondContact O-N 3.09Å; Q174-I178 WeakPolarHBondContact O-CD1 3.4Å; Q174-I178 WeakPolarHBondContact O-CG1 3.29Å; Q174-I178 PolarHBondContact O-N 2.68Å
175L98.3Very high97.6Very high97 Ų97102.9 Ų102.951%0.50851%0.509SS..Hα-helixtrans-65.7-45.6174.7-70.3169.2000111.3L171 L172 L177 I178 E179L171-L175 WeakPolarHBondContact O-CG 3.4Å; L171-L175 PolarHBondContact O-N 3.18Å; L172-L175 WeakPolarHBondContact O-CB 3.31Å; L172-L175 PolarHBondContact O-N 3.33Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 3.37Å; L175-I178 PolarHBondContact O-N 2.82Å; L175-E179 PolarHBondContact O-N 3.11Å
176D98.2Very high97.8Very high95 Ų95105.2 Ų105.251%0.50852%0.518SS..Hα-helixtrans-59.1-42.3176.4-63.6-14.8000111.3L172 E179 Q180L172-D176 VanDerWaalsContact O-CG 3.32Å; L172-D176 PolarHBondContact O-N 2.76Å; D176-E179 PolarHBondContact O-N 2.84Å; D176-Q180 WeakPolarHBondContact O-CB 3.42Å; D176-Q180 PolarHBondContact O-N 3.11Å
177L98.4Very high98Very high87 Ų87105.7 Ų105.746%0.45552%0.522SS..Hα-helixtrans-65.1-41.8176.4179.762.8000112.2L173 L175 Q180 Q181L173-L177 WeakPolarHBondContact O-CB 3.43Å; L173-L177 PolarHBondContact O-N 3.22Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 3.37Å; L177-Q180 PolarHBondContact O-N 2.96Å; L177-Q181 HydrophobicContact CD1-CG 4.46Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.28Å; L177-Q181 WeakPolarHBondContact O-CG 3.37Å; L177-Q181 PolarHBondContact O-N 3.15Å
178I98.4Very high98Very high103 Ų103106.1 Ų106.153%0.52852%0.52SS..Hα-helixtrans-64.7-41.8175.9-70.5163.3000110.3Q174 L175 Q181 Q182Q174-I178 WeakPolarHBondContact O-CD1 3.4Å; Q174-I178 WeakPolarHBondContact O-CG1 3.29Å; Q174-I178 PolarHBondContact O-N 2.68Å; L175-I178 PolarHBondContact O-N 2.82Å; I178-Q181 PolarHBondContact O-N 2.75Å; I178-Q182 VanDerWaalsContact O-CB 3.31Å; I178-Q182 WeakPolarHBondContact O-CB 3.24Å; I178-Q182 PolarHBondContact O-N 2.91Å
179E97.8Very high98.1Very high114 Ų114103.2 Ų103.253%0.53352%0.515SS..Hα-helixtrans-62.1-47.4175.5-172.5178.8169.200111.1L175 D176 Q181 Q182 Q183L175-E179 PolarHBondContact O-N 3.11Å; D176-E179 PolarHBondContact O-N 2.84Å; E179-Q181 VanDerWaalsContact C-N 3.33Å; E179-Q181 PolarHBondContact O-N 3.4Å; E179-Q182 PolarHBondContact O-N 2.99Å; E179-Q182 VanDerWaalsContact O-N 3.15Å; E179-Q183 HydrophobicContact CG-CG 4.47Å; E179-Q183 WeakPolarHBondContact O-CG 3.27Å; E179-Q183 PolarHBondContact O-N 3.35Å; E179-Q183 PolarHBondContact OE1-NE2 3.35Å
180Q98.4Very high98.1Very high111 Ų111102.7 Ų102.752%0.51951%0.511SS..Hα-helixtrans-58.9-43.4176.9-174.3-177.8-2.200111.9D176 L177 Q183 Q184D176-Q180 WeakPolarHBondContact O-CB 3.42Å; D176-Q180 PolarHBondContact O-N 3.11Å; L177-Q180 PolarHBondContact O-N 2.96Å; Q180-Q183 PolarHBondContact O-N 3.48Å; Q180-Q184 WeakPolarHBondContact O-CG 3.41Å; Q180-Q184 PolarHBondContact O-N 3.34Å
181Q98.1Very high98.2Very high102 Ų102103.1 Ų103.148%0.47751%0.511SS..Hα-helixtrans-64.5-40.6175.6-74.7176.4-8.300111.8L177 I178 E179 Q184 L185L177-Q181 HydrophobicContact CD1-CG 4.46Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.28Å; L177-Q181 WeakPolarHBondContact O-CG 3.37Å; L177-Q181 PolarHBondContact O-N 3.15Å; I178-Q181 PolarHBondContact O-N 2.75Å; E179-Q181 VanDerWaalsContact C-N 3.33Å; E179-Q181 PolarHBondContact O-N 3.4Å; Q181-Q184 PolarHBondContact O-N 3.41Å; Q181-L185 WeakPolarHBondContact O-CG 3.42Å; Q181-L185 PolarHBondContact O-N 2.97Å
182Q98.6Very high98.2Very high93 Ų93102.2 Ų102.244%0.43551%0.506SS..Hα-helixtrans-65.8-39177.7-175.657.979.700112.3I178 E179 L185 Q186I178-Q182 VanDerWaalsContact O-CB 3.31Å; I178-Q182 WeakPolarHBondContact O-CB 3.24Å; I178-Q182 PolarHBondContact O-N 2.91Å; E179-Q182 PolarHBondContact O-N 2.99Å; E179-Q182 VanDerWaalsContact O-N 3.15Å; Q182-L185 PolarHBondContact O-N 3.08Å; Q182-Q186 WeakPolarHBondContact O-CG 3.35Å; Q182-Q186 PolarHBondContact O-N 3.12Å
183Q98.3Very high98.2Very high105 Ų105101.7 Ų101.749%0.49150%0.504SS..Hα-helixtrans-66.4-40.3173.3-68.8178.714.300111.6E179 Q180 Q186 S187E179-Q183 HydrophobicContact CG-CG 4.47Å; E179-Q183 WeakPolarHBondContact O-CG 3.27Å; E179-Q183 PolarHBondContact O-N 3.35Å; E179-Q183 PolarHBondContact OE1-NE2 3.35Å; Q180-Q183 PolarHBondContact O-N 3.48Å; Q183-Q186 PolarHBondContact O-N 2.97Å; Q183-S187 WeakPolarHBondContact O-CB 3.48Å; Q183-S187 PolarHBondContact O-N 3.32Å
184Q97.8Very high98.2Very high120 Ų120101 Ų10156%0.56150%0.498SS*.Hα-helixtrans-63.4-42.6174-79.2-167.9-18.900112.6Q180 Q181 S187 K188Q180-Q184 WeakPolarHBondContact O-CG 3.41Å; Q180-Q184 PolarHBondContact O-N 3.34Å; Q181-Q184 PolarHBondContact O-N 3.41Å; Q184-S187 WeakPolarHBondContact O-CB 3.28Å; Q184-S187 PolarHBondContact O-N 3.43Å; Q184-K188 WeakPolarHBondContact O-CG 3.48Å; Q184-K188 PolarHBondContact O-N 3.47Å
185L98.3Very high98.1Very high98 Ų98101 Ų10151%0.51350%0.5SS..Hα-helixtrans-59.6-49.4175-76.6167.6000111.2Q181 Q182 S187 K188 D189Q181-L185 WeakPolarHBondContact O-CG 3.42Å; Q181-L185 PolarHBondContact O-N 2.97Å; Q182-L185 PolarHBondContact O-N 3.08Å; L185-S187 VanDerWaalsContact C-N 3.3Å; L185-S187 PolarHBondContact O-N 3.43Å; L185-K188 CarbonylContact O-C 3.51Å; L185-K188 WeakPolarHBondContact O-CA 3.43Å; L185-K188 WeakPolarHBondContact O-CB 3.34Å; L185-K188 PolarHBondContact O-N 3.34Å; L185-D189 PolarHBondContact O-N 3.41Å
186Q98.4Very high98.1Very high117 Ų117101.5 Ų101.555%0.54750%0.498SS..Hα-helixtrans-59.9-38177.2-72.2173800113Q182 Q183 K188 K190Q182-Q186 WeakPolarHBondContact O-CG 3.35Å; Q182-Q186 PolarHBondContact O-N 3.12Å; Q183-Q186 PolarHBondContact O-N 2.97Å; Q186-K188 VanDerWaalsContact C-N 3.34Å; Q186-K190 WeakPolarHBondContact O-CB 3.33Å; Q186-K190 PolarHBondContact O-N 2.95Å; Q186-K190 VanDerWaalsContact O-N 3.11Å
187S97.9Very high98.1Very high81 Ų8199.3 Ų99.357%0.56649%0.494SS*.Hα-helixtrans-63.6-39.4173.7-171.60000112Q183 Q184 L185 E191Q183-S187 WeakPolarHBondContact O-CB 3.48Å; Q183-S187 PolarHBondContact O-N 3.32Å; Q184-S187 WeakPolarHBondContact O-CB 3.28Å; Q184-S187 PolarHBondContact O-N 3.43Å; L185-S187 VanDerWaalsContact C-N 3.3Å; L185-S187 PolarHBondContact O-N 3.43Å; S187-E191 PolarHBondContact O-N 2.74Å; S187-E191 VanDerWaalsContact O-N 3.09Å
188K97.9Very high98.1Very high113 Ų11399.9 Ų99.949%0.49150%0.497SS..Hα-helixtrans-72.5-39.6177.7-75-74.4163.7-162.60113.1Q184 L185 Q186 K190 E191 I192Q184-K188 WeakPolarHBondContact O-CG 3.48Å; Q184-K188 PolarHBondContact O-N 3.47Å; L185-K188 CarbonylContact O-C 3.51Å; L185-K188 WeakPolarHBondContact O-CA 3.43Å; L185-K188 WeakPolarHBondContact O-CB 3.34Å; L185-K188 PolarHBondContact O-N 3.34Å; Q186-K188 VanDerWaalsContact C-N 3.34Å; K188-K190 VanDerWaalsContact C-N 3.3Å; K188-K190 PolarHBondContact O-N 2.95Å; K188-E191 WeakPolarHBondContact CD-OE2 3.4Å; K188-E191 WeakPolarHBondContact CE-OE2 3.19Å; K188-E191 IonicContact NZ-OE1 2.68Å; K188-E191 IonicContact NZ-OE2 3.56Å; K188-E191 PolarHBondContact NZ-OE2 3.37Å; K188-E191 PolarHBondContact O-N 2.92Å; K188-I192 WeakPolarHBondContact O-CB 3.21Å; K188-I192 VanDerWaalsContact O-CG1 3.26Å; K188-I192 WeakPolarHBondContact O-CG1 3.39Å; K188-I192 PolarHBondContact O-N 2.91Å
189D98.3Very high98Very high87 Ų87101.6 Ų101.647%0.46550%0.501SS..Hα-helixtrans-61.1-41174-69.5-36.2000111L185 I192 D193L185-D189 PolarHBondContact O-N 3.41Å; D189-I192 WeakPolarHBondContact O-CB 3.43Å; D189-I192 PolarHBondContact O-N 3.44Å; D189-D193 PolarHBondContact O-N 3.22Å
190K98.4Very high98.1Very high132 Ų132102.7 Ų102.757%0.57451%0.506SS*.Hα-helixtrans-62.7-44.9174-170.3177.9-178.4-84.40112.7Q186 K188 I192 D193 E194Q186-K190 WeakPolarHBondContact O-CB 3.33Å; Q186-K190 PolarHBondContact O-N 2.95Å; Q186-K190 VanDerWaalsContact O-N 3.11Å; K188-K190 VanDerWaalsContact C-N 3.3Å; K188-K190 PolarHBondContact O-N 2.95Å; K190-I192 VanDerWaalsContact C-N 3.3Å; K190-I192 PolarHBondContact O-N 3.25Å; K190-D193 PolarHBondContact O-N 3.05Å; K190-E194 IonicContact NZ-OE1 3.15Å; K190-E194 PolarHBondContact NZ-OE1 2.98Å; K190-E194 WeakPolarHBondContact O-CG 3.31Å; K190-E194 PolarHBondContact O-N 3.18Å
191E98.1Very high98Very high87 Ų87101.3 Ų101.341%0.40751%0.505SS..Hα-helixtrans-59.9-41.5174.7-176-177177.300111.4S187 K188 L195S187-E191 PolarHBondContact O-N 2.74Å; S187-E191 VanDerWaalsContact O-N 3.09Å; K188-E191 WeakPolarHBondContact CD-OE2 3.4Å; K188-E191 WeakPolarHBondContact CE-OE2 3.19Å; K188-E191 IonicContact NZ-OE1 2.68Å; K188-E191 IonicContact NZ-OE2 3.56Å; K188-E191 PolarHBondContact NZ-OE2 3.37Å; K188-E191 PolarHBondContact O-N 2.92Å; E191-L195 HydrophobicContact CG-CD1 4.3Å; E191-L195 WeakPolarHBondContact O-CB 3.48Å; E191-L195 VanDerWaalsContact O-CG 3.29Å; E191-L195 WeakPolarHBondContact O-CG 3.45Å; E191-L195 PolarHBondContact O-N 3.35Å
192I97.9Very high98Very high81 Ų81101 Ų10142%0.41551%0.506SS..Hα-helixtrans-62.7-43.8176.2-73.7164.9000111.2K188 D189 K190 L195 K196K188-I192 WeakPolarHBondContact O-CB 3.21Å; K188-I192 VanDerWaalsContact O-CG1 3.26Å; K188-I192 WeakPolarHBondContact O-CG1 3.39Å; K188-I192 PolarHBondContact O-N 2.91Å; D189-I192 WeakPolarHBondContact O-CB 3.43Å; D189-I192 PolarHBondContact O-N 3.44Å; K190-I192 VanDerWaalsContact C-N 3.3Å; K190-I192 PolarHBondContact O-N 3.25Å; I192-L195 PolarHBondContact O-N 3.45Å; I192-K196 HydrophobicContact CG2-CD 4.35Å; I192-K196 VanDerWaalsContact CG2-CE 3.44Å; I192-K196 WeakPolarHBondContact O-CG 3.44Å; I192-K196 PolarHBondContact O-N 3.06Å
193D98.4Very high97.9Very high88 Ų88101.1 Ų101.147%0.47151%0.509SS..Hα-helixtrans-71.1-35.6-179.7-76.1-13000112.9D189 K190 K196 A197D189-D193 PolarHBondContact O-N 3.22Å; K190-D193 PolarHBondContact O-N 3.05Å; D193-K196 PolarHBondContact O-N 3.3Å; D193-K196 WeakPolarHBondContact OD1-CD 3.36Å; D193-K196 IonicContact OD1-NZ 2.67Å; D193-K196 PolarHBondContact OD1-NZ 3.41Å; D193-A197 PolarHBondContact O-N 2.95Å
194E98.1Very high97.9Very high106 Ų10697.6 Ų97.650%0.49550%0.498SS..Hα-helixtrans-60.2-45.8169.3-72.8175.9-166.500110.9K190 K196 A197 D198K190-E194 IonicContact NZ-OE1 3.15Å; K190-E194 PolarHBondContact NZ-OE1 2.98Å; K190-E194 WeakPolarHBondContact O-CG 3.31Å; K190-E194 PolarHBondContact O-N 3.18Å; E194-K196 PolarHBondContact O-N 3.3Å; E194-A197 PolarHBondContact O-N 3.34Å; E194-D198 PolarHBondContact O-N 3Å
195L97.3Very high97.9Very high104 Ų104100.4 Ų100.455%0.54550%0.504SS..Hα-helixtrans-67.1-32.6176.7-71172.2000113.6E191 I192 K199E191-L195 HydrophobicContact CG-CD1 4.3Å; E191-L195 WeakPolarHBondContact O-CB 3.48Å; E191-L195 VanDerWaalsContact O-CG 3.29Å; E191-L195 WeakPolarHBondContact O-CG 3.45Å; E191-L195 PolarHBondContact O-N 3.35Å; I192-L195 PolarHBondContact O-N 3.45Å; L195-K199 VanDerWaalsContact O-CB 3.32Å; L195-K199 WeakPolarHBondContact O-CB 3.4Å; L195-K199 PolarHBondContact O-N 2.99Å
196K97.7Very high97.8Very high107 Ų107100.2 Ų100.247%0.46550%0.502SS..Hα-helixtrans-64.3-47.9171.2-74171.3-165.6153.50110.8I192 D193 E194 D198 K199 E200I192-K196 HydrophobicContact CG2-CD 4.35Å; I192-K196 VanDerWaalsContact CG2-CE 3.44Å; I192-K196 WeakPolarHBondContact O-CG 3.44Å; I192-K196 PolarHBondContact O-N 3.06Å; D193-K196 PolarHBondContact O-N 3.3Å; D193-K196 WeakPolarHBondContact OD1-CD 3.36Å; D193-K196 IonicContact OD1-NZ 2.67Å; D193-K196 PolarHBondContact OD1-NZ 3.41Å; E194-K196 PolarHBondContact O-N 3.3Å; K196-D198 PolarHBondContact O-N 3.44Å; K196-K199 WeakPolarHBondContact O-CB 3.49Å; K196-K199 PolarHBondContact O-N 2.93Å; K196-E200 WeakPolarHBondContact O-CG 3.47Å; K196-E200 PolarHBondContact O-N 3.16Å
197A98.2Very high97.7Very high50 Ų5099 Ų9941%0.41350%0.496SS..Hα-helixtrans-59.6-46.8177.700000111.2D193 E194 K199 E200 T201D193-A197 PolarHBondContact O-N 2.95Å; E194-A197 PolarHBondContact O-N 3.34Å; A197-K199 PolarHBondContact O-N 2.97Å; A197-E200 PolarHBondContact O-N 3.08Å; A197-T201 VanDerWaalsContact O-CG2 3.26Å; A197-T201 WeakPolarHBondContact O-CG2 3.4Å; A197-T201 PolarHBondContact O-N 2.87Å
198D97.4Very high97.6Very high99 Ų99102.3 Ų102.353%0.52950%0.496SS..Hα-helixtrans-59.3-44.7175.8-92.60.5000112.1E194 K196 E200 T201 L202E194-D198 PolarHBondContact O-N 3Å; K196-D198 PolarHBondContact O-N 3.44Å; D198-E200 VanDerWaalsContact C-N 3.34Å; D198-E200 PolarHBondContact O-N 3.26Å; D198-T201 PolarHBondContact O-N 3.47Å; D198-T201 PolarHBondContact O-OG1 3Å; D198-L202 WeakPolarHBondContact O-CG 3.24Å; D198-L202 PolarHBondContact O-N 3.04Å
199K97.8Very high97.4Very high139 Ų139103 Ų10360%0.60450%0.503SS*.Hα-helixtrans-56.6-45.4174177-173.1175.2-1730111.7L195 K196 A197 L202 L203L195-K199 VanDerWaalsContact O-CB 3.32Å; L195-K199 WeakPolarHBondContact O-CB 3.4Å; L195-K199 PolarHBondContact O-N 2.99Å; K196-K199 WeakPolarHBondContact O-CB 3.49Å; K196-K199 PolarHBondContact O-N 2.93Å; A197-K199 PolarHBondContact O-N 2.97Å; K199-L202 PolarHBondContact O-N 3.07Å; K199-L203 HydrophobicContact CG-CD1 4.2Å; K199-L203 WeakPolarHBondContact O-CG 3.49Å; K199-L203 PolarHBondContact O-N 2.9Å
200E98.1Very high97.2Very high137 Ų137103.4 Ų103.464%0.6450%0.502SS*.Hα-helixtrans-63.5-42.3176.9-72.8179-171.900112.1K196 A197 D198 L202 L203 A204K196-E200 WeakPolarHBondContact O-CG 3.47Å; K196-E200 PolarHBondContact O-N 3.16Å; A197-E200 PolarHBondContact O-N 3.08Å; D198-E200 VanDerWaalsContact C-N 3.34Å; D198-E200 PolarHBondContact O-N 3.26Å; E200-L202 VanDerWaalsContact C-N 3.3Å; E200-L202 PolarHBondContact O-N 2.68Å; E200-L203 PolarHBondContact O-N 3.38Å; E200-A204 WeakPolarHBondContact O-CB 3.49Å; E200-A204 PolarHBondContact O-N 3.19Å
201T97.8Very high97Very high82 Ų82103 Ų10350%0.50350%0.497SS..Hα-helixtrans-62.9-37.9176.277.10000112.3A197 D198 R205A197-T201 VanDerWaalsContact O-CG2 3.26Å; A197-T201 WeakPolarHBondContact O-CG2 3.4Å; A197-T201 PolarHBondContact O-N 2.87Å; D198-T201 PolarHBondContact O-N 3.47Å; D198-T201 PolarHBondContact O-OG1 3Å; T201-R205 WeakPolarHBondContact O-CB 3.46Å; T201-R205 PolarHBondContact O-N 2.82Å
202L98Very high96.8Very high94 Ų94107.8 Ų107.849%0.49251%0.511SS..Hα-helixtrans-69.2-42.6177.1-71.5174.3000111.7D198 K199 E200 R205 I206D198-L202 WeakPolarHBondContact O-CG 3.24Å; D198-L202 PolarHBondContact O-N 3.04Å; K199-L202 PolarHBondContact O-N 3.07Å; E200-L202 VanDerWaalsContact C-N 3.3Å; E200-L202 PolarHBondContact O-N 2.68Å; L202-R205 WeakPolarHBondContact O-CB 3.22Å; L202-R205 PolarHBondContact O-N 2.99Å; L202-R205 VanDerWaalsContact O-N 3.15Å; L202-I206 WeakPolarHBondContact O-CG1 3.42Å; L202-I206 PolarHBondContact O-N 3.43Å
203L96.8Very high96.3Very high96 Ų96108.2 Ų108.250%0.50351%0.514SS..Hα-helixtrans-59.7-49.5173.4-73.6172.7000111K199 E200 R205 I206 E207K199-L203 HydrophobicContact CG-CD1 4.2Å; K199-L203 WeakPolarHBondContact O-CG 3.49Å; K199-L203 PolarHBondContact O-N 2.9Å; E200-L203 PolarHBondContact O-N 3.38Å; L203-R205 PolarHBondContact O-N 3.4Å; L203-I206 PolarHBondContact O-N 2.89Å; L203-I206 VanDerWaalsContact O-N 3.16Å; L203-E207 VanDerWaalsContact O-CB 3.3Å; L203-E207 WeakPolarHBondContact O-CB 3.37Å; L203-E207 PolarHBondContact O-N 2.86Å
204A97.8Very high95.6Very high32 Ų32109 Ų10926%0.26452%0.515SS..Hα-helixtrans-61.2-30175.500000112.7E200 R208E200-A204 WeakPolarHBondContact O-CB 3.49Å; E200-A204 PolarHBondContact O-N 3.19Å; A204-R208 WeakPolarHBondContact O-CG 3.47Å; A204-R208 PolarHBondContact O-N 2.94Å; A204-R208 VanDerWaalsContact O-N 3.15Å; A204-R208 PolarHBondContact O-NH1 2.89Å
205R97.4Very high94.5Very high178 Ų178108.8 Ų108.867%0.67252%0.517SS*.Hα-helixtrans-72-44.5174.3-176.7178.9177.9178.7-0.6111.9T201 L202 L203 R208 M209T201-R205 WeakPolarHBondContact O-CB 3.46Å; T201-R205 PolarHBondContact O-N 2.82Å; L202-R205 WeakPolarHBondContact O-CB 3.22Å; L202-R205 PolarHBondContact O-N 2.99Å; L202-R205 VanDerWaalsContact O-N 3.15Å; L203-R205 PolarHBondContact O-N 3.4Å; R205-R208 PolarHBondContact O-N 3.04Å; R205-M209 WeakPolarHBondContact O-CB 3.39Å; R205-M209 PolarHBondContact O-N 3.09Å
206I95.8Very high93.1Very high94 Ų94107.9 Ų107.948%0.48252%0.516SS..Hα-helixtrans-62.1-48.2175.7-69.6165.5000109.6L202 L203 R208 M209 E210L202-I206 WeakPolarHBondContact O-CG1 3.42Å; L202-I206 PolarHBondContact O-N 3.43Å; L203-I206 PolarHBondContact O-N 2.89Å; L203-I206 VanDerWaalsContact O-N 3.16Å; I206-R208 PolarHBondContact O-N 3.01Å; I206-M209 CarbonylContact O-C 3.54Å; I206-M209 WeakPolarHBondContact O-CA 3.32Å; I206-M209 WeakPolarHBondContact O-CB 3.41Å; I206-M209 PolarHBondContact O-N 3.49Å; I206-E210 WeakPolarHBondContact O-CB 3.33Å; I206-E210 PolarHBondContact O-N 3.04Å
207E97Very high91.7Very high91 Ų91111.7 Ų111.743%0.42553%0.527SS..Hα-helixtrans-61.1-39.9-179.9-165.1-153.5-16100112.2L203 E210 R211L203-E207 VanDerWaalsContact O-CB 3.3Å; L203-E207 WeakPolarHBondContact O-CB 3.37Å; L203-E207 PolarHBondContact O-N 2.86Å; E207-E210 PolarHBondContact O-N 3.27Å; E207-R211 VanDerWaalsContact CD-CZ 3.41Å; E207-R211 WeakPolarHBondContact O-CG 3.47Å; E207-R211 PolarHBondContact O-N 3.49Å; E207-R211 IonicContact OE1-CZ 2.65Å; E207-R211 IonicContact OE1-NH1 2.75Å; E207-R211 PolarHBondContact OE1-NH1 3.25Å; E207-R211 IonicContact OE1-NH2 3.21Å; E207-R211 PolarHBondContact OE1-NH2 2.98Å; E207-R211 IonicContact OE2-CZ 2.74Å; E207-R211 IonicContact OE2-NH1 2.61Å; E207-R211 PolarHBondContact OE2-NH1 3.12Å; E207-R211 IonicContact OE2-NH2 3.79Å; E207-R211 PolarHBondContact OE2-NH2 3.33Å
208R96Very high89.9Confident151 Ų151117.9 Ų117.957%0.5755%0.545SS*.Hα-helixtrans-63.9-40.5169.9-76-173-147.889.4-13.2112.7A204 R205 I206 E210 R212A204-R208 WeakPolarHBondContact O-CG 3.47Å; A204-R208 PolarHBondContact O-N 2.94Å; A204-R208 VanDerWaalsContact O-N 3.15Å; A204-R208 PolarHBondContact O-NH1 2.89Å; R205-R208 PolarHBondContact O-N 3.04Å; I206-R208 PolarHBondContact O-N 3.01Å; R208-E210 VanDerWaalsContact C-N 3.33Å; R208-R212 WeakPolarHBondContact O-CG 3.29Å; R208-R212 PolarHBondContact O-N 3.49Å; R208-R212 VanDerWaalsContact O-N 3.13Å
209M93.9Very high87.6Confident128 Ų128118.9 Ų118.963%0.63155%0.55SS**Hα-helixtrans-66.5-38.5177.5-175.6174.868.500111.1R205 I206 R212 L213R205-M209 WeakPolarHBondContact O-CB 3.39Å; R205-M209 PolarHBondContact O-N 3.09Å; I206-M209 CarbonylContact O-C 3.54Å; I206-M209 WeakPolarHBondContact O-CA 3.32Å; I206-M209 WeakPolarHBondContact O-CB 3.41Å; I206-M209 PolarHBondContact O-N 3.49Å; M209-R212 PolarHBondContact O-N 3.14Å; M209-L213 PolarHBondContact O-N 3.46Å
210E92.8Very high85Confident96 Ų96116.3 Ų116.345%0.44955%0.546SS..Hα-helixtrans-66.9-47.5176.5-163.4-169.6157.500111.1I206 E207 R208 R212 L213 Q214I206-E210 WeakPolarHBondContact O-CB 3.33Å; I206-E210 PolarHBondContact O-N 3.04Å; E207-E210 PolarHBondContact O-N 3.27Å; R208-E210 VanDerWaalsContact C-N 3.33Å; E210-R212 PolarHBondContact O-N 3.38Å; E210-L213 CarbonylContact O-C 3.56Å; E210-L213 WeakPolarHBondContact O-CA 3.47Å; E210-L213 WeakPolarHBondContact O-CB 3.46Å; E210-L213 PolarHBondContact O-N 2.87Å; E210-Q214 HydrophobicContact CG-CG 4.33Å; E210-Q214 WeakPolarHBondContact O-CB 3.49Å; E210-Q214 WeakPolarHBondContact O-CG 3.36Å; E210-Q214 PolarHBondContact O-N 2.81Å; E210-Q214 PolarHBondContact OE1-NE2 3.26Å
211R95.2Very high82.7Confident124 Ų124114.7 Ų114.747%0.46855%0.548SS..Hα-helixtrans-54-41.8172.5-74.1-174.8-175.6102.10.6112E207 Q214 L215E207-R211 VanDerWaalsContact CD-CZ 3.41Å; E207-R211 WeakPolarHBondContact O-CG 3.47Å; E207-R211 PolarHBondContact O-N 3.49Å; E207-R211 IonicContact OE1-CZ 2.65Å; E207-R211 IonicContact OE1-NH1 2.75Å; E207-R211 PolarHBondContact OE1-NH1 3.25Å; E207-R211 IonicContact OE1-NH2 3.21Å; E207-R211 PolarHBondContact OE1-NH2 2.98Å; E207-R211 IonicContact OE2-CZ 2.74Å; E207-R211 IonicContact OE2-NH1 2.61Å; E207-R211 PolarHBondContact OE2-NH1 3.12Å; E207-R211 IonicContact OE2-NH2 3.79Å; E207-R211 PolarHBondContact OE2-NH2 3.33Å; R211-Q214 PolarHBondContact O-N 2.95Å; R211-L215 WeakPolarHBondContact O-CB 3.31Å; R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 2.88Å
212R93.4Very high80.2Confident186 Ų186120.4 Ų120.470%0.70256%0.56SS**Hα-helixtrans-65.5-38.4174.8-71.2176.667.8-171.71.4112.8R208 M209 E210 T216R208-R212 WeakPolarHBondContact O-CG 3.29Å; R208-R212 PolarHBondContact O-N 3.49Å; R208-R212 VanDerWaalsContact O-N 3.13Å; M209-R212 PolarHBondContact O-N 3.14Å; E210-R212 PolarHBondContact O-N 3.38Å; R212-T216 WeakPolarHBondContact O-CB 3.39Å; R212-T216 PolarHBondContact O-N 3.02Å; R212-T216 PolarHBondContact O-OG1 3.45Å
213L87.9Confident77.7Confident91 Ų91121.4 Ų121.448%0.47657%0.566SS.*Hα-helixtrans-69.9-40.3176.3-176.964.3000111.8M209 E210 T216 R217M209-L213 PolarHBondContact O-N 3.46Å; E210-L213 CarbonylContact O-C 3.56Å; E210-L213 WeakPolarHBondContact O-CA 3.47Å; E210-L213 WeakPolarHBondContact O-CB 3.46Å; E210-L213 PolarHBondContact O-N 2.87Å; L213-T216 PolarHBondContact O-N 3.41Å; L213-R217 WeakPolarHBondContact O-CB 3.26Å; L213-R217 WeakPolarHBondContact O-CG 3.48Å; L213-R217 PolarHBondContact O-N 2.84Å
214Q84.1Confident75.4Confident105 Ų105124 Ų12449%0.49157%0.573SS.*Hα-helixtrans-63.9-44.5175-70.7-177.71400110.9E210 R211 R217 K218E210-Q214 HydrophobicContact CG-CG 4.33Å; E210-Q214 WeakPolarHBondContact O-CB 3.49Å; E210-Q214 WeakPolarHBondContact O-CG 3.36Å; E210-Q214 PolarHBondContact O-N 2.81Å; E210-Q214 PolarHBondContact OE1-NE2 3.26Å; R211-Q214 PolarHBondContact O-N 2.95Å; Q214-R217 PolarHBondContact O-N 3Å; Q214-K218 WeakPolarHBondContact O-CB 3.47Å; Q214-K218 PolarHBondContact O-N 3.45Å
215L74.5Confident72.9Confident100 Ų100133.7 Ų133.752%0.52460%0.603SS.*Hα-helixtrans-58.4-50.6170.5-73.4170.9000111R211 R217 K218 D219R211-L215 WeakPolarHBondContact O-CB 3.31Å; R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 2.88Å; L215-R217 PolarHBondContact O-N 2.88Å; L215-R217 VanDerWaalsContact O-N 3.14Å; L215-K218 CarbonylContact O-C 3.6Å; L215-K218 WeakPolarHBondContact O-CA 3.45Å; L215-K218 PolarHBondContact O-N 3.15Å; L215-D219 WeakPolarHBondContact O-CB 3.49Å; L215-D219 VanDerWaalsContact O-CG 3.28Å; L215-D219 PolarHBondContact O-N 3.39Å
216T68.7Low70.4Confident86 Ų86130.9 Ų130.953%0.52860%0.6SS.*Hα-helixtrans-56.5-35.5176.5-51.10000112.7R212 L213 T220R212-T216 WeakPolarHBondContact O-CB 3.39Å; R212-T216 PolarHBondContact O-N 3.02Å; R212-T216 PolarHBondContact O-OG1 3.45Å; L213-T216 PolarHBondContact O-N 3.41Å; T216-T220 PolarHBondContact O-N 2.98Å; T216-T220 VanDerWaalsContact O-N 3.07Å; T216-T220 PolarHBondContact O-OG1 3.49Å
217R67.7Low67.8Low187 Ų187135.7 Ų135.771%0.70662%0.618SS**Hα-helixtrans-75.4-19175-75.9180175-172.7-0.9114.3L213 Q214 L215L213-R217 WeakPolarHBondContact O-CB 3.26Å; L213-R217 WeakPolarHBondContact O-CG 3.48Å; L213-R217 PolarHBondContact O-N 2.84Å; Q214-R217 PolarHBondContact O-N 3Å; L215-R217 PolarHBondContact O-N 2.88Å; L215-R217 VanDerWaalsContact O-N 3.14Å
218K60.9Low65Low179 Ų179138.9 Ų138.978%0.77863%0.633SS**Hα-helixtrans-99.7-31.1-178.8-149.1163.3-175176.90111.9Q214 L215Q214-K218 WeakPolarHBondContact O-CB 3.47Å; Q214-K218 PolarHBondContact O-N 3.45Å; L215-K218 CarbonylContact O-C 3.6Å; L215-K218 WeakPolarHBondContact O-CA 3.45Å; L215-K218 PolarHBondContact O-N 3.15Å
219D48.7Very low62.3Low121 Ų121137.3 Ų137.365%0.64764%0.643SS**SBendtrans-84.8-8.1171.3-59.2-31.2000113L215 P221L215-D219 WeakPolarHBondContact O-CB 3.49Å; L215-D219 VanDerWaalsContact O-CG 3.28Å; L215-D219 PolarHBondContact O-N 3.39Å; D219-P221 WeakPolarHBondContact O-CD 3.49Å
220T42.5Very low59.7Low84 Ų84139.4 Ų139.452%0.51566%0.655SS.*SBendtrans-74103.5151.3-54.40000105.4T216 R222T216-T220 PolarHBondContact O-N 2.98Å; T216-T220 VanDerWaalsContact O-N 3.07Å; T216-T220 PolarHBondContact O-OG1 3.49Å; T220-R222 PolarHBondContact O-N 2.98Å
221P50.2Low57.4Low104 Ų104143 Ų14368%0.67567%0.672SS**  trans-57.7121.5173.126.6-34000106.3D219 D223D219-P221 WeakPolarHBondContact O-CD 3.49Å; P221-D223 PolarHBondContact O-N 3.3Å
222R45.9Very low54.7Low202 Ų202142.1 Ų142.176%0.76268%0.682SS**  trans-56.1121.6168.8-71.5-169.5-81.5-164.2-7.3105.4T220 K224T220-R222 PolarHBondContact O-N 2.98Å; R222-K224 HydrophobicContact CB-CD 4.45Å; R222-K224 HydrophobicContact CB-CG 4Å; R222-K224 PolarHBondContact O-N 2.87Å
223D44.8Very low51.9Low115 Ų115144 Ų14462%0.61569%0.69SS**  trans-74.852.6-169.4-144.9-8.7000111.3P221 R225P221-D223 PolarHBondContact O-N 3.3Å; D223-R225 PolarHBondContact O-N 2.91Å
224K48.4Very low49.5Very low150 Ų150145.4 Ų145.465%0.65270%0.702SS**G310 helixtrans-82.80.7-178.3-64.1-165.6171-153.40112.3R222 L226R222-K224 HydrophobicContact CB-CD 4.45Å; R222-K224 HydrophobicContact CB-CG 4Å; R222-K224 PolarHBondContact O-N 2.87Å; K224-L226 VanDerWaalsContact C-N 3.31Å
225R44.8Very low47.5Very low235 Ų235144.3 Ų144.389%0.88770%0.704SS**G310 helixtrans-85-3.9172.8-74.2-174.5174.2167.7-2.8113.1D223 F227D223-R225 PolarHBondContact O-N 2.91Å; R225-F227 VanDerWaalsContact C-N 3.34Å
226L45.4Very low45.6Very low120 Ų120146.4 Ų146.463%0.62872%0.716SS**G310 helixtrans-84.1-7.5173.1-63.5177.3000113.6K224K224-L226 VanDerWaalsContact C-N 3.31Å
227F40Very low44.5Very low195 Ų195151.8 Ų151.886%0.85573%0.732SS**  trans-137.972.7175.9-69.6-78000111.1R225R225-F227 VanDerWaalsContact C-N 3.34Å
228Q38.3Very low43.4Very low157 Ų157150.5 Ų150.573%0.73473%0.734SS**  trans-120.7120.2154.4-174.6171.98.300106.4L230Q228-L230 PolarHBondContact O-N 3.38Å
229P40.9Very low42.8Very low119 Ų119150.3 Ų150.377%0.77374%0.742SS**  trans-55136.1169.3-24.935.2000109.8E231P229-E231 PolarHBondContact O-N 3.3Å; P229-E231 VanDerWaalsContact O-N 3.12Å
230L38.4Very low42.2Very low172 Ų172152.1 Ų152.190%0.90175%0.748SS**  trans-65110.3-179.9-74.8150.6000109.8Q228Q228-L230 PolarHBondContact O-N 3.38Å
231E44.5Very low42.1Very low170 Ų170160 Ų16079%0.79477%0.768SS**  trans-61.2132.7156.5-95.8-101.3119.700108.4P229 W233P229-E231 PolarHBondContact O-N 3.3Å; P229-E231 VanDerWaalsContact O-N 3.12Å; E231-W233 PolarHBondContact O-N 2.95Å
232P38.6Very low41.4Very low106 Ų106163 Ų16369%0.68878%0.779SS**  trans-57.6122.2175.8-25.735.3000111.6T234P232-T234 PolarHBondContact O-N 2.86Å
233W35.4Very low41.1Very low226 Ų226160.2 Ų160.286%0.85678%0.778SS**  trans-70.398.7-178.4-16279000110.5E231 P235E231-W233 PolarHBondContact O-N 2.95Å; W233-P235 HydrophobicContact CE3-CB 4.18Å; W233-P235 HydrophobicContact CE3-CG 3.85Å; W233-P235 HydrophobicContact CH2-CB 4.11Å; W233-P235 HydrophobicContact CZ3-CB 3.62Å; W233-P235 HydrophobicContact CZ3-CG 3.62Å; W233-P235 WeakPolarHBondContact O-CD 3.35Å
234T37.4Very low40.6Very low120 Ų120162.8 Ų162.874%0.73679%0.792SS**PPolyproline II helixtrans-78.9118.816449.40000109P232 D236P232-T234 PolarHBondContact O-N 2.86Å; T234-D236 PolarHBondContact O-N 3.36Å
235P42.1Very low40.2Very low82 Ų82162.7 Ų162.753%0.53280%0.797SS.*PPolyproline II helixtrans-67.7116.3175-10.223.9000109.3W233W233-P235 HydrophobicContact CE3-CB 4.18Å; W233-P235 HydrophobicContact CE3-CG 3.85Å; W233-P235 HydrophobicContact CH2-CB 4.11Å; W233-P235 HydrophobicContact CZ3-CB 3.62Å; W233-P235 HydrophobicContact CZ3-CG 3.62Å; W233-P235 WeakPolarHBondContact O-CD 3.35Å
236D34.1Very low39.6Very low145 Ų145160.8 Ų160.878%0.77580%0.798SS**PPolyproline II helixtrans-71.9141.5169.2-135.5-17.8000109.6T234T234-D236 PolarHBondContact O-N 3.36Å
237K45.4Very low38.8Very low198 Ų198163.4 Ų163.486%0.86181%0.807SS**SBendtrans-107.450.8-160-66.5-176.3-179175.30113.6
238E44.7Very low38.3Very low161 Ų161159.2 Ų159.275%0.75280%0.803SS**SBendtrans-153.1137.9174.434.9-157.1172.300109.6
239D47.6Very low38.4Very low175 Ų175157.3 Ų157.394%0.93680%0.804SS**SBendtrans96.125.5-169.9-60.5-14.1000118.7
240M37.6Very low38Very low159 Ų159159.3 Ų159.378%0.78380%0.803SS**  trans-135.345.5171.5-157.2-179.667.200115.1
241W39.1Very low38Very low248 Ų248156.3 Ų156.394%0.93979%0.793SS**  trans-150.287.8158.1-67.6106.7000110.1
242D36.8Very low37.3Very low168 Ų168154.8 Ų154.890%0.89879%0.791SS**  trans-148.469.1157.5-135.75.4000108.7
243L38.9Very low37.2Very low143 Ų143156.9 Ų156.975%0.74980%0.801SS**  trans-140.676.6177.8-110174.1000108
244D33.1Very low37Very low170 Ų170149.9 Ų149.991%0.90979%0.792SS**  trans-81.9125.9157.2-89.7-20.9000108.5
245I41.5Very low36.8Very low148 Ų148150.4 Ų150.476%0.75980%0.795SS**  trans-136.3113.3-179.3-153.6171.2000109.2
246E30.9Very low37Very low194 Ų194151.5 Ų151.591%0.90780%0.802SS**  trans-171.8154.8167.4-118.4-175.716500108.5
247E30.3Very low37Very low175 Ų175152 Ų15282%0.81880%0.804SS**  -159.8124.9-71164.4168.6-177.700106.2
248S28.7Very low37.1Very low108 Ų108147.6 Ų147.676%0.75580%0.796SS**  trans69.7161.2164-127.50000119.2
249P39.8Very low36.6Very low116 Ų116149.8 Ų149.875%0.75380%0.803SS**  cis-127.1173.5-4.838.5-21.7000116.4
250Q32.9Very low36.1Very low161 Ų161147 Ų14775%0.75280%0.797SS**  trans-57.4152.7171.1-92.4-78.7-44.100114.5N252Q250-N252 VanDerWaalsContact OE1-N 3.1Å
251P38Very low36.2Very low109 Ų109151.3 Ų151.371%0.70881%0.805SS**  -150.7140.692.336.9-18.3000119
252N31.4Very low35.8Very low138 Ų138143.5 Ų143.574%0.73880%0.802SS**  trans36.2122.6136.3-61.5-51.9000122.2Q250Q250-N252 VanDerWaalsContact OE1-N 3.1Å
253V34.8Very low35.7Very low150 Ų150139.1 Ų139.191%0.90980%0.796SS**  -150.6146.8116.8-170.50000110
254A31.9Very low35.8Very low79 Ų79142.6 Ų142.665%0.65381%0.805SS**  trans-77-178.9176.600000113.2
255T33.3Very low36Very low132 Ų132138.3 Ų138.381%0.8180%0.801SS**  cis-165.2-177.132.2-10.90000109
256P45.6Very low35.8Very low105 Ų105140.9 Ų140.968%0.68281%0.81SS**  trans-132.6-160-132.434.3-8.4000116.4
257L34Very low36.2Very low156 Ų156140.3 Ų140.382%0.81780%0.804SS**  trans99.4150158.5-58.2167.4000118.3
258P47.6Very low37.3Very low105 Ų105143.8 Ų143.868%0.68281%0.81SS**  cis-137.8157.7-36.737.1-21.4000115.5
259F35.6Very low38.1Very low206 Ų206147.5 Ų147.590%0.90481%0.813SS**  trans-63.9155.4155.5-107.1-107.5000111.1
260S36.2Very low37.7Very low117 Ų117148.8 Ų148.882%0.81882%0.818SS**  trans-141.3132.3163.1-83.90000112
261R38.8Very low38.2Very low249 Ų249146.6 Ų146.694%0.9482%0.82SS**  trans-127.3114.5-170.9-170.1-172.8-153.4-148.78.3111.2
262G31.1Very low37.8Very low85 Ų85151.8 Ų151.888%0.87683%0.831SS**  trans84.7158.3153.200000118.3
263G35.3Very low37.9Very low75 Ų75148.7 Ų148.777%0.77383%0.832SS**  trans140.479.4157.400000118.9
264K41.7Very low37.7Very low216 Ų216148.5 Ų148.594%0.93983%0.826SS**  trans51.4121.1143.4-64-179.9179.2176.50120.3
265G36Very low37.8Very low80 Ų80149 Ų14983%0.82583%0.829SS**  trans-73.6-173.7-177.600000118.7
266Q38Very low37.9Very low202 Ų202151.4 Ų151.494%0.94483%0.829SS**  trans-146.2150.6171-125.1176.91.300112.3
267K39.9Very low37.5Very low183 Ų183152.7 Ų152.780%0.79683%0.834SS**  trans-83.2138.1-175.3-63.1173.4177.31730112.1
268R52.9Low37.6Very low247 Ų247152.9 Ų152.993%0.93283%0.831SS**  trans-136.3107.3144.1-55.4-176.386.3172.34.9104.9
269K45Very low36.9Very low187 Ų187155.6 Ų155.681%0.81383%0.832SS**  53.984.851.9-79.6-127.7-179.4-176.60113.3
270T31.6Very low37Very low143 Ų143151.2 Ų151.288%0.87783%0.827SS**  trans-140.9118.1142.340.30000109
271C42.7Very low36.8Very low115 Ų115155.9 Ų155.978%0.77783%0.827SS**  trans-136.2117.7169.4-570000108.3
272F31.2Very low36.4Very low218 Ų218147.9 Ų147.996%0.95682%0.821SS**  trans-163129.8157.2-86.2-75.8000103.3
273G33.6Very low36.9Very low72 Ų72152.7 Ų152.774%0.74282%0.818SS**  cis96.5137.228.200000109.2
274N29.4Very low36.7Very low147 Ų147155.1 Ų155.179%0.78682%0.823SS**  cis-172.8144.1-0-174.5-1.5000109.4
275A34.9Very low36.2Very low88 Ų88149.5 Ų149.573%0.72782%0.817SS**  trans-155.7104.1160.500000108.6
276K34.1Very low36Very low184 Ų184155.4 Ų155.480%0.882%0.82SS**  53.412089.8-61.5-179.6-178.61790111.2
277V37.5Very low35.8Very low132 Ų132154.4 Ų154.480%0.882%0.82SS**  cis-154.9126.744.7171.30000108.8
278Q35.6Very low35.2Very low160 Ų160151 Ų15175%0.74882%0.819SS**  41.5150.7108.2-68.2-142.613.300119.5
279K34.8Very low34.9Very low162 Ų162144.6 Ų144.670%0.70481%0.81SS**  cis175.8125.5-18.5172.9-178.3-178.2-179.30110.9
280S35.7Very low34Very low114 Ų114144.7 Ų144.780%0.79781%0.813SS**  trans-172.2114.1150.546.50000108.4
281R33.5Very low34Very low215 Ų215146.8 Ų146.881%0.81181%0.81SS**  72.191.759.1-172178165.2169.2-6.3113.5
282G30.3Very low33.3Very low80 Ų80147.1 Ų147.183%0.82581%0.814SS**  trans-135.1139.8153.500000108.8
283K41.7Very low33.1Very low186 Ų186145 Ų14581%0.80981%0.807SS**  trans-120.9133.4-176.4-76.4-177.2173.5-174.60110.8
284S30.7Very low32.8Very low126 Ų126148.6 Ų148.688%0.88182%0.815SS**  trans178.7167.5148.350.60000108.7
285A30.9Very low33Very low98 Ų98149.9 Ų149.981%0.8182%0.816SS**  -144.3151-56.800000106.7
286K32.1Very low33.2Very low204 Ų204151.2 Ų151.289%0.88782%0.817SS**  trans-73.5141.2-178.4-63.1178.4176.9-178.20111.1
287L33.7Very low32.9Very low181 Ų181145.6 Ų145.695%0.94881%0.812SS**  trans-142.6149.7131.6-78.2-172.2000110.9
288S27.9Very low33Very low111 Ų111145 Ų14578%0.77681%0.814SS**  trans-161.8160.7-176.8-171.90000104.3
289P45.2Very low32.9Very low114 Ų114143.3 Ų143.374%0.7482%0.816SS**  cis-124.1-173.51543.1-24.6000112.1
290Q27.1Very low32.8Very low188 Ų188143 Ų14388%0.87982%0.822SS**  -167.9153.672.6-172.4167.1-33.800111.4
291K32.2Very low32.7Very low187 Ų187146.5 Ų146.581%0.81383%0.826SS**  trans-91.9153.8-179.9-71.3-178169-168.20112.9
292S27.3Very low32.7Very low122 Ų122146.5 Ų146.585%0.85383%0.826SS**  trans-149.9145.5135.849.70000110.2
293E26.9Very low32.8Very low175 Ų175149.8 Ų149.882%0.81882%0.82SS**  trans-92.5146.5179-69.4161.5122.700111.1
294T28.5Very low32.4Very low146 Ų146148 Ų14890%0.89682%0.819SS**  trans-162148.1141.4-62.70000108.9
295E33.7Very low32.3Very low175 Ų175151.8 Ų151.882%0.81881%0.813SS**  trans-70.7174.4-174.2-88.5-74.5113.300114.8
296P37.3Very low32.3Very low115 Ų115152.6 Ų152.675%0.74781%0.813SS**  trans-89.4136.4-145.533.5-37.4000116.4
297G29.1Very low32.5Very low67 Ų67151.1 Ų151.169%0.69181%0.807SS**  trans-116.8131.6163.400000111.4P299G297-P299 WeakPolarHBondContact O-CD 3.14Å
298S38.4Very low32.5Very low120 Ų120149.1 Ų149.184%0.83979%0.792SS**  trans-73.3126.6178.3178.40000112.2
299P34.1Very low32.7Very low123 Ų123149.4 Ų149.480%0.79979%0.79SS**  trans-122.395.4170.729.4-9.3000110.9G297G297-P299 WeakPolarHBondContact O-CD 3.14Å
300N31.9Very low32.9Very low155 Ų155149.1 Ų149.183%0.82979%0.788SS**  trans-10576.4171.4-161.8-9.6000109.9
301Q34.5Very low33.2Very low188 Ų188147.3 Ų147.388%0.87978%0.78SS**  trans-125.5130.3166-86.6-167.1-5.400110.9
302R33.1Very low33.2Very low216 Ų216146.6 Ų146.682%0.81578%0.776SS**  trans-107.289.3-175.7-178.3-178.2-173.3165.50.1108.4L304R302-L304 PolarHBondContact O-N 3.33Å; R302-L304 VanDerWaalsContact O-N 3.11Å
303E32.3Very low33.3Very low149 Ų149145.3 Ų145.370%0.69677%0.767SS**  trans-61.7112.5169.2-76.6-167.3145.400109.9R305E303-R305 PolarHBondContact O-N 3.14Å; E303-R305 IonicContact OE2-CZ 3.78Å; E303-R305 IonicContact OE2-NH1 3.64Å; E303-R305 PolarHBondContact OE2-NH1 3Å; E303-R305 IonicContact OE2-NH2 2.7Å
304L33.1Very low33.6Very low149 Ų149143.4 Ų143.478%0.7877%0.767SS**  trans-7999.4166.5-70.6173.7000108.7R302 S306R302-L304 PolarHBondContact O-N 3.33Å; R302-L304 VanDerWaalsContact O-N 3.11Å; L304-S306 PolarHBondContact O-N 3.48Å
305R29.6Very low34.2Very low204 Ų204142.1 Ų142.177%0.7776%0.762SS**  trans-77.2116165.2-83.2179.1167.263.77.3110.1E303E303-R305 PolarHBondContact O-N 3.14Å; E303-R305 IonicContact OE2-CZ 3.78Å; E303-R305 IonicContact OE2-NH1 3.64Å; E303-R305 PolarHBondContact OE2-NH1 3Å; E303-R305 IonicContact OE2-NH2 2.7Å
306S31.2Very low34Very low115 Ų115138.4 Ų138.480%0.80476%0.761SS**  trans-116.5119.4153.845.10000109.5L304L304-S306 PolarHBondContact O-N 3.48Å
307K35.1Very low33.7Very low173 Ų173144.3 Ų144.375%0.75277%0.768SS**  trans-130.4110.7165.3-80.8-63.3-156.9160.10104.3
308E34.5Very low33.7Very low139 Ų139146.8 Ų146.865%0.6578%0.775SS**  101.3127.881-170.5-170.3121.500110
309T32Very low33.1Very low118 Ų118144.5 Ų144.572%0.72477%0.77SS**  trans143.8159.1134.447.40000112.9
310P49.1Very low32.9Very low108 Ų108143.3 Ų143.370%0.70177%0.771SS**  cis-140.3-167.8-29.234.5-13.6000115
311E32.7Very low32.7Very low150 Ų150142.9 Ų142.970%0.70176%0.764SS**  trans83.5112.3163.6-53.6-93.3116.800116.6
312K33.2Very low32.8Very low171 Ų171143.7 Ų143.774%0.74376%0.759SS**  99.5126.564.2-172.1175.4-172177.40110
313S29.5Very low32.5Very low95 Ų95140.9 Ų140.966%0.66476%0.76SS**  cis-164.9144.925.150.60000115.4
314V32.8Very low32.5Very low135 Ų135138.9 Ų138.982%0.81877%0.769SS**  trans63.3141.2130.3174.80000120.7
315P40.9Very low32.6Very low120 Ų120139.3 Ų139.378%0.77977%0.771SS**  cis-134.9-178.5-33.438.8-18.6000114.3
316A28.7Very low32.7Very low97 Ų97137 Ų13780%0.80277%0.773SS**  trans-80.6162.8-177.300000116.6
317R31Very low32.4Very low239 Ų239138.4 Ų138.490%0.90277%0.771SS**  trans-144.1145.4144.9-75-162.9-179.8-171.71.9110.9
318S29.8Very low32Very low119 Ų119136.2 Ų136.283%0.83278%0.776SS**  trans29.9138.4152.556.60000120.6
319G26.5Very low31.8Very low71 Ų71138 Ų13873%0.73278%0.782SS**  cis164-176.710.400000110.5
320A28.8Very low31.7Very low98 Ų98140.3 Ų140.381%0.8179%0.789SS**  trans-57.9165175.800000112.6
321E29.4Very low30.9Very low147 Ų147143.1 Ų143.169%0.68779%0.793SS**  cis-157.4157.838.1-68.2-174.2100.400114
322R34.8Very low31.5Very low205 Ų205141.1 Ų141.177%0.77479%0.793SS**  trans41.9125.3133.6-64.6175.2-179.8156.5-0.4122.5
323D27.8Very low31.4Very low157 Ų157140.7 Ų140.784%0.8479%0.794SS**  34.9114.2116.8-63.3-44.1000119.9
324A32.4Very low31.4Very low107 Ų107144.7 Ų144.788%0.88481%0.807SS**  trans-151138.2139.900000110.2
325L34.2Very low31.2Very low157 Ų157143.6 Ų143.682%0.82281%0.805SS**  trans-104.5145.2-175.3-83.3170.6000112.2
326L31.4Very low30.5Very low155 Ų155143.7 Ų143.781%0.81281%0.807SS**  trans77.8137.4141-73.3169.2000122.8
327L26.6Very low30.9Very low146 Ų146147 Ų14776%0.76481%0.806SS**  trans81.4110.2135.8-168.467000120
328C26.9Very low31.1Very low126 Ų126143.8 Ų143.885%0.85180%0.803SS**  -151.4147.1113.3-108.10000110.9
329K29.6Very low31.8Very low178 Ų178144.4 Ų144.477%0.77479%0.793SS**  trans-74.1154.8168.7-69.4177.4169.6-174.50109.4
330D29.4Very low33.2Very low165 Ų165149 Ų14988%0.88280%0.801SS**  -157.5134115.7-89.5-29.2000110
331E32.5Very low34.3Very low167 Ų167149.8 Ų149.878%0.7879%0.791SS**  trans-135.6141172.6-94.2-70.7140.600103.7E333E331-E333 PolarHBondContact OE2-N 2.85Å
332P44.5Very low35.8Very low108 Ų108149 Ų14970%0.70180%0.798SS**  -149.4147.181.636-16.7000117.8
333E31.2Very low36.9Very low162 Ų162146.8 Ų146.876%0.75780%0.795SS**  trans68.4102133-67.3171.9-17600119.1E331E331-E333 PolarHBondContact OE2-N 2.85Å
334L30.6Very low38.2Very low180 Ų180148.3 Ų148.394%0.94280%0.799SS**  -135.1118.1113-81.7-174.4000110.4
335S27.9Very low39.6Very low111 Ų111148.6 Ų148.678%0.77680%0.795SS**  trans-76.1124.5178.457.20000112.2
336C27Very low41Very low123 Ų123145.1 Ų145.183%0.83178%0.78SS**  trans-131.6101.8150-86.20000108.1
337Q36.4Very low42.7Very low167 Ų167145 Ų14578%0.7879%0.786SS**  trans-64132.7160.9-71-173.7104.500108.1
338M35.8Very low44.3Very low170 Ų170146 Ų14684%0.83779%0.787SS**  trans-138.3102.3157.2-127.6-179.2-6600107
339E44.7Very low45.9Very low132 Ų132148 Ų14862%0.61779%0.786SS**  trans-43.9158.8-179.9-93.366.7-174.100115.6L341E339-L341 WeakPolarHBondContact O-CD1 3.3Å; E339-L341 PolarHBondContact O-N 3.11Å
340D54.8Low47Very low167 Ų167148.2 Ų148.289%0.89378%0.783SS**  trans-32.7119.4174.5-81.4-49.2000115.1
341L53.1Low48.1Very low115 Ų115148 Ų14860%0.60278%0.781SS**  trans-116.9134.1153.8-66.9102000109.6E339 F343E339-L341 WeakPolarHBondContact O-CD1 3.3Å; E339-L341 PolarHBondContact O-N 3.11Å; L341-F343 HydrophobicContact CB-CD2 3.65Å; L341-F343 HydrophobicContact CB-CE2 3.94Å; L341-F343 HydrophobicContact CD2-CD2 4.14Å; L341-F343 HydrophobicContact CD2-CE2 3.62Å; L341-F343 HydrophobicContact CG-CE2 4.43Å; L341-F343 PolarHBondContact O-N 2.67Å
342P60.1Low48.9Very low130 Ų130144.3 Ų144.384%0.84477%0.772SS**  trans-80.253.7-176.535.4-37.8000112
343F57.8Low49.2Very low160 Ų160145.1 Ų145.170%0.70278%0.779SS**  trans-104.1120175.4-64.6-54.7000110.5L341 S345L341-F343 HydrophobicContact CB-CD2 3.65Å; L341-F343 HydrophobicContact CB-CE2 3.94Å; L341-F343 HydrophobicContact CD2-CD2 4.14Å; L341-F343 HydrophobicContact CD2-CE2 3.62Å; L341-F343 HydrophobicContact CG-CE2 4.43Å; L341-F343 PolarHBondContact O-N 2.67Å; F343-S345 PolarHBondContact O-N 3.11Å
344M55Low49.5Very low189 Ų189148.1 Ų148.193%0.93178%0.784SS**  trans-69.2101.1170.7-67.3-153.674.700109.7
345S61.3Low50.2Low113 Ų113146.5 Ų146.579%0.7978%0.776SS**  trans-80.2128.3167.252.60000109.8F343F343-S345 PolarHBondContact O-N 3.11Å
346T65.4Low50.9Low83 Ų83149.4 Ų149.451%0.50978%0.777SS.*  trans-99.8124.9167.758.60000108.6E348T346-E348 PolarHBondContact O-N 3.31Å; T346-E348 PolarHBondContact OG1-O 3.45Å
347T66.8Low51.9Low153 Ų153148 Ų14894%0.93977%0.767SS**SBendtrans-67.4-20.1173.6-45.80000112
348E58.6Low52.5Low167 Ų167145.8 Ų145.878%0.7877%0.767SS**SBendtrans-77.6127.3173.6-64-170.2171.500111.4T346 Y350T346-E348 PolarHBondContact O-N 3.31Å; T346-E348 PolarHBondContact OG1-O 3.45Å; E348-Y350 PolarHBondContact O-N 3.32Å
349M62.1Low52.7Low168 Ų168145.6 Ų145.683%0.82877%0.768SS**  trans-74.9114.6174.7-173.7175.469.400109.5L351M349-L351 PolarHBondContact O-N 3.49Å
350Y51.4Low52.6Low183 Ų183144.7 Ų144.772%0.71878%0.777SS**  trans-57.5122.8170.6-83.5-93.9000109.8E348 C352E348-Y350 PolarHBondContact O-N 3.32Å; Y350-C352 PolarHBondContact O-N 3.07Å
351L53.1Low52.2Low161 Ų161142.8 Ų142.884%0.84377%0.773SS**  trans-70.672.3167.3-79.4165.1000109.7M349 C353M349-L351 PolarHBondContact O-N 3.49Å; L351-C353 PolarHBondContact O-N 3.02Å
352C49.3Very low51.3Low88 Ų88145 Ų14560%0.59579%0.785SS**  trans-55.3130.2157.8-66.90000107.6Y350 W354Y350-C352 PolarHBondContact O-N 3.07Å; C352-W354 PolarHBondContact O-N 2.66Å
353C50.3Low50.3Low126 Ų126147.3 Ų147.385%0.85178%0.784SS**  trans-6975.2176.1-58.10000110L351 N355L351-C353 PolarHBondContact O-N 3.02Å; C353-N355 PolarHBondContact O-N 3.09Å
354W39Very low49Very low225 Ų225148.4 Ų148.485%0.85279%0.791SS**  trans-70.997173.8-136.5-58.9000107C352 Q356C352-W354 PolarHBondContact O-N 2.66Å; W354-Q356 PolarHBondContact O-N 3.27Å
355N45.5Very low48Very low146 Ų146145.6 Ų145.678%0.78179%0.785SS**PPolyproline II helixtrans-54.9119.4165.2-75.2-37000106.9C353C353-N355 PolarHBondContact O-N 3.09Å
356Q41.5Very low46.7Very low172 Ų172145.1 Ų145.180%0.80478%0.782SS**PPolyproline II helixtrans-49.9124.2176.9-171.6172.611.600108.4W354W354-Q356 PolarHBondContact O-N 3.27Å
357P48.5Very low45.5Very low94 Ų94147.1 Ų147.161%0.6180%0.796SS**PPolyproline II helixtrans-55.6127.2176.3-24.133.4000108.7L359P357-L359 PolarHBondContact O-N 2.82Å
358P48.9Very low44Very low120 Ų120148.9 Ų148.978%0.77979%0.791SS**PPolyproline II helixtrans-58.2138172.925.1-32.6000108.4S360P358-S360 PolarHBondContact O-N 2.9Å
359L40.4Very low43Very low166 Ų166148.5 Ų148.587%0.86979%0.787SS**PPolyproline II helixtrans-53.6123.4-174-64.6171.8000110.3P357P357-L359 PolarHBondContact O-N 2.82Å
360S42.8Very low42.1Very low113 Ų113147.8 Ų147.879%0.7978%0.781SS**PPolyproline II helixtrans-54.5128.9-177.2-54.30000111.1P358P358-S360 PolarHBondContact O-N 2.9Å
361P45.3Very low41.5Very low127 Ų127148.4 Ų148.483%0.82579%0.791SS**PPolyproline II helixtrans-56141167.7-25.235.4000111
362L34.8Very low41Very low160 Ų160148.9 Ų148.984%0.83879%0.788SS**PPolyproline II helixtrans-54.6143.4179.8-175.763.6000111.7E364L362-E364 PolarHBondContact O-N 3.01Å; L362-E364 VanDerWaalsContact O-N 3.12Å
363H38.3Very low40.8Very low180 Ų180150.7 Ų150.783%0.83380%0.796SS**  trans-50.2104.4177.9-146.2-83.2000112.8
364E30.9Very low40.5Very low182 Ų182148.9 Ų148.985%0.8579%0.791SS**  trans-130.4155.3163.8-74.5-160.2150.700111.7L362L362-E364 PolarHBondContact O-N 3.01Å; L362-E364 VanDerWaalsContact O-N 3.12Å
365T34.4Very low40.8Very low130 Ų130143.9 Ų143.980%0.79879%0.79SS**  trans-89147.6-143.850.10000116
366S34.5Very low40.6Very low104 Ų104142.6 Ų142.673%0.72778%0.78SS**  trans-55.2152.8170.283.90000113.4
367P40.2Very low40.7Very low124 Ų124147.3 Ų147.381%0.80579%0.79SS**  trans-121.9145.4130.533.2-25.8000112.8
368K34.9Very low40.5Very low191 Ų191146.6 Ų146.683%0.8378%0.784SS**  trans-84.5160.6171.7-67.5175.8175.1177.20111.2
369K36.6Very low40.5Very low159 Ų159145.6 Ų145.669%0.69178%0.778SS**  trans115104.9162.3-71.9-178.1160-75.70111.6
370E44.4Very low40.6Very low153 Ų153144.6 Ų144.672%0.71577%0.768SS**  76.1100.881.3100.5-156.7163.600111.3
371E39.1Very low41Very low196 Ų196145.5 Ų145.592%0.91677%0.769SS**  trans-158.9142.8136.3-160.1156.3176.700109.2
372E41.9Very low41.2Very low170 Ų170145.1 Ų145.179%0.79476%0.764SS**  trans-84.6146.8-178.7-104.5-176.2102.400112
373V45.3Very low41.7Very low126 Ų126145.7 Ų145.776%0.76476%0.762SS**SBendtrans67.2134.4143.5175.70000118.3
374A43.5Very low42.3Very low89 Ų89145.2 Ų145.274%0.73677%0.766SS**  trans72.362.1166.100000117.7
375S44.6Very low43.3Very low120 Ų120143.6 Ų143.684%0.83976%0.76SS**  trans-156.6173.2137.4-87.70000111.2
376E42Very low44.5Very low119 Ų119144.8 Ų144.856%0.55676%0.76SS**  trans83.665.9172.6-48.6-136.787.200118.6T378 H380E376-T378 WeakPolarHBondContact CA-OG1 3.33Å; E376-T378 WeakPolarHBondContact CB-OG1 3.41Å; E376-T378 VanDerWaalsContact CG-OG1 3.29Å; E376-T378 WeakPolarHBondContact CG-OG1 3.32Å; E376-T378 VanDerWaalsContact OE1-CB 3.31Å; E376-T378 WeakPolarHBondContact OE1-CB 3.39Å; E376-T378 PolarHBondContact OE1-OG1 2.97Å; E376-H380 IonicContact OE1-CE1 3.35Å; E376-H380 IonicContact OE2-CE1 3.45Å; E376-H380 PolarHBondContact OE2-CE1 2.92Å; E376-H380 IonicContact OE2-NE2 2.69Å
377W43.6Very low45.6Very low270 Ų270144.9 Ų144.9100%1.02375%0.752SS**  trans-85.923.7132.9-97.487.1000111.7P379W377-P379 WeakPolarHBondContact O-CD 3.22Å
378T44.4Very low46.8Very low80 Ų80144.3 Ų144.349%0.49175%0.745SS.*  trans-76.3122.3169.73.60000108.4E376 H380E376-T378 WeakPolarHBondContact CA-OG1 3.33Å; E376-T378 WeakPolarHBondContact CB-OG1 3.41Å; E376-T378 VanDerWaalsContact CG-OG1 3.29Å; E376-T378 WeakPolarHBondContact CG-OG1 3.32Å; E376-T378 VanDerWaalsContact OE1-CB 3.31Å; E376-T378 WeakPolarHBondContact OE1-CB 3.39Å; E376-T378 PolarHBondContact OE1-OG1 2.97Å; T378-H380 PolarHBondContact O-N 3.23Å
379P47.8Very low47.8Very low99 Ų99143.4 Ų143.464%0.64374%0.742SS**  trans-64.6121.5167.5-14.929.4000108W377 V381W377-P379 WeakPolarHBondContact O-CD 3.22Å; P379-V381 VanDerWaalsContact C-N 3.34Å; P379-V381 PolarHBondContact O-N 3.38Å
380H43.6Very low49Very low144 Ų144140 Ų14067%0.66774%0.736SS**  trans-64.697.1168.8-65.6-58000109E376 T378 V382E376-H380 IonicContact OE1-CE1 3.35Å; E376-H380 IonicContact OE2-CE1 3.45Å; E376-H380 PolarHBondContact OE2-CE1 2.92Å; E376-H380 IonicContact OE2-NE2 2.69Å; T378-H380 PolarHBondContact O-N 3.23Å; H380-V382 VanDerWaalsContact C-N 3.3Å; H380-V382 PolarHBondContact O-N 3.31Å
381V51.7Low49.9Very low132 Ų132137.2 Ų137.280%0.873%0.733SS**  trans-76.685.5175.7-177.20000108.6P379P379-V381 VanDerWaalsContact C-N 3.34Å; P379-V381 PolarHBondContact O-N 3.38Å
382V48.8Very low51.5Low120 Ų120138.7 Ų138.773%0.72773%0.731SS**  trans-112.397.5167.2-168.90000107.7H380H380-V382 VanDerWaalsContact C-N 3.3Å; H380-V382 PolarHBondContact O-N 3.31Å
383H45.4Very low53.2Low171 Ų171140 Ų14079%0.79273%0.728SS**SBendtrans47.991.2170.1-98.3-71.6000118M385H383-M385 PolarHBondContact O-N 3.03Å
384D50Low54.5Low171 Ų171141.8 Ų141.891%0.91473%0.729SS**SBendtrans463.3148.9-85.78.1000121.8
385M52.3Low55.4Low147 Ų147144 Ų14472%0.72473%0.728SS**  trans-124.290.4177-166.4115.677.700109.5H383 I387H383-M385 PolarHBondContact O-N 3.03Å; M385-I387 HydrophobicContact CG-CD1 4.19Å; M385-I387 HydrophobicContact CG-CG1 3.76Å; M385-I387 PolarHBondContact O-N 3.34Å
386L59.6Low56.5Low155 Ų155146 Ų14681%0.81272%0.724SS**  trans-68.878.1175.4-170.183.2000110.7V388L386-V388 HydrophobicContact CD2-CG2 3.95Å; L386-V388 HydrophobicContact CG-CG2 4.05Å; L386-V388 PolarHBondContact O-N 3.41Å
387I58.7Low58Low107 Ų107147.7 Ų147.755%0.54974%0.735SS.*  trans-75.293.7172.8-58.6180000108.1M385 F389M385-I387 HydrophobicContact CG-CD1 4.19Å; M385-I387 HydrophobicContact CG-CG1 3.76Å; M385-I387 PolarHBondContact O-N 3.34Å; I387-F389 HydrophobicContact CB-CE2 4.2Å; I387-F389 HydrophobicContact CG2-CD2 4.04Å; I387-F389 HydrophobicContact CG2-CE1 4.22Å; I387-F389 HydrophobicContact CG2-CE2 3.69Å; I387-F389 HydrophobicContact CG2-CG 4.45Å; I387-F389 HydrophobicContact CG2-CZ 3.79Å; I387-F389 WeakPolarHBondContact O-CD2 3.34Å; I387-F389 PolarHBondContact O-N 3.11Å; I387-F389 VanDerWaalsContact O-N 3.11Å
388V65.3Low59.6Low111 Ų111142.9 Ų142.967%0.67372%0.724SS**  trans-73.798.7170.9-178.20000108.3L386 P390L386-V388 HydrophobicContact CD2-CG2 3.95Å; L386-V388 HydrophobicContact CG-CG2 4.05Å; L386-V388 PolarHBondContact O-N 3.41Å; V388-P390 VanDerWaalsContact O-CD 3.29Å; V388-P390 WeakPolarHBondContact O-CD 3.48Å
389F55.5Low60.4Low173 Ų173144.6 Ų144.676%0.75974%0.736SS**  trans-66.2118.9173-72.1-87.1000110I387 S391I387-F389 HydrophobicContact CB-CE2 4.2Å; I387-F389 HydrophobicContact CG2-CD2 4.04Å; I387-F389 HydrophobicContact CG2-CE1 4.22Å; I387-F389 HydrophobicContact CG2-CE2 3.69Å; I387-F389 HydrophobicContact CG2-CG 4.45Å; I387-F389 HydrophobicContact CG2-CZ 3.79Å; I387-F389 WeakPolarHBondContact O-CD2 3.34Å; I387-F389 PolarHBondContact O-N 3.11Å; I387-F389 VanDerWaalsContact O-N 3.11Å; F389-S391 PolarHBondContact O-N 3.46Å
390P61.7Low60.9Low87 Ų87147.1 Ų147.157%0.56574%0.744SS**  trans-65129.5176.624.5-33.4000111.1V388 W392V388-P390 VanDerWaalsContact O-CD 3.29Å; V388-P390 WeakPolarHBondContact O-CD 3.48Å; P390-W392 VanDerWaalsContact CG-NE1 3.27Å; P390-W392 PolarHBondContact O-N 2.85Å
391S64.1Low61.8Low94 Ų94148.1 Ų148.166%0.65775%0.746SS**  trans-76.586.5171.8-179.20000109.8F389F389-S391 PolarHBondContact O-N 3.46Å
392W71Confident62.1Low228 Ų228148.1 Ų148.186%0.86474%0.742SS**  trans-73.4136.8163.8-55.881.3000108.3P390P390-W392 VanDerWaalsContact CG-NE1 3.27Å; P390-W392 PolarHBondContact O-N 2.85Å
393R77.6Confident62.4Low197 Ų197150.1 Ų150.174%0.74375%0.748SS**  trans-124.4133.3170.3-63.4-176.7-169-103.1-2.6107.7N395R393-N395 PolarHBondContact O-N 2.85Å; R393-N395 PolarHBondContact O-ND2 2.97Å
394E73.3Confident62.8Low164 Ų164144.6 Ų144.677%0.76673%0.732SS**  trans-66.2123.7175-168.9161.1-157.800108.9
395N63.6Low62.8Low135 Ų135141.2 Ų141.272%0.72272%0.721SS**  trans-108102.9174.3-72.5-94.7000106.4R393 I397R393-N395 PolarHBondContact O-N 2.85Å; R393-N395 PolarHBondContact O-ND2 2.97Å; N395-I397 PolarHBondContact O-N 2.99Å
396H67.5Low63Low162 Ų162141.3 Ų141.375%0.7572%0.724SS**  trans-66.1106.8170.7-70.7-78.8000108.6
397I73.6Confident63.2Low154 Ų154140.7 Ų140.779%0.7972%0.72SS**  trans-84115.3170.7-58.6172.5000106.1N395N395-I397 PolarHBondContact O-N 2.99Å
398E75.3Confident63.9Low169 Ų169141.2 Ų141.279%0.7973%0.731SS**PPolyproline II helixtrans-64.8127.8178.1-165.5172.1-164.500109.6L400E398-L400 PolarHBondContact O-N 3.35Å
399P62.8Low64.3Low117 Ų117141.5 Ų141.576%0.7673%0.725SS**PPolyproline II helixtrans-59.4124.6177.6-24.334.4000110.8K401P399-K401 PolarHBondContact O-N 3.29Å
400L58.3Low65.3Low152 Ų152137 Ų13780%0.79671%0.713SS**PPolyproline II helixtrans-63.5124.3177.2-175.667.2000109.2E398 D402E398-L400 PolarHBondContact O-N 3.35Å; L400-D402 PolarHBondContact O-N 3.46Å
401K61Low66.4Low165 Ų165139.2 Ų139.272%0.71772%0.719SS**PPolyproline II helixtrans-56.3135.8-178.8-64.6177.8-179.3176.10111.2P399 D403 A404P399-K401 PolarHBondContact O-N 3.29Å; K401-D403 PolarHBondContact O-N 2.96Å; K401-A404 PolarHBondContact O-N 3.48Å
402D59.1Low67.6Low132 Ų132139.7 Ų139.771%0.70671%0.714SS**G310 helixtrans-60.4-18.5-168.6-64.4-64.3000115.1L400 A404 C405L400-D402 PolarHBondContact O-N 3.46Å; D402-A404 PolarHBondContact O-N 3.47Å; D402-A404 VanDerWaalsContact O-N 3.1Å; D402-C405 WeakPolarHBondContact O-CB 3.43Å; D402-C405 PolarHBondContact O-N 2.89Å
403D54.9Low68.4Low161 Ų161134.7 Ų134.786%0.86171%0.705SS**G310 helixtrans-66.3-12.1-177-59.8-45.8000114.5K401K401-D403 PolarHBondContact O-N 2.96Å
404A53.7Low69.1Low56 Ų56126.3 Ų126.346%0.46368%0.68SS.*G310 helixtrans-91.9-6.6172.200000113.9K401 D402 N406K401-A404 PolarHBondContact O-N 3.48Å; D402-A404 PolarHBondContact O-N 3.47Å; D402-A404 VanDerWaalsContact O-N 3.1Å; A404-N406 VanDerWaalsContact C-N 3.29Å; A404-N406 PolarHBondContact O-N 2.98Å
405C51.2Low69.8Low99 Ų99120 Ų12067%0.66965%0.652SS**THydrogen-bonded Turntrans-80.91.1-161.8-147.60000115.2D402D402-C405 WeakPolarHBondContact O-CB 3.43Å; D402-C405 PolarHBondContact O-N 2.89Å
406N56Low71Confident150 Ų150117.3 Ų117.380%0.80263%0.634SS**THydrogen-bonded Turntrans-11031-176.7-71.1-72.2000114.1A404 P408A404-N406 VanDerWaalsContact C-N 3.29Å; A404-N406 PolarHBondContact O-N 2.98Å; N406-P408 WeakPolarHBondContact O-CD 3.26Å
407I62.8Low72.2Confident141 Ų141114.9 Ų114.972%0.72363%0.626SS**SBendtrans-97.4107.8162.3-59169.5000106.6E409I407-E409 PolarHBondContact O-N 3.35Å
408P73.8Confident73.1Confident119 Ų119115.2 Ų115.277%0.77362%0.622SS**  trans-60.2111.6174.9-21.133000108.9N406N406-P408 WeakPolarHBondContact O-CD 3.26Å
409E73.1Confident73.9Confident116 Ų116111.1 Ų111.154%0.54260%0.6SS.*  trans-58.7130.2175.2-165.3-172.3175.200107.5I407 L411 R419I407-E409 PolarHBondContact O-N 3.35Å; E409-L411 PolarHBondContact O-N 3.29Å; E409-R419 IonicContact OE1-CZ 3.18Å; E409-R419 IonicContact OE1-NE 3.33Å; E409-R419 PolarHBondContact OE1-NE 3.39Å; E409-R419 IonicContact OE1-NH2 3.49Å; E409-R419 PolarHBondContact OE1-NH2 2.89Å; E409-R419 IonicContact OE2-NH2 2.75Å
410P78Confident75.4Confident80 Ų80110 Ų11052%0.51958%0.584SS.*  trans-6695.6-175.223.7-33.7000110.7D412 T415P410-D412 PolarHBondContact O-N 2.93Å; P410-T415 HydrophobicContact CG-CG2 4.41Å; P410-T415 WeakPolarHBondContact O-CB 3.48Å; P410-T415 PolarHBondContact O-OG1 2.84Å
411L83.1Confident77.1Confident133 Ų133104.7 Ų104.770%0.69656%0.561SS**  trans-68.49.6-179.5-75163.4000114.2E409 F416E409-L411 PolarHBondContact O-N 3.29Å; L411-F416 HydrophobicContact CB-CE2 4.44Å; L411-F416 HydrophobicContact CD2-CE2 3.8Å; L411-F416 HydrophobicContact CD2-CZ 3.82Å
412D89.8Confident78.7Confident103 Ų103105 Ų10555%0.55156%0.563SS**  trans-58.6139.6174.5176.557000111.8P410 G414 T415 F416P410-D412 PolarHBondContact O-N 2.93Å; D412-G414 PolarHBondContact O-N 2.85Å; D412-G414 VanDerWaalsContact O-N 3.14Å; D412-G414 VanDerWaalsContact OD2-CA 3.28Å; D412-G414 WeakPolarHBondContact OD2-CA 3.2Å; D412-G414 PolarHBondContact OD2-N 3.29Å; D412-T415 WeakPolarHBondContact O-CA 3.38Å; D412-T415 VanDerWaalsContact O-CB 3.32Å; D412-T415 WeakPolarHBondContact O-CB 3.45Å; D412-T415 PolarHBondContact O-N 3.22Å; D412-F416 PolarHBondContact O-N 3.29Å
413D88.9Confident80.4Confident123 Ų123104 Ų10466%0.65856%0.557SS**Hα-helixtrans-55.5-34.4178.6-76.3-19.4000111.5T415 F416 L417D413-T415 VanDerWaalsContact C-N 3.27Å; D413-T415 PolarHBondContact O-N 2.81Å; D413-F416 PolarHBondContact O-N 3.04Å; D413-L417 WeakPolarHBondContact O-CB 3.44Å; D413-L417 WeakPolarHBondContact O-CD1 3.03Å; D413-L417 VanDerWaalsContact O-CG 3.32Å; D413-L417 WeakPolarHBondContact O-CG 3.49Å; D413-L417 PolarHBondContact O-N 3.01Å
414G91.6Very high82.3Confident21 Ų21100.3 Ų100.322%0.21653%0.534CS..Hα-helixtrans-62.9-29.5175.200000113.6D412 K418D412-G414 PolarHBondContact O-N 2.85Å; D412-G414 VanDerWaalsContact O-N 3.14Å; D412-G414 VanDerWaalsContact OD2-CA 3.28Å; D412-G414 WeakPolarHBondContact OD2-CA 3.2Å; D412-G414 PolarHBondContact OD2-N 3.29Å; G414-K418 VanDerWaalsContact O-CD 3.25Å; G414-K418 WeakPolarHBondContact O-CD 3.37Å; G414-K418 WeakPolarHBondContact O-CG 3.43Å; G414-K418 PolarHBondContact O-N 3.33Å
415T88.1Confident84.3Confident32 Ų32102.3 Ų102.320%0.19654%0.537CS..Hα-helixtrans-73.4-48.2172.6-52.10000110.5P410 D412 D413 L417 K418 R419P410-T415 HydrophobicContact CG-CG2 4.41Å; P410-T415 WeakPolarHBondContact O-CB 3.48Å; P410-T415 PolarHBondContact O-OG1 2.84Å; D412-T415 WeakPolarHBondContact O-CA 3.38Å; D412-T415 VanDerWaalsContact O-CB 3.32Å; D412-T415 WeakPolarHBondContact O-CB 3.45Å; D412-T415 PolarHBondContact O-N 3.22Å; D413-T415 VanDerWaalsContact C-N 3.27Å; D413-T415 PolarHBondContact O-N 2.81Å; T415-L417 PolarHBondContact O-N 2.96Å; T415-K418 WeakPolarHBondContact O-CB 3.26Å; T415-K418 PolarHBondContact O-N 3.33Å; T415-K418 VanDerWaalsContact O-N 3.14Å; T415-R419 WeakPolarHBondContact O-CG 3.47Å; T415-R419 PolarHBondContact O-N 2.96Å
416F89.4Confident86.5Confident78 Ų78100.9 Ų100.934%0.34252%0.523SS..Hα-helixtrans-58.8-48.1176.5-79.3-86.6000111.9L411 D412 D413 K418 R419 H420L411-F416 HydrophobicContact CB-CE2 4.44Å; L411-F416 HydrophobicContact CD2-CE2 3.8Å; L411-F416 HydrophobicContact CD2-CZ 3.82Å; D412-F416 PolarHBondContact O-N 3.29Å; D413-F416 PolarHBondContact O-N 3.04Å; F416-K418 VanDerWaalsContact C-N 3.26Å; F416-K418 PolarHBondContact O-N 2.96Å; F416-R419 VanDerWaalsContact CG-NH1 3.25Å; F416-R419 PolarHBondContact O-N 2.74Å; F416-R419 VanDerWaalsContact O-N 3.11Å; F416-H420 PolarHBondContact O-CD2 2.86Å; F416-H420 PolarHBondContact O-N 3.15Å
417L92.5Very high88.4Confident111 Ų11197.7 Ų97.758%0.58150%0.503SS*.Hα-helixtrans-53.6-42.2174.5-78.5161.2000111.9D413 T415 A421D413-L417 WeakPolarHBondContact O-CB 3.44Å; D413-L417 WeakPolarHBondContact O-CD1 3.03Å; D413-L417 VanDerWaalsContact O-CG 3.32Å; D413-L417 WeakPolarHBondContact O-CG 3.49Å; D413-L417 PolarHBondContact O-N 3.01Å; T415-L417 PolarHBondContact O-N 2.96Å; L417-A421 WeakPolarHBondContact O-CB 3.34Å; L417-A421 PolarHBondContact O-N 2.9Å
418K91.9Very high90Very high162 Ų16296 Ų9670%0.70449%0.491SS*.Hα-helixtrans-67.4-43.9175.9-72.3164.7-168.9166.10112.6G414 T415 F416 H420G414-K418 VanDerWaalsContact O-CD 3.25Å; G414-K418 WeakPolarHBondContact O-CD 3.37Å; G414-K418 WeakPolarHBondContact O-CG 3.43Å; G414-K418 PolarHBondContact O-N 3.33Å; T415-K418 WeakPolarHBondContact O-CB 3.26Å; T415-K418 PolarHBondContact O-N 3.33Å; T415-K418 VanDerWaalsContact O-N 3.14Å; F416-K418 VanDerWaalsContact C-N 3.26Å; F416-K418 PolarHBondContact O-N 2.96Å; K418-H420 VanDerWaalsContact C-N 3.34Å; K418-H420 PolarHBondContact O-N 3.22Å
419R92Very high91.1Very high83 Ų8398.3 Ų98.331%0.31348%0.484SS..Hα-helixtrans-59.4-44.8176.1-62.8-164-145.391.20.9110.9E409 T415 F416E409-R419 IonicContact OE1-CZ 3.18Å; E409-R419 IonicContact OE1-NE 3.33Å; E409-R419 PolarHBondContact OE1-NE 3.39Å; E409-R419 IonicContact OE1-NH2 3.49Å; E409-R419 PolarHBondContact OE1-NH2 2.89Å; E409-R419 IonicContact OE2-NH2 2.75Å; T415-R419 WeakPolarHBondContact O-CG 3.47Å; T415-R419 PolarHBondContact O-N 2.96Å; F416-R419 VanDerWaalsContact CG-NH1 3.25Å; F416-R419 PolarHBondContact O-N 2.74Å; F416-R419 VanDerWaalsContact O-N 3.11Å
420H93.5Very high92.2Very high94 Ų9498.1 Ų98.144%0.43548%0.478SS..Hα-helixtrans-82.7-24.2-176.3-70.9-76000114.7F416 K418 K422 L423 E424F416-H420 PolarHBondContact O-CD2 2.86Å; F416-H420 PolarHBondContact O-N 3.15Å; K418-H420 VanDerWaalsContact C-N 3.34Å; K418-H420 PolarHBondContact O-N 3.22Å; H420-K422 VanDerWaalsContact C-N 3.28Å; H420-K422 PolarHBondContact O-N 2.94Å; H420-K422 VanDerWaalsContact O-N 3.11Å; H420-L423 PolarHBondContact O-N 3.42Å; H420-E424 PolarHBondContact O-N 3.17Å
421A94.9Very high93.1Very high39 Ų3999.4 Ų99.432%0.32248%0.476SS..Hα-helixtrans-52.1-39.7-175.400000114.3L417 L425L417-A421 WeakPolarHBondContact O-CB 3.34Å; L417-A421 PolarHBondContact O-N 2.9Å; A421-L425 VanDerWaalsContact O-CB 3.29Å; A421-L425 WeakPolarHBondContact O-CB 3.35Å; A421-L425 WeakPolarHBondContact O-CG 3.49Å; A421-L425 PolarHBondContact O-N 2.95Å
422K94.8Very high93.7Very high173 Ų173101.9 Ų101.975%0.75248%0.476SS*.Hα-helixtrans-64.7-45.7177.6-174.4-179.1177.3-1750111.5H420 D426H420-K422 VanDerWaalsContact C-N 3.28Å; H420-K422 PolarHBondContact O-N 2.94Å; H420-K422 VanDerWaalsContact O-N 3.11Å; K422-D426 WeakPolarHBondContact O-CB 3.35Å; K422-D426 PolarHBondContact O-N 2.65Å
423L94.2Very high94Very high110 Ų110105.8 Ų105.858%0.57648%0.483SS*.Hα-helixtrans-69.1-42.5-179.7-64.4175.1000111.4H420 D426 E427H420-L423 PolarHBondContact O-N 3.42Å; L423-D426 PolarHBondContact O-N 3.48Å; L423-E427 PolarHBondContact O-N 2.9Å
424E96.1Very high94.4Very high83 Ų83103 Ų10339%0.38847%0.468SS..Hα-helixtrans-60.6-45.5174-81.2-167-141.600112.6H420 D426 E427 K428H420-E424 PolarHBondContact O-N 3.17Å; E424-D426 VanDerWaalsContact C-N 3.32Å; E424-E427 PolarHBondContact O-N 3.43Å; E424-K428 VanDerWaalsContact O-CB 3.27Å; E424-K428 WeakPolarHBondContact O-CB 3.42Å; E424-K428 WeakPolarHBondContact O-CD 3.35Å; E424-K428 WeakPolarHBondContact O-CG 3.47Å; E424-K428 PolarHBondContact O-N 3.26Å; E424-K428 IonicContact OE2-NZ 2.66Å; E424-K428 PolarHBondContact OE2-NZ 3.42Å
425L95.8Very high94.6Very high98 Ų98106.3 Ų106.351%0.51348%0.48SS..Hα-helixtrans-66-37.8178.8-76.2173.7000111.3A421 K428 R429A421-L425 VanDerWaalsContact O-CB 3.29Å; A421-L425 WeakPolarHBondContact O-CB 3.35Å; A421-L425 WeakPolarHBondContact O-CG 3.49Å; A421-L425 PolarHBondContact O-N 2.95Å; L425-K428 PolarHBondContact O-N 3.25Å; L425-R429 WeakPolarHBondContact O-CB 3.27Å; L425-R429 VanDerWaalsContact O-CG 3.23Å; L425-R429 WeakPolarHBondContact O-CG 3.46Å; L425-R429 PolarHBondContact O-N 3.48Å
426D95.9Very high95Very high70 Ų70109.9 Ų109.937%0.37449%0.494SS..Hα-helixtrans-67-43174.7-173.764.8000112.1K422 L423 E424 R429 R430K422-D426 WeakPolarHBondContact O-CB 3.35Å; K422-D426 PolarHBondContact O-N 2.65Å; L423-D426 PolarHBondContact O-N 3.48Å; E424-D426 VanDerWaalsContact C-N 3.32Å; D426-R429 WeakPolarHBondContact O-CB 3.23Å; D426-R429 PolarHBondContact O-N 2.61Å; D426-R429 VanDerWaalsContact O-N 3.16Å; D426-R430 PolarHBondContact O-N 3.16Å; D426-R430 IonicContact OD2-CZ 2.93Å; D426-R430 IonicContact OD2-NE 3.72Å; D426-R430 PolarHBondContact OD2-NE 2.85Å; D426-R430 IonicContact OD2-NH2 3.97Å; D426-R430 PolarHBondContact OD2-NH2 3.11Å
427E96.4Very high95.3Very high83 Ų83112.3 Ų112.339%0.38850%0.501SS..Hα-helixtrans-63.4-44.5172.7178.8146.2-149.200111.6L423 E424 R429 R430 K431L423-E427 PolarHBondContact O-N 2.9Å; E424-E427 PolarHBondContact O-N 3.43Å; E427-R429 PolarHBondContact O-N 2.82Å; E427-R430 PolarHBondContact O-N 2.82Å; E427-R430 VanDerWaalsContact O-N 3.16Å; E427-K431 HydrophobicContact CG-CG 4.23Å; E427-K431 WeakPolarHBondContact O-CG 3.42Å; E427-K431 PolarHBondContact O-N 3.31Å; E427-K431 WeakPolarHBondContact OE1-CE 3.46Å; E427-K431 IonicContact OE1-NZ 3.84Å; E427-K431 PolarHBondContact OE1-NZ 3.18Å
428K96.9Very high95.5Very high106 Ų106110.6 Ų110.646%0.46149%0.492SS..Hα-helixtrans-58.9-32.4173.6-74.3160.8-178.5162.30111.9E424 L425 R432E424-K428 VanDerWaalsContact O-CB 3.27Å; E424-K428 WeakPolarHBondContact O-CB 3.42Å; E424-K428 WeakPolarHBondContact O-CD 3.35Å; E424-K428 WeakPolarHBondContact O-CG 3.47Å; E424-K428 PolarHBondContact O-N 3.26Å; E424-K428 IonicContact OE2-NZ 2.66Å; E424-K428 PolarHBondContact OE2-NZ 3.42Å; L425-K428 PolarHBondContact O-N 3.25Å; K428-R432 WeakPolarHBondContact O-CD 3.48Å; K428-R432 VanDerWaalsContact O-CG 3.26Å; K428-R432 WeakPolarHBondContact O-CG 3.33Å; K428-R432 PolarHBondContact O-N 3.16Å
429R96.3Very high95.8Very high166 Ų166111 Ų11163%0.62649%0.489SS*.Hα-helixtrans-71.8-49.5171.9-75168.4-177.7-169.31.8111.4L425 D426 E427 K431 R432 W433L425-R429 WeakPolarHBondContact O-CB 3.27Å; L425-R429 VanDerWaalsContact O-CG 3.23Å; L425-R429 WeakPolarHBondContact O-CG 3.46Å; L425-R429 PolarHBondContact O-N 3.48Å; D426-R429 WeakPolarHBondContact O-CB 3.23Å; D426-R429 PolarHBondContact O-N 2.61Å; D426-R429 VanDerWaalsContact O-N 3.16Å; E427-R429 PolarHBondContact O-N 2.82Å; R429-K431 PolarHBondContact O-N 3.42Å; R429-R432 WeakPolarHBondContact O-CB 3.18Å; R429-R432 PolarHBondContact O-N 2.83Å; R429-R432 VanDerWaalsContact O-N 3.11Å; R429-W433 VanDerWaalsContact O-CD1 3.31Å; R429-W433 PolarHBondContact O-N 3.39Å
430R95.5Very high96Very high112 Ų112112.1 Ų112.142%0.42350%0.498SS..Hα-helixtrans-55.6-50.2176.3-80-177.3-86.9119.5-2.5112D426 E427 R432 W433 D434D426-R430 PolarHBondContact O-N 3.16Å; D426-R430 IonicContact OD2-CZ 2.93Å; D426-R430 IonicContact OD2-NE 3.72Å; D426-R430 PolarHBondContact OD2-NE 2.85Å; D426-R430 IonicContact OD2-NH2 3.97Å; D426-R430 PolarHBondContact OD2-NH2 3.11Å; E427-R430 PolarHBondContact O-N 2.82Å; E427-R430 VanDerWaalsContact O-N 3.16Å; R430-R432 VanDerWaalsContact C-N 3.27Å; R430-R432 PolarHBondContact O-N 2.8Å; R430-W433 WeakPolarHBondContact O-CB 3.46Å; R430-W433 PolarHBondContact O-N 2.71Å; R430-D434 PolarHBondContact O-N 3.06Å
431K97.6Very high96.1Very high108 Ų108113.2 Ų113.247%0.4750%0.503SS..Hα-helixtrans-57-38.1176.1-61.3-53.5-175.1-154.50112.5E427 R429 I435E427-K431 HydrophobicContact CG-CG 4.23Å; E427-K431 WeakPolarHBondContact O-CG 3.42Å; E427-K431 PolarHBondContact O-N 3.31Å; E427-K431 WeakPolarHBondContact OE1-CE 3.46Å; E427-K431 IonicContact OE1-NZ 3.84Å; E427-K431 PolarHBondContact OE1-NZ 3.18Å; R429-K431 PolarHBondContact O-N 3.42Å; K431-I435 VanDerWaalsContact O-CB 3.3Å; K431-I435 WeakPolarHBondContact O-CB 3.36Å; K431-I435 WeakPolarHBondContact O-CD1 3.48Å; K431-I435 WeakPolarHBondContact O-CG1 3.42Å; K431-I435 PolarHBondContact O-N 3.37Å
432R96.9Very high96.2Very high185 Ų185118.8 Ų118.870%0.69852%0.516SS*.Hα-helixtrans-66.5-42.3176-72.7170.4-171.3-83.90.8111.8K428 R429 R430 Q436K428-R432 WeakPolarHBondContact O-CD 3.48Å; K428-R432 VanDerWaalsContact O-CG 3.26Å; K428-R432 WeakPolarHBondContact O-CG 3.33Å; K428-R432 PolarHBondContact O-N 3.16Å; R429-R432 WeakPolarHBondContact O-CB 3.18Å; R429-R432 PolarHBondContact O-N 2.83Å; R429-R432 VanDerWaalsContact O-N 3.11Å; R430-R432 VanDerWaalsContact C-N 3.27Å; R430-R432 PolarHBondContact O-N 2.8Å; R432-Q436 WeakPolarHBondContact O-CB 3.19Å; R432-Q436 PolarHBondContact O-N 2.83Å
433W95.6Very high96.2Very high184 Ų184115 Ų11570%0.69751%0.507SS*.Hα-helixtrans-64.5-44.3175.7-83.354.8000112.2R429 R430 Q436 R437R429-W433 VanDerWaalsContact O-CD1 3.31Å; R429-W433 PolarHBondContact O-N 3.39Å; R430-W433 WeakPolarHBondContact O-CB 3.46Å; R430-W433 PolarHBondContact O-N 2.71Å; W433-Q436 WeakPolarHBondContact O-CB 3.21Å; W433-Q436 PolarHBondContact O-N 3.03Å; W433-R437 WeakPolarHBondContact O-CB 3.29Å; W433-R437 PolarHBondContact O-N 3.23Å
434D97.2Very high96.3Very high66 Ų66116.2 Ų116.235%0.35351%0.508SS..Hα-helixtrans-64.9-43.3177-67.2-34.3000111.4R430 Q436 R437 I438R430-D434 PolarHBondContact O-N 3.06Å; D434-Q436 VanDerWaalsContact C-N 3.28Å; D434-Q436 PolarHBondContact O-N 2.99Å; D434-R437 PolarHBondContact O-N 2.83Å; D434-R437 IonicContact OD1-NH1 2.68Å; D434-I438 WeakPolarHBondContact O-CB 3.34Å; D434-I438 WeakPolarHBondContact O-CD1 3.3Å; D434-I438 WeakPolarHBondContact O-CG1 3.4Å; D434-I438 PolarHBondContact O-N 2.93Å
435I94.5Very high96.2Very high89 Ų89117.5 Ų117.546%0.45651%0.514SS..Hα-helixtrans-60.1-39.4173.8-72.9166.1000111.2K431 R439K431-I435 VanDerWaalsContact O-CB 3.3Å; K431-I435 WeakPolarHBondContact O-CB 3.36Å; K431-I435 WeakPolarHBondContact O-CD1 3.48Å; K431-I435 WeakPolarHBondContact O-CG1 3.42Å; K431-I435 PolarHBondContact O-N 3.37Å; I435-R439 VanDerWaalsContact O-CG 3.24Å; I435-R439 WeakPolarHBondContact O-CG 3.4Å; I435-R439 PolarHBondContact O-N 3.32Å; I435-R439 VanDerWaalsContact O-N 3.11Å
436Q96.3Very high96.2Very high108 Ų108120.5 Ų120.551%0.50552%0.518SS..Hα-helixtrans-65.3-50.6175176.9172.1-18.100111.2R432 W433 D434 I438 R439 E440R432-Q436 WeakPolarHBondContact O-CB 3.19Å; R432-Q436 PolarHBondContact O-N 2.83Å; W433-Q436 WeakPolarHBondContact O-CB 3.21Å; W433-Q436 PolarHBondContact O-N 3.03Å; D434-Q436 VanDerWaalsContact C-N 3.28Å; D434-Q436 PolarHBondContact O-N 2.99Å; Q436-I438 VanDerWaalsContact C-N 3.32Å; Q436-I438 PolarHBondContact O-N 3.5Å; Q436-R439 WeakPolarHBondContact O-CA 3.34Å; Q436-R439 WeakPolarHBondContact O-CB 3.34Å; Q436-R439 PolarHBondContact O-N 3.38Å; Q436-E440 HydrophobicContact CG-CG 4.47Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.45Å; Q436-E440 PolarHBondContact NE2-OE1 3.15Å; Q436-E440 WeakPolarHBondContact O-CG 3.36Å; Q436-E440 PolarHBondContact O-N 2.84Å
437R97Very high96.1Very high129 Ų129122.5 Ų122.549%0.48753%0.528SS..Hα-helixtrans-57.1-42.7177.7-171.7-172.8-65156.20.4112W433 D434 R439 E440 Q441W433-R437 WeakPolarHBondContact O-CB 3.29Å; W433-R437 PolarHBondContact O-N 3.23Å; D434-R437 PolarHBondContact O-N 2.83Å; D434-R437 IonicContact OD1-NH1 2.68Å; R437-R439 VanDerWaalsContact C-N 3.34Å; R437-R439 PolarHBondContact O-N 2.75Å; R437-E440 PolarHBondContact O-N 3.28Å; R437-Q441 WeakPolarHBondContact O-CB 3.46Å; R437-Q441 WeakPolarHBondContact O-CG 3.32Å; R437-Q441 PolarHBondContact O-N 3.16Å
438I96.4Very high95.9Very high75 Ų75123 Ų12339%0.38553%0.53SS..Hα-helixtrans-64-37.9176.3-70.1164.8000111.2D434 Q436 R442D434-I438 WeakPolarHBondContact O-CB 3.34Å; D434-I438 WeakPolarHBondContact O-CD1 3.3Å; D434-I438 WeakPolarHBondContact O-CG1 3.4Å; D434-I438 PolarHBondContact O-N 2.93Å; Q436-I438 VanDerWaalsContact C-N 3.32Å; Q436-I438 PolarHBondContact O-N 3.5Å; I438-R442 WeakPolarHBondContact O-CB 3.47Å; I438-R442 WeakPolarHBondContact O-CG 3.47Å; I438-R442 PolarHBondContact O-N 2.89Å
439R97.4Very high95.6Very high171 Ų171123.1 Ų123.165%0.64553%0.533SS*.Hα-helixtrans-66.1-45.1174.7-72.5167.4-178.9-161.60.5111.2I435 Q436 R437 R442 V443I435-R439 VanDerWaalsContact O-CG 3.24Å; I435-R439 WeakPolarHBondContact O-CG 3.4Å; I435-R439 PolarHBondContact O-N 3.32Å; I435-R439 VanDerWaalsContact O-N 3.11Å; Q436-R439 WeakPolarHBondContact O-CA 3.34Å; Q436-R439 WeakPolarHBondContact O-CB 3.34Å; Q436-R439 PolarHBondContact O-N 3.38Å; R437-R439 VanDerWaalsContact C-N 3.34Å; R437-R439 PolarHBondContact O-N 2.75Å; R439-R442 PolarHBondContact O-N 2.97Å; R439-V443 WeakPolarHBondContact O-CG2 3.47Å; R439-V443 PolarHBondContact O-N 3.36Å
440E96.5Very high95.2Very high106 Ų106123.8 Ų123.850%0.49554%0.535SS..Hα-helixtrans-61.4-47.8177.3-70.6166.6-177.300111.3Q436 R437 R442 V443 F444Q436-E440 HydrophobicContact CG-CG 4.47Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.45Å; Q436-E440 PolarHBondContact NE2-OE1 3.15Å; Q436-E440 WeakPolarHBondContact O-CG 3.36Å; Q436-E440 PolarHBondContact O-N 2.84Å; R437-E440 PolarHBondContact O-N 3.28Å; E440-R442 PolarHBondContact O-N 2.87Å; E440-V443 PolarHBondContact O-N 2.99Å; E440-V443 VanDerWaalsContact O-N 3.14Å; E440-F444 WeakPolarHBondContact O-CB 3.46Å; E440-F444 PolarHBondContact O-N 2.75Å
441Q96.4Very high94.6Very high117 Ų117122.5 Ų122.555%0.54754%0.535SS..Hα-helixtrans-57.7-43.5173.6-75.9176-23.900112.5R437 V443 F444 Q445R437-Q441 WeakPolarHBondContact O-CB 3.46Å; R437-Q441 WeakPolarHBondContact O-CG 3.32Å; R437-Q441 PolarHBondContact O-N 3.16Å; Q441-V443 VanDerWaalsContact C-N 3.35Å; Q441-V443 PolarHBondContact O-N 3.34Å; Q441-F444 PolarHBondContact O-N 2.75Å; Q441-Q445 WeakPolarHBondContact O-CB 3.48Å; Q441-Q445 PolarHBondContact O-N 3.11Å
442R97.3Very high93.6Very high156 Ų156120.8 Ų120.859%0.58953%0.531SS*.Hα-helixtrans-65.3-35.2175.9-74.9172.3-178.9-165.81112.6I438 R439 E440 R446I438-R442 WeakPolarHBondContact O-CB 3.47Å; I438-R442 WeakPolarHBondContact O-CG 3.47Å; I438-R442 PolarHBondContact O-N 2.89Å; R439-R442 PolarHBondContact O-N 2.97Å; E440-R442 PolarHBondContact O-N 2.87Å; R442-R446 WeakPolarHBondContact O-CB 3.17Å; R442-R446 WeakPolarHBondContact O-CD 3.47Å; R442-R446 WeakPolarHBondContact O-CG 3.49Å; R442-R446 PolarHBondContact O-N 2.67Å; R442-R446 VanDerWaalsContact O-N 3.14Å
443V94.3Very high92.5Very high94 Ų94121 Ų12157%0.5753%0.532SS*.Hα-helixtrans-68.6-46.1174.31700000110.4R439 E440 Q441 R446 L447R439-V443 WeakPolarHBondContact O-CG2 3.47Å; R439-V443 PolarHBondContact O-N 3.36Å; E440-V443 PolarHBondContact O-N 2.99Å; E440-V443 VanDerWaalsContact O-N 3.14Å; Q441-V443 VanDerWaalsContact C-N 3.35Å; Q441-V443 PolarHBondContact O-N 3.34Å; V443-R446 PolarHBondContact O-N 3.01Å; V443-L447 WeakPolarHBondContact O-CB 3.37Å; V443-L447 PolarHBondContact O-N 2.98Å
444F95.9Very high91Very high135 Ų135120 Ų12059%0.59253%0.533SS*.Hα-helixtrans-59.1-49.4176.4-177.5-94.4000111.8E440 Q441 R446 L447 Q448E440-F444 WeakPolarHBondContact O-CB 3.46Å; E440-F444 PolarHBondContact O-N 2.75Å; Q441-F444 PolarHBondContact O-N 2.75Å; F444-R446 VanDerWaalsContact C-N 3.35Å; F444-R446 PolarHBondContact O-N 3.02Å; F444-L447 WeakPolarHBondContact O-CB 3.28Å; F444-L447 PolarHBondContact O-N 3.39Å; F444-L447 VanDerWaalsContact O-N 3.09Å; F444-Q448 WeakPolarHBondContact O-CB 3.32Å; F444-Q448 PolarHBondContact O-N 2.93Å
445Q94.9Very high89.2Confident110 Ų110123.6 Ų123.651%0.51455%0.545SS..Hα-helixtrans-59.5-42.4177.7-172-176.644.200112.1Q441 L447 Q448 Q449Q441-Q445 WeakPolarHBondContact O-CB 3.48Å; Q441-Q445 PolarHBondContact O-N 3.11Å; Q445-L447 VanDerWaalsContact C-N 3.35Å; Q445-L447 PolarHBondContact O-N 3.25Å; Q445-Q448 PolarHBondContact O-N 3.47Å; Q445-Q449 WeakPolarHBondContact O-CB 3.46Å; Q445-Q449 VanDerWaalsContact O-CG 3.31Å; Q445-Q449 WeakPolarHBondContact O-CG 3.25Å; Q445-Q449 PolarHBondContact O-N 2.92Å
446R95.9Very high87.1Confident161 Ų161124.9 Ų124.961%0.60856%0.557SS**Hα-helixtrans-64.5-37.3174.6-74.5169.6-178.6-173.8-0.4112.5R442 V443 F444 R450R442-R446 WeakPolarHBondContact O-CB 3.17Å; R442-R446 WeakPolarHBondContact O-CD 3.47Å; R442-R446 WeakPolarHBondContact O-CG 3.49Å; R442-R446 PolarHBondContact O-N 2.67Å; R442-R446 VanDerWaalsContact O-N 3.14Å; V443-R446 PolarHBondContact O-N 3.01Å; F444-R446 VanDerWaalsContact C-N 3.35Å; F444-R446 PolarHBondContact O-N 3.02Å; R446-R450 WeakPolarHBondContact O-CG 3.35Å; R446-R450 PolarHBondContact O-N 3.42Å
447L93.3Very high84.8Confident112 Ų112125.3 Ų125.359%0.58657%0.567SS**Hα-helixtrans-68.1-44.3176.4-176.562.3000110.9V443 F444 Q445 Q449 R450 M451V443-L447 WeakPolarHBondContact O-CB 3.37Å; V443-L447 PolarHBondContact O-N 2.98Å; F444-L447 WeakPolarHBondContact O-CB 3.28Å; F444-L447 PolarHBondContact O-N 3.39Å; F444-L447 VanDerWaalsContact O-N 3.09Å; Q445-L447 VanDerWaalsContact C-N 3.35Å; Q445-L447 PolarHBondContact O-N 3.25Å; L447-Q449 PolarHBondContact O-N 3.34Å; L447-R450 WeakPolarHBondContact O-CB 3.07Å; L447-R450 PolarHBondContact O-N 3.13Å; L447-R450 VanDerWaalsContact O-N 3.12Å; L447-M451 PolarHBondContact O-N 3.45Å
448Q92.7Very high82.6Confident93 Ų93126.4 Ų126.444%0.43558%0.577SS.*Hα-helixtrans-61.9-41.4174.9-167.5-179.516.100111.6F444 Q445 R450 M451 N452F444-Q448 WeakPolarHBondContact O-CB 3.32Å; F444-Q448 PolarHBondContact O-N 2.93Å; Q445-Q448 PolarHBondContact O-N 3.47Å; Q448-R450 VanDerWaalsContact C-N 3.35Å; Q448-R450 PolarHBondContact O-N 2.69Å; Q448-M451 PolarHBondContact O-N 2.68Å; Q448-N452 WeakPolarHBondContact O-CB 3.48Å; Q448-N452 PolarHBondContact O-N 2.72Å
449Q89.2Confident80.4Confident108 Ų108131.5 Ų131.551%0.50560%0.599SS.*Hα-helixtrans-61.2-39.8171.5-76.8174.3-8.900112.3Q445 L447 R453Q445-Q449 WeakPolarHBondContact O-CB 3.46Å; Q445-Q449 VanDerWaalsContact O-CG 3.31Å; Q445-Q449 WeakPolarHBondContact O-CG 3.25Å; Q445-Q449 PolarHBondContact O-N 2.92Å; L447-Q449 PolarHBondContact O-N 3.34Å; Q449-R453 VanDerWaalsContact O-CB 3.27Å; Q449-R453 WeakPolarHBondContact O-CB 3.36Å; Q449-R453 VanDerWaalsContact O-CG 3.24Å; Q449-R453 WeakPolarHBondContact O-CG 3.21Å; Q449-R453 PolarHBondContact O-N 2.87Å
450R89.4Confident78.3Confident180 Ų180128.1 Ų128.168%0.67960%0.598SS**Hα-helixtrans-66.6-38.5174.4-74.1173177-165.4-2.4112.3R446 L447 Q448 K454R446-R450 WeakPolarHBondContact O-CG 3.35Å; R446-R450 PolarHBondContact O-N 3.42Å; L447-R450 WeakPolarHBondContact O-CB 3.07Å; L447-R450 PolarHBondContact O-N 3.13Å; L447-R450 VanDerWaalsContact O-N 3.12Å; Q448-R450 VanDerWaalsContact C-N 3.35Å; Q448-R450 PolarHBondContact O-N 2.69Å; R450-K454 WeakPolarHBondContact O-CG 3.39Å; R450-K454 PolarHBondContact O-N 3.35Å; R450-K454 VanDerWaalsContact O-N 3.16Å
451M82.3Confident76.4Confident85 Ų85131.2 Ų131.242%0.41961%0.613SS.*Hα-helixtrans-65.6-50.2174.6-174.8-157.270.100110.9L447 Q448 R453 K454 K455L447-M451 PolarHBondContact O-N 3.45Å; Q448-M451 PolarHBondContact O-N 2.68Å; M451-R453 PolarHBondContact O-N 3.33Å; M451-K454 WeakPolarHBondContact O-CB 3.29Å; M451-K454 PolarHBondContact O-N 2.98Å; M451-K454 VanDerWaalsContact O-N 3.08Å; M451-K455 HydrophobicContact CE-CD 4.36Å; M451-K455 PolarHBondContact O-N 2.94Å
452N76.1Confident74.7Confident72 Ų72130.3 Ų130.339%0.38562%0.617SS.*Hα-helixtrans-62.5-43.2179.4-73.1-9.1000111.3Q448 K454 K455 T456Q448-N452 WeakPolarHBondContact O-CB 3.48Å; Q448-N452 PolarHBondContact O-N 2.72Å; N452-K454 PolarHBondContact O-N 2.92Å; N452-K455 CarbonylContact O-C 3.57Å; N452-K455 WeakPolarHBondContact O-CA 3.39Å; N452-K455 PolarHBondContact O-N 2.86Å; N452-T456 PolarHBondContact O-N 3.01Å; N452-T456 PolarHBondContact O-OG1 2.75Å; N452-T456 VanDerWaalsContact O-OG1 3.07Å
453R73.3Confident73.1Confident191 Ų191131.4 Ų131.472%0.72163%0.628SS**Hα-helixtrans-60.9-29.8173.5-75.4-177.868.4-172.71.4113.5Q449 M451 V457Q449-R453 VanDerWaalsContact O-CB 3.27Å; Q449-R453 WeakPolarHBondContact O-CB 3.36Å; Q449-R453 VanDerWaalsContact O-CG 3.24Å; Q449-R453 WeakPolarHBondContact O-CG 3.21Å; Q449-R453 PolarHBondContact O-N 2.87Å; M451-R453 PolarHBondContact O-N 3.33Å; R453-V457 VanDerWaalsContact O-CB 3.29Å; R453-V457 WeakPolarHBondContact O-CB 3.45Å; R453-V457 WeakPolarHBondContact O-CG2 3.46Å; R453-V457 PolarHBondContact O-N 3.14Å
454K64.6Low71.6Confident163 Ų163133.2 Ų133.271%0.70963%0.634SS**Hα-helixtrans-71.8-36.8171.5-75.2178.6173-1630112.1R450 M451 N452 Q458R450-K454 WeakPolarHBondContact O-CG 3.39Å; R450-K454 PolarHBondContact O-N 3.35Å; R450-K454 VanDerWaalsContact O-N 3.16Å; M451-K454 WeakPolarHBondContact O-CB 3.29Å; M451-K454 PolarHBondContact O-N 2.98Å; M451-K454 VanDerWaalsContact O-N 3.08Å; N452-K454 PolarHBondContact O-N 2.92Å; K454-Q458 PolarHBondContact O-N 3.27Å
455K60Low70.2Confident140 Ų140132.7 Ų132.761%0.60965%0.648SS**Hα-helixtrans-69.9-41.8175.6-65.4-176.3177.6-168.70112.4M451 N452 V457 Q458M451-K455 HydrophobicContact CE-CD 4.36Å; M451-K455 PolarHBondContact O-N 2.94Å; N452-K455 CarbonylContact O-C 3.57Å; N452-K455 WeakPolarHBondContact O-CA 3.39Å; N452-K455 PolarHBondContact O-N 2.86Å; K455-V457 VanDerWaalsContact C-N 3.31Å; K455-V457 PolarHBondContact O-N 3.29Å; K455-Q458 PolarHBondContact O-N 3.14Å
456T48.9Very low69.1Low116 Ų116130.1 Ų130.171%0.71264%0.642SS**THydrogen-bonded Turntrans-78.1-9.8179.2-470000113.8N452N452-T456 PolarHBondContact O-N 3.01Å; N452-T456 PolarHBondContact O-OG1 2.75Å; N452-T456 VanDerWaalsContact O-OG1 3.07Å
457V48.7Very low67.9Low117 Ų117130.6 Ų130.671%0.70965%0.648SS**THydrogen-bonded Turntrans-103.2-0.3173.2176.10000111.7R453 K455R453-V457 VanDerWaalsContact O-CB 3.29Å; R453-V457 WeakPolarHBondContact O-CB 3.45Å; R453-V457 WeakPolarHBondContact O-CG2 3.46Å; R453-V457 PolarHBondContact O-N 3.14Å; K455-V457 VanDerWaalsContact C-N 3.31Å; K455-V457 PolarHBondContact O-N 3.29Å
458Q51.7Low67Low153 Ų153134.6 Ų134.672%0.71566%0.657SS**  trans-104.557.4155.7-78.3-167.5-27.400109.7K454 K455 T460K454-Q458 PolarHBondContact O-N 3.27Å; K455-Q458 PolarHBondContact O-N 3.14Å; Q458-T460 PolarHBondContact O-N 3.27Å
459E48.8Very low66.2Low181 Ų181134.8 Ų134.885%0.84667%0.667SS**  trans-69.6100.4130.2-159.8165.8-133.500103.7E461E459-E461 PolarHBondContact O-N 3.47Å
460T54.8Low65.8Low100 Ų100136.1 Ų136.161%0.61367%0.673SS**  trans-61.4105.5171.8430000105.9Q458Q458-T460 PolarHBondContact O-N 3.27Å
461E55.4Low65.2Low172 Ų172133.8 Ų133.880%0.80468%0.679SS**  trans-45.6120.2160.6-177.6177.7-138.200105.4E459 E463E459-E461 PolarHBondContact O-N 3.47Å; E461-E463 PolarHBondContact O-N 3.21Å
462P62Low65.2Low97 Ų97138.1 Ų138.163%0.6370%0.698SS**  trans-57.2115.3-17021.1-32.2000107L464P462-L464 PolarHBondContact O-N 2.9Å
463E63.3Low65.5Low179 Ų179139.7 Ų139.784%0.83671%0.706SS**  trans-59.3106.2-177.1-70.2-174164.400106.5E461 S465E461-E463 PolarHBondContact O-N 3.21Å; E463-S465 PolarHBondContact O-N 2.93Å
464L63.2Low66.1Low132 Ų132134.8 Ų134.869%0.69170%0.697SS**  trans-69.675.2-175.2-69178000109.2P462 S466P462-L464 PolarHBondContact O-N 2.9Å; L464-S466 PolarHBondContact O-N 3.11Å
465S66.9Low67.1Low125 Ų125136.6 Ų136.687%0.87471%0.708SS**  trans-68.3-19.6177.5600000111.9E463E463-S465 PolarHBondContact O-N 2.93Å
466S71Confident68.3Low56 Ų56133.5 Ų133.539%0.39271%0.709SS.*  trans-141.8143.5179.81790000110.8L464 Y468L464-S466 PolarHBondContact O-N 3.11Å; S466-Y468 WeakPolarHBondContact OG-CB 3.29Å; S466-Y468 PolarHBondContact OG-N 3Å; S466-Y468 PolarHBondContact OG-O 3.47Å; S466-Y468 VanDerWaalsContact OG-O 3.11Å
467F69.8Low70Confident170 Ų170135.3 Ų135.375%0.74671%0.712SS**SBendtrans-92.9-1.7165.2-71.6-78.2000112.8
468Y75.2Confident71.6Confident196 Ų196135.2 Ų135.277%0.76971%0.712SS**SBendtrans-90.7139.9172.8-65.7-83.9000109.9S466S466-Y468 WeakPolarHBondContact OG-CB 3.29Å; S466-Y468 PolarHBondContact OG-N 3Å; S466-Y468 PolarHBondContact OG-O 3.47Å; S466-Y468 VanDerWaalsContact OG-O 3.11Å
469P76.9Confident73.2Confident98 Ų98135.6 Ų135.664%0.63672%0.717SS**PPolyproline II helixtrans-61.5156.217528.6-35.7000111.3D473P469-D473 HydrophobicContact CB-CB 4.29Å
470E78.9Confident74.8Confident136 Ų136130.3 Ų130.364%0.63670%0.697SS**PPolyproline II helixtrans-72.9158177.6-62-169.1-179.600110.6E472 D473E470-E472 PolarHBondContact O-N 2.79Å; E470-E472 VanDerWaalsContact O-N 3.12Å; E470-D473 PolarHBondContact N-OD2 3.03Å; E470-D473 PolarHBondContact O-N 2.83Å; E470-D473 VanDerWaalsContact O-N 3.08Å
471T78.3Confident76.4Confident131 Ų131131.7 Ų131.780%0.80471%0.708SS**THydrogen-bonded Turntrans-65.7-16.2-177.845.60000113.5
472E82.5Confident77.8Confident176 Ų176130.4 Ų130.482%0.82270%0.7SS**THydrogen-bonded Turntrans-84.9-21.1177.1-56.7-171.4-17400112.2E470 V474E470-E472 PolarHBondContact O-N 2.79Å; E470-E472 VanDerWaalsContact O-N 3.12Å; E472-V474 VanDerWaalsContact C-N 3.3Å; E472-V474 PolarHBondContact O-N 3.29Å
473D82.6Confident78.8Confident105 Ų105133.7 Ų133.756%0.56171%0.711SS**SBendtrans-83.42.4-179.9-61.9-38.9000113.9P469 E470 E475P469-D473 HydrophobicContact CB-CB 4.29Å; E470-D473 PolarHBondContact N-OD2 3.03Å; E470-D473 PolarHBondContact O-N 2.83Å; E470-D473 VanDerWaalsContact O-N 3.08Å; D473-E475 PolarHBondContact O-N 3.18Å
474V83.9Confident79.8Confident88 Ų88127.9 Ų127.953%0.53369%0.69SS.*  trans-81.386.5-170.8-174.50000111.3E472E472-V474 VanDerWaalsContact C-N 3.3Å; E472-V474 PolarHBondContact O-N 3.29Å
475E86.5Confident81.1Confident200 Ų200126.8 Ų126.894%0.93569%0.688SS**  trans-65.2-38.3178.6-63.4-175161.100113.9D473D473-E475 PolarHBondContact O-N 3.18Å
476A85.3Confident82.1Confident75 Ų75124.7 Ų124.762%0.6267%0.67SS**  trans-155.7149.3-173.700000113.6
477I83.6Confident82.8Confident154 Ų154123.9 Ų123.979%0.7967%0.666SS**  trans-102111.9173.7-58.2175.5000109.2
478V82.9Confident83.5Confident115 Ų115125.3 Ų125.370%0.69767%0.672SS**  trans-97.9110.7178.1-172.40000110.4T480V478-T480 HydrophobicContact CG1-CG2 4.11Å; V478-T480 PolarHBondContact O-N 3.07Å
479I86.7Confident83.9Confident162 Ų162118.5 Ų118.583%0.83166%0.662SS**  trans-82.3105.4173.8-56.2176.8000108.6
480T81.5Confident84.2Confident69 Ų69123.2 Ų123.242%0.42367%0.667SS.*  trans-104.1135.2174.238.10000110.6V478 F482V478-T480 HydrophobicContact CG1-CG2 4.11Å; V478-T480 PolarHBondContact O-N 3.07Å; T480-F482 PolarHBondContact O-N 2.75Å; T480-F482 PolarHBondContact OG1-O 2.87Å
481P88.1Confident84.6Confident130 Ų130120.7 Ų120.784%0.84466%0.663SS**SBendtrans-76.9-3.9177.330.9-33.8000113.2
482F84.2Confident85.2Confident144 Ų144119.3 Ų119.363%0.63265%0.65SS**SBendtrans-130.3129.5174.853.8-92.8000109.4T480T480-F482 PolarHBondContact O-N 2.75Å; T480-F482 PolarHBondContact OG1-O 2.87Å
483L83.9Confident85.5Confident166 Ų166115.3 Ų115.387%0.86964%0.639SS**PPolyproline II helixtrans-80.3120.8173.2-172.770.8000108.7
484P84.3Confident85.8Confident58 Ų58120.6 Ų120.638%0.37766%0.657SS.*PPolyproline II helixtrans-68.8144.4178.128.2-34.2000111.1V486 P491P484-V486 HydrophobicContact CG-CG2 4.39Å; P484-V486 PolarHBondContact O-N 2.99Å; P484-P491 HydrophobicContact CB-CB 3.91Å; P484-P491 HydrophobicContact CG-CB 4.46Å
485V89.8Confident86Confident108 Ų108123.7 Ų123.766%0.65567%0.67SS**PPolyproline II helixtrans-73.2121168.7-175.50000108.1L492V485-L492 HydrophobicContact CB-CD1 4.22Å; V485-L492 HydrophobicContact CG1-CD1 3.69Å; V485-L492 HydrophobicContact CG1-CG 4.46Å; V485-L492 PolarHBondContact O-N 3.02Å
486V88.1Confident86.2Confident82 Ų82118.2 Ų118.250%0.49765%0.654SS.*EExtended strand (participates in β ladder)trans-109.4138.2-173.6169.20000110.6P484 R490P484-V486 HydrophobicContact CG-CG2 4.39Å; P484-V486 PolarHBondContact O-N 2.99Å; V486-R490 CarbonylContact C-O 3.57Å; V486-R490 WeakPolarHBondContact CA-O 3.45Å
487A86.3Confident86.6Confident38 Ų38124.2 Ų124.231%0.31467%0.669SS.*EExtended strand (participates in β ladder)trans-131.1136.7166.800000109.1G489 R490 L492A487-G489 PolarHBondContact O-N 2.81Å; A487-R490 PolarHBondContact N-O 3.14Å; A487-R490 PolarHBondContact O-N 3.24Å; A487-L492 HydrophobicContact CB-CD2 3.67Å; A487-L492 HydrophobicContact CB-CG 4.28Å
488F84.1Confident86.9Confident200 Ų200124.2 Ų124.288%0.87767%0.666SS**THydrogen-bonded Turntrans5042-177.3-51.2-74.1000113.8R490F488-R490 PolarHBondContact O-N 2.75Å
489G83.9Confident87.3Confident54 Ų54125.7 Ų125.756%0.55767%0.67SS**THydrogen-bonded Turntrans72.30.8-179.700000115.6A487A487-G489 PolarHBondContact O-N 2.81Å
490R82.4Confident87.3Confident196 Ų196126.7 Ų126.774%0.7467%0.668SS**EExtended strand (participates in β ladder)trans-118143.5178.2-62.5-170.9178.3-154.7-2.5112.3V486 A487 F488V486-R490 CarbonylContact C-O 3.57Å; V486-R490 WeakPolarHBondContact CA-O 3.45Å; A487-R490 PolarHBondContact N-O 3.14Å; A487-R490 PolarHBondContact O-N 3.24Å; F488-R490 PolarHBondContact O-N 2.75Å
491P88.8Confident87.5Confident84 Ų84128.7 Ų128.755%0.54567%0.673SS.*EExtended strand (participates in β ladder)trans-62.7137.617428-35.1000110.2P484P484-P491 HydrophobicContact CB-CB 3.91Å; P484-P491 HydrophobicContact CG-CB 4.46Å
492L89.4Confident87.4Confident101 Ų101125.1 Ų125.153%0.52965%0.646SS.*PPolyproline II helixtrans-62.1129.6-180-75.6177.1000110.8V485 A487V485-L492 HydrophobicContact CB-CD1 4.22Å; V485-L492 HydrophobicContact CG1-CD1 3.69Å; V485-L492 HydrophobicContact CG1-CG 4.46Å; V485-L492 PolarHBondContact O-N 3.02Å; A487-L492 HydrophobicContact CB-CD2 3.67Å; A487-L492 HydrophobicContact CB-CG 4.28Å
493P89.7Confident87.4Confident92 Ų92124.2 Ų124.260%0.59766%0.655SS**PPolyproline II helixtrans-68.8151.4175.429.6-34.7000110.9L495P493-L495 HydrophobicContact CG-CD2 4.12Å; P493-L495 HydrophobicContact CG-CG 4.45Å; P493-L495 PolarHBondContact O-N 2.77Å
494K88.1Confident87.4Confident216 Ų216125.1 Ų125.194%0.93965%0.647SS**  trans-73.596.3171.3-66.9-178.2-179.5179.10109.4
495L88.8Confident87.3Confident153 Ų153125 Ų12580%0.80164%0.643SS**PPolyproline II helixtrans-81139.3173.7-58.5179000110.3P493P493-L495 HydrophobicContact CG-CD2 4.12Å; P493-L495 HydrophobicContact CG-CG 4.45Å; P493-L495 PolarHBondContact O-N 2.77Å
496S91.4Very high86.8Confident86 Ų86125.7 Ų125.760%0.60164%0.643SS**PPolyproline II helixtrans-78.4149166.253.20000110.2Q498S496-Q498 PolarHBondContact O-N 2.68Å; S496-Q498 PolarHBondContact OG-NE2 2.93Å
497Q92.8Very high86Confident201 Ų201127.7 Ų127.794%0.93965%0.647SS**PPolyproline II helixtrans-67.3120.9177.5-176.9177.3-11.200109.9
498Q90.1Very high85Confident154 Ų154137 Ų13772%0.7267%0.674SS**  trans-139.3159.4177.5-61.9-174.217.300109.5S496S496-Q498 PolarHBondContact O-N 2.68Å; S496-Q498 PolarHBondContact OG-NE2 2.93Å
499N90.1Very high84.1Confident146 Ų146129.6 Ų129.678%0.78165%0.647SS**  trans-73.5151.7171.3-67.9-47.8000110.2E501N499-E501 PolarHBondContact O-N 3.4Å
500F88.2Confident83.1Confident182 Ų182130.3 Ų130.380%0.79863%0.633SS**  trans-73.2119.5175176.8-96.7000110.4L502F500-L502 HydrophobicContact CE1-CD2 3.5Å; F500-L502 VanDerWaalsContact CE1-CD2 3.5Å; F500-L502 HydrophobicContact CE1-CG 3.99Å; F500-L502 HydrophobicContact CZ-CD2 3.46Å; F500-L502 VanDerWaalsContact CZ-CD2 3.46Å; F500-L502 HydrophobicContact CZ-CG 4.41Å
501E86.2Confident81.9Confident112 Ų112125.2 Ų125.252%0.52363%0.626SS.*  trans-122.7140.8176.1-67-173.2-161.400110.7N499 R510N499-E501 PolarHBondContact O-N 3.4Å; E501-R510 IonicContact OE1-NH2 3.99Å; E501-R510 IonicContact OE2-CZ 3.44Å; E501-R510 IonicContact OE2-NH1 3.59Å; E501-R510 PolarHBondContact OE2-NH1 3.02Å; E501-R510 IonicContact OE2-NH2 2.92Å; E501-R510 PolarHBondContact OE2-NH2 2.59Å
502L85.8Confident80.3Confident54 Ų54131.3 Ų131.328%0.28364%0.638SS.*  trans-85.8121.9174.1-66.5179.9000109.4F500 W504 L505F500-L502 HydrophobicContact CE1-CD2 3.5Å; F500-L502 VanDerWaalsContact CE1-CD2 3.5Å; F500-L502 HydrophobicContact CE1-CG 3.99Å; F500-L502 HydrophobicContact CZ-CD2 3.46Å; F500-L502 VanDerWaalsContact CZ-CD2 3.46Å; F500-L502 HydrophobicContact CZ-CG 4.41Å; L502-W504 HydrophobicContact CB-CD2 4.28Å; L502-W504 HydrophobicContact CB-CZ2 4.15Å; L502-W504 HydrophobicContact CD1-CZ2 3.86Å; L502-W504 HydrophobicContact CD2-CH2 3.75Å; L502-W504 HydrophobicContact CD2-CZ2 3.76Å; L502-W504 HydrophobicContact CD2-CZ3 4.43Å; L502-W504 HydrophobicContact CG-CZ2 4.15Å; L502-W504 PolarHBondContact O-N 3.11Å; L502-L505 HydrophobicContact CB-CB 4.3Å; L502-L505 HydrophobicContact CB-CD1 4.08Å; L502-L505 HydrophobicContact CB-CG 4.02Å; L502-L505 HydrophobicContact CD1-CD1 3.81Å; L502-L505 HydrophobicContact CD1-CG 4.32Å; L502-L505 HydrophobicContact CG-CD1 4.38Å; L502-L505 PolarHBondContact O-N 3.23Å
503P82.9Confident78.8Confident125 Ų125132.9 Ų132.981%0.81265%0.646SS**THydrogen-bonded Turntrans-60.3-13.1-174.3-27.335.3000116.2
504W84.8Confident77.2Confident186 Ų186136.6 Ų136.671%0.70566%0.655SS**THydrogen-bonded Turntrans-107.55.2179.762.382.2000113.7L502L502-W504 HydrophobicContact CB-CD2 4.28Å; L502-W504 HydrophobicContact CB-CZ2 4.15Å; L502-W504 HydrophobicContact CD1-CZ2 3.86Å; L502-W504 HydrophobicContact CD2-CH2 3.75Å; L502-W504 HydrophobicContact CD2-CZ2 3.76Å; L502-W504 HydrophobicContact CD2-CZ3 4.43Å; L502-W504 HydrophobicContact CG-CZ2 4.15Å; L502-W504 PolarHBondContact O-N 3.11Å
505L81.9Confident75.8Confident56 Ų56130.9 Ų130.929%0.29364%0.638SS.*  trans-10298.2172-72.2-174.6000110.1L502 R510L502-L505 HydrophobicContact CB-CB 4.3Å; L502-L505 HydrophobicContact CB-CD1 4.08Å; L502-L505 HydrophobicContact CB-CG 4.02Å; L502-L505 HydrophobicContact CD1-CD1 3.81Å; L502-L505 HydrophobicContact CD1-CG 4.32Å; L502-L505 HydrophobicContact CG-CD1 4.38Å; L502-L505 PolarHBondContact O-N 3.23Å; L505-R510 PolarHBondContact O-NH1 2.87Å
506D78.6Confident74.4Confident121 Ų121128.8 Ų128.865%0.64763%0.634SS**  trans-55151.8170.6-66.2-19.6000111.2R508 S509 R510D506-R508 PolarHBondContact O-N 2.96Å; D506-S509 PolarHBondContact N-OG 2.7Å; D506-S509 WeakPolarHBondContact O-CA 3.31Å; D506-S509 WeakPolarHBondContact O-CB 3.15Å; D506-S509 PolarHBondContact O-N 3.33Å; D506-S509 PolarHBondContact O-OG 3.01Å; D506-R510 PolarHBondContact O-N 3.05Å
507E71.8Confident73Confident124 Ų124134.8 Ų134.858%0.57965%0.649SS**Hα-helixtrans-46.4-39.9175.5-152.964.7-99.400113S509 R510 C511E507-S509 VanDerWaalsContact C-N 3.27Å; E507-S509 PolarHBondContact O-N 3.12Å; E507-R510 WeakPolarHBondContact O-CB 3.34Å; E507-R510 PolarHBondContact O-N 3.47Å; E507-R510 VanDerWaalsContact O-N 3.16Å; E507-R510 IonicContact OE1-CZ 2.68Å; E507-R510 IonicContact OE1-NE 2.75Å; E507-R510 PolarHBondContact OE1-NE 2.98Å; E507-R510 IonicContact OE1-NH2 3.32Å; E507-R510 PolarHBondContact OE1-NH2 3.21Å; E507-R510 IonicContact OE2-CZ 3.15Å; E507-R510 IonicContact OE2-NE 3.67Å; E507-R510 IonicContact OE2-NH2 2.76Å; E507-R510 PolarHBondContact OE2-NH2 3.21Å; E507-C511 PolarHBondContact O-N 2.97Å; E507-C511 PolarHBondContact O-SG 3.05Å
508R66.6Low71.4Confident234 Ų234134.3 Ų134.388%0.88364%0.644SS**Hα-helixtrans-63.2-29177.2-109.1179174.4-164.6-1.5114.3D506D506-R508 PolarHBondContact O-N 2.96Å
509S64.4Low70Confident45 Ų45134.1 Ų134.132%0.31564%0.643SS.*Hα-helixtrans-75.7-37176-24.70000111.1D506 E507 R512D506-S509 PolarHBondContact N-OG 2.7Å; D506-S509 WeakPolarHBondContact O-CA 3.31Å; D506-S509 WeakPolarHBondContact O-CB 3.15Å; D506-S509 PolarHBondContact O-N 3.33Å; D506-S509 PolarHBondContact O-OG 3.01Å; E507-S509 VanDerWaalsContact C-N 3.27Å; E507-S509 PolarHBondContact O-N 3.12Å; S509-R512 PolarHBondContact O-N 2.99Å
510R62Low68.4Low68 Ų68132.7 Ų132.726%0.25764%0.639SS.*Hα-helixtrans-61.3-45.7-177.1-60.3-164.7-97.3-131.528.7111.4E501 L505 D506 E507 R512 I513E501-R510 IonicContact OE1-NH2 3.99Å; E501-R510 IonicContact OE2-CZ 3.44Å; E501-R510 IonicContact OE2-NH1 3.59Å; E501-R510 PolarHBondContact OE2-NH1 3.02Å; E501-R510 IonicContact OE2-NH2 2.92Å; E501-R510 PolarHBondContact OE2-NH2 2.59Å; L505-R510 PolarHBondContact O-NH1 2.87Å; D506-R510 PolarHBondContact O-N 3.05Å; E507-R510 WeakPolarHBondContact O-CB 3.34Å; E507-R510 PolarHBondContact O-N 3.47Å; E507-R510 VanDerWaalsContact O-N 3.16Å; E507-R510 IonicContact OE1-CZ 2.68Å; E507-R510 IonicContact OE1-NE 2.75Å; E507-R510 PolarHBondContact OE1-NE 2.98Å; E507-R510 IonicContact OE1-NH2 3.32Å; E507-R510 PolarHBondContact OE1-NH2 3.21Å; E507-R510 IonicContact OE2-CZ 3.15Å; E507-R510 IonicContact OE2-NE 3.67Å; E507-R510 IonicContact OE2-NH2 2.76Å; E507-R510 PolarHBondContact OE2-NH2 3.21Å; R510-R512 PolarHBondContact O-N 3.35Å; R510-I513 PolarHBondContact O-N 3.43Å
511C56.8Low66.9Low89 Ų89129.7 Ų129.760%0.60164%0.638SS**THydrogen-bonded Turntrans-59.8-14.5177.8-53.80000115.4E507E507-C511 PolarHBondContact O-N 2.97Å; E507-C511 PolarHBondContact O-SG 3.05Å
512R56.1Low65.4Low212 Ų212131.9 Ų131.980%0.865%0.648SS**THydrogen-bonded Turntrans-89.5-14.8-176.6-147.9-177.1-170.4-1553.3113.8S509 R510S509-R512 PolarHBondContact O-N 2.99Å; R510-R512 PolarHBondContact O-N 3.35Å
513I57.4Low64Low135 Ų135141 Ų14169%0.69268%0.679SS**THydrogen-bonded Turntrans-84.2-30.5179.9-63173.3000110.8R510 V515R510-I513 PolarHBondContact O-N 3.43Å; I513-V515 PolarHBondContact O-N 3.1Å
514E56.9Low63Low170 Ų170141 Ų14179%0.79468%0.676SS**  trans-81.214-178.1-59.7-167.9156.700115P516E514-P516 WeakPolarHBondContact O-CD 3.45Å
515V58.9Low61.3Low95 Ų95138.2 Ų138.258%0.57668%0.684SS**  trans-73.5112.5174-171.80000108.4I513 K517I513-V515 PolarHBondContact O-N 3.1Å; V515-K517 PolarHBondContact O-N 3.43Å
516P59.5Low60Low109 Ų109147.1 Ų147.171%0.70871%0.714SS**  trans-62132.6-177.425.2-33.9000109.9E514 K518E514-P516 WeakPolarHBondContact O-CD 3.45Å; P516-K518 PolarHBondContact O-N 3Å
517K61.4Low59Low213 Ų213154.9 Ų154.993%0.92674%0.742SS**  trans-48.8108.9177.4-86.6178.9174.9171.90109.6V515 H519V515-K517 PolarHBondContact O-N 3.43Å; K517-H519 PolarHBondContact O-N 3.47Å
518K59.9Low58.4Low191 Ų191156.4 Ų156.483%0.8375%0.75SS**  trans-63.1122.4174.1-69.9-155.4174.3-168.30108.9P516 T520P516-K518 PolarHBondContact O-N 3Å; K518-T520 PolarHBondContact O-N 3.29Å; K518-T520 VanDerWaalsContact O-N 3.11Å
519H60.8Low57.9Low150 Ų150152.3 Ų152.369%0.69474%0.743SS**  trans-53.8113.8177.3-169.7-34.8000109.6K517 H522K517-H519 PolarHBondContact O-N 3.47Å; H519-H522 AromaticContact CE1-CD2 3.75Å; H519-H522 AromaticContact CE1-NE2 3.74Å
520T56.2Low57.6Low115 Ų115158.3 Ų158.371%0.70677%0.767SS**PPolyproline II helixtrans-66.3128.9170.327.50000108.6K518 H522K518-T520 PolarHBondContact O-N 3.29Å; K518-T520 VanDerWaalsContact O-N 3.11Å; T520-H522 PolarHBondContact O-N 3.24Å
521P56.8Low57.3Low120 Ų120163.6 Ų163.678%0.77980%0.797SS**PPolyproline II helixtrans-67.8131178.827.4-32.9000109.4R523P521-R523 PolarHBondContact O-N 3.12Å
522H54Low57.3Low158 Ų158168.3 Ų168.373%0.73181%0.809SS**PPolyproline II helixtrans-60.4124.1-179.6-75.4-87.3000110.7H519 T520 T524H519-H522 AromaticContact CE1-CD2 3.75Å; H519-H522 AromaticContact CE1-NE2 3.74Å; T520-H522 PolarHBondContact O-N 3.24Å; H522-T524 PolarHBondContact O-N 3.19Å; H522-T524 VanDerWaalsContact O-N 3.08Å
523R55.7Low57.4Low244 Ų244165.3 Ų165.392%0.92181%0.809SS**  trans-68.8104172.6-163.7-177-164.9-149.65.4108P521 C525P521-R523 PolarHBondContact O-N 3.12Å; R523-C525 PolarHBondContact O-N 2.99Å
524T63.4Low57.4Low125 Ų125167.5 Ų167.577%0.76782%0.818SS**PPolyproline II helixtrans-68.7125.7179.746.50000110.4H522 R526H522-T524 PolarHBondContact O-N 3.19Å; H522-T524 VanDerWaalsContact O-N 3.08Å; T524-R526 PolarHBondContact O-N 3.22Å
525C48.5Very low57.5Low128 Ų128167.3 Ų167.387%0.86582%0.82SS**PPolyproline II helixtrans-66.1129.4168.3-73.90000109.2R523R523-C525 PolarHBondContact O-N 2.99Å
526R54.4Low57.3Low244 Ų244173.3 Ų173.392%0.92184%0.84SS**PPolyproline II helixtrans-76.5142.6159.1-70.4-172.2173.5-151.5-2108.3T524T524-R526 PolarHBondContact O-N 3.22Å
527K57.4Low57.1Low283 Ų283179.2 Ų179.2100%1.2385%0.852SS**  trans-68.60172.6-70.4-177.8175-178.50110.8

Retrieved 527 of 527 residues in 224.1 ms (Link to these results)