A0A087YKJ0_POEFO Loading...

DNA excision repair protein ERCC-1

Non-catalytic component of a structure-specific DNA repair endonuclease responsible for the 5'-incision during DNA repair. Responsible, in conjunction with SLX4, for the first step in the repair of interstrand cross-links (ICL). Participates in the processing of anaphase bridge-generating DNA structures, which consist in incompletely processed DNA lesions arising during S or G2 phase, and can result in cytokinesis failure. Also required for homology-directed repair (HDR) of DNA double-strand breaks, in conjunction with SLX4.

AlphaFold DB , UniProt , Accession A0A087YKJ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M39.6Very low44.6Very low247 Ų247179.7 Ų179.7100%1.21785%0.849SS**  0130.40-72.3163.5165.600108.8
2K40.5Very low45.1Very low210 Ų210173.3 Ų173.391%0.91384%0.839SS**  trans-92.6126.6177.2-67.8176.7177.8177.30109.2
3K46.8Very low45.4Very low196 Ų196165.8 Ų165.885%0.85282%0.822SS**  trans-85.6112.7166.9-74-173.3176.2-177.50108.8
4R46.3Very low45.1Very low241 Ų241168.6 Ų168.691%0.90983%0.827SS**PPolyproline II helixtrans-79.5138.9163.1-91.3-179.8170.6160.4-4.4108.1
5F42.1Very low45.3Very low187 Ų187165.4 Ų165.482%0.8282%0.822SS**PPolyproline II helixtrans-92.4128.1160.9-67.9-85.6000107.9
6H40.5Very low45.5Very low158 Ų158167 Ų16773%0.73182%0.822SS**PPolyproline II helixtrans-91.1133.8169.2-162.4-95.4000107.3D8H6-D8 IonicContact CE1-OD1 3.33Å; H6-D8 IonicContact CE1-OD2 2.73Å; H6-D8 PolarHBondContact CE1-OD2 3.03Å; H6-D8 IonicContact ND1-OD2 2.72Å; H6-D8 PolarHBondContact ND1-OD2 3.16Å; H6-D8 VanDerWaalsContact ND1-OD2 3.15Å
7I48.1Very low45.6Very low135 Ų135168.5 Ų168.569%0.69283%0.827SS**  trans-123.7109.9172.8-60.1174.9000105.2
8D42.2Very low45.9Very low129 Ų129172.6 Ų172.669%0.6983%0.832SS**  trans-73139.1168.8-86.8-68.5000109.8H6H6-D8 IonicContact CE1-OD1 3.33Å; H6-D8 IonicContact CE1-OD2 2.73Å; H6-D8 PolarHBondContact CE1-OD2 3.03Å; H6-D8 IonicContact ND1-OD2 2.72Å; H6-D8 PolarHBondContact ND1-OD2 3.16Å; H6-D8 VanDerWaalsContact ND1-OD2 3.15Å
9L49.9Very low46.6Very low160 Ų160170.2 Ų170.284%0.83883%0.829SS**  trans-122.731.1-172.3-98.1167.4000112.3
10D50.7Low46.7Very low166 Ų166167.8 Ų167.889%0.88883%0.827SS**  trans-11083168.9-87.4-50.8000110.1
11D44.3Very low46.5Very low148 Ų148167.9 Ų167.979%0.79183%0.83SS**  trans-124.9115163.3-155.4-9.7000110A13D11-A13 PolarHBondContact O-N 2.97Å
12S50Low47.1Very low103 Ų103165.5 Ų165.572%0.7281%0.813SS**THydrogen-bonded Turntrans-80.937.8-163.6-141.40000113.1
13A48.5Very low47.5Very low75 Ų75161 Ų16162%0.6281%0.805SS**THydrogen-bonded Turntrans-89.6-14.6-170.900000114.4D11D11-A13 PolarHBondContact O-N 2.97Å
14F41.5Very low47.5Very low205 Ų205161.2 Ų161.290%0.89981%0.809SS**SBendtrans-100.8-2.6-170.3-100.9-85.8000116.3
15T47.8Very low47.1Very low121 Ų121158.7 Ų158.774%0.74281%0.805SS**  trans-108.111.6-173.238.10000115.5
16K49.7Very low47.4Very low191 Ų191158.9 Ų158.983%0.8381%0.808SS**  trans-93.2111.3171.6-78.1-177.2176.9174.10111.8
17E46.4Very low47.1Very low192 Ų192156.8 Ų156.890%0.89781%0.809SS**PPolyproline II helixtrans-52.8137.3167-88.1-172.5128.600111.4
18R50.9Low46.3Very low243 Ų243158.6 Ų158.692%0.91782%0.819SS**PPolyproline II helixtrans-80.3120.3171.9-91.4-175.8172.6176.1-1.3110.3
19T58.5Low46Very low127 Ų127157.8 Ų157.878%0.77982%0.823SS**PPolyproline II helixtrans-60.1133.8170.3-320000110.5
20P50Low45.3Very low121 Ų121160 Ų16079%0.78683%0.826SS**PPolyproline II helixtrans-66.9134.5179.925.3-33.5000111.8
21L41.4Very low44.3Very low171 Ų171155.5 Ų155.590%0.89582%0.819SS**PPolyproline II helixtrans-74.6133.2179.8-67.4171.9000111.2
22K53.1Low43.7Very low196 Ų196157.2 Ų157.285%0.85282%0.822SS**PPolyproline II helixtrans-75.1126.2179.4-167.1174.2-174.8176.10110.2Q24K22-Q24 PolarHBondContact O-N 2.9Å
23P49.3Very low42.9Very low117 Ų117161.1 Ų161.176%0.7683%0.829SS**PPolyproline II helixtrans-68124.2-178.425.7-33.1000111.4F25P23-F25 PolarHBondContact O-N 3.33Å
24Q46.2Very low42Very low199 Ų199164.6 Ų164.693%0.9384%0.837SS**  trans-9867.4-175.8-164.9172.910.700110.6K22K22-Q24 PolarHBondContact O-N 2.9Å
25F38Very low41.5Very low189 Ų189160.4 Ų160.483%0.82983%0.828SS**  trans-133.4109.6175.6-149.4-96.5000110.2P23P23-F25 PolarHBondContact O-N 3.33Å
26Q47.8Very low40.6Very low190 Ų190161.4 Ų161.489%0.88884%0.835SS**  trans-102.1120.5173.8-78-179.5-2900109.2
27P35.3Very low39.5Very low114 Ų114156.5 Ų156.574%0.7483%0.83SS**  trans-71.3132.917028.6-31.9000110.5S29P27-S29 PolarHBondContact O-N 3.46Å
28L29.9Very low39.4Very low174 Ų174153.4 Ų153.491%0.91183%0.826SS**  trans-73.8106.5-176.5-176.371000111.4
29S37.2Very low38.3Very low111 Ų111145.9 Ų145.978%0.77682%0.816SS**  trans-83.5135.1174.939.30000112.3P27P27-S29 PolarHBondContact O-N 3.46Å
30K35.7Very low36.7Very low208 Ų208146.2 Ų146.290%0.90482%0.818SS**  trans-90.7131.7173.6-77.2-176.8174.6-179.60111.5
31G28.7Very low35.8Very low70 Ų70146.3 Ų146.372%0.72282%0.821SS**  trans66.591.7132.900000120.6
32Q32.3Very low35.1Very low185 Ų185143.9 Ų143.986%0.86481%0.814SS**  trans25.4121.8135-62.7170.7-71.700121.2
33Q32.9Very low33.7Very low185 Ų185140.1 Ų140.186%0.86481%0.808SS**  168.4109.3113.5-89.817261.100108.3
34N29.8Very low32.6Very low148 Ų148142.9 Ų142.979%0.79181%0.81SS**  87.8123.780.2-102.214.7000116.2
35T29.8Very low31.6Very low117 Ų117138.8 Ų138.872%0.71880%0.803SS**  trans78.6125.5148.754.70000123.6
36T29.2Very low31.1Very low142 Ų142135.7 Ų135.787%0.87180%0.8SS**  trans76.5132.2146.828.10000122.8
37A27.2Very low30.2Very low88 Ų88132.8 Ų132.873%0.72780%0.795SS**  trans-104.2-176.5161.700000108.7
38P44.3Very low29.9Very low126 Ų126137.3 Ų137.382%0.81880%0.803SS**  cis-138.6-163.85.142.9-23.1000115.4
39A27.4Very low29.9Very low86 Ų86134.8 Ų134.871%0.71180%0.8SS**  trans109.3120.615200000120.1
40T26Very low29.5Very low133 Ų133135.2 Ų135.282%0.81680%0.803SS**  trans18.2127145.650.70000121.5
41S29.9Very low29.6Very low123 Ų123130.2 Ų130.286%0.8680%0.8SS**  169172.910353.30000114.6
42T26.6Very low30.3Very low121 Ų121135.3 Ų135.374%0.74281%0.806SS**  trans-67.8165.9-164.5-23.50000118.1
43T25.4Very low30.8Very low117 Ų117132.7 Ų132.772%0.71880%0.804SS**  trans72.7117.8149.433.20000122.4
44E26Very low31.5Very low175 Ų175131.3 Ų131.382%0.81880%0.802SS**  trans59.2124.1133.7-65.8-172.3167.700124.5
45S25.2Very low32.7Very low112 Ų112127.8 Ų127.878%0.78379%0.789SS**  trans95.5153.1135.880.50000121.6
46V26.4Very low33.6Very low125 Ų125131 Ų13176%0.75879%0.79SS**  trans85.395.6168.7-165.60000119
47T30.1Very low34.5Very low128 Ų128127.2 Ų127.279%0.78577%0.772SS**  trans14.4128.3147.346.60000121.9
48K27.9Very low35.4Very low210 Ų210127.1 Ų127.191%0.91376%0.76SS**  trans-155.3146.5137-115163.1-169.3171.70113.1
49S29.4Very low35.9Very low120 Ų120129.6 Ų129.684%0.83975%0.754SS**  trans-83.5142.7-179440000112.5
50S30.5Very low37Very low121 Ų121129.8 Ų129.885%0.84674%0.742SS**  trans-155111.3148.450.70000109.4
51A37.6Very low38.3Very low102 Ų102128.6 Ų128.684%0.84373%0.734SS**PPolyproline II helixtrans-75.8131.1174.800000109.4
52Q42.4Very low39Very low178 Ų178130.1 Ų130.183%0.83273%0.728SS**PPolyproline II helixtrans-74.3147.4162.6-68.2-162.7-20.300109.6L54Q52-L54 PolarHBondContact O-N 3.4Å
53P42Very low39.9Very low129 Ų129128.6 Ų128.684%0.83872%0.722SS**PPolyproline II helixtrans-67.5123.6-179.127.2-33.4000110.6
54L48.2Very low40.9Very low157 Ų157131.9 Ų131.982%0.82273%0.726SS**PPolyproline II helixtrans-65.5149.7178.4-74.5166.6000112Q52Q52-L54 PolarHBondContact O-N 3.4Å
55S55.1Low41.8Very low74 Ų74128.6 Ų128.652%0.51772%0.718SS.*PPolyproline II helixtrans-68.9142.4176.6-175.80000111A57 D58S55-A57 PolarHBondContact O-N 3.36Å; S55-D58 PolarHBondContact O-N 2.99Å
56Y49.9Very low42.2Very low185 Ų185129.2 Ų129.273%0.72572%0.718SS**Hα-helixtrans-56.3-25.1177.1-177.1-104000113.2D58 I60Y56-D58 VanDerWaalsContact C-N 3.34Å; Y56-D58 PolarHBondContact O-N 3.23Å; Y56-I60 HydrophobicContact CD1-CD1 4.33Å; Y56-I60 HydrophobicContact CE1-CD1 3.66Å
57A46.9Very low42.5Very low61 Ų61129.8 Ų129.850%0.50472%0.722SS.*Hα-helixtrans-63-35.1176.500000113.5S55S55-A57 PolarHBondContact O-N 3.36Å
58D46.7Very low42.6Very low87 Ų87128.1 Ų128.147%0.46572%0.721SS.*Hα-helixtrans-76.9-28.9-174.5-61-49.3000112.4S55 Y56 I60 V61S55-D58 PolarHBondContact O-N 2.99Å; Y56-D58 VanDerWaalsContact C-N 3.34Å; Y56-D58 PolarHBondContact O-N 3.23Å; D58-I60 PolarHBondContact O-N 3.41Å; D58-V61 PolarHBondContact O-N 3.14Å
59Y54.9Low42.7Very low177 Ų177123 Ų12369%0.69472%0.717SS**Hα-helixtrans-67.4-36.5179.9-168.3-97.5000112.8V61Y59-V61 VanDerWaalsContact C-N 3.29Å; Y59-V61 PolarHBondContact O-N 3.45Å
60I50.9Low42.9Very low91 Ų91121.8 Ų121.847%0.46772%0.715SS.*Hα-helixtrans-72.1-24.6-177.5-66.3-174.7000111.8Y56 D58 S63Y56-I60 HydrophobicContact CD1-CD1 4.33Å; Y56-I60 HydrophobicContact CE1-CD1 3.66Å; D58-I60 PolarHBondContact O-N 3.41Å; I60-S63 PolarHBondContact O-OG 2.9Å
61V53.2Low43.2Very low107 Ų107122.2 Ų122.265%0.64872%0.715SS**Hα-helixtrans-80.8-34.1-178.6-178.40000112.4D58 Y59D58-V61 PolarHBondContact O-N 3.14Å; Y59-V61 VanDerWaalsContact C-N 3.29Å; Y59-V61 PolarHBondContact O-N 3.45Å
62Q43.5Very low42.9Very low156 Ų156125.9 Ų125.973%0.72971%0.714SS**Hα-helixtrans-76.4-23.8-179.2-78.1-178.3-10.800114.6K64Q62-K64 PolarHBondContact O-N 3.44Å; Q62-K64 VanDerWaalsContact O-N 3.09Å
63S45.5Very low42.2Very low89 Ų89127.5 Ų127.562%0.62271%0.713SS**THydrogen-bonded Turntrans-73.33.4-176.5640000115.8I60I60-S63 PolarHBondContact O-OG 2.9Å
64K45.9Very low41.4Very low185 Ų185127.6 Ų127.680%0.80471%0.707SS**THydrogen-bonded Turntrans-119.84179.9-73-172174.9-1790115.3Q62Q62-K64 PolarHBondContact O-N 3.44Å; Q62-K64 VanDerWaalsContact O-N 3.09Å
65T45.3Very low40.4Very low106 Ų106124.4 Ų124.465%0.6570%0.702SS**SBendtrans-137.265.7-176.955.80000112.7
66T33.4Very low39Very low126 Ų126132.2 Ų132.277%0.77372%0.722SS**  trans-163.4149.9157.8-79.50000109.6
67T32.9Very low38Very low137 Ų137127.7 Ų127.784%0.8472%0.718SS**  trans63130-17940.40000117.9
68A32.2Very low37.2Very low93 Ų93133.8 Ų133.877%0.76973%0.733SS**  cis170.7148.9-45.100000108.3
69A31Very low36.3Very low101 Ų101136.4 Ų136.484%0.83575%0.746SS**  trans9.8134.3161.200000122.1
70A32.4Very low35Very low95 Ų95134.1 Ų134.179%0.78575%0.75SS**  trans-78.4167.3164.200000113.1
71P36.8Very low33.8Very low130 Ų130141.1 Ų141.184%0.84477%0.771SS**  -137.2169.2123.836.1-23.8000115.2
72Q31.2Very low32.5Very low179 Ų179140.1 Ų140.184%0.83677%0.774SS**  trans-85.3154.7-177.6-56.8175.5-51.800113.7
73R28.1Very low31.7Very low212 Ų212142 Ų14280%0.878%0.782SS**  174144.5103.9-98.4-175.9177.3171.41.3115.9
74D25.6Very low30.7Very low132 Ų132141 Ų14171%0.70679%0.786SS**  trans53.2115.3141.3-52.3-28.4000124.1
75A27.3Very low29.8Very low89 Ų89137.5 Ų137.574%0.73679%0.792SS**  trans45.4126.6132.200000122.3
76Y24.5Very low28.8Very low238 Ų238135.8 Ų135.893%0.93380%0.796SS**  -164.6167.8109.6-119.4-92000111.2
77S29.8Very low28.5Very low91 Ų91137.6 Ų137.664%0.63680%0.799SS**  trans-135.4163.4-168.968.20000114.5
78K30.2Very low28.2Very low189 Ų189137 Ų13782%0.82280%0.8SS**  trans73.8155.8169.7-66.1175.6170.6-179.70115.5
79L27.7Very low27.9Very low142 Ų142137.8 Ų137.874%0.74380%0.8SS**  cis-156.2141.515.2-157.584.6000113.4
80V27.4Very low27.7Very low128 Ų128141 Ų14178%0.77680%0.802SS**  trans37.9128.9141.1173.30000122.5
81R25.3Very low27.4Very low238 Ų238144.9 Ų144.990%0.89880%0.804SS**  -159.8151.3109-159.2160.8-177.8125.8-0.3112.7
82A27.1Very low27.2Very low86 Ų86144 Ų14471%0.71180%0.799SS**  trans-128149.9-179.300000111.4
83E26.1Very low26.9Very low195 Ų195141.9 Ų141.991%0.91180%0.797SS**  trans-168.8157.9148.5-67.6-148.9147.100105.9
84G25Very low26.7Very low68 Ų68140 Ų14070%0.70180%0.798SS**  cis161.6134.2-3.800000110.2
85A26.4Very low26.5Very low113 Ų113140.4 Ų140.493%0.93481%0.805SS**  trans62.6156.3-177.500000116.6
86G24.2Very low26.4Very low70 Ų70141.8 Ų141.872%0.72280%0.804SS**  cis134.8146.8100000111.6
87I27.3Very low26.5Very low164 Ų164135.4 Ų135.484%0.84179%0.794SS**  cis-155.3134.5-3.8-63.6164.9000108
88S27.5Very low26.2Very low123 Ų123137.3 Ų137.386%0.8680%0.803SS**  trans173.2128.4142.7-85.70000115.6
89S24.6Very low26.1Very low111 Ų111139.9 Ų139.978%0.77681%0.807SS**  trans-112.9152165.2167.60000108.5
90L26.4Very low26Very low167 Ų167141.7 Ų141.787%0.87482%0.815SS**  trans-158.4105.8150.5-101.5179.2000111.4
91Q27.4Very low26Very low177 Ų177143.5 Ų143.583%0.82782%0.82SS**  trans-108.3156.1143.8-84.3-169.8-22.900107.8
92P31.8Very low26Very low113 Ų113135.7 Ų135.773%0.73481%0.814SS**  -141.617711737-20.7000111.1
93V25.4Very low26Very low133 Ų133136.7 Ų136.781%0.80682%0.816SS**  cis-150.3148.930.5178.20000110.1
94E23.8Very low26Very low174 Ų174136.1 Ų136.181%0.81381%0.813SS**  trans-96.1158.8169.3-63.2-174.4134.800113
95T22.2Very low26Very low140 Ų140139.1 Ų139.186%0.85982%0.818SS**  trans-136.895.8153.5-52.60000112.4
96V24.8Very low26Very low118 Ų118139.8 Ų139.872%0.71581%0.81SS**  trans-0.7129.8147.7177.60000118.6
97S25.3Very low26.2Very low103 Ų103145.9 Ų145.972%0.7282%0.82SS**  -163.4115.4112.7-140.50000116.8
98T25.5Very low26.1Very low132 Ų132145.1 Ų145.181%0.8182%0.818SS**  trans42.5140.6146.749.70000124.5
99R26.1Very low26.1Very low242 Ų242144.3 Ų144.391%0.91381%0.81SS**  trans-103.2156.7-177.9-45.2163-176.2168.8-0.6111.4
100I26.1Very low26.2Very low180 Ų180145.1 Ų145.192%0.92381%0.81SS**  trans-137.5145.8135.4-67.2-168.1000108.6
101L28Very low26.2Very low166 Ų166147.2 Ų147.287%0.86981%0.812SS**  trans-113.7145.8-177.1178.174.1000109.5
102G24.8Very low26.1Very low75 Ų75142.1 Ų142.177%0.77381%0.807SS**  trans-177.9131.2171.300000112.9
103S28.1Very low25.8Very low107 Ų107142.7 Ų142.775%0.74881%0.809SS**  trans-98.5163.7-164.6-54.70000115.7
104E25Very low25.8Very low183 Ų183145 Ų14586%0.85581%0.811SS**  trans-2.6136.3149.9-54.6170.913000119.2
105T24.5Very low25.9Very low131 Ų131143.1 Ų143.180%0.80481%0.811SS**  177.4129.4112.3-68.30000113.1
106V26.7Very low26.1Very low127 Ų127144.5 Ų144.577%0.7781%0.808SS**  trans-4.4129.4153.9-169.80000120
107Q30.1Very low26.7Very low197 Ų197144.4 Ų144.492%0.92181%0.81SS**  -172178.1123.2-106.6179.3-4.100114.9
108D25.2Very low26.7Very low149 Ų149147.5 Ų147.580%0.79781%0.813SS**  trans-116.6175.4-141.8-1647.9000115.7
109C26Very low26.6Very low105 Ų105147.6 Ų147.671%0.70981%0.808SS**  trans89.491.4149.9-118.60000123.6
110V27.5Very low26.7Very low128 Ų128141.8 Ų141.878%0.77680%0.8SS**  30.1118.8116.3-172.50000122.2
111K26.4Very low26.9Very low211 Ų211142 Ų14292%0.91779%0.794SS**  trans148.5152.5138.7-100.3177.3176.3176.90109.4
112G25.2Very low26.9Very low70 Ų70144.4 Ų144.472%0.72279%0.791SS**  cis176.9155.4-1.600000109.1
113T26.3Very low26.9Very low125 Ų125147.2 Ų147.277%0.76779%0.789SS**  trans-105.7144.7-163.1-54.70000114
114E24.6Very low27Very low181 Ų181149.9 Ų149.985%0.84680%0.795SS**  trans61.4159.6161.8-76170.7129.200118.4
115V26.3Very low27.2Very low136 Ų136147.9 Ų147.982%0.82479%0.785SS**  cis-139.2166.614.3-169.60000110.5
116Q25.1Very low27.4Very low169 Ų169149.5 Ų149.579%0.7978%0.781SS**  trans-74.7-176.6166.8-50.3-177.928.100113.3
117P37.5Very low27.5Very low115 Ų115152.1 Ų152.175%0.74779%0.785SS**  -151.3158.981.135.2-13.7000119.4
118E25.6Very low27.2Very low168 Ų168151 Ų15179%0.78578%0.779SS**  trans59.2132.4142.6-61.9-80.7125.500122.6
119D24.5Very low27.1Very low135 Ų135150.1 Ų150.172%0.72278%0.78SS**  -177169.495.3-141.7-38.6000113.7
120V28.2Very low27.2Very low120 Ų120149.8 Ų149.873%0.72778%0.784SS**  trans96.588.6166.1-164.40000120.1
121K29.6Very low27.2Very low184 Ų184147.5 Ų147.580%0.878%0.779SS**  34145.8120.9-59.7169.8-178.8162.60119.8
122R27.2Very low27.2Very low216 Ų216146.5 Ų146.582%0.81578%0.778SS**  cis-165.2147.128.3-156.8175.2-172.9166.91.8113.5
123N25.4Very low27.2Very low135 Ų135149.9 Ų149.972%0.72278%0.779SS**  trans18.1138155.2-5314000122.9
124D31Very low27.2Very low163 Ų163148.2 Ų148.287%0.87277%0.773SS**  -152.3167.7109.8-130.7-39.5000112.7
125E29.5Very low27.4Very low140 Ų140145.7 Ų145.765%0.65478%0.775SS**  trans-97.6149.5-158.7-67.9-16688.300119.3
126K27.7Very low27.5Very low165 Ų165144.7 Ų144.772%0.71777%0.774SS**  trans29.4131.5141.2-60.5167.6-176.3146.30121.4
127H27.8Very low27.8Very low183 Ų183144.3 Ų144.385%0.84778%0.776SS**  -168.8150.991.7-129.3-86.7000113.9
128E25.4Very low27.4Very low172 Ų172147.7 Ų147.780%0.80478%0.779SS**  trans-103.5176.6176.8-72.1-177.7113.400113.7
129T23.3Very low27.6Very low132 Ų132144.5 Ų144.581%0.8178%0.775SS**  trans100118.7167.465.30000115.7
130A26.7Very low28.1Very low97 Ų97145.1 Ų145.180%0.80278%0.779SS**  71.4132.956.200000112.9
131A27.1Very low28.5Very low81 Ų81144.6 Ų144.667%0.66978%0.778SS**  cis-163.2177.3-5.600000110.5
132E26.5Very low28.6Very low190 Ų190141.3 Ų141.389%0.88878%0.778SS**  trans67.2153.2154.9-78.4164.1-141.800119
133D25.6Very low28.9Very low140 Ų140136.7 Ų136.775%0.74977%0.774SS**  cis-159160.6-8.3-176.227000111.9
134S27.4Very low29.7Very low91 Ų91138.2 Ų138.264%0.63678%0.78SS**  trans62.4123.4153.180.80000122.9
135S27.1Very low30.1Very low127 Ų127137.8 Ų137.889%0.88877%0.773SS**  167.5163.7108.454.20000111.4
136S28.6Very low30.8Very low115 Ų115133.4 Ų133.480%0.80477%0.766SS**  trans-124158.1-160.6570000113.2
137L31.2Very low32.4Very low162 Ų162127.7 Ų127.785%0.84875%0.745SS**  trans-167.8148.2143.2-102.6169000113.7
138K30.9Very low33.4Very low186 Ų186126.7 Ų126.781%0.80974%0.738SS**  trans-64.6172-177.3-56.1152.4-177.3174.60112.7
139S29.5Very low34.6Very low100 Ų100123.6 Ų123.670%0.69973%0.733SS**  cis-161166.7-0.629.60000106.5
140D33.8Very low35.9Very low149 Ų149121.6 Ų121.680%0.79772%0.72SS**  179.9-177.376.4-126.4-1.6000111.2
141P36.8Very low37.3Very low109 Ų109118.7 Ų118.771%0.70870%0.7SS**  trans-80.4139.9-140.331.9-38.6000116.5V143P141-V143 PolarHBondContact O-N 3.35Å
142S31.5Very low38.7Very low115 Ų115118.6 Ų118.680%0.80469%0.694SS**  trans-65.5113.5169.752.90000111.9
143V34.6Very low40.7Very low119 Ų119112 Ų11272%0.72168%0.678SS**  trans-45136.61611740000110.1P141 Q145P141-V143 PolarHBondContact O-N 3.35Å; V143-Q145 VanDerWaalsContact C-N 3.31Å; V143-Q145 PolarHBondContact O-N 3.48Å
144I42.7Very low43.4Very low166 Ų166108.8 Ų108.885%0.85167%0.666SS**  trans-64.293.2173.5-58.8173.9000108.2G146I144-G146 PolarHBondContact O-N 3.11Å
145Q37.9Very low46.5Very low154 Ų154104.9 Ų104.972%0.7264%0.639SS**  trans-72.3112.8169.4-68.3-175.10.400107.6V143V143-Q145 VanDerWaalsContact C-N 3.31Å; V143-Q145 PolarHBondContact O-N 3.48Å
146G45Very low49.7Very low49 Ų4999 Ų9951%0.50560%0.597SS.*PPolyproline II helixtrans-55.3158.7162.900000110.4I144 K148I144-G146 PolarHBondContact O-N 3.11Å; G146-K148 PolarHBondContact O-N 3.12Å
147P60.1Low52.9Low44 Ų4493.9 Ų93.929%0.28656%0.561SS.*PPolyproline II helixtrans-53.4127-175.421.7-32.7000110.6Q189 T218 F219P147-Q189 PolarHBondContact O-NE2 3.01Å; P147-T218 HydrophobicContact CB-CG2 4.4Å; P147-T218 HydrophobicContact CG-CG2 4.11Å; P147-F219 HydrophobicContact CG-CE1 4.02Å; P147-F219 HydrophobicContact CG-CZ 4.16Å
148K50.8Low56.1Low163 Ų16386.2 Ų86.271%0.70952%0.521SS*.PPolyproline II helixtrans-50.8141.3177.4-72.4177.9177.9175.30109.4G146 V150G146-K148 PolarHBondContact O-N 3.12Å; K148-V150 PolarHBondContact O-N 3.14Å
149P49.2Very low59.2Low107 Ų10777.5 Ų77.570%0.69548%0.483SS*.  trans-66.397.417827.1-33.9000109.5
150V52.1Low62.4Low89 Ų8974.6 Ų74.654%0.53946%0.462SS..  trans-87.3120.2169.5-177.90000106.9K148 I157K148-V150 PolarHBondContact O-N 3.14Å; V150-I157 WeakPolarHBondContact O-CD1 3.4Å; V150-I157 VanDerWaalsContact O-CG1 3.28Å; V150-I157 WeakPolarHBondContact O-CG1 3.44Å
151G54.8Low65.2Low36 Ų3673.5 Ų73.537%0.37145%0.447SS..SBendtrans98.7165.1177.900000115E177G151-E177 WeakPolarHBondContact CA-OE1 3.5Å
152S56.9Low68Low79 Ų7969 Ų6955%0.55242%0.416SS*.  trans-66.4134.1175.9-176.10000109.3S154 S155 E177S152-S154 PolarHBondContact O-N 3.21Å; S152-S155 PolarHBondContact O-N 3.19Å; S152-S155 PolarHBondContact O-OG 3.4Å; S152-E177 PolarHBondContact N-OE1 3.19Å
153G68.8Low71Confident52 Ų5270.9 Ų70.954%0.53641%0.406SS..THydrogen-bonded Turntrans-59.4-5.8-168.400000116.8K268G153-K268 PolarHBondContact O-NZ 2.75Å
154S81.7Confident73.7Confident72 Ų7269 Ų6950%0.50341%0.41SS..THydrogen-bonded Turntrans-101.8-7.9174.651.90000115.4S152 K268S152-S154 PolarHBondContact O-N 3.21Å; S154-K268 VanDerWaalsContact C-CE 3.4Å; S154-K268 WeakPolarHBondContact O-CE 3.29Å
155S91.9Very high76.1Confident10 Ų1062 Ų627%0.0737%0.374CS..SBendtrans-88.7160.2-179.863.40000113.6S152 P175 E177 K268S152-S155 PolarHBondContact O-N 3.19Å; S152-S155 PolarHBondContact O-OG 3.4Å; S155-P175 CarbonylContact C-O 3.54Å; S155-P175 VanDerWaalsContact CA-O 3.24Å; S155-P175 WeakPolarHBondContact CA-O 2.97Å; S155-E177 WeakPolarHBondContact CB-OE1 3.41Å; S155-E177 PolarHBondContact OG-OE1 2.89Å; S155-K268 WeakPolarHBondContact O-CE 3.19Å; S155-K268 PolarHBondContact O-NZ 3.26Å
156I95.3Very high78.8Confident3 Ų357.3 Ų57.32%0.01536%0.357CS..EExtended strand (participates in β ladder)trans-94.2129163.1-63.6171.7000108V158 V171 V174 P175 W176 E177 Y185 L187 L264 K268I156-V158 HydrophobicContact CG2-CG2 4.3Å; I156-V171 HydrophobicContact CD1-CG1 4.18Å; I156-V174 HydrophobicContact CD1-CB 4.34Å; I156-V174 HydrophobicContact CD1-CG1 3.84Å; I156-V174 HydrophobicContact CG1-CG1 3.82Å; I156-P175 PolarHBondContact N-O 3Å; I156-W176 HydrophobicContact CB-CB 4.05Å; I156-W176 WeakPolarHBondContact O-CA 3.45Å; I156-W176 WeakPolarHBondContact O-CB 3.11Å; I156-E177 PolarHBondContact O-N 2.97Å; I156-Y185 HydrophobicContact CG2-CD1 4.2Å; I156-L187 HydrophobicContact CD1-CD2 3.95Å; I156-L187 HydrophobicContact CG1-CD2 4.08Å; I156-L187 HydrophobicContact CG2-CD2 4.08Å; I156-L264 HydrophobicContact CD1-CB 4.29Å; I156-K268 HydrophobicContact CD1-CB 3.99Å; I156-K268 HydrophobicContact CD1-CG 4.49Å; I156-K268 HydrophobicContact CG1-CB 3.82Å; I156-K268 HydrophobicContact CG1-CD 4.41Å; I156-K268 HydrophobicContact CG1-CG 3.87Å
157I95.9Very high81.2Confident8 Ų855 Ų554%0.04133%0.333CS..EExtended strand (participates in β ladder)trans-90.7122.5175.4-40.1-56.3000108.8V150 E177 V181 Y185 V186V150-I157 WeakPolarHBondContact O-CD1 3.4Å; V150-I157 VanDerWaalsContact O-CG1 3.28Å; V150-I157 WeakPolarHBondContact O-CG1 3.44Å; I157-E177 HydrophobicContact CD1-CG 3.65Å; I157-E177 WeakPolarHBondContact CD1-OE1 3.46Å; I157-V181 HydrophobicContact CG2-CG1 3.85Å; I157-V181 HydrophobicContact CG2-CG2 4.43Å; I157-Y185 CarbonylContact O-C 3.56Å; I157-Y185 WeakPolarHBondContact O-CA 3.41Å; I157-V186 HydrophobicContact CB-CB 4.02Å; I157-V186 HydrophobicContact CB-CG2 4.41Å; I157-V186 HydrophobicContact CG1-CB 4.26Å; I157-V186 PolarHBondContact N-O 3Å; I157-V186 VanDerWaalsContact N-O 3.11Å; I157-V186 PolarHBondContact O-N 3.36Å
158V97.2Very high82.8Confident1 Ų153.8 Ų53.81%0.00633%0.325CS..EExtended strand (participates in β ladder)trans-105.6130.2-176.4-176.90000108.9I156 Q162 L168 W176 E177 F178 G179 Y185I156-V158 HydrophobicContact CG2-CG2 4.3Å; V158-Q162 HydrophobicContact CG1-CB 3.83Å; V158-L168 HydrophobicContact CG1-CD1 4.27Å; V158-L168 HydrophobicContact CG1-CD2 3.98Å; V158-L168 HydrophobicContact CG2-CD2 3.96Å; V158-W176 HydrophobicContact CB-CE3 4.38Å; V158-W176 HydrophobicContact CG2-CB 3.97Å; V158-W176 HydrophobicContact CG2-CD2 4.2Å; V158-W176 HydrophobicContact CG2-CE3 3.8Å; V158-W176 HydrophobicContact CG2-CG 4.3Å; V158-E177 PolarHBondContact N-O 3.4Å; V158-F178 HydrophobicContact CB-CD1 4.06Å; V158-F178 HydrophobicContact CB-CE1 4.22Å; V158-F178 HydrophobicContact CG1-CD1 4.02Å; V158-F178 HydrophobicContact CG1-CE1 3.75Å; V158-F178 WeakPolarHBondContact O-CA 3.3Å; V158-G179 PolarHBondContact O-N 3.42Å; V158-G179 VanDerWaalsContact O-N 3.1Å; V158-Y185 HydrophobicContact CG1-CD1 4.36Å; V158-Y185 HydrophobicContact CG1-CE1 3.99Å; V158-Y185 HydrophobicContact CG2-CD1 4.05Å; V158-Y185 HydrophobicContact CG2-CE1 4.12Å
159S96.8Very high84.9Confident3 Ų353.3 Ų53.32%0.02132%0.322CS..  trans-65.2138.7173.7-1730000110.8R161 Q162 V181 P183 D184S159-R161 PolarHBondContact O-N 2.99Å; S159-Q162 PolarHBondContact O-N 3.33Å; S159-V181 PolarHBondContact OG-O 3.39Å; S159-P183 WeakPolarHBondContact CB-O 3.47Å; S159-D184 PolarHBondContact N-O 3.17Å
160P96.1Very high87.1Confident39 Ų3951.2 Ų51.225%0.25330%0.303SS..G310 helixtrans-45.2-27.4167.5-34.437.1000114.8Q162 R163 G179P160-Q162 PolarHBondContact O-N 3.08Å; P160-R163 WeakPolarHBondContact O-CB 3.32Å; P160-R163 WeakPolarHBondContact O-CD 3.41Å; P160-R163 VanDerWaalsContact O-CG 3.24Å; P160-R163 WeakPolarHBondContact O-CG 3.38Å; P160-R163 PolarHBondContact O-N 3.4Å; P160-G179 WeakPolarHBondContact CD-O 3.33Å
161R93.6Very high89.1Confident125 Ų12547.5 Ų47.547%0.47228%0.28SS..G310 helixtrans-65.8-20.3177.8-56.4176.973.3-101.2-2.1113.7S159 D184 Y207 R211S159-R161 PolarHBondContact O-N 2.99Å; R161-D184 IonicContact NH1-OD1 2.77Å; R161-D184 PolarHBondContact NH1-OD1 2.89Å; R161-Y207 PolarHBondContact NH1-OH 3.38Å; R161-Y207 PolarHBondContact NH2-OH 2.56Å; R161-R211 VanDerWaalsContact NH1-CZ 3.34Å
162Q95.3Very high91Very high15 Ų1554.9 Ų54.97%0.0730%0.297CS..G310 helixtrans-94.88.5178.6-60.4-58.4-36.300113.4V158 S159 P160 G164 N165 L168 D184 Y185V158-Q162 HydrophobicContact CG1-CB 3.83Å; S159-Q162 PolarHBondContact O-N 3.33Å; P160-Q162 PolarHBondContact O-N 3.08Å; Q162-G164 PolarHBondContact O-N 3.2Å; Q162-N165 HydrophobicContact CB-CB 4.44Å; Q162-N165 WeakPolarHBondContact O-CB 3.39Å; Q162-N165 PolarHBondContact O-N 3.25Å; Q162-N165 PolarHBondContact OE1-ND2 3.1Å; Q162-L168 WeakPolarHBondContact O-CD1 3.29Å; Q162-D184 HydrophobicContact CG-CB 3.79Å; Q162-D184 PolarHBondContact NE2-OD1 3.09Å; Q162-Y185 HydrophobicContact CG-CE2 4.09Å
163R93.7Very high92.6Very high155 Ų15555 Ų5559%0.58530%0.298SS*.THydrogen-bonded Turntrans-57.7128.9171.9-76.1171.8-175151.22.9110.4P160 N165 F178P160-R163 WeakPolarHBondContact O-CB 3.32Å; P160-R163 WeakPolarHBondContact O-CD 3.41Å; P160-R163 VanDerWaalsContact O-CG 3.24Å; P160-R163 WeakPolarHBondContact O-CG 3.38Å; P160-R163 PolarHBondContact O-N 3.4Å; R163-N165 VanDerWaalsContact C-N 3.33Å; R163-F178 HydrophobicContact CG-CD1 4.29Å; R163-F178 HydrophobicContact CG-CE1 3.52Å; R163-F178 HydrophobicContact CG-CE2 4.17Å; R163-F178 HydrophobicContact CG-CZ 3.46Å; R163-F178 VanDerWaalsContact CG-CZ 3.46Å
164G91.8Very high93.8Very high79 Ų7953.2 Ų53.281%0.81428%0.276SS*.THydrogen-bonded Turntrans85.3-6.6-176.600000115.3Q162Q162-G164 PolarHBondContact O-N 3.2Å
165N94.2Very high94.4Very high18 Ų1853.6 Ų53.610%0.09628%0.277CS..  trans-63.3125.3174.9-174.4-27.3000110.3Q162 R163 I167 L168 Y185 F195Q162-N165 HydrophobicContact CB-CB 4.44Å; Q162-N165 WeakPolarHBondContact O-CB 3.39Å; Q162-N165 PolarHBondContact O-N 3.25Å; Q162-N165 PolarHBondContact OE1-ND2 3.1Å; R163-N165 VanDerWaalsContact C-N 3.33Å; N165-I167 PolarHBondContact O-N 2.56Å; N165-I167 VanDerWaalsContact O-N 3.14Å; N165-I167 WeakPolarHBondContact OD1-CB 3.23Å; N165-I167 VanDerWaalsContact OD1-CG1 3.29Å; N165-I167 WeakPolarHBondContact OD1-CG1 3.43Å; N165-I167 PolarHBondContact OD1-N 3.1Å; N165-L168 PolarHBondContact O-N 3.05Å; N165-Y185 PolarHBondContact ND2-OH 2.86Å; N165-F195 WeakPolarHBondContact ND2-CD1 3.4Å; N165-F195 WeakPolarHBondContact ND2-CE1 3.24Å
166P93.5Very high94.5Very high56 Ų5657.4 Ų57.436%0.36429%0.29SS..G310 helixtrans-59.9-23.9-178.224.3-35.7000114.2L168 K169 F170 P257P166-L168 PolarHBondContact O-N 2.83Å; P166-K169 WeakPolarHBondContact O-CB 3.43Å; P166-K169 PolarHBondContact O-N 3.46Å; P166-F170 WeakPolarHBondContact O-CD2 3.16Å; P166-P257 HydrophobicContact CB-CB 4.34Å; P166-P257 HydrophobicContact CG-CB 4.2Å
167I95.1Very high94.5Very high0 Ų061 Ų610%031%0.307CS..G310 helixtrans-54.9-36.1178.8-67.7171.9000111.9N165 K169 F170 V171 F195 P257 A260 L264N165-I167 PolarHBondContact O-N 2.56Å; N165-I167 VanDerWaalsContact O-N 3.14Å; N165-I167 WeakPolarHBondContact OD1-CB 3.23Å; N165-I167 VanDerWaalsContact OD1-CG1 3.29Å; N165-I167 WeakPolarHBondContact OD1-CG1 3.43Å; N165-I167 PolarHBondContact OD1-N 3.1Å; I167-K169 PolarHBondContact O-N 3.43Å; I167-K169 VanDerWaalsContact O-N 3.07Å; I167-F170 PolarHBondContact O-N 3.34Å; I167-V171 HydrophobicContact CG2-CG2 4.35Å; I167-V171 PolarHBondContact O-N 3.23Å; I167-F195 HydrophobicContact CD1-CD2 3.6Å; I167-F195 HydrophobicContact CD1-CE1 4.44Å; I167-F195 HydrophobicContact CD1-CE2 3.23Å; I167-F195 HydrophobicContact CD1-CG 4.35Å; I167-F195 HydrophobicContact CD1-CZ 3.7Å; I167-P257 HydrophobicContact CG1-CB 3.9Å; I167-A260 HydrophobicContact CD1-CB 3.61Å; I167-A260 HydrophobicContact CG1-CB 3.94Å; I167-L264 HydrophobicContact CG2-CD1 3.71Å
168L94.3Very high94.5Very high20 Ų2064.7 Ų64.711%0.10532%0.322CS..G310 helixtrans-62.3-18180-62.2178.3000113.7V158 Q162 N165 P166 F170 W176 F178 Y185V158-L168 HydrophobicContact CG1-CD1 4.27Å; V158-L168 HydrophobicContact CG1-CD2 3.98Å; V158-L168 HydrophobicContact CG2-CD2 3.96Å; Q162-L168 WeakPolarHBondContact O-CD1 3.29Å; N165-L168 PolarHBondContact O-N 3.05Å; P166-L168 PolarHBondContact O-N 2.83Å; L168-F170 VanDerWaalsContact C-N 3.33Å; L168-W176 HydrophobicContact CB-CH2 4.43Å; L168-W176 HydrophobicContact CB-CZ2 3.96Å; L168-W176 HydrophobicContact CD1-CH2 4.12Å; L168-W176 HydrophobicContact CD1-CZ2 4.45Å; L168-W176 HydrophobicContact CD1-CZ3 4.36Å; L168-W176 HydrophobicContact CD2-CD2 4.28Å; L168-W176 HydrophobicContact CD2-CE3 4.47Å; L168-W176 HydrophobicContact CD2-CZ2 4.46Å; L168-F178 HydrophobicContact CD1-CE1 4.5Å; L168-F178 HydrophobicContact CD1-CZ 4.31Å; L168-Y185 HydrophobicContact CD2-CE1 3.92Å
169K94.4Very high94.4Very high152 Ų15265.2 Ų65.266%0.66133%0.328SS*.G310 helixtrans-79.7-16175.2-56.8179.8179.9-179.20113.4P166 I167 R172P166-K169 WeakPolarHBondContact O-CB 3.43Å; P166-K169 PolarHBondContact O-N 3.46Å; I167-K169 PolarHBondContact O-N 3.43Å; I167-K169 VanDerWaalsContact O-N 3.07Å; K169-R172 PolarHBondContact O-NE 3.39Å; K169-R172 PolarHBondContact O-NH2 3.15Å
170F95.3Very high94.2Very high64 Ų6472.6 Ų72.628%0.28137%0.367SS..THydrogen-bonded Turntrans-106.5-19.2-176.7-60.9-77.3000112.9P166 I167 L168 R172 P257 E258P166-F170 WeakPolarHBondContact O-CD2 3.16Å; I167-F170 PolarHBondContact O-N 3.34Å; L168-F170 VanDerWaalsContact C-N 3.33Å; F170-R172 PolarHBondContact O-N 2.94Å; F170-P257 HydrophobicContact CD2-CB 4.26Å; F170-P257 HydrophobicContact CE2-CB 4.09Å; F170-P257 HydrophobicContact CE2-CG 3.94Å; F170-E258 HydrophobicContact CD1-CB 3.67Å; F170-E258 HydrophobicContact CD1-CG 3.74Å; F170-E258 HydrophobicContact CD2-CB 4.43Å; F170-E258 HydrophobicContact CE1-CB 3.87Å; F170-E258 HydrophobicContact CE1-CG 4.18Å; F170-E258 HydrophobicContact CG-CB 3.97Å; F170-E258 HydrophobicContact CG-CG 4.31Å; F170-E258 HydrophobicContact CZ-CB 4.34Å
171V95.1Very high94.2Very high10 Ų1071.9 Ų71.96%0.06136%0.362CS..  trans-74102.5166.7-175.80000108.7I156 I167 L264 E265I156-V171 HydrophobicContact CD1-CG1 4.18Å; I167-V171 HydrophobicContact CG2-CG2 4.35Å; I167-V171 PolarHBondContact O-N 3.23Å; V171-L264 HydrophobicContact CG2-CB 4.44Å; V171-L264 HydrophobicContact CG2-CD1 4.24Å; V171-E265 HydrophobicContact CG1-CG 4.11Å
172R93.6Very high94.2Very high191 Ų19169.5 Ų69.572%0.72136%0.361SS*.  trans-129.8-30.1-173.8-62.6-179.9-175.1179.73.1113.5K169 F170 V174 E265K169-R172 PolarHBondContact O-NE 3.39Å; K169-R172 PolarHBondContact O-NH2 3.15Å; F170-R172 PolarHBondContact O-N 2.94Å; R172-V174 PolarHBondContact O-N 2.87Å; R172-E265 PolarHBondContact N-OE1 3.35Å
173S92.2Very high94.2Very high82 Ų8268.9 Ų68.957%0.57336%0.359SS*.SBendtrans-75-13.4-179.1-44.70000112.9R262 E265S173-R262 PolarHBondContact OG-NH1 3.23Å; S173-E265 WeakPolarHBondContact CB-OE1 3.42Å; S173-E265 PolarHBondContact N-OE1 3.03Å; S173-E265 PolarHBondContact OG-OE1 3.38Å; S173-E265 PolarHBondContact OG-OE2 3.48Å; S173-E265 VanDerWaalsContact OG-OE2 3.08Å
174V92.9Very high94.4Very high14 Ų1461.6 Ų61.69%0.08533%0.331CS..SBendtrans-139.1130.7-171.6178.80000108.6I156 R172 E265 K268I156-V174 HydrophobicContact CD1-CB 4.34Å; I156-V174 HydrophobicContact CD1-CG1 3.84Å; I156-V174 HydrophobicContact CG1-CG1 3.82Å; R172-V174 PolarHBondContact O-N 2.87Å; V174-E265 HydrophobicContact CG2-CB 4.19Å; V174-E265 HydrophobicContact CG2-CG 4.31Å; V174-K268 HydrophobicContact CG1-CB 4.1Å; V174-K268 HydrophobicContact CG1-CG 3.63Å
175P94.1Very high94.6Very high80 Ų8057.9 Ų57.952%0.51929%0.293SS..  trans-68.5149.817728.8-33.5000110.9S155 I156S155-P175 CarbonylContact C-O 3.54Å; S155-P175 VanDerWaalsContact CA-O 3.24Å; S155-P175 WeakPolarHBondContact CA-O 2.97Å; I156-P175 PolarHBondContact N-O 3Å
176W95.3Very high94.7Very high91 Ų9158.1 Ų58.135%0.34530%0.295SS..EExtended strand (participates in β ladder)trans-139.9149.9176.862.4-98.1000111.2I156 V158 L168 F178I156-W176 HydrophobicContact CB-CB 4.05Å; I156-W176 WeakPolarHBondContact O-CA 3.45Å; I156-W176 WeakPolarHBondContact O-CB 3.11Å; V158-W176 HydrophobicContact CB-CE3 4.38Å; V158-W176 HydrophobicContact CG2-CB 3.97Å; V158-W176 HydrophobicContact CG2-CD2 4.2Å; V158-W176 HydrophobicContact CG2-CE3 3.8Å; V158-W176 HydrophobicContact CG2-CG 4.3Å; L168-W176 HydrophobicContact CB-CH2 4.43Å; L168-W176 HydrophobicContact CB-CZ2 3.96Å; L168-W176 HydrophobicContact CD1-CH2 4.12Å; L168-W176 HydrophobicContact CD1-CZ2 4.45Å; L168-W176 HydrophobicContact CD1-CZ3 4.36Å; L168-W176 HydrophobicContact CD2-CD2 4.28Å; L168-W176 HydrophobicContact CD2-CE3 4.47Å; L168-W176 HydrophobicContact CD2-CZ2 4.46Å; W176-F178 HydrophobicContact CH2-CE2 4.17Å; W176-F178 HydrophobicContact CH2-CZ 4.17Å; W176-F178 HydrophobicContact CZ3-CD2 4.15Å; W176-F178 HydrophobicContact CZ3-CE1 4.25Å; W176-F178 AromaticContact CZ3-CE2 3.65Å; W176-F178 HydrophobicContact CZ3-CE2 3.65Å; W176-F178 AromaticContact CZ3-CZ 3.69Å; W176-F178 HydrophobicContact CZ3-CZ 3.69Å
177E94.9Very high94.7Very high78 Ų7855.5 Ų55.536%0.36428%0.278SS..EExtended strand (participates in β ladder)trans-138.2152.3-177.662.9-167.3136.300110.7G151 S152 S155 I156 I157 V158G151-E177 WeakPolarHBondContact CA-OE1 3.5Å; S152-E177 PolarHBondContact N-OE1 3.19Å; S155-E177 WeakPolarHBondContact CB-OE1 3.41Å; S155-E177 PolarHBondContact OG-OE1 2.89Å; I156-E177 PolarHBondContact O-N 2.97Å; I157-E177 HydrophobicContact CD1-CG 3.65Å; I157-E177 WeakPolarHBondContact CD1-OE1 3.46Å; V158-E177 PolarHBondContact N-O 3.4Å
178F96.1Very high94.5Very high85 Ų8555.8 Ų55.837%0.37328%0.281SS..EExtended strand (participates in β ladder)trans-81.5125.6174.2-72.6-65.9000110.3V158 R163 L168 W176V158-F178 HydrophobicContact CB-CD1 4.06Å; V158-F178 HydrophobicContact CB-CE1 4.22Å; V158-F178 HydrophobicContact CG1-CD1 4.02Å; V158-F178 HydrophobicContact CG1-CE1 3.75Å; V158-F178 WeakPolarHBondContact O-CA 3.3Å; R163-F178 HydrophobicContact CG-CD1 4.29Å; R163-F178 HydrophobicContact CG-CE1 3.52Å; R163-F178 HydrophobicContact CG-CE2 4.17Å; R163-F178 HydrophobicContact CG-CZ 3.46Å; R163-F178 VanDerWaalsContact CG-CZ 3.46Å; L168-F178 HydrophobicContact CD1-CE1 4.5Å; L168-F178 HydrophobicContact CD1-CZ 4.31Å; W176-F178 HydrophobicContact CH2-CE2 4.17Å; W176-F178 HydrophobicContact CH2-CZ 4.17Å; W176-F178 HydrophobicContact CZ3-CD2 4.15Å; W176-F178 HydrophobicContact CZ3-CE1 4.25Å; W176-F178 AromaticContact CZ3-CE2 3.65Å; W176-F178 HydrophobicContact CZ3-CE2 3.65Å; W176-F178 AromaticContact CZ3-CZ 3.69Å; W176-F178 HydrophobicContact CZ3-CZ 3.69Å
179G94.3Very high94.3Very high13 Ų1359 Ų5913%0.13430%0.296CS..  trans-135.3149.3172.600000110.7V158 P160 V181V158-G179 PolarHBondContact O-N 3.42Å; V158-G179 VanDerWaalsContact O-N 3.1Å; P160-G179 WeakPolarHBondContact CD-O 3.33Å; G179-V181 PolarHBondContact O-N 2.98Å
180D93.6Very high94.2Very high157 Ų15755.3 Ų55.384%0.8429%0.286SS*.  trans-73.1101.4176.9-168.421.9000109.9
181V94.4Very high94.2Very high24 Ų2453.2 Ų53.215%0.14528%0.278CS..  trans-136.9143-173.6-64.70000110.9I157 S159 G179 V186I157-V181 HydrophobicContact CG2-CG1 3.85Å; I157-V181 HydrophobicContact CG2-CG2 4.43Å; S159-V181 PolarHBondContact OG-O 3.39Å; G179-V181 PolarHBondContact O-N 2.98Å; V181-V186 HydrophobicContact CB-CG2 4.1Å; V181-V186 HydrophobicContact CG1-CG2 3.98Å; V181-V186 HydrophobicContact CG2-CG2 4.22Å
182V94.4Very high94.2Very high75 Ų7552.7 Ų52.746%0.45528%0.275SS..SBendtrans-64.3-51.4178.1-179.60000113R211 Q214 L215V182-R211 VanDerWaalsContact O-CZ 3.23Å; V182-R211 PolarHBondContact O-NH1 2.92Å; V182-R211 PolarHBondContact O-NH2 3.44Å; V182-Q214 HydrophobicContact CG1-CB 4.2Å; V182-L215 HydrophobicContact CG1-CD1 4.49Å
183P95.9Very high94.4Very high3 Ų343.6 Ų43.62%0.01924%0.241CC..SBendtrans-67.1171.5172.129.6-36.9000111.6S159 V186 C192 L194 L215 F219S159-P183 WeakPolarHBondContact CB-O 3.47Å; P183-V186 HydrophobicContact CG-CG2 3.73Å; P183-C192 HydrophobicContact CB-CB 3.72Å; P183-C192 HydrophobicContact CG-CB 3.79Å; P183-L194 HydrophobicContact CB-CD2 4.29Å; P183-L215 HydrophobicContact CB-CD1 3.89Å; P183-L215 HydrophobicContact CG-CD1 4.23Å; P183-F219 HydrophobicContact CG-CE2 3.86Å; P183-F219 HydrophobicContact CG-CZ 4.08Å
184D96.7Very high94.6Very high1 Ų139.9 Ų39.91%0.00522%0.215CC..SBendtrans-80.1-32.1177.9-63.7-52.7000111.8S159 R161 Q162 A193 L194 F195 R211S159-D184 PolarHBondContact N-O 3.17Å; R161-D184 IonicContact NH1-OD1 2.77Å; R161-D184 PolarHBondContact NH1-OD1 2.89Å; Q162-D184 HydrophobicContact CG-CB 3.79Å; Q162-D184 PolarHBondContact NE2-OD1 3.09Å; D184-A193 PolarHBondContact N-O 3.47Å; D184-L194 WeakPolarHBondContact OD2-CA 3.43Å; D184-F195 HydrophobicContact CB-CB 4.39Å; D184-F195 PolarHBondContact OD2-N 3.39Å; D184-R211 IonicContact OD1-CZ 3.15Å; D184-R211 IonicContact OD1-NH2 3.68Å; D184-R211 PolarHBondContact OD1-NH2 3.39Å; D184-R211 IonicContact OD2-NH2 2.67Å
185Y96.6Very high94.8Very high2 Ų240.5 Ų40.51%0.00822%0.216CC..EExtended strand (participates in β ladder)trans-138.4134.6175.1-57.1-87.4000110.8I156 I157 V158 Q162 N165 L168 C192 A193 F195 L264I156-Y185 HydrophobicContact CG2-CD1 4.2Å; I157-Y185 CarbonylContact O-C 3.56Å; I157-Y185 WeakPolarHBondContact O-CA 3.41Å; V158-Y185 HydrophobicContact CG1-CD1 4.36Å; V158-Y185 HydrophobicContact CG1-CE1 3.99Å; V158-Y185 HydrophobicContact CG2-CD1 4.05Å; V158-Y185 HydrophobicContact CG2-CE1 4.12Å; Q162-Y185 HydrophobicContact CG-CE2 4.09Å; N165-Y185 PolarHBondContact ND2-OH 2.86Å; L168-Y185 HydrophobicContact CD2-CE1 3.92Å; Y185-C192 CarbonylContact O-C 3.56Å; Y185-C192 WeakPolarHBondContact O-CA 3.46Å; Y185-C192 WeakPolarHBondContact O-CB 3.45Å; Y185-A193 PolarHBondContact N-O 3.14Å; Y185-A193 PolarHBondContact O-N 2.91Å; Y185-F195 HydrophobicContact CD2-CB 4.48Å; Y185-F195 HydrophobicContact CE2-CB 3.84Å; Y185-L264 HydrophobicContact CD1-CD1 3.95Å; Y185-L264 HydrophobicContact CD2-CD1 4.33Å; Y185-L264 HydrophobicContact CD2-CD2 4.21Å; Y185-L264 HydrophobicContact CE1-CD1 3.84Å; Y185-L264 HydrophobicContact CE2-CD1 4.25Å; Y185-L264 HydrophobicContact CG-CD1 4.2Å; Y185-L264 HydrophobicContact CG-CD2 4.09Å
186V96.1Very high94.9Very high22 Ų2236.8 Ų36.813%0.13319%0.192CC..EExtended strand (participates in β ladder)trans-102.5119.7165-175.90000108.1I157 V181 P183 G188 F219I157-V186 HydrophobicContact CB-CB 4.02Å; I157-V186 HydrophobicContact CB-CG2 4.41Å; I157-V186 HydrophobicContact CG1-CB 4.26Å; I157-V186 PolarHBondContact N-O 3Å; I157-V186 VanDerWaalsContact N-O 3.11Å; I157-V186 PolarHBondContact O-N 3.36Å; V181-V186 HydrophobicContact CB-CG2 4.1Å; V181-V186 HydrophobicContact CG1-CG2 3.98Å; V181-V186 HydrophobicContact CG2-CG2 4.22Å; P183-V186 HydrophobicContact CG-CG2 3.73Å; V186-G188 WeakPolarHBondContact CG1-O 3.38Å; V186-F219 HydrophobicContact CG1-CE1 4.06Å; V186-F219 HydrophobicContact CG1-CZ 4.48Å; V186-F219 HydrophobicContact CG2-CZ 4.14Å
187L94.2Very high95Very high1 Ų133.3 Ų33.31%0.00518%0.182CC..EExtended strand (participates in β ladder)trans-106.1-7.9-172-64.5166.8000112.4I156 T191 A193 L264 Y267 K268I156-L187 HydrophobicContact CD1-CD2 3.95Å; I156-L187 HydrophobicContact CG1-CD2 4.08Å; I156-L187 HydrophobicContact CG2-CD2 4.08Å; L187-T191 HydrophobicContact CB-CG2 4Å; L187-T191 HydrophobicContact CD1-CG2 4.43Å; L187-T191 PolarHBondContact N-O 3.4Å; L187-A193 HydrophobicContact CD1-CB 3.73Å; L187-L264 HydrophobicContact CD1-CD2 4.05Å; L187-L264 HydrophobicContact CD2-CB 4.08Å; L187-L264 HydrophobicContact CD2-CD2 3.9Å; L187-L264 HydrophobicContact CG-CD2 4.46Å; L187-Y267 HydrophobicContact CD1-CD2 4.28Å; L187-Y267 HydrophobicContact CD1-CG 4.15Å; L187-K268 WeakPolarHBondContact O-CD 3.21Å
188G91.4Very high95Very high7 Ų729.6 Ų29.67%0.07216%0.164CC..EExtended strand (participates in β ladder)trans175.4178.2177.500000111.5V186 T190 T191 E271V186-G188 WeakPolarHBondContact CG1-O 3.38Å; G188-T190 PolarHBondContact O-N 3.1Å; G188-T190 VanDerWaalsContact O-N 3.15Å; G188-T191 PolarHBondContact N-O 3.38Å; G188-T191 VanDerWaalsContact N-O 3.16Å; G188-T191 PolarHBondContact O-N 3.14Å; G188-E271 VanDerWaalsContact CA-CD 3.41Å; G188-E271 WeakPolarHBondContact CA-OE1 3.49Å
189Q89.6Confident95Very high87 Ų8734.4 Ų34.441%0.40718%0.18SC..THydrogen-bonded Turntrans-59.3-30.1-174.7-176.657.885.300113.8P147 E271P147-Q189 PolarHBondContact O-NE2 3.01Å; Q189-E271 PolarHBondContact N-OE1 3.17Å
190T91.6Very high95.1Very high74 Ų7438.6 Ų38.645%0.45419%0.193SC..THydrogen-bonded Turntrans-122.17.6-179.555.20000113.4G188 T220 L221G188-T190 PolarHBondContact O-N 3.1Å; G188-T190 VanDerWaalsContact O-N 3.15Å; T190-T220 PolarHBondContact O-N 3.36Å; T190-L221 PolarHBondContact O-N 3.32Å
191T94.6Very high95.2Very high20 Ų2031.6 Ų31.612%0.12316%0.155CC..EExtended strand (participates in β ladder)trans-127125.4-170.6-54.70000111.8L187 G188 L221L187-T191 HydrophobicContact CB-CG2 4Å; L187-T191 HydrophobicContact CD1-CG2 4.43Å; L187-T191 PolarHBondContact N-O 3.4Å; G188-T191 PolarHBondContact N-O 3.38Å; G188-T191 VanDerWaalsContact N-O 3.16Å; G188-T191 PolarHBondContact O-N 3.14Å; T191-L221 WeakPolarHBondContact CA-O 3.36Å; T191-L221 HydrophobicContact CG2-CB 4.11Å; T191-L221 HydrophobicContact CG2-CD2 3.77Å; T191-L221 HydrophobicContact CG2-CG 3.95Å
192C95.6Very high95.3Very high0 Ų034.8 Ų34.80%017%0.171CC..EExtended strand (participates in β ladder)trans-132158.4174.1690000112P183 Y185 F219 L221 V223P183-C192 HydrophobicContact CB-CB 3.72Å; P183-C192 HydrophobicContact CG-CB 3.79Å; Y185-C192 CarbonylContact O-C 3.56Å; Y185-C192 WeakPolarHBondContact O-CA 3.46Å; Y185-C192 WeakPolarHBondContact O-CB 3.45Å; C192-F219 HydrophobicContact CB-CB 4.34Å; C192-F219 HydrophobicContact CB-CD1 3.87Å; C192-F219 HydrophobicContact CB-CD2 3.85Å; C192-F219 HydrophobicContact CB-CE1 4.08Å; C192-F219 HydrophobicContact CB-CE2 4.06Å; C192-F219 HydrophobicContact CB-CG 3.75Å; C192-F219 HydrophobicContact CB-CZ 4.17Å; C192-F219 VanDerWaalsContact SG-CD2 3.54Å; C192-F219 VanDerWaalsContact SG-CG 3.54Å; C192-L221 PolarHBondContact N-O 3.29Å; C192-V223 PolarHBondContact O-N 3.12Å
193A97.1Very high95.3Very high0 Ų037.5 Ų37.50%018%0.182CC..EExtended strand (participates in β ladder)trans-122.3140.7166.700000112.2D184 Y185 L187 V223 L264D184-A193 PolarHBondContact N-O 3.47Å; Y185-A193 PolarHBondContact N-O 3.14Å; Y185-A193 PolarHBondContact O-N 2.91Å; L187-A193 HydrophobicContact CD1-CB 3.73Å; A193-V223 CarbonylContact C-O 3.54Å; A193-V223 VanDerWaalsContact CA-O 3.25Å; A193-V223 WeakPolarHBondContact CA-O 3.29Å; A193-V223 HydrophobicContact CB-CB 4.05Å; A193-V223 HydrophobicContact CB-CG1 4.47Å; A193-L264 HydrophobicContact CB-CD2 4.09Å
194L97Very high95.3Very high4 Ų440 Ų402%0.02120%0.196CC..EExtended strand (participates in β ladder)trans-97.7145.2160.8-67.7177.5000108.7P183 D184 I208 R211 L212 L215 V223 L224 L225P183-L194 HydrophobicContact CB-CD2 4.29Å; D184-L194 WeakPolarHBondContact OD2-CA 3.43Å; L194-I208 HydrophobicContact CD1-CD1 4.19Å; L194-R211 HydrophobicContact CD1-CB 4.35Å; L194-L212 HydrophobicContact CD1-CD2 3.77Å; L194-L212 HydrophobicContact CD1-CG 4.25Å; L194-L215 HydrophobicContact CD1-CD2 3.96Å; L194-L215 HydrophobicContact CG-CD2 4.11Å; L194-V223 PolarHBondContact N-O 3.2Å; L194-L224 HydrophobicContact CB-CD1 3.83Å; L194-L225 PolarHBondContact O-N 2.7Å
195F97.5Very high95.1Very high26 Ų2643.4 Ų43.411%0.11422%0.217CC..EExtended strand (participates in β ladder)trans-113.7134.9177.8172.7-103.8000111.9N165 I167 D184 Y185 L225 Q227N165-F195 WeakPolarHBondContact ND2-CD1 3.4Å; N165-F195 WeakPolarHBondContact ND2-CE1 3.24Å; I167-F195 HydrophobicContact CD1-CD2 3.6Å; I167-F195 HydrophobicContact CD1-CE1 4.44Å; I167-F195 HydrophobicContact CD1-CE2 3.23Å; I167-F195 HydrophobicContact CD1-CG 4.35Å; I167-F195 HydrophobicContact CD1-CZ 3.7Å; D184-F195 HydrophobicContact CB-CB 4.39Å; D184-F195 PolarHBondContact OD2-N 3.39Å; Y185-F195 HydrophobicContact CD2-CB 4.48Å; Y185-F195 HydrophobicContact CE2-CB 3.84Å; F195-L225 WeakPolarHBondContact CA-O 3.45Å; F195-L225 HydrophobicContact CD2-CG 4.47Å; F195-Q227 HydrophobicContact CE2-CB 3.8Å; F195-Q227 HydrophobicContact CZ-CB 4.08Å
196L96.6Very high95Very high2 Ų248.8 Ų48.81%0.0125%0.246CC..EExtended strand (participates in β ladder)trans-143.4122.7-179.7-174.360.1000110.9Y200 H201 Y207 I208 L224 L225 V226 Q227 L240L196-Y200 HydrophobicContact CD1-CD1 4.03Å; L196-H201 HydrophobicContact CD1-CB 4.07Å; L196-H201 HydrophobicContact CD2-CB 4.02Å; L196-H201 HydrophobicContact CG-CB 4.09Å; L196-Y207 HydrophobicContact CD1-CD1 3.98Å; L196-Y207 HydrophobicContact CD1-CE1 4.26Å; L196-I208 HydrophobicContact CD2-CB 4.09Å; L196-I208 HydrophobicContact CD2-CD1 4.44Å; L196-I208 HydrophobicContact CD2-CG1 4.2Å; L196-L224 HydrophobicContact CB-CD1 4.26Å; L196-L225 PolarHBondContact N-O 2.87Å; L196-V226 CarbonylContact O-C 3.53Å; L196-V226 VanDerWaalsContact O-CA 3.25Å; L196-V226 WeakPolarHBondContact O-CA 3.33Å; L196-Q227 PolarHBondContact O-N 3.49Å; L196-L240 HydrophobicContact CD2-CD1 4.17Å; L196-L240 HydrophobicContact CD2-CD2 3.72Å
197S96.4Very high95Very high19 Ų1949.8 Ų49.813%0.13325%0.248CC..EExtended strand (participates in β ladder)trans-79.2139.4163.4136.80000109.1R199 Y200 H201 D229S197-R199 VanDerWaalsContact C-N 3.3Å; S197-R199 PolarHBondContact O-N 3.08Å; S197-R199 PolarHBondContact OG-N 3.03Å; S197-Y200 WeakPolarHBondContact O-CB 3.41Å; S197-Y200 PolarHBondContact O-N 3.09Å; S197-Y200 VanDerWaalsContact O-N 3.13Å; S197-Y200 PolarHBondContact OG-N 3.16Å; S197-H201 PolarHBondContact O-N 3.39Å; S197-D229 WeakPolarHBondContact CB-OD2 3.33Å; S197-D229 VanDerWaalsContact OG-CG 3.3Å; S197-D229 PolarHBondContact OG-OD1 3.22Å; S197-D229 PolarHBondContact OG-OD2 2.85Å
198L96.3Very high95.1Very high0 Ų049.9 Ų49.90%025%0.248CC..Hα-helixtrans-65.2-37178.6-144.473.7000111.2Y200 H201 N202 V226 Q227 V228 D229 V230 P233 A236 L237 L240L198-Y200 VanDerWaalsContact C-N 3.31Å; L198-Y200 PolarHBondContact O-N 3.27Å; L198-H201 PolarHBondContact O-N 2.67Å; L198-N202 VanDerWaalsContact O-CG 3.29Å; L198-N202 PolarHBondContact O-N 2.96Å; L198-N202 PolarHBondContact O-OD1 2.82Å; L198-V226 HydrophobicContact CD1-CG1 3.54Å; L198-Q227 WeakPolarHBondContact CB-O 3.43Å; L198-Q227 PolarHBondContact N-O 3.07Å; L198-V228 HydrophobicContact CD2-CG1 4.41Å; L198-D229 PolarHBondContact N-OD1 2.8Å; L198-D229 VanDerWaalsContact N-OD1 3.11Å; L198-V230 HydrophobicContact CB-CG2 4.13Å; L198-V230 HydrophobicContact CD2-CB 4.41Å; L198-P233 HydrophobicContact CD2-CB 3.34Å; L198-A236 HydrophobicContact CD1-CB 4.03Å; L198-A236 HydrophobicContact CD2-CB 4.16Å; L198-A236 HydrophobicContact CG-CB 3.94Å; L198-L237 HydrophobicContact CD1-CD2 3.81Å; L198-L237 HydrophobicContact CD1-CG 4.32Å; L198-L237 HydrophobicContact CD2-CG 4.31Å; L198-L240 HydrophobicContact CD1-CD1 3.58Å
199R95.7Very high95.2Very high185 Ų18554 Ų5470%0.69827%0.266SS*.Hα-helixtrans-60.4-39.5171.1-177-178.3176.5-179.2-0.6111.9S197 L203 D229 V230S197-R199 VanDerWaalsContact C-N 3.3Å; S197-R199 PolarHBondContact O-N 3.08Å; S197-R199 PolarHBondContact OG-N 3.03Å; R199-L203 PolarHBondContact O-N 2.94Å; R199-D229 WeakPolarHBondContact CB-OD1 3.44Å; R199-D229 WeakPolarHBondContact CB-OD2 3.49Å; R199-D229 PolarHBondContact N-OD1 2.81Å; R199-V230 HydrophobicContact CB-CG2 3.82Å
200Y95.7Very high95.5Very high102 Ų10254.1 Ų54.140%0.427%0.269SS..Hα-helixtrans-70.7-39.2175.8-172.9-95.3000112L196 S197 L198 L203 N204 Y207L196-Y200 HydrophobicContact CD1-CD1 4.03Å; S197-Y200 WeakPolarHBondContact O-CB 3.41Å; S197-Y200 PolarHBondContact O-N 3.09Å; S197-Y200 VanDerWaalsContact O-N 3.13Å; S197-Y200 PolarHBondContact OG-N 3.16Å; L198-Y200 VanDerWaalsContact C-N 3.31Å; L198-Y200 PolarHBondContact O-N 3.27Å; Y200-L203 PolarHBondContact O-N 3.28Å; Y200-N204 HydrophobicContact CD1-CB 4.5Å; Y200-N204 HydrophobicContact CE1-CB 4.02Å; Y200-N204 WeakPolarHBondContact CE2-ND2 3.5Å; Y200-N204 PolarHBondContact O-N 3.37Å; Y200-Y207 HydrophobicContact CD1-CD1 4.21Å; Y200-Y207 AromaticContact CE1-CD1 3.73Å; Y200-Y207 HydrophobicContact CE1-CD1 3.73Å; Y200-Y207 HydrophobicContact CE1-CD2 4.13Å; Y200-Y207 HydrophobicContact CE1-CE1 4.07Å; Y200-Y207 HydrophobicContact CE1-CE2 4.45Å; Y200-Y207 AromaticContact CE1-CG 3.75Å; Y200-Y207 HydrophobicContact CE1-CG 3.75Å
201H96.5Very high95.7Very high10 Ų1051 Ų515%0.04625%0.249CC..Hα-helixtrans-60.4-44.1175.1-177.151.6000112.1L196 S197 L198 L203 N204 P205L196-H201 HydrophobicContact CD1-CB 4.07Å; L196-H201 HydrophobicContact CD2-CB 4.02Å; L196-H201 HydrophobicContact CG-CB 4.09Å; S197-H201 PolarHBondContact O-N 3.39Å; L198-H201 PolarHBondContact O-N 2.67Å; H201-L203 PolarHBondContact O-N 3.39Å; H201-N204 CarbonylContact O-C 3.16Å; H201-N204 PolarHBondContact O-N 3.18Å; H201-N204 VanDerWaalsContact O-N 3.11Å; H201-P205 WeakPolarHBondContact O-CA 3.21Å; H201-P205 VanDerWaalsContact O-N 3.08Å
202N94.9Very high95.6Very high90 Ų9051 Ų5148%0.48125%0.248SC..Hα-helixtrans-61.1-27176.9-69.6-0.6000113.2L198L198-N202 VanDerWaalsContact O-CG 3.29Å; L198-N202 PolarHBondContact O-N 2.96Å; L198-N202 PolarHBondContact O-OD1 2.82Å
203L96.1Very high95.5Very high132 Ų13259.2 Ų59.269%0.69128%0.284SS*.Hα-helixtrans-86.8-32.1174.8-174.264.5000112.5R199 Y200 H201R199-L203 PolarHBondContact O-N 2.94Å; Y200-L203 PolarHBondContact O-N 3.28Å; H201-L203 PolarHBondContact O-N 3.39Å
204N95.8Very high95.4Very high57 Ų5764.7 Ų64.731%0.30531%0.309SS..  trans-134.571.6-174-58.9-83.6000111.1Y200 H201 N206 Y207Y200-N204 HydrophobicContact CD1-CB 4.5Å; Y200-N204 HydrophobicContact CE1-CB 4.02Å; Y200-N204 WeakPolarHBondContact CE2-ND2 3.5Å; Y200-N204 PolarHBondContact O-N 3.37Å; H201-N204 CarbonylContact O-C 3.16Å; H201-N204 PolarHBondContact O-N 3.18Å; H201-N204 VanDerWaalsContact O-N 3.11Å; N204-N206 VanDerWaalsContact C-N 3.34Å; N204-N206 PolarHBondContact O-N 3.4Å; N204-Y207 VanDerWaalsContact O-CB 3.26Å; N204-Y207 WeakPolarHBondContact O-CB 3.24Å; N204-Y207 PolarHBondContact O-N 2.95Å
205P92.9Very high95.1Very high71 Ų7164.7 Ų64.746%0.46131%0.309SS..THydrogen-bonded Turntrans-63-38.4-174.322-32.9000112.8H201 Y207H201-P205 WeakPolarHBondContact O-CA 3.21Å; H201-P205 VanDerWaalsContact O-N 3.08Å; P205-Y207 PolarHBondContact O-N 3.08Å
206N94.6Very high94.8Very high116 Ų11665 Ų6562%0.6232%0.32SS*.Hα-helixtrans-66.2-22.6-179.9-66.8-16.4000113.8N204 I208 H209 D210N204-N206 VanDerWaalsContact C-N 3.34Å; N204-N206 PolarHBondContact O-N 3.4Å; N206-I208 VanDerWaalsContact C-N 3.3Å; N206-I208 PolarHBondContact O-N 3.12Å; N206-H209 WeakPolarHBondContact O-CB 3.38Å; N206-H209 PolarHBondContact O-N 2.85Å; N206-H209 VanDerWaalsContact O-N 3.07Å; N206-D210 PolarHBondContact O-N 2.71Å
207Y95.7Very high94.3Very high43 Ų4370.1 Ų70.117%0.16936%0.356CS..Hα-helixtrans-52.4-45.8-174.9172.7-104.9000112.9R161 L196 Y200 N204 P205 H209 D210 R211R161-Y207 PolarHBondContact NH1-OH 3.38Å; R161-Y207 PolarHBondContact NH2-OH 2.56Å; L196-Y207 HydrophobicContact CD1-CD1 3.98Å; L196-Y207 HydrophobicContact CD1-CE1 4.26Å; Y200-Y207 HydrophobicContact CD1-CD1 4.21Å; Y200-Y207 AromaticContact CE1-CD1 3.73Å; Y200-Y207 HydrophobicContact CE1-CD1 3.73Å; Y200-Y207 HydrophobicContact CE1-CD2 4.13Å; Y200-Y207 HydrophobicContact CE1-CE1 4.07Å; Y200-Y207 HydrophobicContact CE1-CE2 4.45Å; Y200-Y207 AromaticContact CE1-CG 3.75Å; Y200-Y207 HydrophobicContact CE1-CG 3.75Å; N204-Y207 VanDerWaalsContact O-CB 3.26Å; N204-Y207 WeakPolarHBondContact O-CB 3.24Å; N204-Y207 PolarHBondContact O-N 2.95Å; P205-Y207 PolarHBondContact O-N 3.08Å; Y207-H209 VanDerWaalsContact C-N 3.33Å; Y207-H209 PolarHBondContact O-N 3.1Å; Y207-D210 PolarHBondContact O-N 2.91Å; Y207-R211 HydrophobicContact CD1-CG 4.24Å; Y207-R211 HydrophobicContact CD2-CG 4.05Å; Y207-R211 HydrophobicContact CE1-CG 3.87Å; Y207-R211 HydrophobicContact CE2-CG 3.64Å; Y207-R211 HydrophobicContact CG-CG 4.33Å; Y207-R211 WeakPolarHBondContact O-CG 3.39Å; Y207-R211 PolarHBondContact O-N 2.75Å
208I95.6Very high94Very high2 Ų273.1 Ų73.11%0.0137%0.373CS..Hα-helixtrans-69.2-32.9-176.4-17255000112.3L194 L196 N206 R211 L212 L224 L240 I243L194-I208 HydrophobicContact CD1-CD1 4.19Å; L196-I208 HydrophobicContact CD2-CB 4.09Å; L196-I208 HydrophobicContact CD2-CD1 4.44Å; L196-I208 HydrophobicContact CD2-CG1 4.2Å; N206-I208 VanDerWaalsContact C-N 3.3Å; N206-I208 PolarHBondContact O-N 3.12Å; I208-R211 PolarHBondContact O-N 2.87Å; I208-L212 HydrophobicContact CD1-CD1 4.28Å; I208-L212 HydrophobicContact CD1-CG 4.11Å; I208-L212 HydrophobicContact CG1-CD1 3.98Å; I208-L212 HydrophobicContact CG1-CG 4.32Å; I208-L212 WeakPolarHBondContact O-CB 3.49Å; I208-L212 VanDerWaalsContact O-CG 3.27Å; I208-L212 WeakPolarHBondContact O-CG 3.43Å; I208-L212 PolarHBondContact O-N 3.44Å; I208-L224 HydrophobicContact CD1-CD1 3.56Å; I208-L224 HydrophobicContact CD1-CD2 4.08Å; I208-L224 HydrophobicContact CD1-CG 4.48Å; I208-L224 HydrophobicContact CG1-CD1 4.43Å; I208-L224 HydrophobicContact CG1-CD2 4.09Å; I208-L240 HydrophobicContact CG2-CD2 4.11Å; I208-I243 HydrophobicContact CG2-CD1 4.31Å
209H94.3Very high93.8Very high95 Ų9573.9 Ų73.944%0.4438%0.377SS..Hα-helixtrans-64.4-46176.2-66.4-84.2000111.3N206 Y207 L212 K213 I243N206-H209 WeakPolarHBondContact O-CB 3.38Å; N206-H209 PolarHBondContact O-N 2.85Å; N206-H209 VanDerWaalsContact O-N 3.07Å; Y207-H209 VanDerWaalsContact C-N 3.33Å; Y207-H209 PolarHBondContact O-N 3.1Å; H209-L212 PolarHBondContact O-N 2.9Å; H209-K213 WeakPolarHBondContact O-CB 3.15Å; H209-K213 PolarHBondContact O-N 2.97Å; H209-I243 WeakPolarHBondContact NE2-CD1 3.35Å
210D95.1Very high93.7Very high88 Ų8870.9 Ų70.947%0.47138%0.379SS..Hα-helixtrans-66.2-39.1177.7-68.6-37.7000111.9N206 Y207 K213 Q214N206-D210 PolarHBondContact O-N 2.71Å; Y207-D210 PolarHBondContact O-N 2.91Å; D210-K213 PolarHBondContact O-N 3.36Å; D210-Q214 VanDerWaalsContact O-CG 3.27Å; D210-Q214 WeakPolarHBondContact O-CG 3.23Å; D210-Q214 PolarHBondContact O-N 3.36Å
211R95.1Very high93.7Very high9 Ų968.9 Ų68.93%0.03438%0.375CS..Hα-helixtrans-66.2-41.3176.8-67.7-68.4-69.7142.3-4.3112.7R161 V182 D184 L194 Y207 I208 Q214 L215R161-R211 VanDerWaalsContact NH1-CZ 3.34Å; V182-R211 VanDerWaalsContact O-CZ 3.23Å; V182-R211 PolarHBondContact O-NH1 2.92Å; V182-R211 PolarHBondContact O-NH2 3.44Å; D184-R211 IonicContact OD1-CZ 3.15Å; D184-R211 IonicContact OD1-NH2 3.68Å; D184-R211 PolarHBondContact OD1-NH2 3.39Å; D184-R211 IonicContact OD2-NH2 2.67Å; L194-R211 HydrophobicContact CD1-CB 4.35Å; Y207-R211 HydrophobicContact CD1-CG 4.24Å; Y207-R211 HydrophobicContact CD2-CG 4.05Å; Y207-R211 HydrophobicContact CE1-CG 3.87Å; Y207-R211 HydrophobicContact CE2-CG 3.64Å; Y207-R211 HydrophobicContact CG-CG 4.33Å; Y207-R211 WeakPolarHBondContact O-CG 3.39Å; Y207-R211 PolarHBondContact O-N 2.75Å; I208-R211 PolarHBondContact O-N 2.87Å; R211-Q214 PolarHBondContact O-N 3.05Å; R211-L215 WeakPolarHBondContact O-CB 3.43Å; R211-L215 PolarHBondContact O-N 3.31Å
212L93.9Very high93.6Very high20 Ų2070.2 Ų70.211%0.10538%0.38CS..Hα-helixtrans-65.4-39.1173.9-72.7169.6000111.6L194 I208 H209 L215 G216 I243 A247 C249L194-L212 HydrophobicContact CD1-CD2 3.77Å; L194-L212 HydrophobicContact CD1-CG 4.25Å; I208-L212 HydrophobicContact CD1-CD1 4.28Å; I208-L212 HydrophobicContact CD1-CG 4.11Å; I208-L212 HydrophobicContact CG1-CD1 3.98Å; I208-L212 HydrophobicContact CG1-CG 4.32Å; I208-L212 WeakPolarHBondContact O-CB 3.49Å; I208-L212 VanDerWaalsContact O-CG 3.27Å; I208-L212 WeakPolarHBondContact O-CG 3.43Å; I208-L212 PolarHBondContact O-N 3.44Å; H209-L212 PolarHBondContact O-N 2.9Å; L212-L215 PolarHBondContact O-N 3.2Å; L212-G216 PolarHBondContact O-N 2.97Å; L212-I243 HydrophobicContact CD1-CG2 3.64Å; L212-A247 HydrophobicContact CD1-CB 4.03Å; L212-C249 VanDerWaalsContact CD2-SG 3.59Å
213K93.6Very high93.7Very high172 Ų17266.2 Ų66.275%0.74836%0.359SS*.Hα-helixtrans-64.2-39.2175-173.7179.7178.5-176.20112.6H209 D210H209-K213 WeakPolarHBondContact O-CB 3.15Å; H209-K213 PolarHBondContact O-N 2.97Å; D210-K213 PolarHBondContact O-N 3.36Å
214Q93.6Very high93.8Very high116 Ų11660 Ų6054%0.54233%0.326SS..Hα-helixtrans-66.9-38.6173.9-73.2166.98.200112.6V182 D210 R211V182-Q214 HydrophobicContact CG1-CB 4.2Å; D210-Q214 VanDerWaalsContact O-CG 3.27Å; D210-Q214 WeakPolarHBondContact O-CG 3.23Å; D210-Q214 PolarHBondContact O-N 3.36Å; R211-Q214 PolarHBondContact O-N 3.05Å
215L92.4Very high93.9Very high3 Ų357.4 Ų57.42%0.01631%0.312CS..Hα-helixtrans-70.8-34.8-179.7-175.563.7000112.9V182 P183 L194 R211 L212 T218 F219 R222V182-L215 HydrophobicContact CG1-CD1 4.49Å; P183-L215 HydrophobicContact CB-CD1 3.89Å; P183-L215 HydrophobicContact CG-CD1 4.23Å; L194-L215 HydrophobicContact CD1-CD2 3.96Å; L194-L215 HydrophobicContact CG-CD2 4.11Å; R211-L215 WeakPolarHBondContact O-CB 3.43Å; R211-L215 PolarHBondContact O-N 3.31Å; L212-L215 PolarHBondContact O-N 3.2Å; L215-T218 PolarHBondContact O-OG1 3.07Å; L215-F219 HydrophobicContact CD1-CD2 3.77Å; L215-F219 HydrophobicContact CD1-CE2 3.98Å; L215-R222 HydrophobicContact CD2-CB 4.48Å; L215-R222 HydrophobicContact CD2-CG 4.09Å
216G89.8Confident94.2Very high32 Ų3254 Ų5433%0.3329%0.29SS..THydrogen-bonded Turntrans56.5-138.3179.700000113.2L212 R222L212-G216 PolarHBondContact O-N 2.97Å; G216-R222 PolarHBondContact O-NH1 3.49Å
217S87.2Confident94.3Very high111 Ų11150 Ų5078%0.77627%0.267SS*.THydrogen-bonded Turntrans-107.622.5178.953.70000113.3F219S217-F219 PolarHBondContact O-N 2.8Å
218T89.4Confident94.4Very high81 Ų8148.4 Ų48.450%0.49726%0.262SS..SBendtrans-64.1-24.8-176.4-52.60000113.9P147 L215P147-T218 HydrophobicContact CB-CG2 4.4Å; P147-T218 HydrophobicContact CG-CG2 4.11Å; L215-T218 PolarHBondContact O-OG1 3.07Å
219F93.1Very high94.4Very high16 Ų1651.1 Ų51.17%0.0728%0.277CS..  trans-123139.9-179.4-63.9-89.6000110.4P147 P183 V186 C192 L215 S217 R222P147-F219 HydrophobicContact CG-CE1 4.02Å; P147-F219 HydrophobicContact CG-CZ 4.16Å; P183-F219 HydrophobicContact CG-CE2 3.86Å; P183-F219 HydrophobicContact CG-CZ 4.08Å; V186-F219 HydrophobicContact CG1-CE1 4.06Å; V186-F219 HydrophobicContact CG1-CZ 4.48Å; V186-F219 HydrophobicContact CG2-CZ 4.14Å; C192-F219 HydrophobicContact CB-CB 4.34Å; C192-F219 HydrophobicContact CB-CD1 3.87Å; C192-F219 HydrophobicContact CB-CD2 3.85Å; C192-F219 HydrophobicContact CB-CE1 4.08Å; C192-F219 HydrophobicContact CB-CE2 4.06Å; C192-F219 HydrophobicContact CB-CG 3.75Å; C192-F219 HydrophobicContact CB-CZ 4.17Å; C192-F219 VanDerWaalsContact SG-CD2 3.54Å; C192-F219 VanDerWaalsContact SG-CG 3.54Å; L215-F219 HydrophobicContact CD1-CD2 3.77Å; L215-F219 HydrophobicContact CD1-CE2 3.98Å; S217-F219 PolarHBondContact O-N 2.8Å; F219-R222 HydrophobicContact CB-CG 3.99Å; F219-R222 WeakPolarHBondContact O-CD 3.36Å; F219-R222 WeakPolarHBondContact O-CG 3.29Å
220T93.4Very high94.4Very high122 Ų12248.7 Ų48.775%0.74827%0.268SS*.SBendtrans-71.5-46.9178.1-46.10000111.2T190T190-T220 PolarHBondContact O-N 3.36Å
221L94.1Very high94.3Very high60 Ų6054.9 Ų54.931%0.31429%0.291SS..EExtended strand (participates in β ladder)trans-103.3109.9175.9-179.557.4000109.7T190 T191 C192 V223 Y267T190-L221 PolarHBondContact O-N 3.32Å; T191-L221 WeakPolarHBondContact CA-O 3.36Å; T191-L221 HydrophobicContact CG2-CB 4.11Å; T191-L221 HydrophobicContact CG2-CD2 3.77Å; T191-L221 HydrophobicContact CG2-CG 3.95Å; C192-L221 PolarHBondContact N-O 3.29Å; L221-V223 HydrophobicContact CD1-CG2 4.41Å; L221-V223 HydrophobicContact CG-CG2 4.19Å; L221-Y267 HydrophobicContact CD2-CD1 4.48Å; L221-Y267 HydrophobicContact CD2-CE1 4.15Å
222R96.1Very high94.3Very high39 Ų3959.4 Ų59.415%0.14732%0.316CS..EExtended strand (participates in β ladder)trans-112.1106.1179.8-66.8170.3-65153.815.3108.8L215 G216 F219 A247 D248 C249 T250L215-R222 HydrophobicContact CD2-CB 4.48Å; L215-R222 HydrophobicContact CD2-CG 4.09Å; G216-R222 PolarHBondContact O-NH1 3.49Å; F219-R222 HydrophobicContact CB-CG 3.99Å; F219-R222 WeakPolarHBondContact O-CD 3.36Å; F219-R222 WeakPolarHBondContact O-CG 3.29Å; R222-A247 VanDerWaalsContact CZ-O 3.29Å; R222-A247 PolarHBondContact NH1-O 3.2Å; R222-A247 PolarHBondContact NH2-O 3.19Å; R222-D248 VanDerWaalsContact NH2-CB 3.29Å; R222-D248 PolarHBondContact NH2-O 3Å; R222-C249 CarbonylContact O-C 3.56Å; R222-C249 WeakPolarHBondContact O-CA 3.37Å; R222-T250 PolarHBondContact O-N 2.98Å
223V97.2Very high94.3Very high6 Ų658.9 Ų58.94%0.03631%0.314CS..EExtended strand (participates in β ladder)trans-92.6130.1179.5-177.20000109.2C192 A193 L194 L221 T250 I252 Y267C192-V223 PolarHBondContact O-N 3.12Å; A193-V223 CarbonylContact C-O 3.54Å; A193-V223 VanDerWaalsContact CA-O 3.25Å; A193-V223 WeakPolarHBondContact CA-O 3.29Å; A193-V223 HydrophobicContact CB-CB 4.05Å; A193-V223 HydrophobicContact CB-CG1 4.47Å; L194-V223 PolarHBondContact N-O 3.2Å; L221-V223 HydrophobicContact CD1-CG2 4.41Å; L221-V223 HydrophobicContact CG-CG2 4.19Å; V223-T250 CarbonylContact C-O 3.58Å; V223-T250 WeakPolarHBondContact CA-O 3.43Å; V223-I252 HydrophobicContact CG1-CB 4.17Å; V223-I252 HydrophobicContact CG1-CG1 3.72Å; V223-Y267 HydrophobicContact CG1-CE2 4.1Å; V223-Y267 HydrophobicContact CG2-CE1 4.03Å; V223-Y267 HydrophobicContact CG2-CE2 4.08Å
224L97.7Very high94.4Very high1 Ų157.7 Ų57.71%0.00531%0.311CS..EExtended strand (participates in β ladder)trans-100.1103.1163.6-176.458.6000108.2L194 L196 I208 V226 L240 C244 T250 L251 I252L194-L224 HydrophobicContact CB-CD1 3.83Å; L196-L224 HydrophobicContact CB-CD1 4.26Å; I208-L224 HydrophobicContact CD1-CD1 3.56Å; I208-L224 HydrophobicContact CD1-CD2 4.08Å; I208-L224 HydrophobicContact CD1-CG 4.48Å; I208-L224 HydrophobicContact CG1-CD1 4.43Å; I208-L224 HydrophobicContact CG1-CD2 4.09Å; L224-V226 HydrophobicContact CD2-CG2 4.06Å; L224-V226 HydrophobicContact CG-CG2 3.76Å; L224-L240 HydrophobicContact CD2-CD2 4.36Å; L224-C244 VanDerWaalsContact CD2-SG 3.55Å; L224-T250 PolarHBondContact N-O 3.02Å; L224-L251 HydrophobicContact CD2-CD1 4.42Å; L224-L251 HydrophobicContact CG-CD1 4.49Å; L224-I252 PolarHBondContact O-N 3.02Å
225L97.9Very high94.4Very high3 Ų358 Ų582%0.01631%0.312CS..EExtended strand (participates in β ladder)trans-88.4106.4178.1179.458.8000109.1L194 F195 L196 I252 A254 A260 Y263 L264L194-L225 PolarHBondContact O-N 2.7Å; F195-L225 WeakPolarHBondContact CA-O 3.45Å; F195-L225 HydrophobicContact CD2-CG 4.47Å; L196-L225 PolarHBondContact N-O 2.87Å; L225-I252 HydrophobicContact CD1-CB 4.3Å; L225-I252 HydrophobicContact CD1-CG2 3.88Å; L225-A254 HydrophobicContact CD1-CB 4.28Å; L225-A260 HydrophobicContact CD1-CB 4.42Å; L225-A260 HydrophobicContact CD2-CB 4.13Å; L225-A260 HydrophobicContact CG-CB 4.46Å; L225-Y263 HydrophobicContact CD1-CD2 3.97Å; L225-L264 HydrophobicContact CD2-CD1 4.4Å; L225-L264 HydrophobicContact CD2-CD2 3.82Å; L225-L264 HydrophobicContact CD2-CG 3.96Å
226V98Very high94.6Very high0 Ų058.1 Ų58.10%031%0.313CS..EExtended strand (participates in β ladder)trans-104.7120.2-175.7-177.70000110.6L196 L198 L224 L237 L240 L251 I252 L253 A254L196-V226 CarbonylContact O-C 3.53Å; L196-V226 VanDerWaalsContact O-CA 3.25Å; L196-V226 WeakPolarHBondContact O-CA 3.33Å; L198-V226 HydrophobicContact CD1-CG1 3.54Å; L224-V226 HydrophobicContact CD2-CG2 4.06Å; L224-V226 HydrophobicContact CG-CG2 3.76Å; V226-L237 HydrophobicContact CG1-CD2 4.33Å; V226-L240 HydrophobicContact CG1-CD1 4.17Å; V226-L240 HydrophobicContact CG2-CD1 4.32Å; V226-L251 HydrophobicContact CB-CD1 4.22Å; V226-L251 HydrophobicContact CG2-CD1 3.44Å; V226-L251 VanDerWaalsContact CG2-CD1 3.44Å; V226-I252 PolarHBondContact N-O 3.35Å; V226-L253 HydrophobicContact CB-CD2 3.97Å; V226-L253 HydrophobicContact CG1-CD2 4.45Å; V226-L253 CarbonylContact O-C 3.6Å; V226-L253 WeakPolarHBondContact O-CA 3.39Å; V226-A254 PolarHBondContact O-N 2.84Å
227Q97.2Very high94.9Very high30 Ų3057.9 Ų57.914%0.1430%0.304CS..EExtended strand (participates in β ladder)trans-85.8121.6170.9-179.3-179.6-25.900110.3F195 L196 L198 D229 A254F195-Q227 HydrophobicContact CE2-CB 3.8Å; F195-Q227 HydrophobicContact CZ-CB 4.08Å; L196-Q227 PolarHBondContact O-N 3.49Å; L198-Q227 WeakPolarHBondContact CB-O 3.43Å; L198-Q227 PolarHBondContact N-O 3.07Å; Q227-D229 HydrophobicContact CG-CB 4.45Å; Q227-D229 PolarHBondContact O-N 2.99Å; Q227-A254 CarbonylContact C-O 3.54Å; Q227-A254 WeakPolarHBondContact CA-O 3.38Å
228V97.2Very high95.3Very high10 Ų1060.3 Ų60.36%0.06130%0.301CS..  trans-86.891.3178.8-174.80000109.6L198 P233 L253 A254 W255L198-V228 HydrophobicContact CD2-CG1 4.41Å; V228-P233 HydrophobicContact CG1-CB 3.73Å; V228-P233 HydrophobicContact CG1-CG 4.07Å; V228-L253 HydrophobicContact CG2-CB 4.36Å; V228-A254 PolarHBondContact N-O 2.85Å; V228-W255 HydrophobicContact CB-CD2 4.33Å; V228-W255 HydrophobicContact CB-CE3 4.01Å; V228-W255 HydrophobicContact CB-CZ3 4.24Å; V228-W255 HydrophobicContact CG1-CD2 4.5Å; V228-W255 HydrophobicContact CG1-CE3 3.81Å; V228-W255 HydrophobicContact CG1-CH2 4.02Å; V228-W255 HydrophobicContact CG1-CZ3 3.54Å
229D95.4Very high95.6Very high60 Ų6060.8 Ų60.832%0.32130%0.298SS..  trans-115.822.1-176.562.9-16000113.5S197 L198 R199 Q227S197-D229 WeakPolarHBondContact CB-OD2 3.33Å; S197-D229 VanDerWaalsContact OG-CG 3.3Å; S197-D229 PolarHBondContact OG-OD1 3.22Å; S197-D229 PolarHBondContact OG-OD2 2.85Å; L198-D229 PolarHBondContact N-OD1 2.8Å; L198-D229 VanDerWaalsContact N-OD1 3.11Å; R199-D229 WeakPolarHBondContact CB-OD1 3.44Å; R199-D229 WeakPolarHBondContact CB-OD2 3.49Å; R199-D229 PolarHBondContact N-OD1 2.81Å; Q227-D229 HydrophobicContact CG-CB 4.45Å; Q227-D229 PolarHBondContact O-N 2.99Å
230V95.4Very high95.8Very high43 Ų4360 Ų6026%0.26129%0.294SS..SBendtrans-127.4144.8-178.2179.40000110.2L198 R199L198-V230 HydrophobicContact CB-CG2 4.13Å; L198-V230 HydrophobicContact CD2-CB 4.41Å; R199-V230 HydrophobicContact CB-CG2 3.82Å
231K93.1Very high96Very high219 Ų21956 Ų5695%0.95227%0.273SS*.SBendtrans-65.9-38.1-176.7-69.3-173.1177.4-176.80114.4P233K231-P233 WeakPolarHBondContact O-CD 3.43Å
232D94.2Very high96.1Very high103 Ų10361.8 Ų61.855%0.55129%0.291SS*.  trans-115.196.8173.1179.211.7000109.2H234D232-H234 IonicContact OD1-CD2 3.88Å; D232-H234 PolarHBondContact OD1-CD2 3.18Å; D232-H234 IonicContact OD1-CG 2.7Å; D232-H234 PolarHBondContact OD1-N 3.02Å
233P94.6Very high96Very high10 Ų1061 Ų617%0.06529%0.29CS..  trans-91.1-7.5-179.237.3-36.8000113.2L198 V228 K231 H235 A236 L237L198-P233 HydrophobicContact CD2-CB 3.34Å; V228-P233 HydrophobicContact CG1-CB 3.73Å; V228-P233 HydrophobicContact CG1-CG 4.07Å; K231-P233 WeakPolarHBondContact O-CD 3.43Å; P233-H235 PolarHBondContact O-N 3.02Å; P233-A236 PolarHBondContact O-N 3.04Å; P233-L237 HydrophobicContact CB-CD1 3.79Å; P233-L237 HydrophobicContact CB-CG 4.12Å; P233-L237 HydrophobicContact CG-CD1 4.25Å; P233-L237 VanDerWaalsContact O-CB 3.31Å; P233-L237 WeakPolarHBondContact O-CB 3.47Å; P233-L237 VanDerWaalsContact O-CG 3.24Å; P233-L237 WeakPolarHBondContact O-CG 3.38Å; P233-L237 PolarHBondContact O-N 3.25Å
234H94.9Very high96Very high147 Ų14760.9 Ų60.968%0.68129%0.289SS*.Hα-helixtrans-64.8-39.6-162.6-67.7-70.9000113.7D232 K238D232-H234 IonicContact OD1-CD2 3.88Å; D232-H234 PolarHBondContact OD1-CD2 3.18Å; D232-H234 IonicContact OD1-CG 2.7Å; D232-H234 PolarHBondContact OD1-N 3.02Å; H234-K238 WeakPolarHBondContact O-CB 3.39Å; H234-K238 PolarHBondContact O-N 3.29Å
235H94.5Very high95.9Very high121 Ų12166.3 Ų66.356%0.5632%0.322SS*.Hα-helixtrans-67.7-55.7178.2-164.9-79.2000111.6P233 L237 K238 E239P233-H235 PolarHBondContact O-N 3.02Å; H235-L237 VanDerWaalsContact C-N 3.31Å; H235-L237 PolarHBondContact O-N 2.89Å; H235-K238 WeakPolarHBondContact O-CB 3.46Å; H235-K238 PolarHBondContact O-N 2.77Å; H235-K238 VanDerWaalsContact O-N 3.08Å; H235-E239 IonicContact CE1-OE1 3.98Å; H235-E239 PolarHBondContact CE1-OE1 3.1Å; H235-E239 IonicContact CE1-OE2 3.34Å; H235-E239 PolarHBondContact CE1-OE2 3.4Å; H235-E239 VanDerWaalsContact ND1-CD 3.32Å; H235-E239 IonicContact ND1-OE1 2.98Å; H235-E239 IonicContact ND1-OE2 3.82Å; H235-E239 PolarHBondContact ND1-OE2 3.43Å; H235-E239 PolarHBondContact O-N 2.76Å; H235-E239 VanDerWaalsContact O-N 3.1Å
236A95.2Very high95.7Very high6 Ų672.9 Ų72.95%0.0535%0.354CS..Hα-helixtrans-58.5-40.9-179.400000112.2L198 P233 E239 L240L198-A236 HydrophobicContact CD1-CB 4.03Å; L198-A236 HydrophobicContact CD2-CB 4.16Å; L198-A236 HydrophobicContact CG-CB 3.94Å; P233-A236 PolarHBondContact O-N 3.04Å; A236-E239 PolarHBondContact O-N 2.99Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 VanDerWaalsContact O-CG 3.29Å; A236-L240 WeakPolarHBondContact O-CG 3.47Å; A236-L240 PolarHBondContact O-N 3.37Å
237L96.8Very high95.5Very high27 Ų2774.2 Ų74.214%0.14137%0.365CS..Hα-helixtrans-66.8-35.8176.3-70.8-179.8000112.9L198 V226 P233 H235 E239 A241 L253L198-L237 HydrophobicContact CD1-CD2 3.81Å; L198-L237 HydrophobicContact CD1-CG 4.32Å; L198-L237 HydrophobicContact CD2-CG 4.31Å; V226-L237 HydrophobicContact CG1-CD2 4.33Å; P233-L237 HydrophobicContact CB-CD1 3.79Å; P233-L237 HydrophobicContact CB-CG 4.12Å; P233-L237 HydrophobicContact CG-CD1 4.25Å; P233-L237 VanDerWaalsContact O-CB 3.31Å; P233-L237 WeakPolarHBondContact O-CB 3.47Å; P233-L237 VanDerWaalsContact O-CG 3.24Å; P233-L237 WeakPolarHBondContact O-CG 3.38Å; P233-L237 PolarHBondContact O-N 3.25Å; H235-L237 VanDerWaalsContact C-N 3.31Å; H235-L237 PolarHBondContact O-N 2.89Å; L237-E239 VanDerWaalsContact C-N 3.34Å; L237-A241 WeakPolarHBondContact O-CB 3.48Å; L237-A241 PolarHBondContact O-N 2.94Å; L237-L253 HydrophobicContact CD1-CD1 3.87Å; L237-L253 HydrophobicContact CD2-CD1 4.12Å; L237-L253 HydrophobicContact CD2-CD2 3.52Å; L237-L253 HydrophobicContact CD2-CG 4.48Å
238K96.6Very high95.4Very high162 Ų16279 Ų7970%0.70439%0.392SS*.Hα-helixtrans-64.2-40.3174.9-178.8-174.6176.3-1730111.5H234 H235 R242H234-K238 WeakPolarHBondContact O-CB 3.39Å; H234-K238 PolarHBondContact O-N 3.29Å; H235-K238 WeakPolarHBondContact O-CB 3.46Å; H235-K238 PolarHBondContact O-N 2.77Å; H235-K238 VanDerWaalsContact O-N 3.08Å; K238-R242 PolarHBondContact O-N 3.49Å
239E95.3Very high95.2Very high92 Ų9279.3 Ų79.343%0.4339%0.394SS..Hα-helixtrans-69.8-48.9176.8-67.6176.8123.400111.5H235 A236 L237 A241 R242 I243H235-E239 IonicContact CE1-OE1 3.98Å; H235-E239 PolarHBondContact CE1-OE1 3.1Å; H235-E239 IonicContact CE1-OE2 3.34Å; H235-E239 PolarHBondContact CE1-OE2 3.4Å; H235-E239 VanDerWaalsContact ND1-CD 3.32Å; H235-E239 IonicContact ND1-OE1 2.98Å; H235-E239 IonicContact ND1-OE2 3.82Å; H235-E239 PolarHBondContact ND1-OE2 3.43Å; H235-E239 PolarHBondContact O-N 2.76Å; H235-E239 VanDerWaalsContact O-N 3.1Å; A236-E239 PolarHBondContact O-N 2.99Å; L237-E239 VanDerWaalsContact C-N 3.34Å; E239-A241 VanDerWaalsContact C-N 3.32Å; E239-A241 PolarHBondContact O-N 3.36Å; E239-R242 WeakPolarHBondContact O-CB 3.25Å; E239-R242 PolarHBondContact O-N 3.26Å; E239-R242 VanDerWaalsContact O-N 3.14Å; E239-I243 WeakPolarHBondContact O-CG1 3.35Å; E239-I243 PolarHBondContact O-N 2.73Å
240L96.5Very high95.3Very high0 Ų079.3 Ų79.30%040%0.396CS..Hα-helixtrans-60.3-38.7176-72.1171.8000112.6L196 L198 I208 L224 V226 A236 I243 C244L196-L240 HydrophobicContact CD2-CD1 4.17Å; L196-L240 HydrophobicContact CD2-CD2 3.72Å; L198-L240 HydrophobicContact CD1-CD1 3.58Å; I208-L240 HydrophobicContact CG2-CD2 4.11Å; L224-L240 HydrophobicContact CD2-CD2 4.36Å; V226-L240 HydrophobicContact CG1-CD1 4.17Å; V226-L240 HydrophobicContact CG2-CD1 4.32Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 VanDerWaalsContact O-CG 3.29Å; A236-L240 WeakPolarHBondContact O-CG 3.47Å; A236-L240 PolarHBondContact O-N 3.37Å; L240-I243 HydrophobicContact CD2-CD1 4.44Å; L240-I243 PolarHBondContact O-N 2.83Å; L240-C244 WeakPolarHBondContact O-CB 3.34Å; L240-C244 PolarHBondContact O-N 3.02Å; L240-C244 PolarHBondContact O-SG 3.28Å
241A97.1Very high95.4Very high37 Ų3779.6 Ų79.631%0.30640%0.396SS..Hα-helixtrans-62.4-42.8174.500000111.8L237 E239 I243 C244 V245 L251L237-A241 WeakPolarHBondContact O-CB 3.48Å; L237-A241 PolarHBondContact O-N 2.94Å; E239-A241 VanDerWaalsContact C-N 3.32Å; E239-A241 PolarHBondContact O-N 3.36Å; A241-I243 PolarHBondContact O-N 2.72Å; A241-C244 PolarHBondContact O-N 3.31Å; A241-V245 WeakPolarHBondContact O-CG2 3.4Å; A241-V245 PolarHBondContact O-N 3.15Å; A241-L251 HydrophobicContact CB-CD2 3.96Å
242R96.9Very high95.6Very high181 Ų18171 Ų7168%0.68336%0.36SS*.Hα-helixtrans-61.5-43.5174.1-175-177.6-179.1178.62.9111.6K238 E239 V245 M246K238-R242 PolarHBondContact O-N 3.49Å; E239-R242 WeakPolarHBondContact O-CB 3.25Å; E239-R242 PolarHBondContact O-N 3.26Å; E239-R242 VanDerWaalsContact O-N 3.14Å; R242-V245 PolarHBondContact O-N 3.01Å; R242-M246 HydrophobicContact CG-SD 4.06Å; R242-M246 WeakPolarHBondContact O-CG 3.48Å; R242-M246 PolarHBondContact O-N 3.3Å
243I95.3Very high95.8Very high23 Ų2368.8 Ų68.812%0.11835%0.348CS..Hα-helixtrans-61.4-44.4176.5-66164.1000110.6I208 H209 L212 E239 L240 A241 V245 M246 A247I208-I243 HydrophobicContact CG2-CD1 4.31Å; H209-I243 WeakPolarHBondContact NE2-CD1 3.35Å; L212-I243 HydrophobicContact CD1-CG2 3.64Å; E239-I243 WeakPolarHBondContact O-CG1 3.35Å; E239-I243 PolarHBondContact O-N 2.73Å; L240-I243 HydrophobicContact CD2-CD1 4.44Å; L240-I243 PolarHBondContact O-N 2.83Å; A241-I243 PolarHBondContact O-N 2.72Å; I243-V245 PolarHBondContact O-N 2.95Å; I243-M246 PolarHBondContact O-N 3.16Å; I243-A247 VanDerWaalsContact O-CB 3.28Å; I243-A247 WeakPolarHBondContact O-CB 2.94Å; I243-A247 PolarHBondContact O-N 2.9Å
244C95.9Very high95.9Very high4 Ų468.3 Ų68.33%0.02735%0.345CS..Hα-helixtrans-62.3-42.8178.8-69.80000112.6L224 L240 A241 A247 D248 C249 L251L224-C244 VanDerWaalsContact CD2-SG 3.55Å; L240-C244 WeakPolarHBondContact O-CB 3.34Å; L240-C244 PolarHBondContact O-N 3.02Å; L240-C244 PolarHBondContact O-SG 3.28Å; A241-C244 PolarHBondContact O-N 3.31Å; C244-A247 PolarHBondContact O-N 3.01Å; C244-D248 PolarHBondContact O-N 3.02Å; C244-D248 VanDerWaalsContact O-N 3.1Å; C244-C249 HydrophobicContact CB-CB 4.38Å; C244-C249 WeakPolarHBondContact CB-O 3.28Å; C244-C249 PolarHBondContact O-N 3.32Å; C244-L251 HydrophobicContact CB-CB 4.19Å
245V95.9Very high96Very high114 Ų11469.4 Ų69.469%0.69134%0.343SS*.Hα-helixtrans-63.8-42.8174.7172.40000111.3A241 R242 I243 A247A241-V245 WeakPolarHBondContact O-CG2 3.4Å; A241-V245 PolarHBondContact O-N 3.15Å; R242-V245 PolarHBondContact O-N 3.01Å; I243-V245 PolarHBondContact O-N 2.95Å; V245-A247 VanDerWaalsContact C-N 3.28Å; V245-A247 PolarHBondContact O-N 3.46Å
246M94.2Very high96.1Very high142 Ų14265.5 Ų65.570%0.733%0.329SS*.Hα-helixtrans-71.1-21.8179.3-70.9178.162.800114R242 I243R242-M246 HydrophobicContact CG-SD 4.06Å; R242-M246 WeakPolarHBondContact O-CG 3.48Å; R242-M246 PolarHBondContact O-N 3.3Å; I243-M246 PolarHBondContact O-N 3.16Å
247A93.3Very high96.1Very high27 Ų2766.8 Ų66.822%0.22334%0.337CS..THydrogen-bonded Turntrans-105.46.7-178.600000113.6L212 R222 I243 C244 V245 C249L212-A247 HydrophobicContact CD1-CB 4.03Å; R222-A247 VanDerWaalsContact CZ-O 3.29Å; R222-A247 PolarHBondContact NH1-O 3.2Å; R222-A247 PolarHBondContact NH2-O 3.19Å; I243-A247 VanDerWaalsContact O-CB 3.28Å; I243-A247 WeakPolarHBondContact O-CB 2.94Å; I243-A247 PolarHBondContact O-N 2.9Å; C244-A247 PolarHBondContact O-N 3.01Å; V245-A247 VanDerWaalsContact C-N 3.28Å; V245-A247 PolarHBondContact O-N 3.46Å; A247-C249 PolarHBondContact O-N 3.18Å; A247-C249 PolarHBondContact O-SG 3.34Å; A247-C249 VanDerWaalsContact O-SG 3.35Å
248D94.3Very high96.1Very high132 Ų13271.3 Ų71.371%0.70636%0.358SS*.THydrogen-bonded Turntrans49.750.4-173.9-66-48.5000113.1R222 C244R222-D248 VanDerWaalsContact NH2-CB 3.29Å; R222-D248 PolarHBondContact NH2-O 3Å; C244-D248 PolarHBondContact O-N 3.02Å; C244-D248 VanDerWaalsContact O-N 3.1Å
249C94.6Very high96.1Very high16 Ų1666.4 Ų66.411%0.10834%0.337CS..  trans-116.4144.1179.8-66.20000111.6L212 R222 C244 A247L212-C249 VanDerWaalsContact CD2-SG 3.59Å; R222-C249 CarbonylContact O-C 3.56Å; R222-C249 WeakPolarHBondContact O-CA 3.37Å; C244-C249 HydrophobicContact CB-CB 4.38Å; C244-C249 WeakPolarHBondContact CB-O 3.28Å; C244-C249 PolarHBondContact O-N 3.32Å; A247-C249 PolarHBondContact O-N 3.18Å; A247-C249 PolarHBondContact O-SG 3.34Å; A247-C249 VanDerWaalsContact O-SG 3.35Å
250T96.4Very high96.2Very high60 Ų6062 Ų6237%0.36832%0.317SS..EExtended strand (participates in β ladder)trans-86111.8175.5-52.20000110.1R222 V223 L224 I252R222-T250 PolarHBondContact O-N 2.98Å; V223-T250 CarbonylContact C-O 3.58Å; V223-T250 WeakPolarHBondContact CA-O 3.43Å; L224-T250 PolarHBondContact N-O 3.02Å; T250-I252 HydrophobicContact CG2-CD1 4.17Å; T250-I252 HydrophobicContact CG2-CG1 4.34Å
251L97.5Very high96.2Very high48 Ų4862 Ų6225%0.25132%0.317SS..EExtended strand (participates in β ladder)trans-76.3122.7173.5-179.659000110.4L224 V226 A241 C244 L253L224-L251 HydrophobicContact CD2-CD1 4.42Å; L224-L251 HydrophobicContact CG-CD1 4.49Å; V226-L251 HydrophobicContact CB-CD1 4.22Å; V226-L251 HydrophobicContact CG2-CD1 3.44Å; V226-L251 VanDerWaalsContact CG2-CD1 3.44Å; A241-L251 HydrophobicContact CB-CD2 3.96Å; C244-L251 HydrophobicContact CB-CB 4.19Å; L251-L253 HydrophobicContact CD1-CD2 3.77Å; L251-L253 HydrophobicContact CD2-CD2 4.15Å; L251-L253 HydrophobicContact CG-CD2 3.84Å
252I97.9Very high96.2Very high38 Ų3866.9 Ų66.920%0.19533%0.327CS..EExtended strand (participates in β ladder)trans-121.1130.5171.4-61.4-64.9000108.2V223 L224 L225 V226 T250 Y263 Y267V223-I252 HydrophobicContact CG1-CB 4.17Å; V223-I252 HydrophobicContact CG1-CG1 3.72Å; L224-I252 PolarHBondContact O-N 3.02Å; L225-I252 HydrophobicContact CD1-CB 4.3Å; L225-I252 HydrophobicContact CD1-CG2 3.88Å; V226-I252 PolarHBondContact N-O 3.35Å; T250-I252 HydrophobicContact CG2-CD1 4.17Å; T250-I252 HydrophobicContact CG2-CG1 4.34Å; I252-Y263 HydrophobicContact CG2-CD2 3.64Å; I252-Y263 HydrophobicContact CG2-CE2 3.76Å; I252-Y263 HydrophobicContact CG2-CG 4.07Å; I252-Y267 HydrophobicContact CG1-CE2 4.4Å; I252-Y267 WeakPolarHBondContact CG1-OH 3.17Å
253L97.7Very high96.2Very high57 Ų5761.8 Ų61.830%0.29831%0.309SS..EExtended strand (participates in β ladder)trans-103.7138.8179.8-52.4-173.8000109.9V226 V228 L237 L251 Y263V226-L253 HydrophobicContact CB-CD2 3.97Å; V226-L253 HydrophobicContact CG1-CD2 4.45Å; V226-L253 CarbonylContact O-C 3.6Å; V226-L253 WeakPolarHBondContact O-CA 3.39Å; V228-L253 HydrophobicContact CG2-CB 4.36Å; L237-L253 HydrophobicContact CD1-CD1 3.87Å; L237-L253 HydrophobicContact CD2-CD1 4.12Å; L237-L253 HydrophobicContact CD2-CD2 3.52Å; L237-L253 HydrophobicContact CD2-CG 4.48Å; L251-L253 HydrophobicContact CD1-CD2 3.77Å; L251-L253 HydrophobicContact CD2-CD2 4.15Å; L251-L253 HydrophobicContact CG-CD2 3.84Å; L253-Y263 WeakPolarHBondContact O-CE2 3.37Å
254A97.5Very high96.3Very high0 Ų060.8 Ų60.80%030%0.303CS..EExtended strand (participates in β ladder)trans-129.7131.3172.300000110.2L225 V226 Q227 V228 E259 A260 Y263L225-A254 HydrophobicContact CD1-CB 4.28Å; V226-A254 PolarHBondContact O-N 2.84Å; Q227-A254 CarbonylContact C-O 3.54Å; Q227-A254 WeakPolarHBondContact CA-O 3.38Å; V228-A254 PolarHBondContact N-O 2.85Å; A254-E259 WeakPolarHBondContact CA-OE2 3.4Å; A254-E259 HydrophobicContact CB-CB 4.36Å; A254-E259 HydrophobicContact CB-CG 4.34Å; A254-A260 HydrophobicContact CB-CB 3.73Å; A254-Y263 HydrophobicContact CB-CD2 4.28Å; A254-Y263 HydrophobicContact CB-CE2 4.1Å
255W96.5Very high96.2Very high170 Ų17061 Ų6164%0.64430%0.304SS*.SBendtrans-87.5-12.2178-63.791000112.7V228 E259V228-W255 HydrophobicContact CB-CD2 4.33Å; V228-W255 HydrophobicContact CB-CE3 4.01Å; V228-W255 HydrophobicContact CB-CZ3 4.24Å; V228-W255 HydrophobicContact CG1-CD2 4.5Å; V228-W255 HydrophobicContact CG1-CE3 3.81Å; V228-W255 HydrophobicContact CG1-CH2 4.02Å; V228-W255 HydrophobicContact CG1-CZ3 3.54Å; W255-E259 PolarHBondContact N-OE2 3.42Å
256S96.1Very high96.1Very high39 Ų3958 Ų5827%0.27329%0.286SS..SBendtrans-142.2156.6174.882.10000112.1E258 E259 A260S256-E258 PolarHBondContact O-N 2.86Å; S256-E258 PolarHBondContact OG-N 3.31Å; S256-E259 PolarHBondContact O-N 2.89Å; S256-E259 WeakPolarHBondContact OG-CB 3.35Å; S256-E259 PolarHBondContact OG-N 2.95Å; S256-A260 PolarHBondContact O-N 3.01Å
257P95.9Very high96.1Very high33 Ų3354 Ų5421%0.21426%0.263CS..Hα-helixtrans-66.5-19.7172.728-35.5000112.9P166 I167 F170 G261P166-P257 HydrophobicContact CB-CB 4.34Å; P166-P257 HydrophobicContact CG-CB 4.2Å; I167-P257 HydrophobicContact CG1-CB 3.9Å; F170-P257 HydrophobicContact CD2-CB 4.26Å; F170-P257 HydrophobicContact CE2-CB 4.09Å; F170-P257 HydrophobicContact CE2-CG 3.94Å; P257-G261 PolarHBondContact O-N 3.14Å; P257-G261 VanDerWaalsContact O-N 3.09Å
258E96.4Very high96.2Very high123 Ų12353.7 Ų53.758%0.57526%0.257SS*.Hα-helixtrans-71.9-47.9173.5179.9174.9-168.300111.2F170 S256 A260 G261 R262F170-E258 HydrophobicContact CD1-CB 3.67Å; F170-E258 HydrophobicContact CD1-CG 3.74Å; F170-E258 HydrophobicContact CD2-CB 4.43Å; F170-E258 HydrophobicContact CE1-CB 3.87Å; F170-E258 HydrophobicContact CE1-CG 4.18Å; F170-E258 HydrophobicContact CG-CB 3.97Å; F170-E258 HydrophobicContact CG-CG 4.31Å; F170-E258 HydrophobicContact CZ-CB 4.34Å; S256-E258 PolarHBondContact O-N 2.86Å; S256-E258 PolarHBondContact OG-N 3.31Å; E258-A260 VanDerWaalsContact C-N 3.34Å; E258-A260 PolarHBondContact O-N 3.49Å; E258-G261 PolarHBondContact O-N 3.32Å; E258-R262 PolarHBondContact O-N 3.29Å
259E97.3Very high96Very high58 Ų5850.2 Ų50.227%0.27124%0.243SC..Hα-helixtrans-61.2-43.3175.2-173.8-177-159.300111.1A254 W255 S256 G261 R262 Y263A254-E259 WeakPolarHBondContact CA-OE2 3.4Å; A254-E259 HydrophobicContact CB-CB 4.36Å; A254-E259 HydrophobicContact CB-CG 4.34Å; W255-E259 PolarHBondContact N-OE2 3.42Å; S256-E259 PolarHBondContact O-N 2.89Å; S256-E259 WeakPolarHBondContact OG-CB 3.35Å; S256-E259 PolarHBondContact OG-N 2.95Å; E259-G261 VanDerWaalsContact C-N 3.34Å; E259-G261 PolarHBondContact O-N 3.29Å; E259-R262 WeakPolarHBondContact O-CB 3.35Å; E259-R262 PolarHBondContact O-N 3.5Å; E259-R262 VanDerWaalsContact O-N 3.14Å; E259-Y263 HydrophobicContact CG-CD2 4.28Å; E259-Y263 HydrophobicContact CG-CE2 3.6Å; E259-Y263 WeakPolarHBondContact O-CD2 3.47Å; E259-Y263 PolarHBondContact O-N 2.89Å; E259-Y263 PolarHBondContact OE1-OH 2.74Å
260A97.1Very high95.7Very high0 Ų055.2 Ų55.20%026%0.261CS..Hα-helixtrans-58.5-43.6173.700000112.3I167 L225 A254 S256 E258 Y263 L264I167-A260 HydrophobicContact CD1-CB 3.61Å; I167-A260 HydrophobicContact CG1-CB 3.94Å; L225-A260 HydrophobicContact CD1-CB 4.42Å; L225-A260 HydrophobicContact CD2-CB 4.13Å; L225-A260 HydrophobicContact CG-CB 4.46Å; A254-A260 HydrophobicContact CB-CB 3.73Å; S256-A260 PolarHBondContact O-N 3.01Å; E258-A260 VanDerWaalsContact C-N 3.34Å; E258-A260 PolarHBondContact O-N 3.49Å; A260-Y263 PolarHBondContact O-N 3.21Å; A260-L264 WeakPolarHBondContact O-CG 3.4Å; A260-L264 PolarHBondContact O-N 2.88Å
261G96.7Very high95.2Very high0 Ų055.8 Ų55.80%026%0.259CS..Hα-helixtrans-61.2-43.3173.600000112.2P257 E258 E259 Y263 L264 E265P257-G261 PolarHBondContact O-N 3.14Å; P257-G261 VanDerWaalsContact O-N 3.09Å; E258-G261 PolarHBondContact O-N 3.32Å; E259-G261 VanDerWaalsContact C-N 3.34Å; E259-G261 PolarHBondContact O-N 3.29Å; G261-Y263 VanDerWaalsContact C-N 3.32Å; G261-Y263 PolarHBondContact O-N 3.35Å; G261-L264 PolarHBondContact O-N 2.85Å; G261-L264 VanDerWaalsContact O-N 3.17Å; G261-E265 WeakPolarHBondContact O-CG 3.41Å; G261-E265 PolarHBondContact O-N 3.32Å
262R96.9Very high94.5Very high139 Ų13961.8 Ų61.853%0.52528%0.283SS..Hα-helixtrans-63.9-34178.7-17054.8173177.6-1.7113S173 E258 E259 E265 T266S173-R262 PolarHBondContact OG-NH1 3.23Å; E258-R262 PolarHBondContact O-N 3.29Å; E259-R262 WeakPolarHBondContact O-CB 3.35Å; E259-R262 PolarHBondContact O-N 3.5Å; E259-R262 VanDerWaalsContact O-N 3.14Å; R262-E265 WeakPolarHBondContact CD-OE2 3.28Å; R262-E265 IonicContact CZ-OE2 3.04Å; R262-E265 IonicContact NE-OE2 3.18Å; R262-E265 IonicContact NH1-OE2 3.71Å; R262-E265 PolarHBondContact NH1-OE2 2.92Å; R262-T266 WeakPolarHBondContact O-CB 3.48Å; R262-T266 PolarHBondContact O-N 3.32Å; R262-T266 PolarHBondContact O-OG1 2.84Å
263Y97.3Very high93.8Very high75 Ų7564.3 Ų64.329%0.29429%0.293SS..Hα-helixtrans-65.5-43.6172.1-67.7-44.3000112.4L225 I252 L253 A254 E259 A260 G261 E265 T266 Y267L225-Y263 HydrophobicContact CD1-CD2 3.97Å; I252-Y263 HydrophobicContact CG2-CD2 3.64Å; I252-Y263 HydrophobicContact CG2-CE2 3.76Å; I252-Y263 HydrophobicContact CG2-CG 4.07Å; L253-Y263 WeakPolarHBondContact O-CE2 3.37Å; A254-Y263 HydrophobicContact CB-CD2 4.28Å; A254-Y263 HydrophobicContact CB-CE2 4.1Å; E259-Y263 HydrophobicContact CG-CD2 4.28Å; E259-Y263 HydrophobicContact CG-CE2 3.6Å; E259-Y263 WeakPolarHBondContact O-CD2 3.47Å; E259-Y263 PolarHBondContact O-N 2.89Å; E259-Y263 PolarHBondContact OE1-OH 2.74Å; A260-Y263 PolarHBondContact O-N 3.21Å; G261-Y263 VanDerWaalsContact C-N 3.32Å; G261-Y263 PolarHBondContact O-N 3.35Å; Y263-E265 PolarHBondContact O-N 3.37Å; Y263-T266 PolarHBondContact O-N 2.83Å; Y263-T266 VanDerWaalsContact O-N 3.15Å; Y263-Y267 VanDerWaalsContact O-CD2 3.26Å; Y263-Y267 WeakPolarHBondContact O-CD2 3.44Å; Y263-Y267 PolarHBondContact O-N 3.11Å
264L96.1Very high92.8Very high2 Ų265.7 Ų65.71%0.0131%0.305CS..Hα-helixtrans-60.6-44.4176.6-61173.2000111.7I156 I167 V171 Y185 L187 A193 L225 A260 G261 T266 Y267 K268I156-L264 HydrophobicContact CD1-CB 4.29Å; I167-L264 HydrophobicContact CG2-CD1 3.71Å; V171-L264 HydrophobicContact CG2-CB 4.44Å; V171-L264 HydrophobicContact CG2-CD1 4.24Å; Y185-L264 HydrophobicContact CD1-CD1 3.95Å; Y185-L264 HydrophobicContact CD2-CD1 4.33Å; Y185-L264 HydrophobicContact CD2-CD2 4.21Å; Y185-L264 HydrophobicContact CE1-CD1 3.84Å; Y185-L264 HydrophobicContact CE2-CD1 4.25Å; Y185-L264 HydrophobicContact CG-CD1 4.2Å; Y185-L264 HydrophobicContact CG-CD2 4.09Å; L187-L264 HydrophobicContact CD1-CD2 4.05Å; L187-L264 HydrophobicContact CD2-CB 4.08Å; L187-L264 HydrophobicContact CD2-CD2 3.9Å; L187-L264 HydrophobicContact CG-CD2 4.46Å; A193-L264 HydrophobicContact CB-CD2 4.09Å; L225-L264 HydrophobicContact CD2-CD1 4.4Å; L225-L264 HydrophobicContact CD2-CD2 3.82Å; L225-L264 HydrophobicContact CD2-CG 3.96Å; A260-L264 WeakPolarHBondContact O-CG 3.4Å; A260-L264 PolarHBondContact O-N 2.88Å; G261-L264 PolarHBondContact O-N 2.85Å; G261-L264 VanDerWaalsContact O-N 3.17Å; L264-T266 VanDerWaalsContact C-N 3.31Å; L264-T266 PolarHBondContact O-N 2.95Å; L264-Y267 PolarHBondContact O-N 3.4Å; L264-K268 PolarHBondContact O-N 3.45Å; L264-K268 VanDerWaalsContact O-N 3.11Å
265E94.8Very high91.7Very high8 Ų868.9 Ų68.94%0.03733%0.331CS..Hα-helixtrans-59.1-41.4173.1-67-177.4150.100112.5V171 R172 S173 V174 G261 R262 Y263 S269V171-E265 HydrophobicContact CG1-CG 4.11Å; R172-E265 PolarHBondContact N-OE1 3.35Å; S173-E265 WeakPolarHBondContact CB-OE1 3.42Å; S173-E265 PolarHBondContact N-OE1 3.03Å; S173-E265 PolarHBondContact OG-OE1 3.38Å; S173-E265 PolarHBondContact OG-OE2 3.48Å; S173-E265 VanDerWaalsContact OG-OE2 3.08Å; V174-E265 HydrophobicContact CG2-CB 4.19Å; V174-E265 HydrophobicContact CG2-CG 4.31Å; G261-E265 WeakPolarHBondContact O-CG 3.41Å; G261-E265 PolarHBondContact O-N 3.32Å; R262-E265 WeakPolarHBondContact CD-OE2 3.28Å; R262-E265 IonicContact CZ-OE2 3.04Å; R262-E265 IonicContact NE-OE2 3.18Å; R262-E265 IonicContact NH1-OE2 3.71Å; R262-E265 PolarHBondContact NH1-OE2 2.92Å; Y263-E265 PolarHBondContact O-N 3.37Å; E265-S269 VanDerWaalsContact O-CB 3.27Å; E265-S269 WeakPolarHBondContact O-CB 3.28Å; E265-S269 PolarHBondContact O-N 2.74Å; E265-S269 PolarHBondContact O-OG 2.99Å
266T94.3Very high90.6Very high50 Ų5064.9 Ų64.931%0.30732%0.322SS..Hα-helixtrans-66.6-47.7-179.4-57.50000110.3R262 Y263 L264 K268 S269 Y270R262-T266 WeakPolarHBondContact O-CB 3.48Å; R262-T266 PolarHBondContact O-N 3.32Å; R262-T266 PolarHBondContact O-OG1 2.84Å; Y263-T266 PolarHBondContact O-N 2.83Å; Y263-T266 VanDerWaalsContact O-N 3.15Å; L264-T266 VanDerWaalsContact C-N 3.31Å; L264-T266 PolarHBondContact O-N 2.95Å; T266-K268 PolarHBondContact O-N 2.9Å; T266-S269 PolarHBondContact O-N 2.71Å; T266-S269 PolarHBondContact O-OG 3.15Å; T266-Y270 HydrophobicContact CG2-CD2 3.88Å; T266-Y270 HydrophobicContact CG2-CE2 3.93Å; T266-Y270 WeakPolarHBondContact O-CB 3.13Å; T266-Y270 WeakPolarHBondContact O-CD2 3.03Å; T266-Y270 PolarHBondContact O-N 2.75Å
267Y94.3Very high89.3Confident59 Ų5968.7 Ų68.723%0.23134%0.339CS..Hα-helixtrans-58-46176.1-83.4-67.6000112.6L187 L221 V223 I252 Y263 L264 Y270 E271L187-Y267 HydrophobicContact CD1-CD2 4.28Å; L187-Y267 HydrophobicContact CD1-CG 4.15Å; L221-Y267 HydrophobicContact CD2-CD1 4.48Å; L221-Y267 HydrophobicContact CD2-CE1 4.15Å; V223-Y267 HydrophobicContact CG1-CE2 4.1Å; V223-Y267 HydrophobicContact CG2-CE1 4.03Å; V223-Y267 HydrophobicContact CG2-CE2 4.08Å; I252-Y267 HydrophobicContact CG1-CE2 4.4Å; I252-Y267 WeakPolarHBondContact CG1-OH 3.17Å; Y263-Y267 VanDerWaalsContact O-CD2 3.26Å; Y263-Y267 WeakPolarHBondContact O-CD2 3.44Å; Y263-Y267 PolarHBondContact O-N 3.11Å; L264-Y267 PolarHBondContact O-N 3.4Å; Y267-Y270 PolarHBondContact O-N 2.87Å; Y267-E271 PolarHBondContact O-N 2.88Å
268K93.7Very high88Confident20 Ų2074.5 Ų74.59%0.08737%0.368CS..Hα-helixtrans-67.8-43.1179.2-176.760.9-177.5178.50112.5G153 S154 S155 I156 V174 L187 L264 T266 Y270 E271G153-K268 PolarHBondContact O-NZ 2.75Å; S154-K268 VanDerWaalsContact C-CE 3.4Å; S154-K268 WeakPolarHBondContact O-CE 3.29Å; S155-K268 WeakPolarHBondContact O-CE 3.19Å; S155-K268 PolarHBondContact O-NZ 3.26Å; I156-K268 HydrophobicContact CD1-CB 3.99Å; I156-K268 HydrophobicContact CD1-CG 4.49Å; I156-K268 HydrophobicContact CG1-CB 3.82Å; I156-K268 HydrophobicContact CG1-CD 4.41Å; I156-K268 HydrophobicContact CG1-CG 3.87Å; V174-K268 HydrophobicContact CG1-CB 4.1Å; V174-K268 HydrophobicContact CG1-CG 3.63Å; L187-K268 WeakPolarHBondContact O-CD 3.21Å; L264-K268 PolarHBondContact O-N 3.45Å; L264-K268 VanDerWaalsContact O-N 3.11Å; T266-K268 PolarHBondContact O-N 2.9Å; K268-Y270 PolarHBondContact O-N 3.43Å; K268-E271 WeakPolarHBondContact CE-OE2 3.34Å; K268-E271 IonicContact NZ-OE2 3.9Å; K268-E271 PolarHBondContact NZ-OE2 2.9Å; K268-E271 WeakPolarHBondContact O-CB 3.27Å; K268-E271 PolarHBondContact O-N 2.95Å
269S90.3Very high87Confident60 Ų6075.1 Ų75.142%0.4237%0.368SS..Hα-helixtrans-72.9-13.5-179.561.60000114.3E265 T266 K273E265-S269 VanDerWaalsContact O-CB 3.27Å; E265-S269 WeakPolarHBondContact O-CB 3.28Å; E265-S269 PolarHBondContact O-N 2.74Å; E265-S269 PolarHBondContact O-OG 2.99Å; T266-S269 PolarHBondContact O-N 2.71Å; T266-S269 PolarHBondContact O-OG 3.15Å; S269-K273 VanDerWaalsContact O-CE 3.28Å; S269-K273 WeakPolarHBondContact O-CE 3.36Å
270Y88.7Confident85.9Confident121 Ų12180.4 Ų80.448%0.47539%0.393SS..Hα-helixtrans-101-3.7174.9-77.4-116.9000113.5T266 Y267 K268 K272 K273 L277T266-Y270 HydrophobicContact CG2-CD2 3.88Å; T266-Y270 HydrophobicContact CG2-CE2 3.93Å; T266-Y270 WeakPolarHBondContact O-CB 3.13Å; T266-Y270 WeakPolarHBondContact O-CD2 3.03Å; T266-Y270 PolarHBondContact O-N 2.75Å; Y267-Y270 PolarHBondContact O-N 2.87Å; K268-Y270 PolarHBondContact O-N 3.43Å; Y270-K272 PolarHBondContact O-N 2.91Å; Y270-K273 HydrophobicContact CD1-CB 4.37Å; Y270-K273 HydrophobicContact CD1-CD 3.62Å; Y270-K273 HydrophobicContact CD2-CD 4.01Å; Y270-K273 HydrophobicContact CE1-CD 3.79Å; Y270-K273 HydrophobicContact CE2-CD 4.19Å; Y270-K273 HydrophobicContact CG-CD 3.73Å; Y270-K273 VanDerWaalsContact CZ-NZ 3.29Å; Y270-K273 PolarHBondContact O-N 3.4Å; Y270-L277 HydrophobicContact CE1-CD1 4.44Å
271E86Confident84.5Confident71 Ų7188.6 Ų88.633%0.33243%0.431SS..THydrogen-bonded Turntrans-49.2-35.8179.6-178179.5-163.400113.6G188 Q189 Y267 K268G188-E271 VanDerWaalsContact CA-CD 3.41Å; G188-E271 WeakPolarHBondContact CA-OE1 3.49Å; Q189-E271 PolarHBondContact N-OE1 3.17Å; Y267-E271 PolarHBondContact O-N 2.88Å; K268-E271 WeakPolarHBondContact CE-OE2 3.34Å; K268-E271 IonicContact NZ-OE2 3.9Å; K268-E271 PolarHBondContact NZ-OE2 2.9Å; K268-E271 WeakPolarHBondContact O-CB 3.27Å; K268-E271 PolarHBondContact O-N 2.95Å
272K82.9Confident83.3Confident175 Ų17592.5 Ų92.576%0.76146%0.455SS*.THydrogen-bonded Turntrans-109.95.2-177.4-60.4-179.7-177.5176.60114.1Y270Y270-K272 PolarHBondContact O-N 2.91Å
273K83.3Confident82.2Confident91 Ų9191.6 Ų91.640%0.39646%0.457SS..  trans-82.2127.1-177-73.7-176.7-1761680110.3S269 Y270 L277S269-K273 VanDerWaalsContact O-CE 3.28Å; S269-K273 WeakPolarHBondContact O-CE 3.36Å; Y270-K273 HydrophobicContact CD1-CB 4.37Å; Y270-K273 HydrophobicContact CD1-CD 3.62Å; Y270-K273 HydrophobicContact CD2-CD 4.01Å; Y270-K273 HydrophobicContact CE1-CD 3.79Å; Y270-K273 HydrophobicContact CE2-CD 4.19Å; Y270-K273 HydrophobicContact CG-CD 3.73Å; Y270-K273 VanDerWaalsContact CZ-NZ 3.29Å; Y270-K273 PolarHBondContact O-N 3.4Å; K273-L277 HydrophobicContact CD-CD1 4.32Å
274P77.5Confident81.3Confident85 Ų8596.9 Ų96.955%0.55248%0.482SS*.  trans-68.3156.8176.929.8-35.1000111.1D276P274-D276 PolarHBondContact O-N 2.94Å
275A73.1Confident80.9Confident67 Ų67101.3 Ų101.355%0.55451%0.505SS*.G310 helixtrans-67.85.3178.900000114.5L277 L278A275-L277 PolarHBondContact O-N 3.03Å; A275-L278 HydrophobicContact CB-CD1 4.47Å; A275-L278 WeakPolarHBondContact O-CB 3.16Å; A275-L278 PolarHBondContact O-N 3.44Å
276D73.6Confident80.6Confident86 Ų86107.1 Ų107.146%0.4653%0.528SS..G310 helixtrans-64.2-24.9179-66.3-42.1000113.3P274 L278 K279P274-D276 PolarHBondContact O-N 2.94Å; D276-L278 PolarHBondContact O-N 3.46Å; D276-K279 PolarHBondContact O-N 2.87Å; D276-K279 WeakPolarHBondContact OD1-CE 3.38Å; D276-K279 IonicContact OD1-NZ 3.79Å; D276-K279 PolarHBondContact OD1-NZ 2.92Å
277L68.9Low80.3Confident119 Ų119108.4 Ų108.462%0.62353%0.532SS*.G310 helixtrans-69.8-15.7170.7-65.3177.5000113.6Y270 K273 A275Y270-L277 HydrophobicContact CE1-CD1 4.44Å; K273-L277 HydrophobicContact CD-CD1 4.32Å; A275-L277 PolarHBondContact O-N 3.03Å
278L69.7Low80.1Confident156 Ų156106.6 Ų106.682%0.81753%0.528SS*.G310 helixtrans-97.7-8.4178.3-56.8176.7000112.6A275 D276A275-L278 HydrophobicContact CB-CD1 4.47Å; A275-L278 WeakPolarHBondContact O-CB 3.16Å; A275-L278 PolarHBondContact O-N 3.44Å; D276-L278 PolarHBondContact O-N 3.46Å
279K74.1Confident80Confident135 Ų135110.5 Ų110.559%0.58755%0.545SS*.SBendtrans-75.8138.6174.5-69.9176.1-178.4163.30109.3D276 Q281D276-K279 PolarHBondContact O-N 2.87Å; D276-K279 WeakPolarHBondContact OD1-CE 3.38Å; D276-K279 IonicContact OD1-NZ 3.79Å; D276-K279 PolarHBondContact OD1-NZ 2.92Å; K279-Q281 PolarHBondContact O-N 3.22Å; K279-Q281 VanDerWaalsContact O-N 3.12Å
280E74.6Confident80Confident170 Ų170108.2 Ų108.279%0.79453%0.529SS*.  trans-56.6117171.1-175.2178.5-164.600109.7V282E280-V282 HydrophobicContact CB-CG2 4.41Å; E280-V282 HydrophobicContact CG-CG2 3.81Å; E280-V282 PolarHBondContact O-N 3.45Å
281Q67.9Low80.1Confident171 Ų171102.9 Ų102.980%0.79951%0.509SS*.  trans-78.176.3169.8-68.2-162.21.300108.9K279 E283K279-Q281 PolarHBondContact O-N 3.22Å; K279-Q281 VanDerWaalsContact O-N 3.12Å; Q281-E283 PolarHBondContact O-N 3.41Å; Q281-E283 VanDerWaalsContact O-N 3.08Å
282V71Confident80.4Confident82 Ų82103 Ų10350%0.49751%0.511SS..  trans-59114.7170.5-178.50000107.9E280 K284E280-V282 HydrophobicContact CB-CG2 4.41Å; E280-V282 HydrophobicContact CG-CG2 3.81Å; E280-V282 PolarHBondContact O-N 3.45Å; V282-K284 PolarHBondContact O-N 3.07Å
283E74.4Confident80.8Confident120 Ų12098.6 Ų98.656%0.56150%0.502SS*.  trans-56.8123.1176.7-69.8-175.3-174.100108.9Q281 D285 S288 K289Q281-E283 PolarHBondContact O-N 3.41Å; Q281-E283 VanDerWaalsContact O-N 3.08Å; E283-D285 VanDerWaalsContact C-N 3.25Å; E283-D285 PolarHBondContact O-N 3.13Å; E283-S288 WeakPolarHBondContact OE2-CB 3.27Å; E283-S288 PolarHBondContact OE2-OG 3.1Å; E283-K289 WeakPolarHBondContact O-CE 3.41Å
284K77.8Confident81.2Confident187 Ų18794.8 Ų94.881%0.81349%0.486SS*.  trans-76.6-17.2-172.4-69.9-176.7-179.3176.10113V282 K289V282-K284 PolarHBondContact O-N 3.07Å; K284-K289 PolarHBondContact O-NZ 3.26Å
285D88.7Confident81.9Confident94 Ų9492.7 Ų92.750%0.50347%0.472SS..SBendtrans-62.9146.4-177.6-172.228.2000112.3E283 L287 K289E283-D285 VanDerWaalsContact C-N 3.25Å; E283-D285 PolarHBondContact O-N 3.13Å; D285-L287 WeakPolarHBondContact OD2-CB 3.25Å; D285-K289 WeakPolarHBondContact O-CG 3.27Å; D285-K289 PolarHBondContact O-N 3.08Å
286Y87.3Confident82.9Confident131 Ų13195.2 Ų95.251%0.51448%0.48SS..Hα-helixtrans-66.3-42.9179.8174-99.7000111.1S288 K289 V290 L309Y286-S288 PolarHBondContact O-N 2.84Å; Y286-K289 PolarHBondContact O-N 3.19Å; Y286-V290 HydrophobicContact CD2-CG2 4.2Å; Y286-V290 HydrophobicContact CE1-CG2 4.13Å; Y286-V290 HydrophobicContact CE2-CG2 3.77Å; Y286-V290 WeakPolarHBondContact O-CG2 3.37Å; Y286-V290 PolarHBondContact O-N 2.58Å; Y286-L309 HydrophobicContact CE1-CD2 4.44Å
287L89.6Confident83.7Confident77 Ų7792 Ų9240%0.40346%0.464SS..Hα-helixtrans-62.9-44.2-178.8-178.658.8000111.4D285 T291 I306 L309D285-L287 WeakPolarHBondContact OD2-CB 3.25Å; L287-T291 VanDerWaalsContact O-CB 3.23Å; L287-T291 WeakPolarHBondContact O-CB 3.26Å; L287-T291 PolarHBondContact O-N 2.88Å; L287-T291 PolarHBondContact O-OG1 3.38Å; L287-I306 HydrophobicContact CD1-CG1 4.44Å; L287-L309 HydrophobicContact CD1-CD1 3.5Å; L287-L309 VanDerWaalsContact CD1-CD1 3.5Å
288S89.5Confident84.5Confident20 Ų2095 Ų9514%0.1447%0.472CS..Hα-helixtrans-59.5-51.8175.5-56.30000111.8E283 Y286 V290 T291 D292E283-S288 WeakPolarHBondContact OE2-CB 3.27Å; E283-S288 PolarHBondContact OE2-OG 3.1Å; Y286-S288 PolarHBondContact O-N 2.84Å; S288-V290 PolarHBondContact O-N 3.05Å; S288-T291 WeakPolarHBondContact O-CB 3.45Å; S288-T291 PolarHBondContact O-N 2.86Å; S288-T291 VanDerWaalsContact O-N 3.1Å; S288-D292 PolarHBondContact O-N 3.33Å
289K90.7Very high85.4Confident103 Ų10389.2 Ų89.245%0.44844%0.444SS..Hα-helixtrans-58.5-43.4-179.8-74.6170.9178.31610113.6E283 K284 D285 Y286 C293E283-K289 WeakPolarHBondContact O-CE 3.41Å; K284-K289 PolarHBondContact O-NZ 3.26Å; D285-K289 WeakPolarHBondContact O-CG 3.27Å; D285-K289 PolarHBondContact O-N 3.08Å; Y286-K289 PolarHBondContact O-N 3.19Å; K289-C293 VanDerWaalsContact O-CB 3.3Å; K289-C293 WeakPolarHBondContact O-CB 3.44Å; K289-C293 PolarHBondContact O-N 3.41Å
290V90.6Very high86.3Confident12 Ų1283.1 Ų83.17%0.07342%0.418CS..Hα-helixtrans-71.5-36.1177.5179.50000110.9Y286 S288 C293 L294 L309 V315Y286-V290 HydrophobicContact CD2-CG2 4.2Å; Y286-V290 HydrophobicContact CE1-CG2 4.13Å; Y286-V290 HydrophobicContact CE2-CG2 3.77Å; Y286-V290 WeakPolarHBondContact O-CG2 3.37Å; Y286-V290 PolarHBondContact O-N 2.58Å; S288-V290 PolarHBondContact O-N 3.05Å; V290-C293 PolarHBondContact O-N 3.37Å; V290-L294 HydrophobicContact CG1-CD1 3.76Å; V290-L294 HydrophobicContact CG1-CG 4.14Å; V290-L294 WeakPolarHBondContact O-CB 3.35Å; V290-L294 WeakPolarHBondContact O-CG 3.44Å; V290-L294 PolarHBondContact O-N 3.1Å; V290-L309 HydrophobicContact CB-CD1 4.04Å; V290-L309 HydrophobicContact CG1-CD1 3.78Å; V290-L309 HydrophobicContact CG1-CD2 3.93Å; V290-L309 HydrophobicContact CG1-CG 4Å; V290-V315 HydrophobicContact CB-CG2 4.39Å; V290-V315 HydrophobicContact CG1-CG2 3.62Å; V290-V315 HydrophobicContact CG2-CG2 3.78Å
291T91.8Very high87.1Confident9 Ų979.6 Ų79.66%0.05540%0.404CS..Hα-helixtrans-61.6-45.5174.4-61.20000111.6L287 S288 L294 T295 K302 A305L287-T291 VanDerWaalsContact O-CB 3.23Å; L287-T291 WeakPolarHBondContact O-CB 3.26Å; L287-T291 PolarHBondContact O-N 2.88Å; L287-T291 PolarHBondContact O-OG1 3.38Å; S288-T291 WeakPolarHBondContact O-CB 3.45Å; S288-T291 PolarHBondContact O-N 2.86Å; S288-T291 VanDerWaalsContact O-N 3.1Å; T291-L294 PolarHBondContact O-N 2.82Å; T291-T295 HydrophobicContact CG2-CG2 4.32Å; T291-T295 WeakPolarHBondContact O-CB 3.39Å; T291-T295 VanDerWaalsContact O-CG2 3.29Å; T291-T295 WeakPolarHBondContact O-CG2 3.39Å; T291-T295 PolarHBondContact O-N 3.11Å; T291-T295 PolarHBondContact O-OG1 2.92Å; T291-K302 HydrophobicContact CG2-CB 3.85Å; T291-K302 HydrophobicContact CG2-CD 4.05Å; T291-K302 HydrophobicContact CG2-CG 3.7Å; T291-A305 HydrophobicContact CG2-CB 4.2Å
292D91.4Very high88.3Confident72 Ų7277.2 Ų77.239%0.38539%0.391SS..Hα-helixtrans-68.4-38.3178.7-64-24.4000111.4S288 T295 T296 K302S288-D292 PolarHBondContact O-N 3.33Å; D292-T295 WeakPolarHBondContact CA-OG1 3.5Å; D292-T295 PolarHBondContact O-OG1 3.02Å; D292-T296 PolarHBondContact O-N 3.47Å; D292-T296 VanDerWaalsContact O-N 3.14Å; D292-T296 PolarHBondContact O-OG1 3.39Å; D292-K302 IonicContact OD1-NZ 2.73Å
293C91.6Very high89.3Confident84 Ų8478.2 Ų78.257%0.56840%0.398SS*.Hα-helixtrans-60.4-46.7172.2-173.30000112.5K289 V290 T296K289-C293 VanDerWaalsContact O-CB 3.3Å; K289-C293 WeakPolarHBondContact O-CB 3.44Å; K289-C293 PolarHBondContact O-N 3.41Å; V290-C293 PolarHBondContact O-N 3.37Å; C293-T296 WeakPolarHBondContact O-CB 3.18Å
294L91.5Very high90.2Very high10 Ų1073 Ų735%0.05237%0.374CS..Hα-helixtrans-73.2-36.6-178.9-70.7174000112.3V290 T291 T296 V297 I300 A305 I318V290-L294 HydrophobicContact CG1-CD1 3.76Å; V290-L294 HydrophobicContact CG1-CG 4.14Å; V290-L294 WeakPolarHBondContact O-CB 3.35Å; V290-L294 WeakPolarHBondContact O-CG 3.44Å; V290-L294 PolarHBondContact O-N 3.1Å; T291-L294 PolarHBondContact O-N 2.82Å; L294-T296 PolarHBondContact O-N 3.17Å; L294-V297 WeakPolarHBondContact O-CB 3.24Å; L294-V297 PolarHBondContact O-N 2.93Å; L294-V297 VanDerWaalsContact O-N 3.1Å; L294-I300 HydrophobicContact CB-CG2 4.44Å; L294-A305 HydrophobicContact CB-CB 3.79Å; L294-A305 HydrophobicContact CD1-CB 3.83Å; L294-A305 HydrophobicContact CG-CB 4.46Å; L294-I318 HydrophobicContact CD1-CD1 3.92Å; L294-I318 HydrophobicContact CD2-CG2 4.42Å
295T93.1Very high90.8Very high42 Ų4264.1 Ų64.126%0.25834%0.335SS..Hα-helixtrans-74.3-11.9177.654.10000114.1T291 D292 V297 N301 K302T291-T295 HydrophobicContact CG2-CG2 4.32Å; T291-T295 WeakPolarHBondContact O-CB 3.39Å; T291-T295 VanDerWaalsContact O-CG2 3.29Å; T291-T295 WeakPolarHBondContact O-CG2 3.39Å; T291-T295 PolarHBondContact O-N 3.11Å; T291-T295 PolarHBondContact O-OG1 2.92Å; D292-T295 WeakPolarHBondContact CA-OG1 3.5Å; D292-T295 PolarHBondContact O-OG1 3.02Å; T295-V297 PolarHBondContact O-N 3.06Å; T295-N301 VanDerWaalsContact CG2-C 3.44Å; T295-K302 HydrophobicContact CG2-CG 4.09Å
296T92.5Very high91Very high120 Ų12063.7 Ų63.774%0.73633%0.332SS*.THydrogen-bonded Turntrans-61-26.2165.1-60.10000111.6D292 C293 L294 K298D292-T296 PolarHBondContact O-N 3.47Å; D292-T296 VanDerWaalsContact O-N 3.14Å; D292-T296 PolarHBondContact O-OG1 3.39Å; C293-T296 WeakPolarHBondContact O-CB 3.18Å; L294-T296 PolarHBondContact O-N 3.17Å; T296-K298 PolarHBondContact O-N 2.98Å
297V91.4Very high91.3Very high18 Ų1858.8 Ų58.811%0.10932%0.316CS..SBendtrans-75115.7173.7-175.70000110.1L294 T295 S299 I300 L340 V343L294-V297 WeakPolarHBondContact O-CB 3.24Å; L294-V297 PolarHBondContact O-N 2.93Å; L294-V297 VanDerWaalsContact O-N 3.1Å; T295-V297 PolarHBondContact O-N 3.06Å; V297-S299 PolarHBondContact O-N 3.04Å; V297-I300 HydrophobicContact CB-CB 4.47Å; V297-I300 HydrophobicContact CB-CD1 3.65Å; V297-I300 HydrophobicContact CB-CG1 3.95Å; V297-I300 HydrophobicContact CG1-CD1 3.76Å; V297-I300 HydrophobicContact CG1-CG1 4.02Å; V297-I300 HydrophobicContact CG2-CD1 4.27Å; V297-I300 WeakPolarHBondContact O-CB 3.38Å; V297-I300 PolarHBondContact O-N 2.73Å; V297-L340 HydrophobicContact CG2-CD1 4.37Å; V297-V343 HydrophobicContact CG1-CB 4.27Å; V297-V343 HydrophobicContact CG1-CG1 4.38Å; V297-V343 HydrophobicContact CG1-CG2 4.19Å; V297-V343 HydrophobicContact CG2-CG1 4.11Å
298K85.9Confident91.4Very high183 Ų18355.1 Ų55.180%0.79630%0.297SS*.THydrogen-bonded Turntrans-51.1125.1177.6-175.8174.1-176.4172.20111.2T296T296-K298 PolarHBondContact O-N 2.98Å
299S87.4Confident91.5Very high33 Ų3355.1 Ų55.123%0.23130%0.295CS..THydrogen-bonded Turntrans89.32.1-177-24.30000116.7V297 K336 R339V297-S299 PolarHBondContact O-N 3.04Å; S299-K336 WeakPolarHBondContact O-CD 3.21Å; S299-K336 WeakPolarHBondContact O-CE 3.4Å; S299-K336 WeakPolarHBondContact O-CG 3.19Å; S299-R339 VanDerWaalsContact OG-CD 3.25Å; S299-R339 WeakPolarHBondContact OG-CD 3.4Å; S299-R339 PolarHBondContact OG-NH1 3.47Å
300I92.6Very high91.5Very high7 Ų755 Ų554%0.03631%0.307CS..  trans-100125.6172.5-54.3-167.7000109L294 V297 D304 L340L294-I300 HydrophobicContact CB-CG2 4.44Å; V297-I300 HydrophobicContact CB-CB 4.47Å; V297-I300 HydrophobicContact CB-CD1 3.65Å; V297-I300 HydrophobicContact CB-CG1 3.95Å; V297-I300 HydrophobicContact CG1-CD1 3.76Å; V297-I300 HydrophobicContact CG1-CG1 4.02Å; V297-I300 HydrophobicContact CG2-CD1 4.27Å; V297-I300 WeakPolarHBondContact O-CB 3.38Å; V297-I300 PolarHBondContact O-N 2.73Å; I300-D304 HydrophobicContact CG2-CB 3.8Å; I300-L340 HydrophobicContact CD1-CB 3.87Å; I300-L340 HydrophobicContact CD1-CD1 3.64Å; I300-L340 HydrophobicContact CD1-CD2 4Å; I300-L340 HydrophobicContact CD1-CG 4.03Å
301N92.9Very high91.5Very high96 Ų9657.8 Ų57.851%0.51332%0.324SS..  trans-99.9166.3177.4-62.1-17.5000110.7T295 T303 D304 A305T295-N301 VanDerWaalsContact CG2-C 3.44Å; N301-T303 PolarHBondContact O-N 2.98Å; N301-D304 WeakPolarHBondContact CB-OD2 3.36Å; N301-D304 PolarHBondContact N-OD2 2.95Å; N301-D304 WeakPolarHBondContact O-CB 3.49Å; N301-D304 PolarHBondContact O-N 3.28Å; N301-A305 PolarHBondContact O-N 3.37Å; N301-A305 VanDerWaalsContact O-N 3.07Å
302K92.2Very high91.5Very high122 Ų12259.3 Ų59.353%0.5333%0.33SS..Hα-helixtrans-53.9-39.6176.6-62.5-160.1173.1-153.60112.5T291 D292 T295 A305 I306T291-K302 HydrophobicContact CG2-CB 3.85Å; T291-K302 HydrophobicContact CG2-CD 4.05Å; T291-K302 HydrophobicContact CG2-CG 3.7Å; D292-K302 IonicContact OD1-NZ 2.73Å; T295-K302 HydrophobicContact CG2-CG 4.09Å; K302-A305 PolarHBondContact O-N 2.96Å; K302-I306 WeakPolarHBondContact O-CG1 3.49Å; K302-I306 PolarHBondContact O-N 3.07Å
303T92.1Very high91.3Very high103 Ų10360.1 Ų60.163%0.63234%0.341SS*.Hα-helixtrans-62.5-42175.1-430000112.8N301 A305 I306 T307N301-T303 PolarHBondContact O-N 2.98Å; T303-A305 VanDerWaalsContact C-N 3.33Å; T303-A305 PolarHBondContact O-N 3.42Å; T303-I306 PolarHBondContact O-N 3.06Å; T303-T307 PolarHBondContact O-N 2.97Å; T303-T307 PolarHBondContact O-OG1 3.2Å
304D92.7Very high91.3Very high10 Ų1059.2 Ų59.25%0.05333%0.333CS..Hα-helixtrans-65.1-39.9178.7-57.6-55.7000110.7I300 N301 T307 L308 L332 K336I300-D304 HydrophobicContact CG2-CB 3.8Å; N301-D304 WeakPolarHBondContact CB-OD2 3.36Å; N301-D304 PolarHBondContact N-OD2 2.95Å; N301-D304 WeakPolarHBondContact O-CB 3.49Å; N301-D304 PolarHBondContact O-N 3.28Å; D304-T307 PolarHBondContact O-N 3.04Å; D304-L308 WeakPolarHBondContact O-CB 3.49Å; D304-L308 VanDerWaalsContact O-CG 3.29Å; D304-L308 WeakPolarHBondContact O-CG 3.2Å; D304-L308 PolarHBondContact O-N 3.25Å; D304-L332 HydrophobicContact CB-CD1 4.11Å; D304-K336 IonicContact OD1-NZ 3.39Å; D304-K336 PolarHBondContact OD1-NZ 2.62Å; D304-K336 IonicContact OD2-NZ 3.7Å; D304-K336 PolarHBondContact OD2-NZ 3.14Å
305A92.3Very high91.3Very high0 Ų061 Ų610%034%0.344CS..Hα-helixtrans-63.6-41.6176.400000112.6T291 L294 N301 K302 T303 L308 L309T291-A305 HydrophobicContact CG2-CB 4.2Å; L294-A305 HydrophobicContact CB-CB 3.79Å; L294-A305 HydrophobicContact CD1-CB 3.83Å; L294-A305 HydrophobicContact CG-CB 4.46Å; N301-A305 PolarHBondContact O-N 3.37Å; N301-A305 VanDerWaalsContact O-N 3.07Å; K302-A305 PolarHBondContact O-N 2.96Å; T303-A305 VanDerWaalsContact C-N 3.33Å; T303-A305 PolarHBondContact O-N 3.42Å; A305-L308 PolarHBondContact O-N 3.21Å; A305-L309 WeakPolarHBondContact O-CB 3.47Å; A305-L309 PolarHBondContact O-N 3.35Å
306I92.4Very high91.2Very high86 Ų8665.4 Ų65.444%0.44136%0.362SS..Hα-helixtrans-65.2-42.5174.7-66.3163.2000110.8L287 K302 T303 L309 S310L287-I306 HydrophobicContact CD1-CG1 4.44Å; K302-I306 WeakPolarHBondContact O-CG1 3.49Å; K302-I306 PolarHBondContact O-N 3.07Å; T303-I306 PolarHBondContact O-N 3.06Å; I306-L309 PolarHBondContact O-N 3.36Å; I306-S310 WeakPolarHBondContact O-CB 3.22Å; I306-S310 PolarHBondContact O-N 3.33Å
307T92.4Very high91.2Very high28 Ų2860.7 Ų60.717%0.17234%0.337CS..Hα-helixtrans-60-49.2174.2-63.80000111.4T303 D304 L309 S310 T311 C329 P330T303-T307 PolarHBondContact O-N 2.97Å; T303-T307 PolarHBondContact O-OG1 3.2Å; D304-T307 PolarHBondContact O-N 3.04Å; T307-L309 VanDerWaalsContact C-N 3.32Å; T307-L309 PolarHBondContact O-N 3.18Å; T307-S310 WeakPolarHBondContact O-CB 3.33Å; T307-S310 PolarHBondContact O-N 2.93Å; T307-S310 VanDerWaalsContact O-N 3.09Å; T307-T311 PolarHBondContact O-N 3.46Å; T307-T311 PolarHBondContact O-OG1 3.34Å; T307-C329 HydrophobicContact CG2-CB 4.23Å; T307-P330 HydrophobicContact CG2-CG 3.72Å
308L91.6Very high91.2Very high0 Ų060 Ų600%033%0.333CS..Hα-helixtrans-58.6-42.9179-76.8166.4000112.1D304 A305 T311 F312 I318 L326 L332 L340D304-L308 WeakPolarHBondContact O-CB 3.49Å; D304-L308 VanDerWaalsContact O-CG 3.29Å; D304-L308 WeakPolarHBondContact O-CG 3.2Å; D304-L308 PolarHBondContact O-N 3.25Å; A305-L308 PolarHBondContact O-N 3.21Å; L308-T311 PolarHBondContact O-N 2.87Å; L308-F312 HydrophobicContact CD2-CD2 4.04Å; L308-F312 HydrophobicContact CD2-CE2 3.85Å; L308-F312 WeakPolarHBondContact O-CD2 3.34Å; L308-F312 PolarHBondContact O-N 2.86Å; L308-I318 HydrophobicContact CB-CD1 3.81Å; L308-I318 HydrophobicContact CB-CG1 4.19Å; L308-I318 HydrophobicContact CD2-CG2 4.39Å; L308-L326 HydrophobicContact CD2-CD2 3.7Å; L308-L332 HydrophobicContact CD1-CD2 4.16Å; L308-L332 HydrophobicContact CD2-CD2 3.6Å; L308-L332 HydrophobicContact CG-CD2 4Å; L308-L340 HydrophobicContact CD1-CD2 3.58Å; L308-L340 HydrophobicContact CD2-CD2 4.2Å
309L91.9Very high91.5Very high19 Ų1954.5 Ų54.510%0.09931%0.311CS..Hα-helixtrans-63.9-40.3173.5-85.4170.5000112.7Y286 L287 V290 A305 I306 T307 S313Y286-L309 HydrophobicContact CE1-CD2 4.44Å; L287-L309 HydrophobicContact CD1-CD1 3.5Å; L287-L309 VanDerWaalsContact CD1-CD1 3.5Å; V290-L309 HydrophobicContact CB-CD1 4.04Å; V290-L309 HydrophobicContact CG1-CD1 3.78Å; V290-L309 HydrophobicContact CG1-CD2 3.93Å; V290-L309 HydrophobicContact CG1-CG 4Å; A305-L309 WeakPolarHBondContact O-CB 3.47Å; A305-L309 PolarHBondContact O-N 3.35Å; I306-L309 PolarHBondContact O-N 3.36Å; T307-L309 VanDerWaalsContact C-N 3.32Å; T307-L309 PolarHBondContact O-N 3.18Å; L309-S313 WeakPolarHBondContact O-CA 3.45Å; L309-S313 PolarHBondContact O-N 2.77Å
310S91.3Very high91.8Very high100 Ų10058.2 Ų58.270%0.69933%0.329SS*.Hα-helixtrans-65.4-38.9177-169.90000112.2I306 T307I306-S310 WeakPolarHBondContact O-CB 3.22Å; I306-S310 PolarHBondContact O-N 3.33Å; T307-S310 WeakPolarHBondContact O-CB 3.33Å; T307-S310 PolarHBondContact O-N 2.93Å; T307-S310 VanDerWaalsContact O-N 3.09Å
311T91.1Very high91.7Very high71 Ų7158.2 Ų58.244%0.43633%0.329SS..Hα-helixtrans-78.2-44.6-179.2-56.70000113.2T307 L308T307-T311 PolarHBondContact O-N 3.46Å; T307-T311 PolarHBondContact O-OG1 3.34Å; L308-T311 PolarHBondContact O-N 2.87Å
312F90.5Very high91.7Very high42 Ų4255.5 Ų55.518%0.18432%0.318CS..Hα-helixtrans-103.7-6.9-173.2-63.1-73.4000114.6L308 T314 I318 A321 D325 L326 C329L308-F312 HydrophobicContact CD2-CD2 4.04Å; L308-F312 HydrophobicContact CD2-CE2 3.85Å; L308-F312 WeakPolarHBondContact O-CD2 3.34Å; L308-F312 PolarHBondContact O-N 2.86Å; F312-T314 PolarHBondContact O-N 3.34Å; F312-I318 HydrophobicContact CB-CG1 3.79Å; F312-I318 HydrophobicContact CD2-CG1 3.95Å; F312-I318 HydrophobicContact CG-CG1 4.19Å; F312-A321 HydrophobicContact CD1-CB 4.26Å; F312-A321 HydrophobicContact CE1-CB 3.66Å; F312-A321 HydrophobicContact CE2-CB 4.33Å; F312-A321 HydrophobicContact CZ-CB 3.7Å; F312-D325 HydrophobicContact CE1-CB 4.2Å; F312-D325 HydrophobicContact CZ-CB 4Å; F312-L326 HydrophobicContact CE2-CD2 3.82Å; F312-L326 HydrophobicContact CZ-CD2 4.17Å; F312-C329 WeakPolarHBondContact CE2-SG 3.24Å
313S88.6Confident91.6Very high88 Ų8853.2 Ų53.262%0.61531%0.308SS*.SBendtrans61.3-28.8179.6-58.60000116.9L309L309-S313 WeakPolarHBondContact O-CA 3.45Å; L309-S313 PolarHBondContact O-N 2.77Å
314T91Very high91.5Very high65 Ų6553.9 Ų53.940%0.39930%0.304SS..SBendtrans-135.6153.3-174.163.20000110.9F312 E316 G317 I318F312-T314 PolarHBondContact O-N 3.34Å; T314-E316 VanDerWaalsContact C-N 3.26Å; T314-E316 PolarHBondContact O-N 2.84Å; T314-G317 PolarHBondContact O-N 2.74Å; T314-G317 PolarHBondContact OG1-N 2.93Å; T314-I318 WeakPolarHBondContact O-CG1 3.46Å; T314-I318 PolarHBondContact O-N 3.33Å
315V90.6Very high91.4Very high47 Ų4757 Ų5729%0.28532%0.321SS..Hα-helixtrans-64.2-34.9174.3-176.50000111.1V290 I318 I319V290-V315 HydrophobicContact CB-CG2 4.39Å; V290-V315 HydrophobicContact CG1-CG2 3.62Å; V290-V315 HydrophobicContact CG2-CG2 3.78Å; V315-I318 PolarHBondContact O-N 3.28Å; V315-I319 HydrophobicContact CG1-CD1 3.95Å; V315-I319 HydrophobicContact CG1-CG1 4.47Å; V315-I319 VanDerWaalsContact O-CG1 3.32Å; V315-I319 WeakPolarHBondContact O-CG1 3.26Å; V315-I319 PolarHBondContact O-N 3.19Å
316E91.9Very high91.2Very high136 Ų13657 Ų5764%0.63632%0.321SS*.Hα-helixtrans-60-43.7172.9-179.3174.8-166.500112.1T314 I318 I319 N320T314-E316 VanDerWaalsContact C-N 3.26Å; T314-E316 PolarHBondContact O-N 2.84Å; E316-I318 VanDerWaalsContact C-N 3.31Å; E316-I318 PolarHBondContact O-N 3.19Å; E316-I319 PolarHBondContact O-N 2.84Å; E316-I319 VanDerWaalsContact O-N 3.14Å; E316-N320 WeakPolarHBondContact CG-ND2 3.25Å; E316-N320 PolarHBondContact O-N 3.08Å; E316-N320 PolarHBondContact O-ND2 3.4Å
317G91.9Very high91.2Very high21 Ų2156 Ų5622%0.21632%0.319CS..Hα-helixtrans-60-38.717400000112.9T314 A321T314-G317 PolarHBondContact O-N 2.74Å; T314-G317 PolarHBondContact OG1-N 2.93Å; G317-A321 WeakPolarHBondContact O-CB 3.39Å; G317-A321 PolarHBondContact O-N 3.07Å; G317-A321 VanDerWaalsContact O-N 3.12Å
318I91.9Very high91.1Very high2 Ų261.9 Ų61.91%0.0135%0.348CS..Hα-helixtrans-68-35.9175.2-60.1166.3000111.4L294 L308 F312 T314 V315 E316 L340L294-I318 HydrophobicContact CD1-CD1 3.92Å; L294-I318 HydrophobicContact CD2-CG2 4.42Å; L308-I318 HydrophobicContact CB-CD1 3.81Å; L308-I318 HydrophobicContact CB-CG1 4.19Å; L308-I318 HydrophobicContact CD2-CG2 4.39Å; F312-I318 HydrophobicContact CB-CG1 3.79Å; F312-I318 HydrophobicContact CD2-CG1 3.95Å; F312-I318 HydrophobicContact CG-CG1 4.19Å; T314-I318 WeakPolarHBondContact O-CG1 3.46Å; T314-I318 PolarHBondContact O-N 3.33Å; V315-I318 PolarHBondContact O-N 3.28Å; E316-I318 VanDerWaalsContact C-N 3.31Å; E316-I318 PolarHBondContact O-N 3.19Å; I318-L340 HydrophobicContact CG2-CD2 4.12Å
319I92.8Very high90.9Very high68 Ų6862 Ų6235%0.34935%0.349SS..Hα-helixtrans-71.8-44.4179.4-68.6165.2000111.5V315 E316 A321 L344 H345V315-I319 HydrophobicContact CG1-CD1 3.95Å; V315-I319 HydrophobicContact CG1-CG1 4.47Å; V315-I319 VanDerWaalsContact O-CG1 3.32Å; V315-I319 WeakPolarHBondContact O-CG1 3.26Å; V315-I319 PolarHBondContact O-N 3.19Å; E316-I319 PolarHBondContact O-N 2.84Å; E316-I319 VanDerWaalsContact O-N 3.14Å; I319-A321 VanDerWaalsContact C-N 3.3Å; I319-A321 PolarHBondContact O-N 2.89Å; I319-L344 HydrophobicContact CG1-CD1 4.15Å; I319-L344 HydrophobicContact CG1-CD2 4.29Å; I319-H345 PolarHBondContact O-CE1 3.28Å; I319-H345 PolarHBondContact O-NE2 2.95Å
320N92.4Very high90.8Very high112 Ų11265.6 Ų65.660%0.59937%0.373SS*.Hα-helixtrans-81.9-5.7-178.5-67.7-34.3000113.8E316E316-N320 WeakPolarHBondContact CG-ND2 3.25Å; E316-N320 PolarHBondContact O-N 3.08Å; E316-N320 PolarHBondContact O-ND2 3.4Å
321A92Very high90.4Very high6 Ų664 Ų645%0.0537%0.373CS..  trans-63138.3179.200000112.1F312 G317 I319 D325 L326F312-A321 HydrophobicContact CD1-CB 4.26Å; F312-A321 HydrophobicContact CE1-CB 3.66Å; F312-A321 HydrophobicContact CE2-CB 4.33Å; F312-A321 HydrophobicContact CZ-CB 3.7Å; G317-A321 WeakPolarHBondContact O-CB 3.39Å; G317-A321 PolarHBondContact O-N 3.07Å; G317-A321 VanDerWaalsContact O-N 3.12Å; I319-A321 VanDerWaalsContact C-N 3.3Å; I319-A321 PolarHBondContact O-N 2.89Å; A321-D325 HydrophobicContact CB-CB 4.47Å; A321-L326 HydrophobicContact CB-CD2 3.89Å; A321-L326 HydrophobicContact CB-CG 3.93Å
322S91.4Very high90.2Very high40 Ų4060.8 Ų60.828%0.2835%0.353SS..  trans-66.8159.6171.576.40000110.6E324 D325 L326S322-E324 PolarHBondContact O-N 3.42Å; S322-E324 PolarHBondContact OG-N 3.32Å; S322-D325 VanDerWaalsContact CB-OD2 3.29Å; S322-D325 WeakPolarHBondContact CB-OD2 3.29Å; S322-D325 PolarHBondContact N-OD2 2.85Å; S322-D325 PolarHBondContact O-N 3.09Å; S322-D325 PolarHBondContact OG-N 3.38Å; S322-D325 VanDerWaalsContact OG-N 3.1Å; S322-D325 PolarHBondContact OG-OD2 3.47Å; S322-L326 WeakPolarHBondContact O-CG 3.39Å; S322-L326 PolarHBondContact O-N 3.18Å; S322-L326 VanDerWaalsContact O-N 3.1Å
323K90.2Very high90.1Very high73 Ų7360.3 Ų60.332%0.31736%0.36SS..Hα-helixtrans-60.6-28.9175.7176.2168.3147.4-78.80111.5V327 Y341K323-V327 VanDerWaalsContact O-CG2 3.29Å; K323-V327 WeakPolarHBondContact O-CG2 3.24Å; K323-V327 PolarHBondContact O-N 3.36Å; K323-Y341 HydrophobicContact CB-CD1 4.4Å; K323-Y341 HydrophobicContact CB-CD2 4.02Å; K323-Y341 HydrophobicContact CB-CE2 4.35Å; K323-Y341 HydrophobicContact CB-CG 4.04Å
324E90Very high90.2Very high117 Ų11760.4 Ų60.455%0.54736%0.358SS..Hα-helixtrans-74.4-42.5180-67.556.6-12800111S322 L326 V327 L328S322-E324 PolarHBondContact O-N 3.42Å; S322-E324 PolarHBondContact OG-N 3.32Å; E324-L326 VanDerWaalsContact C-N 3.35Å; E324-L326 PolarHBondContact O-N 3.06Å; E324-V327 WeakPolarHBondContact O-CB 3.31Å; E324-V327 PolarHBondContact O-N 2.7Å; E324-V327 VanDerWaalsContact O-N 3.12Å; E324-L328 PolarHBondContact O-N 2.91Å
325D90.4Very high90.2Very high76 Ų7663.7 Ų63.741%0.40637%0.369SS..Hα-helixtrans-64.4-38.7174.7-56.6-47.1000111.9F312 A321 S322 V327 L328F312-D325 HydrophobicContact CE1-CB 4.2Å; F312-D325 HydrophobicContact CZ-CB 4Å; A321-D325 HydrophobicContact CB-CB 4.47Å; S322-D325 VanDerWaalsContact CB-OD2 3.29Å; S322-D325 WeakPolarHBondContact CB-OD2 3.29Å; S322-D325 PolarHBondContact N-OD2 2.85Å; S322-D325 PolarHBondContact O-N 3.09Å; S322-D325 PolarHBondContact OG-N 3.38Å; S322-D325 VanDerWaalsContact OG-N 3.1Å; S322-D325 PolarHBondContact OG-OD2 3.47Å; D325-V327 VanDerWaalsContact C-N 3.26Å; D325-V327 PolarHBondContact O-N 3.02Å; D325-L328 WeakPolarHBondContact O-CB 3.34Å; D325-L328 PolarHBondContact O-N 2.91Å; D325-L328 VanDerWaalsContact O-N 3.14Å
326L89.9Confident90.2Very high1 Ų163.8 Ų63.81%0.00537%0.366CS..Hα-helixtrans-64.6-29.1174.2-66.9174.1000112.4L308 F312 A321 S322 E324 L328 L332 A337 L340 Y341L308-L326 HydrophobicContact CD2-CD2 3.7Å; F312-L326 HydrophobicContact CE2-CD2 3.82Å; F312-L326 HydrophobicContact CZ-CD2 4.17Å; A321-L326 HydrophobicContact CB-CD2 3.89Å; A321-L326 HydrophobicContact CB-CG 3.93Å; S322-L326 WeakPolarHBondContact O-CG 3.39Å; S322-L326 PolarHBondContact O-N 3.18Å; S322-L326 VanDerWaalsContact O-N 3.1Å; E324-L326 VanDerWaalsContact C-N 3.35Å; E324-L326 PolarHBondContact O-N 3.06Å; L326-L328 VanDerWaalsContact C-N 3.35Å; L326-L332 WeakPolarHBondContact O-CD2 3.29Å; L326-A337 HydrophobicContact CB-CB 3.81Å; L326-L340 HydrophobicContact CD1-CD2 4.35Å; L326-L340 HydrophobicContact CD1-CG 4.42Å; L326-L340 HydrophobicContact CD2-CD2 4.01Å; L326-Y341 HydrophobicContact CD1-CD2 4.11Å
327V91.9Very high90.3Very high64 Ų6457.3 Ų57.339%0.38834%0.336SS..Hα-helixtrans-75.8-25.6174.4172.70000111.9K323 E324 D325 C329 P334 A337K323-V327 VanDerWaalsContact O-CG2 3.29Å; K323-V327 WeakPolarHBondContact O-CG2 3.24Å; K323-V327 PolarHBondContact O-N 3.36Å; E324-V327 WeakPolarHBondContact O-CB 3.31Å; E324-V327 PolarHBondContact O-N 2.7Å; E324-V327 VanDerWaalsContact O-N 3.12Å; D325-V327 VanDerWaalsContact C-N 3.26Å; D325-V327 PolarHBondContact O-N 3.02Å; V327-C329 PolarHBondContact O-N 3.13Å; V327-P334 HydrophobicContact CG2-CB 4.22Å; V327-A337 HydrophobicContact CB-CB 4.48Å; V327-A337 HydrophobicContact CG2-CB 3.61Å
328L90.1Very high90.3Very high151 Ų15161.3 Ų61.379%0.79135%0.347SS*.Hα-helixtrans-73.4-16178.8-16265.7000113E324 D325 L326E324-L328 PolarHBondContact O-N 2.91Å; D325-L328 WeakPolarHBondContact O-CB 3.34Å; D325-L328 PolarHBondContact O-N 2.91Å; D325-L328 VanDerWaalsContact O-N 3.14Å; L326-L328 VanDerWaalsContact C-N 3.35Å
329C88.1Confident90.2Very high4 Ų466.6 Ų66.63%0.02737%0.367CS..SBendtrans-65.6128.5179.6-69.50000112.1T307 F312 V327 G331 L332T307-C329 HydrophobicContact CG2-CB 4.23Å; F312-C329 WeakPolarHBondContact CE2-SG 3.24Å; V327-C329 PolarHBondContact O-N 3.13Å; C329-G331 PolarHBondContact O-N 3.47Å; C329-L332 HydrophobicContact CB-CB 3.75Å; C329-L332 HydrophobicContact CB-CD2 4Å; C329-L332 WeakPolarHBondContact O-CB 3.42Å; C329-L332 PolarHBondContact O-N 3.26Å
330P87.9Confident90.2Very high93 Ų9363.4 Ų63.460%0.60435%0.35SS*.THydrogen-bonded Turntrans-63.9122.7-173.223.9-33.1000112T307 L332T307-P330 HydrophobicContact CG2-CG 3.72Å; P330-L332 VanDerWaalsContact C-N 3.3Å; P330-L332 PolarHBondContact O-N 3.11Å
331G83.8Confident90.3Very high67 Ų6761.6 Ų61.669%0.69134%0.336SS*.THydrogen-bonded Turntrans84.7-9.7-176.600000115.2C329 G333C329-G331 PolarHBondContact O-N 3.47Å; G331-G333 PolarHBondContact O-N 2.78Å; G331-G333 VanDerWaalsContact O-N 3.07Å
332L87.7Confident90.3Very high4 Ų464.8 Ų64.82%0.02135%0.352CS..  trans-86.178179.5-164.760.6000111.1D304 L308 L326 C329 P330 K336 A337D304-L332 HydrophobicContact CB-CD1 4.11Å; L308-L332 HydrophobicContact CD1-CD2 4.16Å; L308-L332 HydrophobicContact CD2-CD2 3.6Å; L308-L332 HydrophobicContact CG-CD2 4Å; L326-L332 WeakPolarHBondContact O-CD2 3.29Å; C329-L332 HydrophobicContact CB-CB 3.75Å; C329-L332 HydrophobicContact CB-CD2 4Å; C329-L332 WeakPolarHBondContact O-CB 3.42Å; C329-L332 PolarHBondContact O-N 3.26Å; P330-L332 VanDerWaalsContact C-N 3.3Å; P330-L332 PolarHBondContact O-N 3.11Å; L332-K336 HydrophobicContact CD1-CB 3.5Å; L332-K336 VanDerWaalsContact CD1-CB 3.5Å; L332-K336 HydrophobicContact CD1-CD 3.78Å; L332-K336 HydrophobicContact CD1-CG 4.33Å; L332-K336 HydrophobicContact CG-CB 4.26Å; L332-A337 HydrophobicContact CG-CB 4.37Å
333G88.4Confident90.4Very high32 Ų3267 Ų6733%0.3336%0.364SS..  trans-55.7155-178.500000113.9G331 Q335 K336 A337G331-G333 PolarHBondContact O-N 2.78Å; G331-G333 VanDerWaalsContact O-N 3.07Å; G333-Q335 PolarHBondContact O-N 2.94Å; G333-K336 WeakPolarHBondContact O-CA 3.37Å; G333-K336 WeakPolarHBondContact O-CB 3.21Å; G333-K336 PolarHBondContact O-N 3.29Å; G333-A337 PolarHBondContact O-N 3.31Å; G333-A337 VanDerWaalsContact O-N 3.16Å
334P90Very high90.4Very high89 Ų8966.7 Ų66.758%0.57837%0.365SS*.Hα-helixtrans-62.6-24.1-165.723.2-35000114.9V327 K338V327-P334 HydrophobicContact CG2-CB 4.22Å; P334-K338 VanDerWaalsContact O-CB 3.24Å; P334-K338 WeakPolarHBondContact O-CB 3.2Å; P334-K338 PolarHBondContact O-N 3.06Å
335Q90.2Very high90.5Very high134 Ų13465.2 Ų65.263%0.62636%0.358SS*.Hα-helixtrans-70.8-35.1172-62.4-170.713.600112.8G333 R339G333-Q335 PolarHBondContact O-N 2.94Å; Q335-R339 WeakPolarHBondContact O-CB 3.47Å; Q335-R339 WeakPolarHBondContact O-CG 3.46Å; Q335-R339 PolarHBondContact O-N 2.9Å; Q335-R339 VanDerWaalsContact O-N 3.09Å
336K91.9Very high90.5Very high50 Ų5069.1 Ų69.122%0.21737%0.371CS..Hα-helixtrans-72.1-50.1176.3-63.2-174.8178.6-176.40110.2S299 D304 L332 G333 K338 R339 L340S299-K336 WeakPolarHBondContact O-CD 3.21Å; S299-K336 WeakPolarHBondContact O-CE 3.4Å; S299-K336 WeakPolarHBondContact O-CG 3.19Å; D304-K336 IonicContact OD1-NZ 3.39Å; D304-K336 PolarHBondContact OD1-NZ 2.62Å; D304-K336 IonicContact OD2-NZ 3.7Å; D304-K336 PolarHBondContact OD2-NZ 3.14Å; L332-K336 HydrophobicContact CD1-CB 3.5Å; L332-K336 VanDerWaalsContact CD1-CB 3.5Å; L332-K336 HydrophobicContact CD1-CD 3.78Å; L332-K336 HydrophobicContact CD1-CG 4.33Å; L332-K336 HydrophobicContact CG-CB 4.26Å; G333-K336 WeakPolarHBondContact O-CA 3.37Å; G333-K336 WeakPolarHBondContact O-CB 3.21Å; G333-K336 PolarHBondContact O-N 3.29Å; K336-K338 VanDerWaalsContact C-N 3.34Å; K336-K338 PolarHBondContact O-N 2.81Å; K336-R339 PolarHBondContact O-N 3.21Å; K336-R339 VanDerWaalsContact O-N 3.08Å; K336-L340 PolarHBondContact O-N 2.98Å
337A92.6Very high90.4Very high0 Ų073.5 Ų73.50%040%0.4CS..Hα-helixtrans-54.7-47.9176.100000111.8L326 V327 L332 G333 R339 L340 Y341L326-A337 HydrophobicContact CB-CB 3.81Å; V327-A337 HydrophobicContact CB-CB 4.48Å; V327-A337 HydrophobicContact CG2-CB 3.61Å; L332-A337 HydrophobicContact CG-CB 4.37Å; G333-A337 PolarHBondContact O-N 3.31Å; G333-A337 VanDerWaalsContact O-N 3.16Å; A337-R339 PolarHBondContact O-N 3.19Å; A337-L340 PolarHBondContact O-N 3.27Å; A337-Y341 WeakPolarHBondContact O-CB 3.5Å; A337-Y341 PolarHBondContact O-N 3.32Å
338K92.1Very high90.2Very high105 Ų10580.9 Ų80.946%0.45743%0.427SS..Hα-helixtrans-59.6-46.6173.7-178.2176.8176.8179.70112.4P334 K336 L340 Y341 D342P334-K338 VanDerWaalsContact O-CB 3.24Å; P334-K338 WeakPolarHBondContact O-CB 3.2Å; P334-K338 PolarHBondContact O-N 3.06Å; K336-K338 VanDerWaalsContact C-N 3.34Å; K336-K338 PolarHBondContact O-N 2.81Å; K338-L340 VanDerWaalsContact C-N 3.35Å; K338-L340 PolarHBondContact O-N 3.11Å; K338-Y341 PolarHBondContact O-N 3.28Å; K338-D342 WeakPolarHBondContact CE-OD2 3.33Å; K338-D342 WeakPolarHBondContact CG-OD2 3.5Å; K338-D342 VanDerWaalsContact O-CB 3.23Å; K338-D342 WeakPolarHBondContact O-CB 3.36Å; K338-D342 PolarHBondContact O-N 3.2Å
339R91.4Very high90.1Very high113 Ų11380.5 Ų80.543%0.42643%0.425SS..Hα-helixtrans-63.3-38.3179.9-77.9173.4-172.7154.913.3112.6S299 Q335 K336 A337 V343S299-R339 VanDerWaalsContact OG-CD 3.25Å; S299-R339 WeakPolarHBondContact OG-CD 3.4Å; S299-R339 PolarHBondContact OG-NH1 3.47Å; Q335-R339 WeakPolarHBondContact O-CB 3.47Å; Q335-R339 WeakPolarHBondContact O-CG 3.46Å; Q335-R339 PolarHBondContact O-N 2.9Å; Q335-R339 VanDerWaalsContact O-N 3.09Å; K336-R339 PolarHBondContact O-N 3.21Å; K336-R339 VanDerWaalsContact O-N 3.08Å; A337-R339 PolarHBondContact O-N 3.19Å; R339-V343 WeakPolarHBondContact O-CB 3.4Å; R339-V343 VanDerWaalsContact O-CG2 3.24Å; R339-V343 WeakPolarHBondContact O-CG2 3.48Å; R339-V343 PolarHBondContact O-N 3.34Å
340L92.4Very high89.8Confident0 Ų090.1 Ų90.10%047%0.467CS..Hα-helixtrans-62.2-54.6173.9177.653.9000110.6V297 I300 L308 I318 L326 K336 A337 K338 D342 V343 L344V297-L340 HydrophobicContact CG2-CD1 4.37Å; I300-L340 HydrophobicContact CD1-CB 3.87Å; I300-L340 HydrophobicContact CD1-CD1 3.64Å; I300-L340 HydrophobicContact CD1-CD2 4Å; I300-L340 HydrophobicContact CD1-CG 4.03Å; L308-L340 HydrophobicContact CD1-CD2 3.58Å; L308-L340 HydrophobicContact CD2-CD2 4.2Å; I318-L340 HydrophobicContact CG2-CD2 4.12Å; L326-L340 HydrophobicContact CD1-CD2 4.35Å; L326-L340 HydrophobicContact CD1-CG 4.42Å; L326-L340 HydrophobicContact CD2-CD2 4.01Å; K336-L340 PolarHBondContact O-N 2.98Å; A337-L340 PolarHBondContact O-N 3.27Å; K338-L340 VanDerWaalsContact C-N 3.35Å; K338-L340 PolarHBondContact O-N 3.11Å; L340-D342 PolarHBondContact O-N 3.45Å; L340-V343 PolarHBondContact O-N 3.31Å; L340-V343 VanDerWaalsContact O-N 3.08Å; L340-L344 HydrophobicContact CD1-CD1 3.58Å; L340-L344 HydrophobicContact CD1-CG 3.93Å; L340-L344 HydrophobicContact CG-CD1 4Å; L340-L344 WeakPolarHBondContact O-CG 3.48Å; L340-L344 PolarHBondContact O-N 3.04Å
341Y93.6Very high89.1Confident74 Ų7490.4 Ų90.429%0.2947%0.471SS..Hα-helixtrans-57.5-47.3179.6-171.3-87.6000112K323 L326 A337 K338 V343 L344 H345K323-Y341 HydrophobicContact CB-CD1 4.4Å; K323-Y341 HydrophobicContact CB-CD2 4.02Å; K323-Y341 HydrophobicContact CB-CE2 4.35Å; K323-Y341 HydrophobicContact CB-CG 4.04Å; L326-Y341 HydrophobicContact CD1-CD2 4.11Å; A337-Y341 WeakPolarHBondContact O-CB 3.5Å; A337-Y341 PolarHBondContact O-N 3.32Å; K338-Y341 PolarHBondContact O-N 3.28Å; Y341-V343 VanDerWaalsContact C-N 3.27Å; Y341-V343 PolarHBondContact O-N 3.01Å; Y341-L344 PolarHBondContact O-N 3.06Å; Y341-H345 AromaticContact CD1-ND1 3.97Å; Y341-H345 AromaticContact CD2-CE1 3.68Å; Y341-H345 AromaticContact CD2-ND1 3.57Å; Y341-H345 HydrophobicContact CE1-CB 4.3Å; Y341-H345 AromaticContact CE1-ND1 3.89Å; Y341-H345 AromaticContact CE2-CE1 3.4Å; Y341-H345 WeakPolarHBondContact CE2-CE1 3.34Å; Y341-H345 AromaticContact CE2-ND1 3.5Å; Y341-H345 WeakPolarHBondContact CE2-ND1 3.21Å; Y341-H345 AromaticContact CG-ND1 3.81Å; Y341-H345 AromaticContact CZ-CE1 3.86Å; Y341-H345 AromaticContact CZ-CG 3.98Å; Y341-H345 AromaticContact CZ-ND1 3.65Å; Y341-H345 WeakPolarHBondContact O-CB 3.35Å; Y341-H345 PolarHBondContact O-N 3.02Å; Y341-H345 PolarHBondContact O-ND1 3.14Å; Y341-H345 VanDerWaalsContact O-ND1 3.14Å
342D92.5Very high87.9Confident73 Ų7398.4 Ų98.439%0.3948%0.48SS..Hα-helixtrans-61.6-31.6177.1-72.2-9.4000112K338 L340 K346K338-D342 WeakPolarHBondContact CE-OD2 3.33Å; K338-D342 WeakPolarHBondContact CG-OD2 3.5Å; K338-D342 VanDerWaalsContact O-CB 3.23Å; K338-D342 WeakPolarHBondContact O-CB 3.36Å; K338-D342 PolarHBondContact O-N 3.2Å; L340-D342 PolarHBondContact O-N 3.45Å; D342-K346 WeakPolarHBondContact O-CB 3.34Å; D342-K346 PolarHBondContact O-N 3.46Å
343V92.9Very high86.6Confident88 Ų88103.4 Ų103.453%0.53351%0.511SS..Hα-helixtrans-79.3-37.2178.3165.30000112V297 R339 L340 Y341V297-V343 HydrophobicContact CG1-CB 4.27Å; V297-V343 HydrophobicContact CG1-CG1 4.38Å; V297-V343 HydrophobicContact CG1-CG2 4.19Å; V297-V343 HydrophobicContact CG2-CG1 4.11Å; R339-V343 WeakPolarHBondContact O-CB 3.4Å; R339-V343 VanDerWaalsContact O-CG2 3.24Å; R339-V343 WeakPolarHBondContact O-CG2 3.48Å; R339-V343 PolarHBondContact O-N 3.34Å; L340-V343 PolarHBondContact O-N 3.31Å; L340-V343 VanDerWaalsContact O-N 3.08Å; Y341-V343 VanDerWaalsContact C-N 3.27Å; Y341-V343 PolarHBondContact O-N 3.01Å
344L91.3Very high84.9Confident65 Ų65108.8 Ų108.834%0.3453%0.532SS..Hα-helixtrans-75.1-35.6-179.6-64.9176.2000113I319 L340 Y341I319-L344 HydrophobicContact CG1-CD1 4.15Å; I319-L344 HydrophobicContact CG1-CD2 4.29Å; L340-L344 HydrophobicContact CD1-CD1 3.58Å; L340-L344 HydrophobicContact CD1-CG 3.93Å; L340-L344 HydrophobicContact CG-CD1 4Å; L340-L344 WeakPolarHBondContact O-CG 3.48Å; L340-L344 PolarHBondContact O-N 3.04Å; Y341-L344 PolarHBondContact O-N 3.06Å
345H91.1Very high82.7Confident86 Ų86111.8 Ų111.840%0.39854%0.544SS..Hα-helixtrans-100.5-5.8-173.5-66.592.1000115I319 Y341I319-H345 PolarHBondContact O-CE1 3.28Å; I319-H345 PolarHBondContact O-NE2 2.95Å; Y341-H345 AromaticContact CD1-ND1 3.97Å; Y341-H345 AromaticContact CD2-CE1 3.68Å; Y341-H345 AromaticContact CD2-ND1 3.57Å; Y341-H345 HydrophobicContact CE1-CB 4.3Å; Y341-H345 AromaticContact CE1-ND1 3.89Å; Y341-H345 AromaticContact CE2-CE1 3.4Å; Y341-H345 WeakPolarHBondContact CE2-CE1 3.34Å; Y341-H345 AromaticContact CE2-ND1 3.5Å; Y341-H345 WeakPolarHBondContact CE2-ND1 3.21Å; Y341-H345 AromaticContact CG-ND1 3.81Å; Y341-H345 AromaticContact CZ-CE1 3.86Å; Y341-H345 AromaticContact CZ-CG 3.98Å; Y341-H345 AromaticContact CZ-ND1 3.65Å; Y341-H345 WeakPolarHBondContact O-CB 3.35Å; Y341-H345 PolarHBondContact O-N 3.02Å; Y341-H345 PolarHBondContact O-ND1 3.14Å; Y341-H345 VanDerWaalsContact O-ND1 3.14Å
346K90.1Very high80.3Confident158 Ų158114.1 Ų114.169%0.68757%0.574SS**SBendtrans-75.8128.7-179174.1176.9-176.5-179.60111D342 F348D342-K346 WeakPolarHBondContact O-CB 3.34Å; D342-K346 PolarHBondContact O-N 3.46Å; K346-F348 PolarHBondContact O-N 3.06Å
347P88.8Confident79.7Confident93 Ų93117.3 Ų117.360%0.60459%0.592SS**  trans-64.3137.1177.927.4-35.4000111L349P347-L349 PolarHBondContact O-N 3.06Å
348F87.2Confident79Confident219 Ų219123.5 Ų123.596%0.96162%0.623SS**SBendtrans-59.7-34.7176.3-67.1-76.9000112.6K346K346-F348 PolarHBondContact O-N 3.06Å
349L89.1Confident78.3Confident144 Ų144124.5 Ų124.575%0.75463%0.633SS**SBendtrans-95.4136.1175.7-59.5179.4000110.1P347 S351P347-L349 PolarHBondContact O-N 3.06Å; L349-S351 PolarHBondContact O-N 3.29Å
350K81.3Confident77.6Confident206 Ų206125.2 Ų125.290%0.89665%0.645SS**PPolyproline II helixtrans-63.1128.3163-65.9-179-178.7178.50107.8R352K350-R352 PolarHBondContact O-N 3.3Å
351S73.6Confident76.6Confident99 Ų99133 Ų13369%0.69269%0.685SS**PPolyproline II helixtrans-56.1135.2168.945.30000109.2L349 T353L349-S351 PolarHBondContact O-N 3.29Å; S351-T353 PolarHBondContact O-N 3.41Å
352R58.7Low75.5Confident235 Ų235136.9 Ų136.989%0.88771%0.711SS**  trans-66.3107.1168-83.4-174.9175.7171.2-1107.2K350 N354K350-R352 PolarHBondContact O-N 3.3Å; R352-N354 VanDerWaalsContact C-N 3.3Å; R352-N354 PolarHBondContact O-N 3.44Å
353T58.9Low74.3Confident108 Ų108141.5 Ų141.566%0.66373%0.734SS**  trans-66.994.816447.70000107.7S351 N355S351-T353 PolarHBondContact O-N 3.41Å; T353-N355 PolarHBondContact O-N 3.09Å
354N52.5Low72.8Confident145 Ų145145.6 Ų145.678%0.77575%0.75SS**  trans-67.585.1159.8-72.8-2.7000106.8R352 S356R352-N354 VanDerWaalsContact C-N 3.3Å; R352-N354 PolarHBondContact O-N 3.44Å; N354-S356 PolarHBondContact O-N 3.5Å; N354-S356 VanDerWaalsContact O-N 3.16Å
355N44.7Very low71.3Confident153 Ų153152.3 Ų152.382%0.81878%0.784SS**  trans-66110.8165.2-72.81.3000106.5T353T353-N355 PolarHBondContact O-N 3.09Å
356S39.8Very low69.5Low182 Ų182158.4 Ų158.4100%1.27382%0.819SS**  trans-109.20174.6-171.40000110.9N354N354-S356 PolarHBondContact O-N 3.5Å; N354-S356 VanDerWaalsContact O-N 3.16Å

Retrieved 356 of 356 residues in 607.5 ms (Link to these results)