A0A3Q0KBK3_SCHMA Loading...

Zinc finger CCCH domain-containing protein 6

AlphaFold DB , UniProt , Accession A0A3Q0KBK3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 691 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M46.1Very low60.3Low242 Ų242158.8 Ų158.8100%1.19285%0.853SS**  0106.30-71.4169.9162.800107.1
2T57Low60.7Low128 Ų128160.2 Ų160.279%0.78585%0.85SS**  cis-133.7135.1-1.842.60000108.6
3S49.9Very low60.2Low101 Ų101160.3 Ų160.371%0.70685%0.852SS**  trans-71.2140171.1-50.60000109.8
4I64.1Low60.2Low153 Ų153160.3 Ų160.379%0.78585%0.851SS**  trans-132.2103.9158.5-70-178.9000105.2
5D63.2Low59.7Low142 Ų142157.9 Ų157.976%0.75985%0.852SS**  trans-81.8150.2169.5-46.8-82.1000108.2
6F65.6Low59.3Low196 Ų196152.7 Ų152.786%0.8685%0.847SS**  trans-144132.2171.9-147.5-89.4000110.7
7E70.7Confident59.3Low183 Ų183150.4 Ų150.486%0.85584%0.843SS**  trans-53.9140-169.1-93153.878.700115.2
8E57.7Low58.8Low191 Ų191151.2 Ų151.289%0.89385%0.846SS**  trans-83.5128.5163.7-62.9-175130.700109.1
9G64Low58.9Low77 Ų77152.2 Ų152.279%0.79484%0.843SS**  trans-100.3106.9178.900000111.8
10E61.3Low58.5Low192 Ų192154.2 Ų154.290%0.89785%0.846SS**  trans-71.7136176.5-58.2179.3147.100111.6
11V63.8Low58.5Low142 Ų142153.4 Ų153.486%0.86184%0.84SS**  trans-141.8132.9161.9-79.50000110.1
12E64.9Low58.8Low175 Ų175146.7 Ų146.782%0.81882%0.817SS**  trans-70.7147.2-152.2-54.9178.7142.300116.9L14E12-L14 PolarHBondContact O-N 3.41Å
13D54.2Low58.4Low162 Ų162144.4 Ų144.487%0.86682%0.819SS**  trans-74.9108.2164.3-79.8-53000111
14L60.3Low58.1Low160 Ų160148.7 Ų148.784%0.83883%0.827SS**  trans-94.599.1170.2-68.2-177.9000111.5E12E12-L14 PolarHBondContact O-N 3.41Å
15S52.8Low57.3Low124 Ų124149.2 Ų149.287%0.86783%0.826SS**  trans-88.8133.5170.1-67.40000111.8
16G53.6Low56.3Low75 Ų75151.8 Ų151.877%0.77383%0.827SS**  trans143.7144.4173.300000112
17S59.8Low55.4Low113 Ų113148.2 Ų148.279%0.7982%0.821SS**  cis-159.7134.4-5.752.90000109.4
18D49.1Very low54.1Low165 Ų165146.1 Ų146.188%0.88282%0.816SS**  trans-66.3136.9175.3-57.7-71.1000110.8
19H60.9Low53.6Low171 Ų171147.3 Ų147.379%0.79281%0.814SS**  trans-13398.2170-161.456.8000109.9D21H19-D21 PolarHBondContact O-N 3.42Å
20E50.3Low52.7Low192 Ų192150.3 Ų150.390%0.89781%0.812SS**  trans-76.6112.2169.5-60.3-103.5112.700108.1
21D58.7Low52Low138 Ų138145.2 Ų145.274%0.73880%0.795SS**  trans-121.4162162.1-167.523.3000110.5H19H19-D21 PolarHBondContact O-N 3.42Å
22S53.4Low51.1Low101 Ų101143.6 Ų143.671%0.70679%0.786SS**  trans-117.4168.3-134.958.30000113
23G47.3Very low50.3Low79 Ų79144.4 Ų144.481%0.81479%0.787SS**  trans-52143.1-158.800000116.8
24H45.4Very low49.8Very low192 Ų192144.1 Ų144.189%0.88979%0.79SS**  trans-115.8131.3145.7-146.8-60.6000111.1
25E46.3Very low49Very low163 Ų163141.3 Ų141.376%0.76278%0.784SS**  trans-94.4147.6-172.2164.5170.515800112
26Y42.8Very low48.5Very low196 Ų196142.7 Ų142.777%0.76978%0.781SS**  trans55.4118.7157.3-139.4-108.4000120.7
27T46.1Very low47.8Very low122 Ų122149.4 Ų149.475%0.74878%0.784SS**  -169.2145.1110.517.80000112.2
28D43.4Very low47Very low139 Ų139152.6 Ų152.674%0.74378%0.784SS**  trans-87.3137.8175.1-179.120.8000111
29Y47.1Very low46.6Very low215 Ų215149.3 Ų149.384%0.84377%0.774SS**  trans-156.764.9-175.1-119-75.6000115.4
30D46.1Very low45.8Very low140 Ų140146.5 Ų146.575%0.74977%0.774SS**  trans-84.6148.8143.2-166.248.7000107.2
31P45.3Very low45.4Very low85 Ų85147.7 Ų147.755%0.55278%0.776SS**  cis-136.5173.413.126.9-2.1000116.8
32T46Very low44.8Very low108 Ų108152.4 Ų152.466%0.66378%0.783SS**  164.8124.3105.641.30000116.2V34T32-V34 PolarHBondContact O-N 3.46Å
33K47.2Very low44.3Very low193 Ų193157.3 Ų157.384%0.83979%0.792SS**  trans33.683.6134.1-56.4171.2-174.2161.40118.8S35K33-S35 PolarHBondContact O-N 3.3Å
34V43.7Very low44.2Very low155 Ų155164.6 Ų164.694%0.93980%0.795SS**  trans-74.1110.3150.3-179.60000108.7T32T32-V34 PolarHBondContact O-N 3.46Å
35S44.3Very low44Very low101 Ų101162.5 Ų162.571%0.70679%0.785SS**  trans-95.4119.4-174.262.10000113.6K33 Y37K33-S35 PolarHBondContact O-N 3.3Å; S35-Y37 PolarHBondContact O-N 3.21Å
36L42.1Very low44.1Very low153 Ų153160.8 Ų160.880%0.80179%0.786SS**  trans16.289.1150.7-64.7173.8000116.9K38L36-K38 PolarHBondContact O-N 3Å
37Y39.2Very low44.5Very low217 Ų217158.1 Ų158.185%0.85178%0.781SS**  trans-72.496.8164.1-163.7-101.2000110S35 S39S35-Y37 PolarHBondContact O-N 3.21Å; Y37-S39 WeakPolarHBondContact CD1-OG 3.41Å; Y37-S39 WeakPolarHBondContact CE1-OG 3.48Å; Y37-S39 PolarHBondContact O-N 2.93Å
38K41.5Very low44.4Very low179 Ų179163.8 Ų163.878%0.77879%0.788SS**  trans-77.182.9177.3-74.6-178.1176.5176.30111L36 S40L36-K38 PolarHBondContact O-N 3Å; K38-S40 PolarHBondContact O-N 3.3Å
39S42.3Very low44.4Very low97 Ų97162 Ų16268%0.67878%0.778SS**  trans-61.9124.2166-67.60000110.6Y37Y37-S39 WeakPolarHBondContact CD1-OG 3.41Å; Y37-S39 WeakPolarHBondContact CE1-OG 3.48Å; Y37-S39 PolarHBondContact O-N 2.93Å
40S43.4Very low44.1Very low112 Ų112156.6 Ų156.678%0.78378%0.778SS**  trans-61.7142.7-168.2-67.30000114.8K38 R42K38-S40 PolarHBondContact O-N 3.3Å; S40-R42 PolarHBondContact O-N 3.31Å
41K41.1Very low44Very low216 Ų216155.4 Ų155.494%0.93977%0.772SS**  trans-57.6107.7163.6-66.4179.6178.2-178.70109.7
42R46.9Very low43.8Very low238 Ų238163.4 Ų163.490%0.89879%0.791SS**  trans-102.9115.3159.3-99.2-171.9168.3-163.7-4.4110.1S40 R44S40-R42 PolarHBondContact O-N 3.31Å; R42-R44 PolarHBondContact O-N 3.38Å; R42-R44 VanDerWaalsContact O-N 3.13Å
43K42.1Very low43.5Very low203 Ų203162.9 Ų162.988%0.88379%0.792SS**  trans-65.699.9-177.2-172.1-179-176.5-175.90109.9
44R45Very low42.8Very low233 Ų233165.1 Ų165.188%0.87980%0.795SS**  trans-102.6113.7165.9-85-168.6169.4-173.6-2.6109.7R42 T46R42-R44 PolarHBondContact O-N 3.38Å; R42-R44 VanDerWaalsContact O-N 3.13Å; R44-T46 PolarHBondContact O-N 3.22Å
45H41.9Very low42.4Very low147 Ų147164 Ų16468%0.68179%0.793SS**  trans-89.984.7-175.7-173.6-86.9000109.8Q47H45-Q47 PolarHBondContact CE1-OE1 2.93Å; H45-Q47 PolarHBondContact O-N 2.69Å
46T48.8Very low42Very low127 Ų127163.7 Ų163.778%0.77979%0.79SS**  trans-95.683.2173.954.30000110R44 R48R44-T46 PolarHBondContact O-N 3.22Å; T46-R48 PolarHBondContact O-N 3.37Å; T46-R48 VanDerWaalsContact O-N 3.14Å
47Q50.3Low41.7Very low141 Ų141167.7 Ų167.766%0.65980%0.795SS**  trans-65.3104.7174.3-177.4173.3-4.700109.7H45 N49H45-Q47 PolarHBondContact CE1-OE1 2.93Å; H45-Q47 PolarHBondContact O-N 2.69Å; Q47-N49 PolarHBondContact NE2-OD1 3.47Å
48R44.7Very low41.8Very low241 Ų241168.5 Ų168.591%0.90980%0.796SS**  trans-109.2101.8165.1-93.4-174.9162178.6-6.4107.5T46T46-R48 PolarHBondContact O-N 3.37Å; T46-R48 VanDerWaalsContact O-N 3.14Å
49N43.5Very low41.6Very low100 Ų100167.4 Ų167.454%0.53579%0.794SS.*  trans-59.5141.7-178.5-73.52000111.5Q47 D51Q47-N49 PolarHBondContact NE2-OD1 3.47Å; N49-D51 VanDerWaalsContact C-N 3.31Å; N49-D51 WeakPolarHBondContact CB-OD2 3.4Å; N49-D51 PolarHBondContact ND2-OD2 3.34Å; N49-D51 PolarHBondContact O-N 3.33Å
50A41.1Very low41.6Very low102 Ų102168.3 Ų168.384%0.84380%0.8SS**  trans-90.270161.900000109.1R52A50-R52 PolarHBondContact O-N 3.08Å
51D43.4Very low41.4Very low116 Ų116168.6 Ų168.662%0.6280%0.798SS**  trans-72.972.2179.3-88.7-60.6000112N49 S53N49-D51 VanDerWaalsContact C-N 3.31Å; N49-D51 WeakPolarHBondContact CB-OD2 3.4Å; N49-D51 PolarHBondContact ND2-OD2 3.34Å; N49-D51 PolarHBondContact O-N 3.33Å; D51-S53 VanDerWaalsContact C-N 3.27Å; D51-S53 PolarHBondContact O-N 3.01Å; D51-S53 VanDerWaalsContact O-N 3.16Å
52R40.6Very low41.6Very low252 Ų252165.1 Ų165.195%0.95179%0.794SS**  trans-76.277.2158.1-90.2-174.9159.9-164.1-3.5108.8A50A50-R52 PolarHBondContact O-N 3.08Å
53S40.1Very low41.3Very low97 Ų97160.1 Ų160.168%0.67878%0.784SS**  trans-143.9167169.877.40000113.3D51D51-S53 VanDerWaalsContact C-N 3.27Å; D51-S53 PolarHBondContact O-N 3.01Å; D51-S53 VanDerWaalsContact O-N 3.16Å
54R33.6Very low41.3Very low241 Ų241158 Ų15891%0.90978%0.782SS**  trans-81.4123.6-159.4-61.2162.2175.6154-4.7112.8
55C33.6Very low41.2Very low131 Ų131150.6 Ų150.689%0.88578%0.778SS**  trans-112.899.8138.1-66.10000106.4
56S36.6Very low41.5Very low94 Ų94151 Ų15166%0.65778%0.784SS**  62.276.666.7-163.20000112.6R58S56-R58 PolarHBondContact O-N 3.36Å
57R36.7Very low41.2Very low237 Ų237155.8 Ų155.889%0.89479%0.788SS**  trans-2.6111.8139.6-175.4-174.7-167.6178.14.9113.4
58R41.4Very low41.1Very low234 Ų234153 Ų15388%0.88379%0.789SS**  trans-153.2138.2165-131.9175.4-175.8177.50.4109.7S56S56-R58 PolarHBondContact O-N 3.36Å
59E35.7Very low41.2Very low156 Ų156147.8 Ų147.873%0.72978%0.784SS**  trans-78.6152.8-171.3-58.992.1144.400112.7
60S42.6Very low41.1Very low116 Ų116150.8 Ų150.881%0.81179%0.794SS**  trans-138.173158.352.10000109.7V62S60-V62 PolarHBondContact O-N 3.1Å
61T39Very low41.3Very low119 Ų119153.5 Ų153.573%0.7379%0.794SS**  trans-62.7126171.3-54.70000109.9L63T61-L63 HydrophobicContact CG2-CD1 4.46Å
62V45.6Very low41.7Very low142 Ų142153.7 Ų153.786%0.86180%0.801SS**  trans-118.9148.8163-176.50000107.9S60S60-V62 PolarHBondContact O-N 3.1Å
63L42Very low41.7Very low133 Ų133148.4 Ų148.470%0.69679%0.787SS**  trans-94.1159.3-148.7-12273.7000115.7T61T61-L63 HydrophobicContact CG2-CD1 4.46Å
64L40.4Very low42.2Very low159 Ų159150.7 Ų150.783%0.83280%0.797SS**  trans78.7121.4153.7-65.4158.8000119.5
65G43.7Very low42.7Very low77 Ų77144.2 Ų144.279%0.79478%0.78SS**  trans166.768.1174.700000112.7
66L47.3Very low43Very low155 Ų155140.7 Ų140.781%0.81277%0.766SS**  trans-66.2160.5-178.2-56.8168.8000111.5
67R43.7Very low43.3Very low229 Ų229146.3 Ų146.386%0.86477%0.773SS**  cis-150.1138.335.8-63.7166.3-175.7170.80.7109.4
68A47.2Very low43.4Very low81 Ų81142.3 Ų142.367%0.66977%0.769SS**  55.4134.795.100000114.3
69V46.7Very low43.3Very low133 Ų133134.8 Ų134.881%0.80676%0.757SS**  cis-152.6169.929.2-75.90000111
70E41.8Very low43.3Very low162 Ų162135.3 Ų135.376%0.75777%0.765SS**  cis-161.9-143.6-40.8-145.1124.6115.700110
71L46.6Very low43.1Very low160 Ų160133.5 Ų133.584%0.83875%0.752SS**  trans-142.7170-174-72.3167.9000113.2
72P50.2Low43.2Very low119 Ų119136.8 Ų136.877%0.77376%0.756SS**  -144.3161.6101.438.5-23.7000113.4
73H42.2Very low42.8Very low142 Ų142141 Ų14166%0.65776%0.757SS**  cis86.3115.821.6-170.972.8000118.3
74V50.3Low42.5Very low144 Ų144139.8 Ų139.887%0.87376%0.759SS**  trans-156.7173.9149.1-87.70000110.3
75D42.5Very low42.8Very low105 Ų105140.5 Ų140.556%0.56176%0.756SS**  -150.1169.9-119.9-175.729.9000114.6R77D75-R77 IonicContact OD2-CZ 3.22Å; D75-R77 VanDerWaalsContact OD2-CZ 3.22Å; D75-R77 IonicContact OD2-NE 3.7Å; D75-R77 PolarHBondContact OD2-NE 3.45Å; D75-R77 IonicContact OD2-NH2 2.68Å; D75-R77 PolarHBondContact OD2-NH2 3.41Å
76G41.7Very low42.8Very low57 Ų57143.5 Ų143.559%0.58875%0.749SS**  trans134.7115171.700000114.2
77R41.6Very low42.7Very low212 Ų212146.4 Ų146.480%0.875%0.749SS**  cis79.1134.547-60.8178.8-153.8-161.58.3113.3D75D75-R77 IonicContact OD2-CZ 3.22Å; D75-R77 VanDerWaalsContact OD2-CZ 3.22Å; D75-R77 IonicContact OD2-NE 3.7Å; D75-R77 PolarHBondContact OD2-NE 3.45Å; D75-R77 IonicContact OD2-NH2 2.68Å; D75-R77 PolarHBondContact OD2-NH2 3.41Å
78N39.1Very low42.9Very low154 Ų154139.4 Ų139.482%0.82474%0.736SS**  cis-164.8171.2-10.9-149.7-10000112.7
79A39.3Very low42.9Very low75 Ų75144.2 Ų144.262%0.6274%0.741SS**  trans55.4107.814700000123.5
80N35.2Very low43.3Very low168 Ų168145.4 Ų145.490%0.89874%0.742SS**  58.7153.1110.1-153.12.6000122.5
81S38.9Very low43.7Very low77 Ų77142.6 Ų142.654%0.53874%0.738SS.*  trans102.695.9154.5-172.20000121.8
82K40.6Very low43.6Very low189 Ų189141.7 Ų141.782%0.82273%0.733SS**  trans72.3144.5132-59.9171-166.7165.50122.2
83R36.9Very low43.3Very low230 Ų230142.2 Ų142.287%0.86873%0.729SS**  trans70.9114.7152.1-86.2-174.2164.1-171.6-4.4120.1
84S37Very low43.5Very low108 Ų108141.5 Ų141.576%0.75573%0.726SS**  47131.4116.9-430000118.3
85K46.9Very low43.2Very low174 Ų174142.2 Ų142.276%0.75772%0.717SS**  175.6135.260.9-176.7167.7167.6175.80111.8
86E42.9Very low43.5Very low140 Ų140144.7 Ų144.765%0.65473%0.73SS**  trans69.3147.6151.6-86.6-172.971.200125.1
87R45.8Very low43.5Very low216 Ų216146.1 Ų146.182%0.81573%0.731SS**  trans75.8140.6148.5-74.5170.672.6173.52.1120.6
88S47.7Very low43.6Very low82 Ų82143.7 Ų143.757%0.57373%0.729SS**  cis-174.7155.1-22.147.90000112.2
89K47.8Very low43.8Very low182 Ų182143.8 Ų143.879%0.79173%0.729SS**  trans78.4113168.7-56.7-175.7178.5-175.40114.2
90L54.5Low44.5Very low158 Ų158149.3 Ų149.383%0.82774%0.742SS**  cis80.9148.645.3-65.6169.8000113
91P50Low45.1Very low102 Ų102149 Ų14966%0.66274%0.741SS**  cis-145.6-158.3-33.141.2-22.7000113.3
92L44.8Very low45.7Very low142 Ų142152.9 Ų152.974%0.74376%0.755SS**  trans121.690.5140.3-145.370.6000112
93L44.6Very low45.7Very low130 Ų130149.8 Ų149.868%0.68175%0.752SS**  75.8139.889.8-102.474.6000112.8
94E45.3Very low46.2Very low126 Ų126149.7 Ų149.759%0.58975%0.753SS**  cis-166.5176.8-8.1-145.3168.5-176.100111.5
95F44.4Very low46.8Very low159 Ų159150.8 Ų150.870%0.69775%0.75SS**  trans77120.8160.1-49-49.4000119.2
96L49Very low46.7Very low158 Ų158150.1 Ų150.183%0.82775%0.752SS**  cis-146.8143.8-12.8-95.2178.7000110.1
97S40.3Very low46.8Very low86 Ų86147.7 Ų147.760%0.60175%0.75SS**  trans-84.1142163-84.50000109.5
98E44.4Very low46.5Very low162 Ų162146.4 Ų146.476%0.75775%0.753SS**  77.8162.898.4-58.1170.4109.800114.7
99D43.6Very low46.2Very low156 Ų156150.7 Ų150.783%0.83476%0.764SS**  trans69.6-174.5171.8-52.5-34.9000118.6
100E53.4Low45.8Very low191 Ų191150.4 Ų150.489%0.89377%0.765SS**  trans73.271.1-168.7-59.3-169.6176.200116.2
101D48Very low45.9Very low162 Ų162148.7 Ų148.787%0.86676%0.764SS**  trans-74121.3150.522.6-148.2000110.9
102D51.1Low45.6Very low157 Ų157151 Ų15184%0.8477%0.77SS**  trans-141.1150.4170.8-145.7-22.6000113.6
103T42.5Very low45.3Very low125 Ų125153 Ų15377%0.76777%0.773SS**  trans-11998.7-168.8-61.40000110
104Y46.2Very low45.4Very low227 Ų227153.3 Ų153.389%0.8978%0.781SS**  trans-114138.2170.4-149.9-98.7000114.4
105L49.8Very low45.1Very low131 Ų131157.1 Ų157.169%0.68680%0.795SS**  trans-111165.1-162-142.3160.6000109
106M45.2Very low45Very low161 Ų161154.7 Ų154.779%0.79380%0.798SS**  trans75.5152.2172.1-46.6-175.770.300114.2
107S45Very low44.7Very low88 Ų88151.8 Ų151.862%0.61579%0.791SS**  cis-124.6148.912.2-63.40000114
108H39.6Very low44.8Very low189 Ų189156.9 Ų156.988%0.87581%0.805SS**  trans-88.8125.6160.6-83.3-106.6000109.2
109E41.9Very low44.7Very low172 Ų172152.6 Ų152.680%0.80480%0.804SS**  trans-13398171.8-65.2-172.117900110.2
110E38.5Very low45Very low177 Ų177151.5 Ų151.583%0.82780%0.804SS**PPolyproline II helixtrans-84.2124.8169.5-72.6-112.9125.900109.8
111P55.5Low44.7Very low122 Ų122154.2 Ų154.279%0.79281%0.806SS**PPolyproline II helixtrans-88.2135.116531.9-29.1000111.4
112D44.3Very low44.6Very low149 Ų149155.7 Ų155.780%0.79780%0.804SS**PPolyproline II helixtrans-66.2161-156-141.3-35.2000118.2T114D112-T114 PolarHBondContact O-N 3.17Å
113K38.9Very low44.5Very low185 Ų185159.8 Ų159.880%0.80481%0.808SS**  trans-86.798.5171.9-67.2168.5-174.4132.60111.1
114T45.9Very low45Very low137 Ų137163.9 Ų163.984%0.8482%0.815SS**  trans-112.3153.3165.5530000112.5D112D112-T114 PolarHBondContact O-N 3.17Å
115K40.5Very low45.4Very low205 Ų205162.6 Ų162.689%0.89181%0.814SS**  trans-117.9120.3-165.8-57.6167.7-174.9167.40111.4
116S41.7Very low45.4Very low108 Ų108167.4 Ų167.476%0.75582%0.823SS**  trans-165.3115.1154.239.50000107.8
117S42.3Very low45.8Very low97 Ų97171 Ų17168%0.67883%0.828SS**  81.496.659.474.50000113.3
118E43.4Very low46.4Very low194 Ų194176.5 Ų176.591%0.90784%0.841SS**  trans68.6156.7154.2-70.7161.19100120.3
119G40.7Very low47.4Very low71 Ų71174.7 Ų174.773%0.73284%0.838SS**  trans78118.4-178.700000114.9
120T51Low48.1Very low134 Ų134169 Ų16982%0.82282%0.824SS**  cis-149.3134.30.945.10000111K122T120-K122 PolarHBondContact O-N 3.34Å
121R46.1Very low49.1Very low248 Ų248166.5 Ų166.594%0.93682%0.824SS**  trans-80.591.3170-69.7178.1178167.4-0.8110.3
122K47.2Very low49.1Very low193 Ų193169.6 Ų169.684%0.83983%0.827SS**  trans-162.9150.6166.7-106.4140.7-173.5178.50113.2T120T120-K122 PolarHBondContact O-N 3.34Å
123R48.4Very low49.3Very low242 Ų242172.3 Ų172.391%0.91383%0.832SS**  trans61.679.2165.2-56.7170.792.3169.57.2118.4
124K52.4Low49.8Very low211 Ų211168.7 Ų168.792%0.91783%0.83SS**  trans-134.241.7146.1-151165.3-173.6170.80114
125K55.3Low50.1Low200 Ų200166.2 Ų166.287%0.8782%0.823SS**  trans-95.6141.9158.6-172.5174.4-178.5177.90106.9
126R48.9Very low50.8Low232 Ų232162 Ų16288%0.87582%0.819SS**SBendtrans84.7154.1-162.8-57.9179.7166.5-176.4-5.3114.3
127R53.4Low52Low238 Ų238162.2 Ų162.290%0.89881%0.809SS**  trans71.371.3-169.7-58.8-170177.5-143.4-2.8115.2
128K58.7Low53.8Low203 Ų203160.8 Ų160.888%0.88380%0.799SS**  trans-121.413.8143.7-149.3-154169.9-171.30112.8G130K128-G130 PolarHBondContact O-N 3.36Å
129D60.4Low56Low151 Ų151159.9 Ų159.981%0.80779%0.787SS**  trans-84.156.6174.8-35.2-84000108.1
130G56.6Low58.3Low51 Ų51156.5 Ų156.553%0.52675%0.752SS.*PPolyproline II helixtrans-81.8138.3169.300000108.5K128 H132K128-G130 PolarHBondContact O-N 3.36Å; G130-H132 PolarHBondContact O-N 3.07Å
131P60.5Low60.1Low126 Ų126157.4 Ų157.482%0.81875%0.745SS**PPolyproline II helixtrans-56136.8179.524.5-33.9000109.6K133P131-K133 PolarHBondContact O-N 3.38Å; P131-K133 VanDerWaalsContact O-N 3.1Å
132H53.6Low62.2Low187 Ų187152.5 Ų152.587%0.86673%0.727SS**PPolyproline II helixtrans-53.8121.8176.1-81.5-125.9000108.5G130 S134G130-H132 PolarHBondContact O-N 3.07Å; H132-S134 PolarHBondContact O-N 3.25Å; H132-S134 VanDerWaalsContact O-N 3.08Å
133K50.4Low64.1Low206 Ų206146.8 Ų146.890%0.89670%0.701SS**PPolyproline II helixtrans-55.6122.1163.1-79.1-166171.9-1690106.3P131P131-K133 PolarHBondContact O-N 3.38Å; P131-K133 VanDerWaalsContact O-N 3.1Å
134S48.9Very low65.9Low109 Ų109139.9 Ų139.976%0.76268%0.68SS**PPolyproline II helixtrans-50.5144.8-176.143.60000110.4H132 S136H132-S134 PolarHBondContact O-N 3.25Å; H132-S134 VanDerWaalsContact O-N 3.08Å; S134-S136 PolarHBondContact O-N 3.37Å
135A52.4Low67.3Low84 Ų84131.8 Ų131.869%0.69465%0.647SS**  trans-62.999-172.600000110.9Q137A135-Q137 HydrophobicContact CB-CB 4.38Å; A135-Q137 HydrophobicContact CB-CG 4.44Å; A135-Q137 PolarHBondContact O-N 3.01Å
136S55.3Low68.6Low116 Ų116124.2 Ų124.281%0.81163%0.626SS**  trans-66.282.7151.545.10000106.6S134 S138S134-S136 PolarHBondContact O-N 3.37Å; S136-S138 VanDerWaalsContact C-N 3.32Å; S136-S138 PolarHBondContact O-N 3.13Å
137Q65.6Low70.3Confident113 Ų113121.3 Ų121.353%0.52862%0.615SS.*  trans-69.385.2-157.4-151.1177.4-10.500110A135 L157A135-Q137 HydrophobicContact CB-CB 4.38Å; A135-Q137 HydrophobicContact CB-CG 4.44Å; A135-Q137 PolarHBondContact O-N 3.01Å; Q137-L157 HydrophobicContact CB-CD1 4.01Å; Q137-L157 HydrophobicContact CB-CD2 4.35Å; Q137-L157 HydrophobicContact CB-CG 3.84Å; Q137-L157 HydrophobicContact CG-CD1 4.39Å; Q137-L157 HydrophobicContact CG-CD2 3.83Å; Q137-L157 HydrophobicContact CG-CG 3.71Å; Q137-L157 VanDerWaalsContact NE2-CD2 3.32Å; Q137-L157 WeakPolarHBondContact O-CD1 3.33Å; Q137-L157 WeakPolarHBondContact O-CG 3.38Å
138S81.2Confident72Confident68 Ų68111.3 Ų111.348%0.47658%0.581SS.*  trans-65.2140.1-163.856.60000111.3S136 C140 F156 L157S136-S138 VanDerWaalsContact C-N 3.32Å; S136-S138 PolarHBondContact O-N 3.13Å; S138-C140 PolarHBondContact O-N 2.83Å; S138-F156 WeakPolarHBondContact O-CA 3.38Å; S138-F156 WeakPolarHBondContact O-CB 3.29Å; S138-F156 WeakPolarHBondContact OG-CD1 3.12Å; S138-L157 PolarHBondContact O-N 3.34Å; S138-L157 VanDerWaalsContact O-N 3.13Å
139R88.1Confident73.4Confident174 Ų174107.4 Ų107.466%0.65758%0.579SS**BIsolated β-bridgetrans-59.3134.5-179.3-71.3-175-174.9125.72.4110.1K141 M144 F160R139-K141 PolarHBondContact O-N 2.7Å; R139-M144 HydrophobicContact CB-SD 4.44Å; R139-F160 HydrophobicContact CB-CD1 4.14Å; R139-F160 HydrophobicContact CB-CE1 3.47Å; R139-F160 VanDerWaalsContact CB-CE1 3.47Å; R139-F160 HydrophobicContact CB-CZ 3.99Å; R139-F160 HydrophobicContact CG-CD1 3.72Å; R139-F160 HydrophobicContact CG-CE1 3.59Å; R139-F160 HydrophobicContact CG-CZ 4.45Å
140C90.7Very high74.7Confident0 Ų0105.5 Ų105.50%056%0.564CS.*  trans-65.5105.7-179.2-179.30000111.1S138 Y142 Y143 M144 C148 F156 L157 H158S138-C140 PolarHBondContact O-N 2.83Å; C140-Y142 PolarHBondContact O-N 3.3Å; C140-Y143 WeakPolarHBondContact O-CA 3.32Å; C140-Y143 WeakPolarHBondContact O-CB 3.46Å; C140-Y143 PolarHBondContact O-N 3.33Å; C140-Y143 PolarHBondContact SG-N 3.29Å; C140-Y143 VanDerWaalsContact SG-N 3.41Å; C140-M144 PolarHBondContact O-N 2.82Å; C140-C148 VanDerWaalsContact SG-SG 3.62Å; C140-F156 HydrophobicContact CB-CB 3.56Å; C140-L157 WeakPolarHBondContact CB-O 3.46Å; C140-L157 PolarHBondContact N-O 3.27Å; C140-H158 WeakPolarHBondContact CB-CD2 3.09Å; C140-H158 PolarHBondContact SG-NE2 3.41Å
141K88.5Confident76Confident153 Ų153104.9 Ų104.967%0.66556%0.557SS**Hα-helixtrans-54.1-36.9176.9-174.7178.3178.8-178.80112.4R139 Y143 M144 D145R139-K141 PolarHBondContact O-N 2.7Å; K141-Y143 VanDerWaalsContact C-N 3.32Å; K141-Y143 PolarHBondContact O-N 3.11Å; K141-M144 PolarHBondContact O-N 3.49Å; K141-D145 PolarHBondContact O-N 3.48Å
142Y88.8Confident77.1Confident145 Ų145103.2 Ų103.257%0.56956%0.563SS**Hα-helixtrans-69.2-29.3176.7-60.4-76.6000112.7C140 D145 G146 R147 C148C140-Y142 PolarHBondContact O-N 3.3Å; Y142-D145 PolarHBondContact O-N 2.9Å; Y142-G146 PolarHBondContact O-N 2.99Å; Y142-R147 CarbonylContact O-C 3.39Å; Y142-R147 WeakPolarHBondContact O-CA 3.41Å; Y142-R147 PolarHBondContact O-N 2.92Å; Y142-C148 PolarHBondContact O-N 2.86Å; Y142-C148 VanDerWaalsContact O-N 3.11Å
143Y88.2Confident78.7Confident74 Ų7498.9 Ų98.929%0.2955%0.554SS.*Hα-helixtrans-80.5-35.7176.7-174.9-113.9000111.5C140 K141 D145 G146 C148 H158 F160C140-Y143 WeakPolarHBondContact O-CA 3.32Å; C140-Y143 WeakPolarHBondContact O-CB 3.46Å; C140-Y143 PolarHBondContact O-N 3.33Å; C140-Y143 PolarHBondContact SG-N 3.29Å; C140-Y143 VanDerWaalsContact SG-N 3.41Å; K141-Y143 VanDerWaalsContact C-N 3.32Å; K141-Y143 PolarHBondContact O-N 3.11Å; Y143-D145 PolarHBondContact O-N 3.41Å; Y143-G146 PolarHBondContact O-N 3.48Å; Y143-C148 HydrophobicContact CD2-CB 4.47Å; Y143-H158 HydrophobicContact CD1-CB 3.8Å; Y143-H158 AromaticContact CD1-CD2 3.98Å; Y143-H158 AromaticContact CD1-CG 3.72Å; Y143-H158 AromaticContact CD2-CE1 3.75Å; Y143-H158 AromaticContact CD2-CG 3.94Å; Y143-H158 AromaticContact CD2-ND1 3.57Å; Y143-H158 HydrophobicContact CE1-CB 3.7Å; Y143-H158 WeakPolarHBondContact CE1-O 3.39Å; Y143-H158 HydrophobicContact CE2-CB 4.49Å; Y143-H158 AromaticContact CE2-ND1 3.84Å; Y143-H158 HydrophobicContact CG-CB 4.26Å; Y143-H158 AromaticContact CG-CD2 3.76Å; Y143-H158 AromaticContact CG-CE1 3.92Å; Y143-H158 AromaticContact CG-CG 3.68Å; Y143-H158 AromaticContact CG-ND1 3.78Å; Y143-H158 AromaticContact CG-NE2 3.9Å; Y143-F160 HydrophobicContact CD1-CE1 4.07Å; Y143-F160 AromaticContact CD1-CE2 3.82Å; Y143-F160 HydrophobicContact CD1-CE2 3.82Å; Y143-F160 AromaticContact CD1-CZ 3.58Å; Y143-F160 HydrophobicContact CD1-CZ 3.58Å; Y143-F160 HydrophobicContact CE1-CE2 4.32Å; Y143-F160 HydrophobicContact CE1-CZ 4.37Å; Y143-F160 VanDerWaalsContact CE1-O 3.29Å; Y143-F160 WeakPolarHBondContact CE1-O 3.33Å; Y143-F160 HydrophobicContact CG-CZ 4.5Å
144M85.3Confident80.6Confident97 Ų9790.1 Ų90.148%0.47852%0.518SS..Hα-helixtrans-54-33.4166.3-63.5-17972.100112.4R139 C140 K141 F160R139-M144 HydrophobicContact CB-SD 4.44Å; C140-M144 PolarHBondContact O-N 2.82Å; K141-M144 PolarHBondContact O-N 3.49Å; M144-F160 HydrophobicContact CB-CE2 4.24Å; M144-F160 HydrophobicContact CB-CZ 4.46Å; M144-F160 HydrophobicContact CG-CE2 3.42Å; M144-F160 VanDerWaalsContact CG-CE2 3.42Å; M144-F160 HydrophobicContact CG-CZ 3.41Å; M144-F160 VanDerWaalsContact CG-CZ 3.41Å
145D82.6Confident82.6Confident41 Ų4189.1 Ų89.122%0.21951%0.509CS..THydrogen-bonded Turntrans-91.21.2177-89.4-29.5000114.8K141 Y142 Y143 R147 K165K141-D145 PolarHBondContact O-N 3.48Å; Y142-D145 PolarHBondContact O-N 2.9Å; Y143-D145 PolarHBondContact O-N 3.41Å; D145-R147 VanDerWaalsContact C-N 3.28Å; D145-R147 HydrophobicContact CB-CG 4.42Å; D145-R147 PolarHBondContact O-N 2.95Å; D145-R147 IonicContact OD2-CZ 3.68Å; D145-R147 IonicContact OD2-NE 3.86Å; D145-R147 IonicContact OD2-NH2 2.72Å; D145-R147 PolarHBondContact OD2-NH2 2.78Å; D145-K165 IonicContact OD1-NZ 2.73Å; D145-K165 PolarHBondContact OD1-NZ 3.18Å
146G81.7Confident84.3Confident41 Ų4189.3 Ų89.342%0.42349%0.494SS..THydrogen-bonded Turntrans6625.4-176.500000114.7Y142 Y143Y142-G146 PolarHBondContact O-N 2.99Å; Y143-G146 PolarHBondContact O-N 3.48Å
147R84.6Confident85.9Confident171 Ų17185.8 Ų85.865%0.64547%0.466SS*.  trans-120.76-174.5-67.2-173-70.2-175-3.5114.6Y142 D145 S149Y142-R147 CarbonylContact O-C 3.39Å; Y142-R147 WeakPolarHBondContact O-CA 3.41Å; Y142-R147 PolarHBondContact O-N 2.92Å; D145-R147 VanDerWaalsContact C-N 3.28Å; D145-R147 HydrophobicContact CB-CG 4.42Å; D145-R147 PolarHBondContact O-N 2.95Å; D145-R147 IonicContact OD2-CZ 3.68Å; D145-R147 IonicContact OD2-NE 3.86Å; D145-R147 IonicContact OD2-NH2 2.72Å; D145-R147 PolarHBondContact OD2-NH2 2.78Å; R147-S149 PolarHBondContact O-N 3.45Å
148C89.5Confident87.1Confident27 Ų2782.1 Ų82.118%0.18245%0.449CS..  trans-81.2105.2-179.1-168.40000112.1C140 Y142 Y143 K150 H158C140-C148 VanDerWaalsContact SG-SG 3.62Å; Y142-C148 PolarHBondContact O-N 2.86Å; Y142-C148 VanDerWaalsContact O-N 3.11Å; Y143-C148 HydrophobicContact CD2-CB 4.47Å; C148-K150 PolarHBondContact O-N 3.49Å; C148-H158 VanDerWaalsContact SG-CE1 3.52Å; C148-H158 PolarHBondContact SG-NE2 3.47Å; C148-H158 VanDerWaalsContact SG-NE2 3.36Å
149S88.9Confident87.1Confident122 Ų12285.1 Ų85.185%0.85346%0.46SS*.THydrogen-bonded Turntrans-72.8-7.9174.354.20000114.8R147R147-S149 PolarHBondContact O-N 3.45Å
150K86.8Confident86.7Confident111 Ų11178.8 Ų78.848%0.48344%0.437SS..THydrogen-bonded Turntrans-81.8-12.9-172.7-60.4-169.1175.5-169.40115.1C148 G152 S153 C154C148-K150 PolarHBondContact O-N 3.49Å; K150-G152 PolarHBondContact O-N 3.18Å; K150-S153 WeakPolarHBondContact O-CA 3.41Å; K150-S153 PolarHBondContact O-N 3.23Å; K150-S153 PolarHBondContact O-OG 3.18Å; K150-C154 HydrophobicContact CB-CB 3.89Å
151G84.1Confident85.9Confident37 Ų3785 Ų8538%0.38148%0.475SS..G310 helixtrans50.1-133.5-175.900000112S153 C154 H158G151-S153 VanDerWaalsContact C-N 3.26Å; G151-S153 PolarHBondContact O-N 3.09Å; G151-C154 WeakPolarHBondContact O-CB 3.4Å; G151-C154 PolarHBondContact O-N 3.35Å; G151-H158 PolarHBondContact O-CE1 3.49Å; G151-H158 PolarHBondContact O-ND1 3.21Å
152G84.2Confident85Confident91 Ų9180 Ų8094%0.93846%0.458SS*.G310 helixtrans-69.1-12.8175.100000115.6K150 C154K150-G152 PolarHBondContact O-N 3.18Å; G152-C154 PolarHBondContact O-N 2.87Å
153S86.8Confident84.1Confident97 Ų9777.2 Ų77.268%0.67847%0.466SS*.G310 helixtrans-8616.8175.772.60000113.5K150 G151K150-S153 WeakPolarHBondContact O-CA 3.41Å; K150-S153 PolarHBondContact O-N 3.23Å; K150-S153 PolarHBondContact O-OG 3.18Å; G151-S153 VanDerWaalsContact C-N 3.26Å; G151-S153 PolarHBondContact O-N 3.09Å
154C90.9Very high83.4Confident21 Ų2177.5 Ų77.514%0.14247%0.468CS..  trans-79.8131.8177.8-162.20000111.1K150 G151 G152 F156 H158K150-C154 HydrophobicContact CB-CB 3.89Å; G151-C154 WeakPolarHBondContact O-CB 3.4Å; G151-C154 PolarHBondContact O-N 3.35Å; G152-C154 PolarHBondContact O-N 2.87Å; C154-F156 PolarHBondContact O-N 3.3Å; C154-H158 VanDerWaalsContact CB-NE2 3.32Å; C154-H158 WeakPolarHBondContact CB-NE2 3.4Å; C154-H158 PolarHBondContact SG-NE2 3.08Å; C154-H158 VanDerWaalsContact SG-NE2 3.38Å
155P89.8Confident82.9Confident89 Ų8976.6 Ų76.658%0.57846%0.461SS*.SBendtrans-74.414.2174.633-37.3000113.7
156F89.7Confident82.9Confident88 Ų8878.7 Ų78.739%0.38647%0.473SS..SBendtrans-135.5140.5-176-63-68.1000108.4S138 C140 C154 H158S138-F156 WeakPolarHBondContact O-CA 3.38Å; S138-F156 WeakPolarHBondContact O-CB 3.29Å; S138-F156 WeakPolarHBondContact OG-CD1 3.12Å; C140-F156 HydrophobicContact CB-CB 3.56Å; C154-F156 PolarHBondContact O-N 3.3Å; F156-H158 PolarHBondContact O-CD2 3.02Å
157L88.3Confident83Confident42 Ų4280 Ų8022%0.2247%0.468CS..BIsolated β-bridgetrans-59.8143.7-174.4-73.6-174.3000112.8Q137 S138 C140 F160Q137-L157 HydrophobicContact CB-CD1 4.01Å; Q137-L157 HydrophobicContact CB-CD2 4.35Å; Q137-L157 HydrophobicContact CB-CG 3.84Å; Q137-L157 HydrophobicContact CG-CD1 4.39Å; Q137-L157 HydrophobicContact CG-CD2 3.83Å; Q137-L157 HydrophobicContact CG-CG 3.71Å; Q137-L157 VanDerWaalsContact NE2-CD2 3.32Å; Q137-L157 WeakPolarHBondContact O-CD1 3.33Å; Q137-L157 WeakPolarHBondContact O-CG 3.38Å; S138-L157 PolarHBondContact O-N 3.34Å; S138-L157 VanDerWaalsContact O-N 3.13Å; C140-L157 WeakPolarHBondContact CB-O 3.46Å; C140-L157 PolarHBondContact N-O 3.27Å; L157-F160 WeakPolarHBondContact O-CE1 3.47Å
158H90.1Very high83.2Confident35 Ų3572.3 Ų72.316%0.16244%0.439CS..  trans-114.113171.6-77.1-159.5000111.2C140 Y143 C148 G151 C154 F156 F160C140-H158 WeakPolarHBondContact CB-CD2 3.09Å; C140-H158 PolarHBondContact SG-NE2 3.41Å; Y143-H158 HydrophobicContact CD1-CB 3.8Å; Y143-H158 AromaticContact CD1-CD2 3.98Å; Y143-H158 AromaticContact CD1-CG 3.72Å; Y143-H158 AromaticContact CD2-CE1 3.75Å; Y143-H158 AromaticContact CD2-CG 3.94Å; Y143-H158 AromaticContact CD2-ND1 3.57Å; Y143-H158 HydrophobicContact CE1-CB 3.7Å; Y143-H158 WeakPolarHBondContact CE1-O 3.39Å; Y143-H158 HydrophobicContact CE2-CB 4.49Å; Y143-H158 AromaticContact CE2-ND1 3.84Å; Y143-H158 HydrophobicContact CG-CB 4.26Å; Y143-H158 AromaticContact CG-CD2 3.76Å; Y143-H158 AromaticContact CG-CE1 3.92Å; Y143-H158 AromaticContact CG-CG 3.68Å; Y143-H158 AromaticContact CG-ND1 3.78Å; Y143-H158 AromaticContact CG-NE2 3.9Å; C148-H158 VanDerWaalsContact SG-CE1 3.52Å; C148-H158 PolarHBondContact SG-NE2 3.47Å; C148-H158 VanDerWaalsContact SG-NE2 3.36Å; G151-H158 PolarHBondContact O-CE1 3.49Å; G151-H158 PolarHBondContact O-ND1 3.21Å; C154-H158 VanDerWaalsContact CB-NE2 3.32Å; C154-H158 WeakPolarHBondContact CB-NE2 3.4Å; C154-H158 PolarHBondContact SG-NE2 3.08Å; C154-H158 VanDerWaalsContact SG-NE2 3.38Å; F156-H158 PolarHBondContact O-CD2 3.02Å; H158-F160 PolarHBondContact O-N 2.87Å
159D81.9Confident83.2Confident131 Ų13171.1 Ų71.170%0.70143%0.432SS*.  trans-81.238.7-167.3-50.217000112.7
160F79.7Confident83.2Confident41 Ų4171.3 Ų71.318%0.1842%0.417CS..SBendtrans-151.8138.5-179.859.8-87.3000109.4R139 Y143 M144 L157 H158R139-F160 HydrophobicContact CB-CD1 4.14Å; R139-F160 HydrophobicContact CB-CE1 3.47Å; R139-F160 VanDerWaalsContact CB-CE1 3.47Å; R139-F160 HydrophobicContact CB-CZ 3.99Å; R139-F160 HydrophobicContact CG-CD1 3.72Å; R139-F160 HydrophobicContact CG-CE1 3.59Å; R139-F160 HydrophobicContact CG-CZ 4.45Å; Y143-F160 HydrophobicContact CD1-CE1 4.07Å; Y143-F160 AromaticContact CD1-CE2 3.82Å; Y143-F160 HydrophobicContact CD1-CE2 3.82Å; Y143-F160 AromaticContact CD1-CZ 3.58Å; Y143-F160 HydrophobicContact CD1-CZ 3.58Å; Y143-F160 HydrophobicContact CE1-CE2 4.32Å; Y143-F160 HydrophobicContact CE1-CZ 4.37Å; Y143-F160 VanDerWaalsContact CE1-O 3.29Å; Y143-F160 WeakPolarHBondContact CE1-O 3.33Å; Y143-F160 HydrophobicContact CG-CZ 4.5Å; M144-F160 HydrophobicContact CB-CE2 4.24Å; M144-F160 HydrophobicContact CB-CZ 4.46Å; M144-F160 HydrophobicContact CG-CE2 3.42Å; M144-F160 VanDerWaalsContact CG-CE2 3.42Å; M144-F160 HydrophobicContact CG-CZ 3.41Å; M144-F160 VanDerWaalsContact CG-CZ 3.41Å; L157-F160 WeakPolarHBondContact O-CE1 3.47Å; H158-F160 PolarHBondContact O-N 2.87Å
161T73.3Confident83.4Confident131 Ų13172.2 Ų72.280%0.80442%0.421SS*.  trans-67.4126.8164.3430000108.5A163T161-A163 PolarHBondContact O-N 3.37Å; T161-A163 VanDerWaalsContact O-N 3.1Å
162P69.4Low83.8Confident47 Ų4773.5 Ų73.531%0.30542%0.415SS..  trans-65.4115.4174.626.4-32.6000108.3K164P162-K164 PolarHBondContact O-N 2.77Å
163A70.6Confident84Confident88 Ų8870.6 Ų70.673%0.72738%0.382SS*.PPolyproline II helixtrans-56.4127.4178.600000109.8T161 K165T161-A163 PolarHBondContact O-N 3.37Å; T161-A163 VanDerWaalsContact O-N 3.1Å; A163-K165 PolarHBondContact O-N 3.2Å
164K74Confident84Confident79 Ų7969.4 Ų69.434%0.34337%0.371SS..PPolyproline II helixtrans-54.5132.4174.7-60.6-173-169.4-179.10108.3P162 N166 L186 E189P162-K164 PolarHBondContact O-N 2.77Å; K164-N166 PolarHBondContact O-OD1 3.28Å; K164-L186 HydrophobicContact CB-CD2 4.24Å; K164-L186 HydrophobicContact CD-CD2 4.03Å; K164-E189 IonicContact NZ-OE1 2.65Å; K164-E189 PolarHBondContact NZ-OE1 2.98Å; K164-E189 IonicContact NZ-OE2 2.75Å; K164-E189 PolarHBondContact NZ-OE2 3.48Å
165K74.9Confident83.9Confident78 Ų7871.2 Ų71.234%0.33939%0.393SS..EExtended strand (participates in β ladder)trans-67137.9175.8-64.2172.9-178.9178.10107.7D145 A163 E167 S184 F185D145-K165 IonicContact OD1-NZ 2.73Å; D145-K165 PolarHBondContact OD1-NZ 3.18Å; A163-K165 PolarHBondContact O-N 3.2Å; K165-E167 PolarHBondContact O-N 3.23Å; K165-S184 VanDerWaalsContact CB-O 3.23Å; K165-S184 WeakPolarHBondContact CB-O 3.41Å; K165-S184 WeakPolarHBondContact CG-O 3.36Å; K165-S184 PolarHBondContact N-O 3.48Å; K165-F185 HydrophobicContact CB-CD1 4.07Å; K165-F185 HydrophobicContact CB-CE1 4.26Å; K165-F185 HydrophobicContact CD-CE1 4.23Å; K165-F185 HydrophobicContact CD-CZ 4.37Å
166N81.1Confident83.8Confident85 Ų8573.7 Ų73.746%0.45540%0.399SS..EExtended strand (participates in β ladder)trans-7848.7-169.4-59.5-19.3000111.8K164 F217 L221K164-N166 PolarHBondContact O-OD1 3.28Å; N166-F217 HydrophobicContact CB-CE2 4.24Å; N166-F217 HydrophobicContact CB-CZ 4.09Å; N166-F217 WeakPolarHBondContact OD1-CZ 3.1Å; N166-L221 HydrophobicContact CB-CD2 4.09Å; N166-L221 WeakPolarHBondContact O-CD2 3.3Å
167E85.2Confident83.9Confident69 Ų6970.4 Ų70.432%0.32239%0.386SS..EExtended strand (participates in β ladder)trans-144.8144.1-171.1-71.8173.8-15900108K165 F185 L186 F265 Q267K165-E167 PolarHBondContact O-N 3.23Å; E167-F185 HydrophobicContact CB-CD1 4.03Å; E167-F185 HydrophobicContact CB-CE1 4.37Å; E167-L186 PolarHBondContact O-N 2.8Å; E167-F265 HydrophobicContact CB-CD2 4.46Å; E167-Q267 PolarHBondContact OE2-NE2 2.92Å
168L87.9Confident84Confident9 Ų974.1 Ų74.15%0.04742%0.415CS..EExtended strand (participates in β ladder)trans-66.9140.7174.3-175.376.1000110.5K170 Y172 A173 F190 F209 Y263L168-K170 PolarHBondContact O-N 3.49Å; L168-Y172 HydrophobicContact CD1-CD1 4.23Å; L168-A173 HydrophobicContact CD2-CB 3.79Å; L168-F190 HydrophobicContact CB-CD1 4.31Å; L168-F190 HydrophobicContact CB-CD2 3.88Å; L168-F190 HydrophobicContact CB-CE1 4.24Å; L168-F190 HydrophobicContact CB-CE2 3.82Å; L168-F190 HydrophobicContact CB-CG 4.12Å; L168-F190 HydrophobicContact CB-CZ 3.99Å; L168-F190 HydrophobicContact CD1-CB 3.59Å; L168-F190 HydrophobicContact CD1-CD1 3.92Å; L168-F190 HydrophobicContact CD1-CD2 4.15Å; L168-F190 HydrophobicContact CD1-CG 3.64Å; L168-F190 HydrophobicContact CG-CG 4.43Å; L168-F209 HydrophobicContact CD1-CD1 4.22Å; L168-F209 HydrophobicContact CD1-CE1 3.77Å; L168-F209 HydrophobicContact CD2-CE1 3.62Å; L168-F209 HydrophobicContact CD2-CZ 4.18Å; L168-F209 HydrophobicContact CG-CE1 4.37Å; L168-Y263 HydrophobicContact CD2-CD1 4.34Å; L168-Y263 HydrophobicContact CD2-CG 3.99Å
169C90.5Very high83.7Confident3 Ų378 Ų782%0.0243%0.432CS..  trans-69.1116170.6-171.20000111.4F171 Y172 A173 F185 L186 H187C169-F171 PolarHBondContact O-N 3Å; C169-F171 VanDerWaalsContact O-N 3.09Å; C169-Y172 PolarHBondContact O-N 3.14Å; C169-A173 PolarHBondContact O-N 3.25Å; C169-F185 HydrophobicContact CB-CB 3.59Å; C169-F185 HydrophobicContact CB-CG 4.43Å; C169-L186 PolarHBondContact N-O 3.25Å; C169-H187 VanDerWaalsContact CB-CD2 3.4Å; C169-H187 WeakPolarHBondContact CB-CD2 3.39Å; C169-H187 VanDerWaalsContact CB-NE2 3.34Å; C169-H187 WeakPolarHBondContact CB-NE2 3.46Å
170K88.6Confident83.5Confident125 Ų12579 Ų7954%0.54343%0.432SS..Hα-helixtrans-50.9-31.4173.8172.3158.1-178.21640113.8L168 V174 R264L168-K170 PolarHBondContact O-N 3.49Å; K170-V174 WeakPolarHBondContact O-CG2 3.21Å; K170-R264 HydrophobicContact CD-CB 4.47Å; K170-R264 HydrophobicContact CD-CG 3.85Å; K170-R264 HydrophobicContact CG-CG 3.89Å
171F90.4Very high83.6Confident131 Ų13182.5 Ų82.558%0.57546%0.462SS*.Hα-helixtrans-80.4-32.8176.1-60.7-77.1000112.8C169 V174 G175 M176 C177C169-F171 PolarHBondContact O-N 3Å; C169-F171 VanDerWaalsContact O-N 3.09Å; F171-V174 PolarHBondContact O-N 3.1Å; F171-G175 PolarHBondContact O-N 2.76Å; F171-M176 PolarHBondContact O-N 3.2Å; F171-C177 HydrophobicContact CB-CB 3.72Å
172Y92.1Very high84Confident63 Ų6380 Ų8025%0.24746%0.455CS..Hα-helixtrans-71.6-37.4178.2178.1-97000111.9L168 C169 V174 G175 H187 G188 K208L168-Y172 HydrophobicContact CD1-CD1 4.23Å; C169-Y172 PolarHBondContact O-N 3.14Å; Y172-V174 PolarHBondContact O-N 2.84Å; Y172-V174 VanDerWaalsContact O-N 3.16Å; Y172-G175 PolarHBondContact O-N 3.28Å; Y172-H187 WeakPolarHBondContact CB-CD2 3.33Å; Y172-H187 HydrophobicContact CD1-CB 4.19Å; Y172-H187 HydrophobicContact CD2-CB 3.72Å; Y172-H187 AromaticContact CD2-CD2 3.79Å; Y172-H187 AromaticContact CD2-CG 3.49Å; Y172-H187 VanDerWaalsContact CD2-CG 3.49Å; Y172-H187 AromaticContact CD2-ND1 3.79Å; Y172-H187 HydrophobicContact CE1-CB 4.24Å; Y172-H187 HydrophobicContact CE2-CB 3.78Å; Y172-H187 HydrophobicContact CG-CB 3.94Å; Y172-H187 AromaticContact CG-CD2 3.53Å; Y172-H187 AromaticContact CG-CG 3.67Å; Y172-G188 VanDerWaalsContact CZ-N 3.34Å; Y172-G188 WeakPolarHBondContact OH-CA 3.45Å; Y172-G188 PolarHBondContact OH-N 3.47Å; Y172-K208 VanDerWaalsContact CE1-O 3.27Å; Y172-K208 WeakPolarHBondContact CE1-O 3.19Å; Y172-K208 PolarHBondContact OH-O 2.79Å
173A88.4Confident84.8Confident30 Ų3078.2 Ų78.225%0.24844%0.443CS..Hα-helixtrans-52.2-35.2171.200000112.8L168 C169L168-A173 HydrophobicContact CD2-CB 3.79Å; C169-A173 PolarHBondContact O-N 3.25Å
174V88.3Confident85.5Confident73 Ų7375 Ų7544%0.44242%0.415SS..THydrogen-bonded Turntrans-94.9-6.4179.8-170.90000112.2K170 F171 Y172 M176K170-V174 WeakPolarHBondContact O-CG2 3.21Å; F171-V174 PolarHBondContact O-N 3.1Å; Y172-V174 PolarHBondContact O-N 2.84Å; Y172-V174 VanDerWaalsContact O-N 3.16Å; V174-M176 HydrophobicContact CB-CG 4.44Å; V174-M176 HydrophobicContact CG1-CG 4.03Å; V174-M176 HydrophobicContact CG1-SD 3.89Å
175G88.2Confident86.1Confident59 Ų5974 Ų7461%0.60841%0.411SS*.THydrogen-bonded Turntrans78.612-176.100000115.8F171 Y172F171-G175 PolarHBondContact O-N 2.76Å; Y172-G175 PolarHBondContact O-N 3.28Å
176M88.1Confident86.7Confident141 Ų14170.6 Ų70.670%0.69540%0.397SS*.  trans-108.322.8-173.2-57.2-176.178.200114F171 V174 S178F171-M176 PolarHBondContact O-N 3.2Å; V174-M176 HydrophobicContact CB-CG 4.44Å; V174-M176 HydrophobicContact CG1-CG 4.03Å; V174-M176 HydrophobicContact CG1-SD 3.89Å; M176-S178 PolarHBondContact O-N 3.32Å
177C91.5Very high87.1Confident18 Ų1867.8 Ų67.812%0.12238%0.381CS..  trans-89.592.4-173.4-163.90000113.7F171 K179 E180 H187F171-C177 HydrophobicContact CB-CB 3.72Å; C177-K179 PolarHBondContact O-N 2.93Å; C177-E180 PolarHBondContact O-N 2.89Å; C177-H187 PolarHBondContact SG-CE1 3.11Å; C177-H187 PolarHBondContact SG-NE2 3.28Å
178S89.8Confident87Confident120 Ų12065.7 Ų65.784%0.83938%0.378SS*.THydrogen-bonded Turntrans-63.37.5173.959.80000116M176M176-S178 PolarHBondContact O-N 3.32Å
179K83.7Confident86.9Confident117 Ų11770.2 Ų70.251%0.50940%0.399SS..THydrogen-bonded Turntrans-106.6-12179.1-68.2-174.6172.4-67.10114.3C177 S181 A182 C183C177-K179 PolarHBondContact O-N 2.93Å; K179-S181 PolarHBondContact O-N 2.92Å; K179-A182 CarbonylContact O-C 3.59Å; K179-A182 WeakPolarHBondContact O-CA 3.43Å; K179-A182 PolarHBondContact O-N 3.05Å; K179-C183 HydrophobicContact CB-CB 3.78Å; K179-C183 PolarHBondContact O-N 3.31Å; K179-C183 VanDerWaalsContact O-N 3.14Å
180E78Confident86.9Confident151 Ų15170.1 Ų70.171%0.70640%0.398SS*.G310 helixtrans34.4-102.1173.7-64.3179.6-163.300115.1C177 H187C177-E180 PolarHBondContact O-N 2.89Å; E180-H187 PolarHBondContact O-CE1 3.29Å; E180-H187 PolarHBondContact O-ND1 3.38Å
181S80.9Confident86.9Confident116 Ų11664.3 Ų64.381%0.81137%0.373SS*.G310 helixtrans-79.5-28.2-179.656.80000114.5K179 C183K179-S181 PolarHBondContact O-N 2.92Å; S181-C183 VanDerWaalsContact C-N 3.28Å; S181-C183 PolarHBondContact O-N 3.29Å
182A82.2Confident86.9Confident79 Ų7958.1 Ų58.165%0.65335%0.346SS*.G310 helixtrans-88.913.8178.200000113.2K179K179-A182 CarbonylContact O-C 3.59Å; K179-A182 WeakPolarHBondContact O-CA 3.43Å; K179-A182 PolarHBondContact O-N 3.05Å
183C86.8Confident86.8Confident9 Ų957 Ų576%0.06134%0.342CS..  trans-75.8131.1178.1-165.50000111.5K179 S181 F185 H187K179-C183 HydrophobicContact CB-CB 3.78Å; K179-C183 PolarHBondContact O-N 3.31Å; K179-C183 VanDerWaalsContact O-N 3.14Å; S181-C183 VanDerWaalsContact C-N 3.28Å; S181-C183 PolarHBondContact O-N 3.29Å; C183-F185 PolarHBondContact O-N 2.72Å; C183-H187 WeakPolarHBondContact CB-CE1 3.23Å; C183-H187 WeakPolarHBondContact CB-NE2 3.35Å; C183-H187 PolarHBondContact SG-NE2 2.73Å
184S85.6Confident86.8Confident20 Ų2056.7 Ų56.714%0.1434%0.335CS..SBendtrans-75.413.5177-43.90000114K165K165-S184 VanDerWaalsContact CB-O 3.23Å; K165-S184 WeakPolarHBondContact CB-O 3.41Å; K165-S184 WeakPolarHBondContact CG-O 3.36Å; K165-S184 PolarHBondContact N-O 3.48Å
185F87.1Confident86.9Confident57 Ų5756.4 Ų56.425%0.2533%0.328CS..EExtended strand (participates in β ladder)trans-137.7160.4-175-67.7-81.9000109.5K165 E167 C169 C183K165-F185 HydrophobicContact CB-CD1 4.07Å; K165-F185 HydrophobicContact CB-CE1 4.26Å; K165-F185 HydrophobicContact CD-CE1 4.23Å; K165-F185 HydrophobicContact CD-CZ 4.37Å; E167-F185 HydrophobicContact CB-CD1 4.03Å; E167-F185 HydrophobicContact CB-CE1 4.37Å; C169-F185 HydrophobicContact CB-CB 3.59Å; C169-F185 HydrophobicContact CB-CG 4.43Å; C183-F185 PolarHBondContact O-N 2.72Å
186L87.3Confident86.9Confident7 Ų755.3 Ų55.34%0.03731%0.307CS..EExtended strand (participates in β ladder)trans-72.3133.9-176.1-64.6168.3000112.2K164 E167 C169 E189 F190 F217 L221K164-L186 HydrophobicContact CB-CD2 4.24Å; K164-L186 HydrophobicContact CD-CD2 4.03Å; E167-L186 PolarHBondContact O-N 2.8Å; C169-L186 PolarHBondContact N-O 3.25Å; L186-E189 HydrophobicContact CD2-CB 4.44Å; L186-E189 WeakPolarHBondContact CD2-OE2 3.22Å; L186-F190 HydrophobicContact CB-CB 4.38Å; L186-F190 HydrophobicContact CB-CD2 4.23Å; L186-F190 HydrophobicContact CD1-CD2 3.93Å; L186-F217 HydrophobicContact CD1-CE1 4.49Å; L186-L221 HydrophobicContact CD1-CD1 3.61Å
187H88.1Confident86.8Confident27 Ų2753 Ų5313%0.12530%0.297CS..SBendtrans-125.9138170.2-66.6179.3000107.7C169 Y172 C177 E180 C183 E189C169-H187 VanDerWaalsContact CB-CD2 3.4Å; C169-H187 WeakPolarHBondContact CB-CD2 3.39Å; C169-H187 VanDerWaalsContact CB-NE2 3.34Å; C169-H187 WeakPolarHBondContact CB-NE2 3.46Å; Y172-H187 WeakPolarHBondContact CB-CD2 3.33Å; Y172-H187 HydrophobicContact CD1-CB 4.19Å; Y172-H187 HydrophobicContact CD2-CB 3.72Å; Y172-H187 AromaticContact CD2-CD2 3.79Å; Y172-H187 AromaticContact CD2-CG 3.49Å; Y172-H187 VanDerWaalsContact CD2-CG 3.49Å; Y172-H187 AromaticContact CD2-ND1 3.79Å; Y172-H187 HydrophobicContact CE1-CB 4.24Å; Y172-H187 HydrophobicContact CE2-CB 3.78Å; Y172-H187 HydrophobicContact CG-CB 3.94Å; Y172-H187 AromaticContact CG-CD2 3.53Å; Y172-H187 AromaticContact CG-CG 3.67Å; C177-H187 PolarHBondContact SG-CE1 3.11Å; C177-H187 PolarHBondContact SG-NE2 3.28Å; E180-H187 PolarHBondContact O-CE1 3.29Å; E180-H187 PolarHBondContact O-ND1 3.38Å; C183-H187 WeakPolarHBondContact CB-CE1 3.23Å; C183-H187 WeakPolarHBondContact CB-NE2 3.35Å; C183-H187 PolarHBondContact SG-NE2 2.73Å; H187-E189 PolarHBondContact O-N 2.85Å
188G84.3Confident86.5Confident25 Ų2555.3 Ų55.326%0.25831%0.311SS..EExtended strand (participates in β ladder)trans67.4-59.1174.500000114.8Y172 F190 S210Y172-G188 VanDerWaalsContact CZ-N 3.34Å; Y172-G188 WeakPolarHBondContact OH-CA 3.45Å; Y172-G188 PolarHBondContact OH-N 3.47Å; G188-F190 PolarHBondContact O-N 3.22Å; G188-S210 VanDerWaalsContact O-CB 3.32Å; G188-S210 WeakPolarHBondContact O-CB 3.16Å; G188-S210 PolarHBondContact O-N 3.11Å
189E86.2Confident86.1Confident104 Ų10455.4 Ų55.449%0.48630%0.302SS..EExtended strand (participates in β ladder)trans-52-16176-64.9160.6-175.500114.9K164 L186 H187K164-E189 IonicContact NZ-OE1 2.65Å; K164-E189 PolarHBondContact NZ-OE1 2.98Å; K164-E189 IonicContact NZ-OE2 2.75Å; K164-E189 PolarHBondContact NZ-OE2 3.48Å; L186-E189 HydrophobicContact CD2-CB 4.44Å; L186-E189 WeakPolarHBondContact CD2-OE2 3.22Å; H187-E189 PolarHBondContact O-N 2.85Å
190F88.8Confident86.1Confident0 Ų055.4 Ų55.40%031%0.308CS..EExtended strand (participates in β ladder)trans-76.8129.4-178.6-164.5-92.3000110.6L168 L186 G188 F209 S210 L221 I225 Y263 F265L168-F190 HydrophobicContact CB-CD1 4.31Å; L168-F190 HydrophobicContact CB-CD2 3.88Å; L168-F190 HydrophobicContact CB-CE1 4.24Å; L168-F190 HydrophobicContact CB-CE2 3.82Å; L168-F190 HydrophobicContact CB-CG 4.12Å; L168-F190 HydrophobicContact CB-CZ 3.99Å; L168-F190 HydrophobicContact CD1-CB 3.59Å; L168-F190 HydrophobicContact CD1-CD1 3.92Å; L168-F190 HydrophobicContact CD1-CD2 4.15Å; L168-F190 HydrophobicContact CD1-CG 3.64Å; L168-F190 HydrophobicContact CG-CG 4.43Å; L186-F190 HydrophobicContact CB-CB 4.38Å; L186-F190 HydrophobicContact CB-CD2 4.23Å; L186-F190 HydrophobicContact CD1-CD2 3.93Å; G188-F190 PolarHBondContact O-N 3.22Å; F190-F209 HydrophobicContact CD1-CD1 4.21Å; F190-F209 CarbonylContact O-C 3.59Å; F190-S210 PolarHBondContact O-N 2.97Å; F190-L221 HydrophobicContact CD2-CD1 4.11Å; F190-L221 HydrophobicContact CE2-CB 4.44Å; F190-L221 HydrophobicContact CE2-CD1 4.25Å; F190-I225 HydrophobicContact CE1-CD1 3.53Å; F190-I225 HydrophobicContact CZ-CD1 3.5Å; F190-I225 HydrophobicContact CZ-CG1 4.2Å; F190-Y263 AromaticContact CE1-CD1 3.89Å; F190-Y263 HydrophobicContact CE1-CD1 3.89Å; F190-Y263 HydrophobicContact CE1-CE1 4.19Å; F190-F265 HydrophobicContact CE2-CE2 4.13Å; F190-F265 AromaticContact CZ-CE2 3.88Å; F190-F265 HydrophobicContact CZ-CE2 3.88Å; F190-F265 HydrophobicContact CZ-CZ 4.16Å
191P90Very high86.7Confident3 Ų349.1 Ų49.12%0.01928%0.28CS..EExtended strand (participates in β ladder)trans-66.9136-17227.4-35.8000112.4K193 L214 T218 L221 L222P191-K193 PolarHBondContact O-N 3.08Å; P191-L214 HydrophobicContact CB-CD2 3.83Å; P191-L214 HydrophobicContact CG-CD2 4.43Å; P191-T218 HydrophobicContact CG-CG2 4.37Å; P191-L221 HydrophobicContact CG-CB 4.36Å; P191-L222 HydrophobicContact CG-CB 4.3Å
192C90.5Very high86.9Confident1 Ų149.7 Ų49.71%0.00727%0.27CS..PPolyproline II helixtrans-69.2121.4175.8-179.80000111.1F194 F195 H196 F209 S210 H211C192-F194 VanDerWaalsContact C-N 3.34Å; C192-F194 PolarHBondContact O-N 2.83Å; C192-F195 HydrophobicContact CB-CB 3.85Å; C192-H196 PolarHBondContact O-CD2 2.65Å; C192-H196 PolarHBondContact O-N 2.75Å; C192-F209 HydrophobicContact CB-CB 3.67Å; C192-S210 WeakPolarHBondContact CB-O 3.47Å; C192-S210 PolarHBondContact N-O 3.07Å; C192-H211 WeakPolarHBondContact CB-CD2 3.34Å; C192-H211 WeakPolarHBondContact CB-NE2 2.97Å; C192-H211 PolarHBondContact SG-NE2 2.97Å; C192-H211 VanDerWaalsContact SG-NE2 3.4Å
193K89Confident87Confident39 Ų3951 Ų5117%0.1726%0.262CS..Hα-helixtrans-59.4-43.9179.5-174.9-174.5178.7-171.50112P191 L197 L222 V261 Y263P191-K193 PolarHBondContact O-N 3.08Å; K193-L197 HydrophobicContact CD-CD1 4.42Å; K193-L197 HydrophobicContact CG-CD1 3.64Å; K193-L197 HydrophobicContact CG-CG 4.33Å; K193-L197 VanDerWaalsContact O-CB 3.29Å; K193-L197 WeakPolarHBondContact O-CB 3.4Å; K193-L197 WeakPolarHBondContact O-CG 3.34Å; K193-L197 PolarHBondContact O-N 3.16Å; K193-L222 HydrophobicContact CB-CD1 4.1Å; K193-L222 HydrophobicContact CG-CD1 4.06Å; K193-V261 HydrophobicContact CD-CG1 3.74Å; K193-V261 HydrophobicContact CD-CG2 4.32Å; K193-Y263 HydrophobicContact CB-CE1 4.13Å; K193-Y263 WeakPolarHBondContact CB-OH 3.44Å; K193-Y263 PolarHBondContact N-OH 3.49Å
194F88.6Confident86.9Confident24 Ų2452.6 Ų52.611%0.10528%0.28CS..Hα-helixtrans-69.6-49.2-176.9-60-68.5000111.9C192 H196 L197 T198 N199 D200 C201 H258 V261C192-F194 VanDerWaalsContact C-N 3.34Å; C192-F194 PolarHBondContact O-N 2.83Å; F194-H196 PolarHBondContact O-N 3.2Å; F194-H196 VanDerWaalsContact O-N 3.13Å; F194-L197 PolarHBondContact O-N 2.78Å; F194-T198 WeakPolarHBondContact O-CA 3.44Å; F194-T198 VanDerWaalsContact O-CB 3.28Å; F194-T198 WeakPolarHBondContact O-CB 3.27Å; F194-T198 PolarHBondContact O-N 3.05Å; F194-N199 PolarHBondContact O-N 3.11Å; F194-N199 VanDerWaalsContact O-N 3.16Å; F194-D200 CarbonylContact C-O 3.46Å; F194-D200 WeakPolarHBondContact CB-O 3.21Å; F194-C201 HydrophobicContact CB-CB 4.33Å; F194-H258 AromaticContact CD1-ND1 3.58Å; F194-H258 AromaticContact CE1-CE1 3.93Å; F194-H258 AromaticContact CE1-ND1 3.19Å; F194-H258 WeakPolarHBondContact CE1-ND1 3.46Å; F194-H258 AromaticContact CZ-ND1 3.8Å; F194-V261 HydrophobicContact CE1-CG2 4.05Å; F194-V261 HydrophobicContact CE2-CG2 4.14Å; F194-V261 HydrophobicContact CZ-CB 4.3Å; F194-V261 HydrophobicContact CZ-CG2 3.44Å; F194-V261 VanDerWaalsContact CZ-CG2 3.44Å
195F90.4Very high86.9Confident68 Ų6857 Ų5730%0.29831%0.311SS..Hα-helixtrans-60.5-26178.3-174.6-104.2000113.7C192 N199 C201 H211C192-F195 HydrophobicContact CB-CB 3.85Å; F195-N199 WeakPolarHBondContact CD2-O 3.32Å; F195-N199 VanDerWaalsContact O-CA 3.29Å; F195-N199 WeakPolarHBondContact O-CA 3.24Å; F195-C201 HydrophobicContact CB-CB 4.07Å; F195-H211 VanDerWaalsContact CB-CD2 3.42Å; F195-H211 WeakPolarHBondContact CB-CD2 3.2Å; F195-H211 HydrophobicContact CD1-CB 3.71Å; F195-H211 AromaticContact CD1-CD2 3.93Å; F195-H211 AromaticContact CD1-CG 3.9Å; F195-H211 HydrophobicContact CD2-CB 4.28Å; F195-H211 AromaticContact CD2-CG 3.92Å; F195-H211 HydrophobicContact CE1-CB 3.76Å; F195-H211 WeakPolarHBondContact CE1-O 3.4Å; F195-H211 HydrophobicContact CE2-CB 4.31Å; F195-H211 HydrophobicContact CG-CB 3.99Å; F195-H211 AromaticContact CG-CD2 3.56Å; F195-H211 AromaticContact CG-CG 3.67Å; F195-H211 HydrophobicContact CZ-CB 4.07Å
196H87.9Confident86.8Confident36 Ų3660.5 Ų60.517%0.16733%0.332CS..Hα-helixtrans-103.8-14.4-179-67.3-49.3000115.8C192 F194 A212 L214 L222C192-H196 PolarHBondContact O-CD2 2.65Å; C192-H196 PolarHBondContact O-N 2.75Å; F194-H196 PolarHBondContact O-N 3.2Å; F194-H196 VanDerWaalsContact O-N 3.13Å; H196-A212 PolarHBondContact CE1-O 2.94Å; H196-A212 VanDerWaalsContact CE1-O 3.3Å; H196-A212 PolarHBondContact NE2-O 3.06Å; H196-L214 HydrophobicContact CB-CD1 3.96Å; H196-L214 HydrophobicContact CB-CG 4.46Å; H196-L222 HydrophobicContact CB-CD2 3.58Å
197L87.1Confident86.9Confident92 Ų9261.2 Ų61.248%0.48234%0.337SS..Hα-helixtrans-108-26.9174.7-60.7-176.2000113.3K193 F194 L222K193-L197 HydrophobicContact CD-CD1 4.42Å; K193-L197 HydrophobicContact CG-CD1 3.64Å; K193-L197 HydrophobicContact CG-CG 4.33Å; K193-L197 VanDerWaalsContact O-CB 3.29Å; K193-L197 WeakPolarHBondContact O-CB 3.4Å; K193-L197 WeakPolarHBondContact O-CG 3.34Å; K193-L197 PolarHBondContact O-N 3.16Å; F194-L197 PolarHBondContact O-N 2.78Å; L197-L222 HydrophobicContact CD2-CD2 4.17Å; L197-L222 HydrophobicContact CG-CD2 4.39Å
198T83.9Confident86.9Confident66 Ų6665.4 Ų65.441%0.40536%0.355SS..THydrogen-bonded Turntrans-114.1-18.4-177.3-46.90000111.7F194 D200F194-T198 WeakPolarHBondContact O-CA 3.44Å; F194-T198 VanDerWaalsContact O-CB 3.28Å; F194-T198 WeakPolarHBondContact O-CB 3.27Å; F194-T198 PolarHBondContact O-N 3.05Å; T198-D200 HydrophobicContact CG2-CB 4.29Å; T198-D200 PolarHBondContact O-N 3.31Å
199N81.3Confident87.2Confident122 Ų12265.2 Ų65.265%0.65235%0.347SS*.SBendtrans65.8-31.6-166.1-55.2-68.8000114.1F194 F195F194-N199 PolarHBondContact O-N 3.11Å; F194-N199 VanDerWaalsContact O-N 3.16Å; F195-N199 WeakPolarHBondContact CD2-O 3.32Å; F195-N199 VanDerWaalsContact O-CA 3.29Å; F195-N199 WeakPolarHBondContact O-CA 3.24Å
200D85Confident87.4Confident118 Ų11861.8 Ų61.863%0.63133%0.334SS*.  trans-83.2126.9171.4-57.1-47.4000111.7F194 T198F194-D200 CarbonylContact C-O 3.46Å; F194-D200 WeakPolarHBondContact CB-O 3.21Å; T198-D200 HydrophobicContact CG2-CB 4.29Å; T198-D200 PolarHBondContact O-N 3.31Å
201C90.2Very high87.5Confident19 Ų1964.3 Ų64.313%0.12835%0.346CS..  trans-124.3117.7169.1-176.40000110.9F194 F195 H203 G204 H211F194-C201 HydrophobicContact CB-CB 4.33Å; F195-C201 HydrophobicContact CB-CB 4.07Å; C201-H203 PolarHBondContact O-N 3Å; C201-G204 PolarHBondContact O-N 3.28Å; C201-H211 PolarHBondContact SG-NE2 2.93Å
202H85Confident87.4Confident128 Ų12866.8 Ų66.859%0.59337%0.367SS*.THydrogen-bonded Turntrans-56.4-19.4-179.3-63-70.4000115.2H258H202-H258 AromaticContact CD2-CD2 3.85Å; H202-H258 AromaticContact CD2-CE1 3.93Å; H202-H258 AromaticContact CD2-CG 3.47Å; H202-H258 VanDerWaalsContact CD2-CG 3.47Å; H202-H258 AromaticContact CD2-ND1 3.53Å; H202-H258 AromaticContact NE2-CD2 3.13Å; H202-H258 PolarHBondContact NE2-CD2 3.06Å; H202-H258 AromaticContact NE2-CE1 3.38Å; H202-H258 PolarHBondContact NE2-CE1 3.09Å; H202-H258 AromaticContact NE2-CG 3.26Å; H202-H258 VanDerWaalsContact NE2-CG 3.26Å; H202-H258 AromaticContact NE2-ND1 3.41Å; H202-H258 PolarHBondContact NE2-ND1 2.91Å; H202-H258 AromaticContact NE2-NE2 3.19Å; H202-H258 PolarHBondContact NE2-NE2 3.19Å; H202-H258 VanDerWaalsContact NE2-NE2 3.19Å
203H84.3Confident87.2Confident107 Ų10772.5 Ų72.550%0.49540%0.404SS..THydrogen-bonded Turntrans-89.1-5.2177.3-57.7130.2000114.4C201 S205 D206 C207C201-H203 PolarHBondContact O-N 3Å; H203-S205 PolarHBondContact O-N 3.23Å; H203-D206 PolarHBondContact O-N 2.78Å; H203-C207 HydrophobicContact CB-CB 3.81Å
204G85Confident87Confident41 Ų4172.6 Ų72.642%0.42341%0.406SS..G310 helixtrans55.5-122.2175.400000114C201 D206 H211C201-G204 PolarHBondContact O-N 3.28Å; G204-D206 VanDerWaalsContact C-N 3.35Å; G204-H211 PolarHBondContact O-CE1 2.89Å; G204-H211 PolarHBondContact O-ND1 2.99Å
205S84.1Confident86.9Confident113 Ų11375.3 Ų75.379%0.7943%0.425SS*.G310 helixtrans-71.2-27.1174.146.70000113.8H203 C207H203-S205 PolarHBondContact O-N 3.23Å; S205-C207 VanDerWaalsContact C-N 3.27Å; S205-C207 PolarHBondContact O-N 2.71Å
206D86.5Confident86.7Confident131 Ų13178.3 Ų78.370%0.70144%0.44SS*.G310 helixtrans-96.916.2-164.1-60.89.1000111.3H203 G204 K208H203-D206 PolarHBondContact O-N 2.78Å; G204-D206 VanDerWaalsContact C-N 3.35Å; D206-K208 PolarHBondContact O-N 3.32Å
207C89.5Confident86.6Confident21 Ų2181.3 Ų81.314%0.14245%0.453CS..  trans-63.6131.6179.1-166.50000111.3H203 S205 F209 H211H203-C207 HydrophobicContact CB-CB 3.81Å; S205-C207 VanDerWaalsContact C-N 3.27Å; S205-C207 PolarHBondContact O-N 2.71Å; C207-F209 PolarHBondContact O-N 2.95Å; C207-F209 PolarHBondContact SG-O 3.25Å; C207-H211 VanDerWaalsContact CB-CE1 3.45Å; C207-H211 WeakPolarHBondContact CB-CE1 3.47Å; C207-H211 WeakPolarHBondContact CB-NE2 3.37Å; C207-H211 PolarHBondContact SG-NE2 2.94Å
208K87.9Confident86.6Confident116 Ų11677.8 Ų77.850%0.50444%0.435SS..SBendtrans-69.4-0.3174.3-51.3-173.3-167.4-57.40113Y172 D206Y172-K208 VanDerWaalsContact CE1-O 3.27Å; Y172-K208 WeakPolarHBondContact CE1-O 3.19Å; Y172-K208 PolarHBondContact OH-O 2.79Å; D206-K208 PolarHBondContact O-N 3.32Å
209F89.6Confident86.7Confident20 Ų2080.7 Ų80.79%0.08844%0.439CS..EExtended strand (participates in β ladder)trans-129.9146.6-175.1-55.8-66.4000110.2L168 F190 C192 C207 H211 Y263L168-F209 HydrophobicContact CD1-CD1 4.22Å; L168-F209 HydrophobicContact CD1-CE1 3.77Å; L168-F209 HydrophobicContact CD2-CE1 3.62Å; L168-F209 HydrophobicContact CD2-CZ 4.18Å; L168-F209 HydrophobicContact CG-CE1 4.37Å; F190-F209 HydrophobicContact CD1-CD1 4.21Å; F190-F209 CarbonylContact O-C 3.59Å; C192-F209 HydrophobicContact CB-CB 3.67Å; C207-F209 PolarHBondContact O-N 2.95Å; C207-F209 PolarHBondContact SG-O 3.25Å; F209-H211 PolarHBondContact O-N 3.29Å; F209-Y263 HydrophobicContact CD2-CE2 4.25Å; F209-Y263 HydrophobicContact CE1-CD2 4.44Å; F209-Y263 HydrophobicContact CE1-CE2 4.47Å; F209-Y263 HydrophobicContact CE1-CG 4.45Å; F209-Y263 AromaticContact CE2-CD2 3.97Å; F209-Y263 HydrophobicContact CE2-CD2 3.97Å; F209-Y263 HydrophobicContact CE2-CE1 4.48Å; F209-Y263 AromaticContact CE2-CE2 3.43Å; F209-Y263 HydrophobicContact CE2-CE2 3.43Å; F209-Y263 VanDerWaalsContact CE2-CE2 3.43Å; F209-Y263 AromaticContact CE2-CZ 3.72Å; F209-Y263 HydrophobicContact CZ-CD1 4.39Å; F209-Y263 AromaticContact CZ-CD2 3.6Å; F209-Y263 HydrophobicContact CZ-CD2 3.6Å; F209-Y263 HydrophobicContact CZ-CE1 4.34Å; F209-Y263 AromaticContact CZ-CE2 3.56Å; F209-Y263 HydrophobicContact CZ-CE2 3.56Å; F209-Y263 HydrophobicContact CZ-CG 4.04Å; F209-Y263 AromaticContact CZ-CZ 3.94Å
210S90Very high86.9Confident32 Ų3277.1 Ų77.122%0.22442%0.423CS..EExtended strand (participates in β ladder)trans-62.1131.2-175.5-174.70000112.2G188 F190 C192 A212G188-S210 VanDerWaalsContact O-CB 3.32Å; G188-S210 WeakPolarHBondContact O-CB 3.16Å; G188-S210 PolarHBondContact O-N 3.11Å; F190-S210 PolarHBondContact O-N 2.97Å; C192-S210 WeakPolarHBondContact CB-O 3.47Å; C192-S210 PolarHBondContact N-O 3.07Å; S210-A212 VanDerWaalsContact OG-CB 3.24Å; S210-A212 WeakPolarHBondContact OG-CB 3.35Å; S210-A212 PolarHBondContact OG-N 3.14Å
211H91.1Very high87Confident53 Ų5371.6 Ų71.625%0.24539%0.393CS..  trans-98.911164.4-64.5174.1000111.8C192 F195 C201 G204 C207 F209C192-H211 WeakPolarHBondContact CB-CD2 3.34Å; C192-H211 WeakPolarHBondContact CB-NE2 2.97Å; C192-H211 PolarHBondContact SG-NE2 2.97Å; C192-H211 VanDerWaalsContact SG-NE2 3.4Å; F195-H211 VanDerWaalsContact CB-CD2 3.42Å; F195-H211 WeakPolarHBondContact CB-CD2 3.2Å; F195-H211 HydrophobicContact CD1-CB 3.71Å; F195-H211 AromaticContact CD1-CD2 3.93Å; F195-H211 AromaticContact CD1-CG 3.9Å; F195-H211 HydrophobicContact CD2-CB 4.28Å; F195-H211 AromaticContact CD2-CG 3.92Å; F195-H211 HydrophobicContact CE1-CB 3.76Å; F195-H211 WeakPolarHBondContact CE1-O 3.4Å; F195-H211 HydrophobicContact CE2-CB 4.31Å; F195-H211 HydrophobicContact CG-CB 3.99Å; F195-H211 AromaticContact CG-CD2 3.56Å; F195-H211 AromaticContact CG-CG 3.67Å; F195-H211 HydrophobicContact CZ-CB 4.07Å; C201-H211 PolarHBondContact SG-NE2 2.93Å; G204-H211 PolarHBondContact O-CE1 2.89Å; G204-H211 PolarHBondContact O-ND1 2.99Å; C207-H211 VanDerWaalsContact CB-CE1 3.45Å; C207-H211 WeakPolarHBondContact CB-CE1 3.47Å; C207-H211 WeakPolarHBondContact CB-NE2 3.37Å; C207-H211 PolarHBondContact SG-NE2 2.94Å; F209-H211 PolarHBondContact O-N 3.29Å
212A88.1Confident86.8Confident56 Ų5671.2 Ų71.246%0.46339%0.39SS..SBendtrans-67.1149.1175.300000111H196 S210 L214H196-A212 PolarHBondContact CE1-O 2.94Å; H196-A212 VanDerWaalsContact CE1-O 3.3Å; H196-A212 PolarHBondContact NE2-O 3.06Å; S210-A212 VanDerWaalsContact OG-CB 3.24Å; S210-A212 WeakPolarHBondContact OG-CB 3.35Å; S210-A212 PolarHBondContact OG-N 3.14Å; A212-L214 PolarHBondContact O-N 3.18Å
213P86.1Confident86.8Confident121 Ų12170.9 Ų70.979%0.78639%0.389SS*.  trans-53.1132.6178-27.835.5000112.8T215P213-T215 PolarHBondContact O-N 3.19Å
214L85.4Confident86.9Confident40 Ų4070.1 Ų70.121%0.20938%0.384CS..  trans-58.3108.5-177.7-75.4164.6000111.9P191 H196 A212 R219 L222P191-L214 HydrophobicContact CB-CD2 3.83Å; P191-L214 HydrophobicContact CG-CD2 4.43Å; H196-L214 HydrophobicContact CB-CD1 3.96Å; H196-L214 HydrophobicContact CB-CG 4.46Å; A212-L214 PolarHBondContact O-N 3.18Å; L214-R219 HydrophobicContact CB-CG 3.77Å; L214-R219 HydrophobicContact CD1-CG 4.27Å; L214-R219 HydrophobicContact CD2-CG 4.43Å; L214-R219 HydrophobicContact CG-CG 4.4Å; L214-R219 VanDerWaalsContact O-CZ 3.26Å; L214-R219 PolarHBondContact O-NE 3.28Å; L214-R219 PolarHBondContact O-NH2 3.25Å; L214-L222 HydrophobicContact CD1-CD2 4.49Å; L214-L222 HydrophobicContact CD2-CD2 4.39Å
215T87.6Confident86.6Confident81 Ų8169 Ų6950%0.49737%0.368SS..  trans-67157.3158.769.90000110.4P213 F217 T218 R219P213-T215 PolarHBondContact O-N 3.19Å; T215-F217 PolarHBondContact O-N 2.67Å; T215-T218 WeakPolarHBondContact CA-OG1 3.43Å; T215-T218 PolarHBondContact N-OG1 3.44Å; T215-T218 CarbonylContact O-C 3.56Å; T215-T218 WeakPolarHBondContact O-CA 3.12Å; T215-T218 PolarHBondContact O-N 3.04Å; T215-T218 PolarHBondContact O-OG1 2.87Å; T215-T218 PolarHBondContact OG1-N 3.19Å; T215-T218 PolarHBondContact OG1-OG1 2.96Å; T215-R219 WeakPolarHBondContact O-CG 3.24Å; T215-R219 PolarHBondContact O-N 2.96Å
216E86.3Confident86.4Confident131 Ų13166.2 Ų66.261%0.61235%0.349SS*.Hα-helixtrans-55.7-40179.7-166.257.5-155.700112.9T218 R219 S220E216-T218 PolarHBondContact O-N 2.81Å; E216-R219 PolarHBondContact O-N 3.36Å; E216-R219 IonicContact OE2-CZ 2.81Å; E216-R219 IonicContact OE2-NE 3.96Å; E216-R219 IonicContact OE2-NH1 3.44Å; E216-R219 PolarHBondContact OE2-NH1 2.9Å; E216-S220 PolarHBondContact O-N 3.49Å
217F84.6Confident85.8Confident99 Ų9963.1 Ų63.143%0.43434%0.337SS..Hα-helixtrans-56.8-48.7172.2174.9-100.6000112.3N166 L186 T215 S220 L221N166-F217 HydrophobicContact CB-CE2 4.24Å; N166-F217 HydrophobicContact CB-CZ 4.09Å; N166-F217 WeakPolarHBondContact OD1-CZ 3.1Å; L186-F217 HydrophobicContact CD1-CE1 4.49Å; T215-F217 PolarHBondContact O-N 2.67Å; F217-S220 PolarHBondContact O-N 2.98Å; F217-L221 HydrophobicContact CD1-CD1 4.2Å; F217-L221 HydrophobicContact CE1-CD1 3.74Å; F217-L221 HydrophobicContact CE1-CG 4.33Å; F217-L221 HydrophobicContact CZ-CD1 4.29Å; F217-L221 PolarHBondContact O-N 3.07Å; F217-L221 VanDerWaalsContact O-N 3.14Å
218T86.3Confident84.5Confident18 Ų1867.1 Ų67.111%0.1135%0.352CS..Hα-helixtrans-70.4-27.6178.846.80000113.7P191 T215 E216 L221 L222P191-T218 HydrophobicContact CG-CG2 4.37Å; T215-T218 WeakPolarHBondContact CA-OG1 3.43Å; T215-T218 PolarHBondContact N-OG1 3.44Å; T215-T218 CarbonylContact O-C 3.56Å; T215-T218 WeakPolarHBondContact O-CA 3.12Å; T215-T218 PolarHBondContact O-N 3.04Å; T215-T218 PolarHBondContact O-OG1 2.87Å; T215-T218 PolarHBondContact OG1-N 3.19Å; T215-T218 PolarHBondContact OG1-OG1 2.96Å; E216-T218 PolarHBondContact O-N 2.81Å; T218-L221 HydrophobicContact CG2-CD1 4.4Å; T218-L221 WeakPolarHBondContact O-CB 3.49Å; T218-L221 PolarHBondContact O-N 3.33Å; T218-L222 PolarHBondContact O-N 3.21Å
219R86.3Confident83.1Confident128 Ų12867.6 Ų67.648%0.48336%0.356SS..Hα-helixtrans-61.1-50.9171.2-65.6177.1-168142.21.9110.6L214 T215 E216 L221 L222 E223L214-R219 HydrophobicContact CB-CG 3.77Å; L214-R219 HydrophobicContact CD1-CG 4.27Å; L214-R219 HydrophobicContact CD2-CG 4.43Å; L214-R219 HydrophobicContact CG-CG 4.4Å; L214-R219 VanDerWaalsContact O-CZ 3.26Å; L214-R219 PolarHBondContact O-NE 3.28Å; L214-R219 PolarHBondContact O-NH2 3.25Å; T215-R219 WeakPolarHBondContact O-CG 3.24Å; T215-R219 PolarHBondContact O-N 2.96Å; E216-R219 PolarHBondContact O-N 3.36Å; E216-R219 IonicContact OE2-CZ 2.81Å; E216-R219 IonicContact OE2-NE 3.96Å; E216-R219 IonicContact OE2-NH1 3.44Å; E216-R219 PolarHBondContact OE2-NH1 2.9Å; R219-L221 VanDerWaalsContact C-N 3.28Å; R219-L221 PolarHBondContact O-N 2.84Å; R219-L222 PolarHBondContact O-N 3.05Å; R219-L222 VanDerWaalsContact O-N 3.12Å; R219-E223 WeakPolarHBondContact O-CB 3.45Å; R219-E223 PolarHBondContact O-N 3.46Å
220S87Confident81.4Confident47 Ų4770.6 Ų70.633%0.32938%0.379SS..Hα-helixtrans-58.5-38.7176-175.50000112E216 F217 K224E216-S220 PolarHBondContact O-N 3.49Å; F217-S220 PolarHBondContact O-N 2.98Å; S220-K224 WeakPolarHBondContact O-CB 3.5Å; S220-K224 WeakPolarHBondContact O-CE 3.46Å; S220-K224 WeakPolarHBondContact O-CG 3.08Å; S220-K224 PolarHBondContact O-N 3.43Å; S220-K224 VanDerWaalsContact O-N 3.07Å; S220-K224 VanDerWaalsContact OG-CE 3.29Å; S220-K224 WeakPolarHBondContact OG-CE 3.35Å; S220-K224 PolarHBondContact OG-NZ 2.87Å
221L85.7Confident79.8Confident1 Ų173 Ų731%0.00539%0.393CS..Hα-helixtrans-57.9-51.5173.1-67.9-178000112.1N166 L186 F190 P191 F217 T218 R219 K224 I225N166-L221 HydrophobicContact CB-CD2 4.09Å; N166-L221 WeakPolarHBondContact O-CD2 3.3Å; L186-L221 HydrophobicContact CD1-CD1 3.61Å; F190-L221 HydrophobicContact CD2-CD1 4.11Å; F190-L221 HydrophobicContact CE2-CB 4.44Å; F190-L221 HydrophobicContact CE2-CD1 4.25Å; P191-L221 HydrophobicContact CG-CB 4.36Å; F217-L221 HydrophobicContact CD1-CD1 4.2Å; F217-L221 HydrophobicContact CE1-CD1 3.74Å; F217-L221 HydrophobicContact CE1-CG 4.33Å; F217-L221 HydrophobicContact CZ-CD1 4.29Å; F217-L221 PolarHBondContact O-N 3.07Å; F217-L221 VanDerWaalsContact O-N 3.14Å; T218-L221 HydrophobicContact CG2-CD1 4.4Å; T218-L221 WeakPolarHBondContact O-CB 3.49Å; T218-L221 PolarHBondContact O-N 3.33Å; R219-L221 VanDerWaalsContact C-N 3.28Å; R219-L221 PolarHBondContact O-N 2.84Å; L221-K224 PolarHBondContact O-N 3.09Å; L221-I225 WeakPolarHBondContact O-CG1 3.45Å; L221-I225 PolarHBondContact O-N 3.47Å
222L86.1Confident78Confident11 Ų1177.1 Ų77.16%0.05842%0.417CS..Hα-helixtrans-64.7-42.1-177.7-179.157.9000112.2P191 K193 H196 L197 L214 T218 R219 K224 I225 S226P191-L222 HydrophobicContact CG-CB 4.3Å; K193-L222 HydrophobicContact CB-CD1 4.1Å; K193-L222 HydrophobicContact CG-CD1 4.06Å; H196-L222 HydrophobicContact CB-CD2 3.58Å; L197-L222 HydrophobicContact CD2-CD2 4.17Å; L197-L222 HydrophobicContact CG-CD2 4.39Å; L214-L222 HydrophobicContact CD1-CD2 4.49Å; L214-L222 HydrophobicContact CD2-CD2 4.39Å; T218-L222 PolarHBondContact O-N 3.21Å; R219-L222 PolarHBondContact O-N 3.05Å; R219-L222 VanDerWaalsContact O-N 3.12Å; L222-K224 PolarHBondContact O-N 2.87Å; L222-I225 HydrophobicContact CD1-CD1 4.29Å; L222-I225 WeakPolarHBondContact O-CB 3.44Å; L222-I225 PolarHBondContact O-N 2.96Å; L222-I225 VanDerWaalsContact O-N 3.14Å; L222-S226 PolarHBondContact O-N 3.41Å
223E86.4Confident76.1Confident122 Ų12285.4 Ų85.457%0.5744%0.436SS*.Hα-helixtrans-58.4-45.6175.1-173.6-174.6-16700111.9R219 I225 S226 S227R219-E223 WeakPolarHBondContact O-CB 3.45Å; R219-E223 PolarHBondContact O-N 3.46Å; E223-I225 PolarHBondContact O-N 3.31Å; E223-I225 VanDerWaalsContact O-N 3.15Å; E223-S226 PolarHBondContact O-N 3.24Å; E223-S226 VanDerWaalsContact O-N 3.11Å; E223-S227 WeakPolarHBondContact O-CB 3.29Å; E223-S227 PolarHBondContact O-N 3.01Å; E223-S227 PolarHBondContact O-OG 2.73Å
224K85.1Confident74.2Confident91 Ų9185 Ų8540%0.39643%0.434SS..Hα-helixtrans-63.3-17.3176.9-80.3173.6-72.2-176.70114.5S220 L221 L222 K228S220-K224 WeakPolarHBondContact O-CB 3.5Å; S220-K224 WeakPolarHBondContact O-CE 3.46Å; S220-K224 WeakPolarHBondContact O-CG 3.08Å; S220-K224 PolarHBondContact O-N 3.43Å; S220-K224 VanDerWaalsContact O-N 3.07Å; S220-K224 VanDerWaalsContact OG-CE 3.29Å; S220-K224 WeakPolarHBondContact OG-CE 3.35Å; S220-K224 PolarHBondContact OG-NZ 2.87Å; L221-K224 PolarHBondContact O-N 3.09Å; L222-K224 PolarHBondContact O-N 2.87Å; K224-K228 WeakPolarHBondContact O-CG 3.42Å
225I79.5Confident72.2Confident18 Ų1887.9 Ų87.99%0.09246%0.458CS..Hα-helixtrans-84.6-52169.4-50.3159.5000109F190 L221 L222 E223 S227 K228 Y263 F265F190-I225 HydrophobicContact CE1-CD1 3.53Å; F190-I225 HydrophobicContact CZ-CD1 3.5Å; F190-I225 HydrophobicContact CZ-CG1 4.2Å; L221-I225 WeakPolarHBondContact O-CG1 3.45Å; L221-I225 PolarHBondContact O-N 3.47Å; L222-I225 HydrophobicContact CD1-CD1 4.29Å; L222-I225 WeakPolarHBondContact O-CB 3.44Å; L222-I225 PolarHBondContact O-N 2.96Å; L222-I225 VanDerWaalsContact O-N 3.14Å; E223-I225 PolarHBondContact O-N 3.31Å; E223-I225 VanDerWaalsContact O-N 3.15Å; I225-S227 PolarHBondContact O-N 2.75Å; I225-K228 PolarHBondContact O-N 3.15Å; I225-Y263 HydrophobicContact CD1-CD1 4.46Å; I225-F265 HydrophobicContact CD1-CZ 4.46Å; I225-F265 HydrophobicContact CG1-CE1 3.91Å; I225-F265 HydrophobicContact CG1-CE2 4.43Å; I225-F265 HydrophobicContact CG1-CZ 3.53Å
226S79.1Confident70.4Confident53 Ų5393.8 Ų93.837%0.37148%0.477SS..Hα-helixtrans-59.8-47.1-173.1-156.30000112.2L222 E223 K228 H229L222-S226 PolarHBondContact O-N 3.41Å; E223-S226 PolarHBondContact O-N 3.24Å; E223-S226 VanDerWaalsContact O-N 3.11Å; S226-K228 VanDerWaalsContact C-N 3.28Å; S226-K228 PolarHBondContact O-N 2.77Å; S226-H229 PolarHBondContact O-N 2.86Å
227S73.6Confident68.2Low66 Ų6693.8 Ų93.846%0.46249%0.488SS..THydrogen-bonded Turntrans-70.9-16.4-176-58.10000114.6E223 I225 S230E223-S227 WeakPolarHBondContact O-CB 3.29Å; E223-S227 PolarHBondContact O-N 3.01Å; E223-S227 PolarHBondContact O-OG 2.73Å; I225-S227 PolarHBondContact O-N 2.75Å; S227-S230 PolarHBondContact O-OG 3.26Å
228K63.7Low66.1Low105 Ų10592.7 Ų92.746%0.45751%0.505SS..THydrogen-bonded Turntrans-77.5-41.7172.2-70.7-176175.5-165.80111.1K224 I225 S226 S230 V231K224-K228 WeakPolarHBondContact O-CG 3.42Å; I225-K228 PolarHBondContact O-N 3.15Å; S226-K228 VanDerWaalsContact C-N 3.28Å; S226-K228 PolarHBondContact O-N 2.77Å; K228-S230 PolarHBondContact O-N 3.35Å; K228-V231 WeakPolarHBondContact O-CG2 3.45Å; K228-V231 PolarHBondContact O-N 3.25Å
229H58.6Low64.4Low126 Ų12699.4 Ų99.458%0.58354%0.539SS*.THydrogen-bonded Turntrans-72.1-1.6-171.4-145.2-65.6000114.8S226S226-H229 PolarHBondContact O-N 2.86Å
230S54Low62.4Low83 Ų8399.9 Ų99.958%0.5856%0.556SS**THydrogen-bonded Turntrans-100.1-21.5173.864.10000114.6S227 K228S227-S230 PolarHBondContact O-OG 3.26Å; K228-S230 PolarHBondContact O-N 3.35Å
231V54.9Low60.4Low83 Ų83107.5 Ų107.550%0.50358%0.578SS.*THydrogen-bonded Turntrans-86.1-34.6-174.4-67.80000113.4K228 R233 C234K228-V231 WeakPolarHBondContact O-CG2 3.45Å; K228-V231 PolarHBondContact O-N 3.25Å; V231-R233 PolarHBondContact O-N 2.96Å; V231-R233 VanDerWaalsContact O-N 3.1Å; V231-C234 PolarHBondContact O-N 2.69Å; V231-C234 VanDerWaalsContact O-N 3.14Å
232D53.7Low58.9Low140 Ų140115.7 Ų115.775%0.74962%0.616SS**THydrogen-bonded Turntrans-72.1-5.7-174.6-65.2-61.4000114.8
233R49Very low56.7Low229 Ų229123.3 Ų123.386%0.86465%0.651SS**THydrogen-bonded Turntrans-89.4-2.1171.6-72.5-166.1176.8-163.41.6114.5V231V231-R233 PolarHBondContact O-N 2.96Å; V231-R233 VanDerWaalsContact O-N 3.1Å
234C45.2Very low54.9Low112 Ų112125.2 Ų125.276%0.75767%0.665SS**SBendtrans-143.770.3-179.6-161.20000113.4V231V231-C234 PolarHBondContact O-N 2.69Å; V231-C234 VanDerWaalsContact O-N 3.14Å
235S43.9Very low53.1Low101 Ų101125 Ų12571%0.70667%0.674SS**  trans-152.436.6174.5-80.60000114.9
236K50.6Low51.9Low205 Ų205133.2 Ų133.289%0.89171%0.709SS**  trans-125.278.8167.8-76.4-170.3177.8179.90112.4G238K236-G238 PolarHBondContact O-N 2.76Å
237P39.2Very low50.1Low132 Ų132136.3 Ų136.386%0.85773%0.729SS**  trans-74.8103.2166.731.1-31.1000109.1
238G41.3Very low48.4Very low75 Ų75141.6 Ų141.677%0.77374%0.744SS**  trans178.66.5-176.800000119.8K236K236-G238 PolarHBondContact O-N 2.76Å
239L49.5Very low47.4Very low159 Ų159144.9 Ų144.983%0.83276%0.762SS**  trans-135.395.3176-119.2170.8000111.8R241L239-R241 PolarHBondContact O-N 3.01Å
240V44Very low46.7Very low138 Ų138142.6 Ų142.684%0.83676%0.761SS**  trans-77.2111.3168.6175.20000108.4
241R46.5Very low45.8Very low208 Ų208142 Ų14279%0.78577%0.768SS**  trans-145.9111.7151-79.4-145.8165.4-162.1-7112.5L239L239-R241 PolarHBondContact O-N 3.01Å
242Q52.7Low45.2Very low173 Ų173148.7 Ų148.781%0.80878%0.784SS**  trans50.4129.6146.5-66.8170.9-78.300119.2
243H41.1Very low44.6Very low171 Ų171147.3 Ų147.379%0.79278%0.783SS**  trans-99.4115.1-172.3-178.3-69.6000109.5
244D47.8Very low44.1Very low162 Ų162147.3 Ų147.387%0.86678%0.783SS**  trans-145.6145.8168.1-117.5-45.4000111.9
245S47.3Very low43.9Very low85 Ų85148.4 Ų148.459%0.59478%0.781SS**  trans-103.7115.1-147.2-58.20000114.7
246K54.1Low43.8Very low191 Ų191150.5 Ų150.583%0.8378%0.784SS**  trans-158.1118.7156.6-94.4119.1-170.5173.80112.2F248K246-F248 PolarHBondContact O-N 3.34Å
247P40.9Very low43.7Very low119 Ų119147.6 Ų147.677%0.77378%0.779SS**  trans-79.991.2166.732.1-31.1000109.5M249P247-M249 PolarHBondContact O-N 3.16Å
248F39.2Very low44.3Very low177 Ų177144.8 Ų144.878%0.77675%0.754SS**  trans-74.894.4-177.7-159.2-120.2000110.9K246 S250K246-F248 PolarHBondContact O-N 3.34Å; F248-S250 WeakPolarHBondContact CD1-OG 3.5Å; F248-S250 VanDerWaalsContact CE1-OG 3.23Å; F248-S250 WeakPolarHBondContact CE1-OG 3.42Å; F248-S250 PolarHBondContact O-N 3.13Å
249M42.5Very low44.4Very low173 Ų173145.2 Ų145.285%0.85276%0.758SS**  trans-71.470.6174.5-74.5-73.2105.600111.1P247 G251P247-M249 PolarHBondContact O-N 3.16Å; M249-G251 PolarHBondContact O-N 2.91Å
250S44.2Very low44.6Very low79 Ų79144.3 Ų144.355%0.55275%0.754SS**  trans-69.1110.9169.9-56.90000110.2F248 R252F248-S250 WeakPolarHBondContact CD1-OG 3.5Å; F248-S250 VanDerWaalsContact CE1-OG 3.23Å; F248-S250 WeakPolarHBondContact CE1-OG 3.42Å; F248-S250 PolarHBondContact O-N 3.13Å; S250-R252 PolarHBondContact O-N 3.08Å
251G35Very low45.3Very low70 Ų70139.2 Ų139.272%0.72272%0.723SS**  trans-53.7126.816000000109M249 P253M249-G251 PolarHBondContact O-N 2.91Å; G251-P253 WeakPolarHBondContact O-CD 3.35Å
252R41.6Very low46Very low223 Ų223132.8 Ų132.884%0.84271%0.705SS**  trans-68.4130.7178.8-69.1178.9-179.7-98.60.9109.2S250 R254S250-R252 PolarHBondContact O-N 3.08Å; R252-R254 PolarHBondContact O-N 3.18Å
253P41.9Very low46.7Very low112 Ų112125.5 Ų125.573%0.72767%0.67SS**  trans-57.4112.8154.4-16.430.3000107.4G251 N255G251-P253 WeakPolarHBondContact O-CD 3.35Å; P253-N255 PolarHBondContact O-N 2.92Å
254R38.6Very low47.6Very low229 Ų229121.9 Ų121.986%0.86465%0.649SS**SBendtrans-76112.8157.4-69.1176.3171.7179.3-3.5105R252R252-R254 PolarHBondContact O-N 3.18Å
255N39Very low48.1Very low134 Ų134116.3 Ų116.372%0.71762%0.617SS**SBendtrans173.3-30146.3-84.5-17.1000114.1P253P253-N255 PolarHBondContact O-N 2.92Å
256D42.9Very low48.2Very low145 Ų145118.2 Ų118.278%0.77562%0.621SS**SBendtrans-104.416.4-154.2-52.2-81000118.2
257D49.2Very low48.1Very low145 Ų145115.3 Ų115.378%0.77561%0.61SS**  trans-118.138.9-169-141.1-23.8000113.5
258H51.6Low48.1Very low73 Ų73116.7 Ų116.734%0.33861%0.611SS.*  trans-114.7-7.1-172.1-71.7-71.9000116F194 H202F194-H258 AromaticContact CD1-ND1 3.58Å; F194-H258 AromaticContact CE1-CE1 3.93Å; F194-H258 AromaticContact CE1-ND1 3.19Å; F194-H258 WeakPolarHBondContact CE1-ND1 3.46Å; F194-H258 AromaticContact CZ-ND1 3.8Å; H202-H258 AromaticContact CD2-CD2 3.85Å; H202-H258 AromaticContact CD2-CE1 3.93Å; H202-H258 AromaticContact CD2-CG 3.47Å; H202-H258 VanDerWaalsContact CD2-CG 3.47Å; H202-H258 AromaticContact CD2-ND1 3.53Å; H202-H258 AromaticContact NE2-CD2 3.13Å; H202-H258 PolarHBondContact NE2-CD2 3.06Å; H202-H258 AromaticContact NE2-CE1 3.38Å; H202-H258 PolarHBondContact NE2-CE1 3.09Å; H202-H258 AromaticContact NE2-CG 3.26Å; H202-H258 VanDerWaalsContact NE2-CG 3.26Å; H202-H258 AromaticContact NE2-ND1 3.41Å; H202-H258 PolarHBondContact NE2-ND1 2.91Å; H202-H258 AromaticContact NE2-NE2 3.19Å; H202-H258 PolarHBondContact NE2-NE2 3.19Å; H202-H258 VanDerWaalsContact NE2-NE2 3.19Å
259G43.3Very low47.8Very low84 Ų84114.4 Ų114.487%0.86661%0.606SS**SBendtrans-83-31.8-173.900000116.3
260D53.7Low47.5Very low140 Ų140111.6 Ų111.675%0.74960%0.601SS**  trans-130.257.8-168.6-163.722.7000113.3D262D260-D262 PolarHBondContact O-N 3.21Å
261V57.7Low47.1Very low30 Ų30116.8 Ų116.818%0.18262%0.617CS.*  trans-76.795.7158.4172.70000107.3K193 F194 Y263K193-V261 HydrophobicContact CD-CG1 3.74Å; K193-V261 HydrophobicContact CD-CG2 4.32Å; F194-V261 HydrophobicContact CE1-CG2 4.05Å; F194-V261 HydrophobicContact CE2-CG2 4.14Å; F194-V261 HydrophobicContact CZ-CB 4.3Å; F194-V261 HydrophobicContact CZ-CG2 3.44Å; F194-V261 VanDerWaalsContact CZ-CG2 3.44Å; V261-Y263 HydrophobicContact CB-CD2 4.43Å; V261-Y263 HydrophobicContact CB-CE2 4.01Å; V261-Y263 HydrophobicContact CG1-CD1 4.47Å; V261-Y263 HydrophobicContact CG1-CD2 3.96Å; V261-Y263 HydrophobicContact CG1-CE1 4.22Å; V261-Y263 HydrophobicContact CG1-CE2 3.65Å; V261-Y263 HydrophobicContact CG1-CG 4.36Å; V261-Y263 WeakPolarHBondContact O-CD2 2.83Å; V261-Y263 PolarHBondContact O-N 2.98Å
262D62.8Low47.1Very low74 Ų74120.7 Ų120.740%0.39662%0.618SS.*  trans-70.898.6176.8-158.9-10.5000110.7D260 R264D260-D262 PolarHBondContact O-N 3.21Å; D262-R264 PolarHBondContact O-N 3.4Å; D262-R264 WeakPolarHBondContact OD1-CB 3.29Å; D262-R264 WeakPolarHBondContact OD1-CD 3.11Å; D262-R264 WeakPolarHBondContact OD1-CG 3.42Å; D262-R264 IonicContact OD1-CZ 2.67Å; D262-R264 PolarHBondContact OD1-N 3.47Å; D262-R264 IonicContact OD1-NE 3.81Å; D262-R264 IonicContact OD1-NH1 3.23Å; D262-R264 PolarHBondContact OD1-NH1 3.4Å; D262-R264 WeakPolarHBondContact OD2-CD 3.45Å; D262-R264 IonicContact OD2-CZ 2.93Å; D262-R264 IonicContact OD2-NE 3.75Å; D262-R264 IonicContact OD2-NH1 2.98Å; D262-R264 PolarHBondContact OD2-NH1 3.23Å
263Y66Low46.8Very low20 Ų20115.9 Ų115.98%0.07861%0.609CS.*  trans-72.42.4173.4-67.2-91000113.1L168 F190 K193 F209 I225 V261 F265L168-Y263 HydrophobicContact CD2-CD1 4.34Å; L168-Y263 HydrophobicContact CD2-CG 3.99Å; F190-Y263 AromaticContact CE1-CD1 3.89Å; F190-Y263 HydrophobicContact CE1-CD1 3.89Å; F190-Y263 HydrophobicContact CE1-CE1 4.19Å; K193-Y263 HydrophobicContact CB-CE1 4.13Å; K193-Y263 WeakPolarHBondContact CB-OH 3.44Å; K193-Y263 PolarHBondContact N-OH 3.49Å; F209-Y263 HydrophobicContact CD2-CE2 4.25Å; F209-Y263 HydrophobicContact CE1-CD2 4.44Å; F209-Y263 HydrophobicContact CE1-CE2 4.47Å; F209-Y263 HydrophobicContact CE1-CG 4.45Å; F209-Y263 AromaticContact CE2-CD2 3.97Å; F209-Y263 HydrophobicContact CE2-CD2 3.97Å; F209-Y263 HydrophobicContact CE2-CE1 4.48Å; F209-Y263 AromaticContact CE2-CE2 3.43Å; F209-Y263 HydrophobicContact CE2-CE2 3.43Å; F209-Y263 VanDerWaalsContact CE2-CE2 3.43Å; F209-Y263 AromaticContact CE2-CZ 3.72Å; F209-Y263 HydrophobicContact CZ-CD1 4.39Å; F209-Y263 AromaticContact CZ-CD2 3.6Å; F209-Y263 HydrophobicContact CZ-CD2 3.6Å; F209-Y263 HydrophobicContact CZ-CE1 4.34Å; F209-Y263 AromaticContact CZ-CE2 3.56Å; F209-Y263 HydrophobicContact CZ-CE2 3.56Å; F209-Y263 HydrophobicContact CZ-CG 4.04Å; F209-Y263 AromaticContact CZ-CZ 3.94Å; I225-Y263 HydrophobicContact CD1-CD1 4.46Å; V261-Y263 HydrophobicContact CB-CD2 4.43Å; V261-Y263 HydrophobicContact CB-CE2 4.01Å; V261-Y263 HydrophobicContact CG1-CD1 4.47Å; V261-Y263 HydrophobicContact CG1-CD2 3.96Å; V261-Y263 HydrophobicContact CG1-CE1 4.22Å; V261-Y263 HydrophobicContact CG1-CE2 3.65Å; V261-Y263 HydrophobicContact CG1-CG 4.36Å; V261-Y263 WeakPolarHBondContact O-CD2 2.83Å; V261-Y263 PolarHBondContact O-N 2.98Å; Y263-F265 PolarHBondContact O-N 3.01Å
264R61.5Low46.6Very low94 Ų94117.5 Ų117.536%0.35561%0.61SS.*  trans-69.294.5168.4-64.2167.7-166.6125.1-1.2109K170 D262 D266K170-R264 HydrophobicContact CD-CB 4.47Å; K170-R264 HydrophobicContact CD-CG 3.85Å; K170-R264 HydrophobicContact CG-CG 3.89Å; D262-R264 PolarHBondContact O-N 3.4Å; D262-R264 WeakPolarHBondContact OD1-CB 3.29Å; D262-R264 WeakPolarHBondContact OD1-CD 3.11Å; D262-R264 WeakPolarHBondContact OD1-CG 3.42Å; D262-R264 IonicContact OD1-CZ 2.67Å; D262-R264 PolarHBondContact OD1-N 3.47Å; D262-R264 IonicContact OD1-NE 3.81Å; D262-R264 IonicContact OD1-NH1 3.23Å; D262-R264 PolarHBondContact OD1-NH1 3.4Å; D262-R264 WeakPolarHBondContact OD2-CD 3.45Å; D262-R264 IonicContact OD2-CZ 2.93Å; D262-R264 IonicContact OD2-NE 3.75Å; D262-R264 IonicContact OD2-NH1 2.98Å; D262-R264 PolarHBondContact OD2-NH1 3.23Å; R264-D266 PolarHBondContact O-N 3.37Å; R264-D266 VanDerWaalsContact O-N 3.08Å
265F57.4Low46.7Very low46 Ų46110.4 Ų110.420%0.20260%0.595CS.*  trans-50.4119.5159.7-70.2-78.5000109.4E167 F190 I225 Y263 Q267E167-F265 HydrophobicContact CB-CD2 4.46Å; F190-F265 HydrophobicContact CE2-CE2 4.13Å; F190-F265 AromaticContact CZ-CE2 3.88Å; F190-F265 HydrophobicContact CZ-CE2 3.88Å; F190-F265 HydrophobicContact CZ-CZ 4.16Å; I225-F265 HydrophobicContact CD1-CZ 4.46Å; I225-F265 HydrophobicContact CG1-CE1 3.91Å; I225-F265 HydrophobicContact CG1-CE2 4.43Å; I225-F265 HydrophobicContact CG1-CZ 3.53Å; Y263-F265 PolarHBondContact O-N 3.01Å; F265-Q267 VanDerWaalsContact C-N 3.34Å; F265-Q267 PolarHBondContact O-N 3.22Å
266D50.2Low46.8Very low125 Ų125109 Ų10967%0.66860%0.596SS**  trans-62.998.5167.6-85-56.2000109.5R264 N268R264-D266 PolarHBondContact O-N 3.37Å; R264-D266 VanDerWaalsContact O-N 3.08Å; D266-N268 PolarHBondContact O-N 3.12Å
267Q50.2Low46.8Very low130 Ų130110.8 Ų110.861%0.60760%0.599SS**  trans-70.185.7160.2-69.1-177.8-200106.6E167 F265 L269E167-Q267 PolarHBondContact OE2-NE2 2.92Å; F265-Q267 VanDerWaalsContact C-N 3.34Å; F265-Q267 PolarHBondContact O-N 3.22Å; Q267-L269 PolarHBondContact O-N 3.06Å; Q267-L269 VanDerWaalsContact O-N 3.16Å
268N40.7Very low46.8Very low148 Ų148113 Ų11379%0.79160%0.602SS**  trans-0.297.6178.6-75-23.4000113.3D266 P270D266-N268 PolarHBondContact O-N 3.12Å; N268-P270 VanDerWaalsContact O-N 3.14Å
269L34.3Very low46.3Very low129 Ų129118.1 Ų118.168%0.67563%0.626SS**  trans-47.6126.9162.5-115.171.1000106.8Q267 Q271Q267-L269 PolarHBondContact O-N 3.06Å; Q267-L269 VanDerWaalsContact O-N 3.16Å; L269-Q271 PolarHBondContact O-N 3.31Å
270P35.1Very low46.4Very low114 Ų114121.2 Ų121.274%0.7462%0.622SS**  trans-52.2122178.4-26.334.2000107.8N268 M272N268-P270 VanDerWaalsContact O-N 3.14Å; P270-M272 PolarHBondContact O-N 3.36Å
271Q36.1Very low45.6Very low188 Ų188119.3 Ų119.388%0.87963%0.626SS**  trans-64.791.6179-81-171-15.900108.1L269 N273L269-Q271 PolarHBondContact O-N 3.31Å; Q271-N273 PolarHBondContact O-N 3.14Å
272M34.5Very low45Very low151 Ų151123.5 Ų123.574%0.74465%0.652SS**  trans-60.781.1159.254.6-147.9-76.100106.6P270 I274P270-M272 PolarHBondContact O-N 3.36Å; M272-I274 PolarHBondContact O-N 3.31Å
273N35.6Very low44Very low122 Ų122126 Ų12665%0.65267%0.672SS**  trans-6879.1177.3179.523.2000107.9Q271 S275Q271-N273 PolarHBondContact O-N 3.14Å; N273-S275 PolarHBondContact ND2-OG 3.3Å; N273-S275 PolarHBondContact O-N 3.07Å; N273-S275 PolarHBondContact O-OG 2.92Å
274I38.1Very low42.7Very low147 Ų147128 Ų12875%0.75470%0.7SS**  trans-59.688162.6-59.3174.8000104.6M272 S276M272-I274 PolarHBondContact O-N 3.31Å; I274-S276 PolarHBondContact O-N 3.49Å; I274-S276 VanDerWaalsContact O-N 3.08Å
275S41.2Very low41.6Very low79 Ų79133.7 Ų133.755%0.55273%0.727SS**  trans-67.7112.8-172.5-67.70000106.5N273 E277N273-S275 PolarHBondContact ND2-OG 3.3Å; N273-S275 PolarHBondContact O-N 3.07Å; N273-S275 PolarHBondContact O-OG 2.92Å; S275-E277 PolarHBondContact O-N 3.44Å
276S41.7Very low40.8Very low105 Ų105137.3 Ų137.373%0.73476%0.758SS**  trans-38.9123.5-177.9-173.40000110.2I274 K278I274-S276 PolarHBondContact O-N 3.49Å; I274-S276 VanDerWaalsContact O-N 3.08Å; S276-K278 PolarHBondContact O-N 3.21Å
277E43Very low40.7Very low182 Ų182137.3 Ų137.385%0.8577%0.765SS**  trans-59.9106.9-172.7-66.8179.3127.700108.7S275 E279S275-E277 PolarHBondContact O-N 3.44Å; E277-E279 VanDerWaalsContact C-N 3.28Å; E277-E279 PolarHBondContact O-N 2.92Å
278K48.6Very low40.4Very low192 Ų192139.3 Ų139.384%0.83577%0.774SS**  trans-80.688.3175.6-73.3177-178.6175.50106.5S276 L280S276-K278 PolarHBondContact O-N 3.21Å; K278-L280 PolarHBondContact O-N 3.29Å
279E39.8Very low40.5Very low180 Ų180142.9 Ų142.984%0.84178%0.777SS**  trans-37.3100.4165.2-85.2-75.986.200109.6E277 A281E277-E279 VanDerWaalsContact C-N 3.28Å; E277-E279 PolarHBondContact O-N 2.92Å; E279-A281 VanDerWaalsContact C-N 3.26Å; E279-A281 PolarHBondContact O-N 2.84Å
280L46.1Very low41Very low149 Ų149145.5 Ų145.578%0.7879%0.787SS**  trans-86.478-171.4-169.172.7000107.9K278 T282K278-L280 PolarHBondContact O-N 3.29Å; L280-T282 PolarHBondContact O-N 3.35Å; L280-T282 PolarHBondContact O-OG1 3.27Å
281A37.8Very low41.5Very low100 Ų100145.2 Ų145.283%0.82679%0.786SS**  trans-47.994.9-175.600000111.9E279E279-A281 VanDerWaalsContact C-N 3.26Å; E279-A281 PolarHBondContact O-N 2.84Å
282T44.8Very low41.8Very low118 Ų118142.1 Ų142.172%0.72478%0.779SS**  trans-105.5109.2-179.6-590000106.7L280L280-T282 PolarHBondContact O-N 3.35Å; L280-T282 PolarHBondContact O-OG1 3.27Å
283P41.4Very low42.3Very low126 Ų126142.7 Ų142.782%0.81879%0.785SS**  trans-78.8129.5-167.929.6-34.4000112.3
284G39Very low42.9Very low64 Ų64142.4 Ų142.466%0.6679%0.787SS**  trans91.593.7156.100000117
285F38.9Very low43.6Very low213 Ų213141.1 Ų141.193%0.93479%0.789SS**  trans-152.5122.3135.3-106.5-73.3000109
286S39.9Very low43.8Very low122 Ų122144.2 Ų144.285%0.85380%0.799SS**  trans-111.2118.6-177.3-64.70000111.8
287P47.7Very low43.9Very low125 Ų125147.5 Ų147.581%0.81281%0.808SS**  trans-92.9137.7159-4.824.8000111.1
288Q45Very low43.9Very low172 Ų172148.2 Ų148.280%0.80481%0.808SS**  trans-48.6148.5-173.9-67.2-75.2-3.600117.6
289R42.4Very low43.6Very low223 Ų223142.8 Ų142.884%0.84280%0.799SS**  trans-15.4135.9159.2-69.1168.8162.8162.6-6.2117.9
290M43.6Very low44Very low183 Ų183140 Ų14090%0.90180%0.797SS**  trans-130.3147.9131.3-80.9-63.6172.200109.6
291P47.2Very low43.9Very low108 Ų108138.7 Ų138.770%0.70180%0.795SS**  trans-89155.8-169.534.6-35.4000114.3
292V41.5Very low43.9Very low123 Ų123138.8 Ų138.875%0.74579%0.788SS**  trans-74.1135170.8176.40000110.3T294V292-T294 HydrophobicContact CG1-CG2 4.07Å
293L44.6Very low44Very low164 Ų164139.5 Ų139.586%0.85979%0.792SS**  trans-114.2105.8166.4-71179.4000110.5
294T48.4Very low44.2Very low115 Ų115138.6 Ų138.671%0.70679%0.787SS**  trans-132.1114.4165.951.40000109.1V292V292-T294 HydrophobicContact CG1-CG2 4.07Å
295P53.7Low44Very low121 Ų121141.2 Ų141.279%0.78680%0.795SS**  trans-96.4108.1165.312.85.9000109.5
296N43.9Very low44.4Very low144 Ų144135.6 Ų135.677%0.7778%0.779SS**  trans-72.4134.3154.9-84.7-52.3000108
297L44.2Very low44.5Very low174 Ų174140.1 Ų140.191%0.91178%0.778SS**  trans-120.6136.4162.9-74.9173.3000108.8
298F43.1Very low44.3Very low196 Ų196141.8 Ų141.886%0.8677%0.774SS**  trans-113.9156.3-167.2-115.6-104000110.9
299A43.2Very low43.8Very low78 Ų78142.7 Ų142.765%0.64578%0.776SS**  trans67.4167.8168.400000115V301A299-V301 HydrophobicContact CB-CG2 4.11Å
300P48.5Very low43.8Very low123 Ų123141 Ų14180%0.79977%0.77SS**  cis-82.8163.45.936.1-36.3000113.8
301V42.6Very low43.6Very low121 Ų121137.5 Ų137.573%0.73376%0.761SS**  cis86.590.128.3-176.20000115.1A299A299-V301 HydrophobicContact CB-CG2 4.11Å
302C38.2Very low43.2Very low102 Ų102140.1 Ų140.169%0.68976%0.764SS**  trans54.5109.2139.3-55.30000123.7
303T46.2Very low43.2Very low132 Ų132142.4 Ų142.481%0.8177%0.766SS**  69.4164.1127.462.90000121.1
304P46.4Very low42.8Very low108 Ų108141.9 Ų141.970%0.70176%0.759SS**  cis-142.5136.1-45.837.6-20.1000116.6
305S35.5Very low42.4Very low119 Ų119143.2 Ų143.283%0.83276%0.76SS**  trans61.3-174.5150-123.70000117.9
306P47.2Very low41.9Very low94 Ų94143.5 Ų143.561%0.6177%0.765SS**  cis-133-177.2-17.830.1-8.1000115.4
307R40.8Very low41.7Very low217 Ų217148.4 Ų148.482%0.81977%0.773SS**  trans78.2150.9160.9-46.6-170.1-179.8-159.6-1.5117.8
308H43.5Very low41.8Very low160 Ų160145.2 Ų145.274%0.74177%0.771SS**  cis-167.1176.3-28.4-98.9-45.3000110.1
309F36.2Very low41.7Very low191 Ų191148 Ų14884%0.83878%0.776SS**  trans7992.6163.2-88.2-84000121.7
310R41.3Very low41.6Very low188 Ų188147.4 Ų147.471%0.70978%0.778SS**  42.8122.9119.5-113.5-76.7-178.2162.93120.6E312R310-E312 IonicContact NH1-OE1 2.96Å; R310-E312 PolarHBondContact NH1-OE1 2.69Å; R310-E312 VanDerWaalsContact NH1-OE1 3.09Å
311P40.3Very low41.6Very low109 Ų109150.5 Ų150.571%0.70878%0.784SS**  trans-102.8161.6168.539-34000113.9
312E37Very low41.6Very low164 Ų164156 Ų15677%0.76679%0.791SS**  trans-152.6137.8152-70.3-155.7133.100113.8R310R310-E312 IonicContact NH1-OE1 2.96Å; R310-E312 PolarHBondContact NH1-OE1 2.69Å; R310-E312 VanDerWaalsContact NH1-OE1 3.09Å
313H42.3Very low42.3Very low170 Ų170156.1 Ų156.179%0.78779%0.791SS**  trans67.2154.2146.4-106.8-108.1000127
314E37Very low42.3Very low154 Ų154158.5 Ų158.572%0.7279%0.79SS**  trans72.589.8160.8-56.4-132.711200123.2
315I39.4Very low42.3Very low143 Ų143160 Ų16073%0.73379%0.792SS**  37.9112.5118.5-51.9164.5000118.7
316S43.5Very low42.6Very low127 Ų127162.8 Ų162.889%0.88879%0.794SS**  trans-158.7155.6138.5-93.80000113.2
317R40.1Very low42.8Very low247 Ų247164.3 Ų164.393%0.93280%0.801SS**  trans-98.7139.8-173.6-67.2175.7168.9121-6.8112.2
318A46.5Very low43Very low106 Ų106160 Ų16088%0.87680%0.802SS**  trans-117.9156.9163.100000110.9
319R41.2Very low42.9Very low256 Ų256155.7 Ų155.797%0.96680%0.801SS**  trans-121.7151.7-172.2-72.1174.6168.2168.4-5.1112.3
320G39.9Very low43.1Very low65 Ų65156.2 Ų156.267%0.6781%0.806SS**  trans143.7136.3165.900000111.4
321M49.3Very low43.2Very low188 Ų188156.5 Ų156.593%0.92682%0.815SS**  cis-139.7163.6-0.6-76-62.4179.100111.3
322R41.1Very low43.3Very low236 Ų236159.8 Ų159.889%0.89182%0.823SS**  trans-112160.5170.6-89.1-171.8172.5-165.7-1.8110.4
323P54.4Low43.7Very low105 Ų105157.2 Ų157.268%0.68282%0.82SS**  trans-114.5141.9137.1-3.424.2000113
324F46Very low43.7Very low181 Ų181157.7 Ų157.779%0.79482%0.823SS**  trans12.7155.2143.7-42.7-65.1000121.6
325N45.5Very low44.1Very low141 Ų141156.4 Ų156.475%0.75483%0.826SS**  cis-172142.1-22.6-108.90000106.8
326M42.6Very low44.5Very low176 Ų176155.8 Ų155.887%0.86783%0.829SS**  trans-175161.8150.9-106-60.9115.400109.9
327V51.4Low44.4Very low126 Ų126159.4 Ų159.476%0.76482%0.824SS**  trans-93.4129.4-164.9-177.50000112.6
328P43.6Very low45Very low128 Ų128152.6 Ų152.683%0.83181%0.812SS**  trans-92.1111.4164.330.9-23.3000110.3
329G42.9Very low44.6Very low69 Ų69157.3 Ų157.371%0.71181%0.813SS**  trans16139175.400000120
330E40.2Very low44.9Very low202 Ų202152.1 Ų152.194%0.94480%0.804SS**  trans-129.6150158.1-75.6-153.3129.600111.6
331Q42.7Very low45Very low193 Ų193154.6 Ų154.690%0.90280%0.802SS**  trans-99101.1-164.9-170.5172.298.400110.5
332M42.6Very low44.6Very low178 Ų178155.7 Ų155.788%0.87780%0.796SS**  trans-61.7131-179.6-172.4173.6169.300111
333P45.2Very low44.6Very low110 Ų110150.1 Ų150.171%0.71479%0.792SS**  trans-68.8143.3-171.526.3-35.2000112.8T335P333-T335 PolarHBondContact O-N 3.18Å
334Q43.2Very low43.7Very low180 Ų180155.2 Ų155.284%0.84180%0.804SS**  trans-71.9113.3178.5-63.1-179.76.900110.9V336Q334-V336 PolarHBondContact O-N 3.01Å; Q334-V336 VanDerWaalsContact O-N 3.08Å
335T45.4Very low44.2Very low127 Ų127152.3 Ų152.378%0.77980%0.803SS**  trans-73.895.5171.130.30000110.8P333 Y337P333-T335 PolarHBondContact O-N 3.18Å; T335-Y337 PolarHBondContact O-N 3.08Å
336V47.9Very low44.2Very low131 Ų131150.4 Ų150.479%0.79480%0.8SS**  trans-66.7112.5175.7179.60000110.4Q334Q334-V336 PolarHBondContact O-N 3.01Å; Q334-V336 VanDerWaalsContact O-N 3.08Å
337Y40.7Very low44.5Very low203 Ų203147.8 Ų147.880%0.79680%0.797SS**PPolyproline II helixtrans-96142.5159-89.3-93.3000110T335 K339T335-Y337 PolarHBondContact O-N 3.08Å; Y337-K339 PolarHBondContact O-N 3.33Å
338P51.8Low44.6Very low104 Ų104148 Ų14868%0.67580%0.798SS**PPolyproline II helixtrans-72.2130.4-171.428.1-34.6000112.3
339K38.3Very low44.8Very low205 Ų205147.7 Ų147.789%0.89180%0.796SS**PPolyproline II helixtrans-75.5123.7161.6-75.6179.7176175.80108.6Y337Y337-K339 PolarHBondContact O-N 3.33Å
340N47.5Very low44.6Very low146 Ų146156 Ų15678%0.78181%0.807SS**  trans-108.5144.7161.3-74.8-6.9000109.4
341D42.1Very low44.5Very low117 Ų117150 Ų15063%0.62680%0.8SS**  trans-58.5159178.8-63.7-93.1000112.9
342R41.9Very low44.7Very low211 Ų211146.9 Ų146.980%0.79680%0.8SS**  cis174-172.4-1.8-103175.5165.1122.8-2.5104.2
343C39.4Very low44.6Very low120 Ų120144.9 Ų144.981%0.81180%0.797SS**  trans70.870.4157.3-61.10000118.6
344F37.3Very low45Very low212 Ų212145.8 Ų145.893%0.9380%0.803SS**PPolyproline II helixtrans-80.3134.7136.3-81.7-90.2000109.2
345P56.1Low44.6Very low119 Ų119146.7 Ų146.777%0.77381%0.805SS**PPolyproline II helixtrans-82.4145169.632.6-32.6000111.8
346S45.4Very low44.5Very low101 Ų101149.7 Ų149.771%0.70681%0.81SS**PPolyproline II helixtrans-73.7147.3170.7-179.10000111
347P49.1Very low44.2Very low121 Ų121148.9 Ų148.979%0.78681%0.81SS**PPolyproline II helixtrans-64.1152.1166.828.9-35.6000111.5
348V53.3Low44.2Very low132 Ų132147.1 Ų147.180%0.881%0.809SS**  trans-129.1149.4174.4-76.30000110.4
349P47.6Very low43.8Very low121 Ų121150.2 Ų150.279%0.78681%0.814SS**  trans-89.3159.9-166.835-36.9000115.4
350Y38.8Very low44Very low242 Ų242146.1 Ų146.195%0.94981%0.806SS**  trans0.6127163.5-73.4-93.9000120.2
351G39.1Very low44Very low77 Ų77147 Ų14779%0.79481%0.808SS**  trans-152.2134.6163.800000111.9
352S45.3Very low44.4Very low127 Ų127147.5 Ų147.589%0.88882%0.817SS**PPolyproline II helixtrans-60.9154.8-164.2-50.30000118.1
353V41.9Very low44.3Very low137 Ų137144.8 Ų144.883%0.8382%0.818SS**PPolyproline II helixtrans-87.9151167.1-690000113
354P53.5Low44.6Very low129 Ų129143.8 Ų143.884%0.83882%0.819SS**PPolyproline II helixtrans-103.1156.8157.436.2-29.2000112.3
355F35.2Very low44.8Very low199 Ų199139.3 Ų139.387%0.87381%0.809SS**  trans-131.8127.3-170.2-162.8-79.8000110.5
356Q41.9Very low44.2Very low189 Ų189139.3 Ų139.388%0.88381%0.81SS**  trans175155.1171.3-101.7169.133.200108.4
357S41.6Very low44Very low114 Ų114139.4 Ų139.480%0.79781%0.811SS**  cis-155.7174.6-23.1-159.60000109.4
358Q41.4Very low44.4Very low166 Ų166139 Ų13978%0.77681%0.809SS**  trans-82.1158.7-176-58.9162.6-4.800113.1
359H42.8Very low43.9Very low169 Ų169139.1 Ų139.178%0.78281%0.809SS**  -178.4137.7119.6-109.2-121.7000115.3
360V43.9Very low43.8Very low119 Ų119138.9 Ų138.972%0.72181%0.806SS**  trans73.7131.8145.9175.50000121.6
361M47Very low43.9Very low166 Ų166134.7 Ų134.782%0.81880%0.8SS**  trans-124.3168.8162-77.9-79.7161.200108.6
362P51.2Low43.8Very low126 Ų126134.3 Ų134.382%0.81880%0.796SS**  -139.4159127.335.8-23.3000115.5
363N39.4Very low43.7Very low155 Ų155138.8 Ų138.883%0.82980%0.8SS**  trans-90.6160.1-177.1-67.8-34000114.1
364A45Very low43.9Very low99 Ų99143.2 Ų143.282%0.81880%0.802SS**  trans-157.4156.5140.300000111.5
365T41.8Very low43.8Very low117 Ų117142.6 Ų142.672%0.71880%0.797SS**  cis-171.1121.5-49.6-91.40000109.2
366C43Very low44.6Very low119 Ų119139 Ų13980%0.80479%0.794SS**  trans58.1162.7157.2-69.10000120.1
367S41.9Very low44.5Very low104 Ų104135.1 Ų135.173%0.72779%0.788SS**  cis-161.2168.4-17.5-100.40000111.3
368P56.4Low44.5Very low113 Ų113137.4 Ų137.473%0.73479%0.79SS**  trans-108.5-179.4-17241.8-35.9000115.3
369T43.6Very low44.7Very low133 Ų133136.2 Ų136.282%0.81679%0.788SS**  trans-164.5120.5157.2-80.60000115.8
370V46.2Very low44.6Very low117 Ų117134.1 Ų134.171%0.70978%0.783SS**  trans44.2116.7138.4-170.10000124.9
371N40.1Very low44.9Very low153 Ų153134 Ų13482%0.81878%0.783SS**  trans23.3118.4134.9-49.1-11000124.1
372G37.5Very low45Very low69 Ų69131.3 Ų131.371%0.71178%0.778SS**  83.3137.297.400000122.3
373F42.8Very low44.6Very low221 Ų221133.4 Ų133.497%0.96978%0.781SS**  trans-163.1174.7147.4-109.2-69.3000112.4
374R45.7Very low44.7Very low231 Ų231136.6 Ų136.687%0.87278%0.781SS**  trans-98.9159-166.5-98.4-179.7165.4-135.55115.4
375P52.6Low44.8Very low115 Ų115137.2 Ų137.275%0.74778%0.779SS**  trans-100.8167.9168.639.8-34.8000114.3
376P50.9Low45.3Very low124 Ų124137.3 Ų137.381%0.80578%0.781SS**  trans-137124.2152.135.4-19.2000116.3
377S39.2Very low45.7Very low108 Ų108137.9 Ų137.976%0.75578%0.783SS**  trans9.1138.5141.5-53.70000124.9
378L42.9Very low45.9Very low162 Ų162138.4 Ų138.485%0.84879%0.787SS**  trans72.9156.7151-57.8166.2000117.3
379L44.5Very low45.4Very low140 Ų140144.7 Ų144.773%0.73380%0.796SS**  cis-152.4163.916.5-163.466.8000113.2
380D40.9Very low45.9Very low126 Ų126146.3 Ų146.367%0.67480%0.798SS**  trans6990.8150.9-99.2-57.7000126.1
381T50.4Low46.5Very low117 Ų117148.5 Ų148.572%0.71880%0.803SS**  53.4176.8118-7.90000122.7
382P49.6Very low47.5Very low109 Ų109146.5 Ų146.571%0.70880%0.798SS**  -137.5156.2-119.244.9-25.8000120
383L41.5Very low48.8Very low170 Ų170149.2 Ų149.289%0.8980%0.803SS**  trans-148.2111.3159.8-82-175.8000117.2
384R42.9Very low49.1Very low221 Ų221150.3 Ų150.383%0.83480%0.801SS**  70.4103.8121.5-153.3171.7-166.6177.94.5123.4
385C46.3Very low49.4Very low113 Ų113147.5 Ų147.576%0.76480%0.8SS**  trans81.8170.6139.8-63.20000118.8
386P52.5Low49.5Very low118 Ų118153 Ų15377%0.76681%0.805SS**  -122.7173.2-10215.611.5000115.2
387P50.4Low49.3Very low131 Ų131155.4 Ų155.485%0.85181%0.808SS**PPolyproline II helixtrans-83.3155.2-162.932.8-37.6000116.6
388S47.3Very low49.9Very low116 Ų116158.3 Ų158.381%0.81181%0.812SS**PPolyproline II helixtrans-86.8167.5169.254.90000112.6
389R46.4Very low50.3Low244 Ų244157.9 Ų157.992%0.92181%0.81SS**PPolyproline II helixtrans-85139-171.6-56.6176.3-176179.70.6112
390I53.1Low50.5Low167 Ų167157.6 Ų157.686%0.85682%0.817SS**  trans-121.3139.4164.6-60.6179.5000108.2
391M58.8Low50.7Low163 Ų163154.9 Ų154.980%0.80382%0.819SS**PPolyproline II helixtrans-95.4154.2-175.2-61.3-151.67600112.3
392P61.1Low50.6Low112 Ų112154.7 Ų154.773%0.72782%0.822SS**PPolyproline II helixtrans-71.5147.9174.430.6-35.5000111.8
393P65.2Low50.3Low125 Ų125157.2 Ų157.281%0.81283%0.826SS**PPolyproline II helixtrans-72.8148.4175.930.5-34.6000112
394R49.1Very low50.6Low245 Ų245160.2 Ų160.293%0.92583%0.826SS**PPolyproline II helixtrans-69.6136.1174.9-77.3175.2134118.8-7.4111.3
395M52.1Low50.4Low172 Ų172158.8 Ų158.885%0.84783%0.826SS**PPolyproline II helixtrans-67145.2161.3-69.1177.165.900110.5
396R53.7Low50.5Low230 Ų230158.9 Ų158.987%0.86883%0.825SS**PPolyproline II helixtrans-93.7149.8158.2-71.4-174.1174.8-172.8-2108.9M398R396-M398 HydrophobicContact CB-SD 4.41Å
397M47.9Very low50.1Low174 Ų174165.1 Ų165.186%0.85783%0.834SS**PPolyproline II helixtrans-93.4145.3175.6-48-128.279.200109.3
398M52.2Low49.5Very low170 Ų170168.9 Ų168.984%0.83784%0.837SS**  trans-139.4154.2168.4-84.195100.700109.9R396R396-M398 HydrophobicContact CB-SD 4.41Å
399D51.2Low49.6Very low152 Ų152174.3 Ų174.381%0.81384%0.84SS**  trans-68.2147.2-161.2-83.4-71.4000117.4G401D399-G401 PolarHBondContact O-N 3.22Å
400P47.1Very low49.9Very low134 Ų134168.9 Ų168.987%0.8784%0.836SS**  trans-8161.6169.936.2-35000111.5
401G45.9Very low49.2Very low69 Ų69170.8 Ų170.871%0.71183%0.832SS**  trans-113.82-163.700000118.8D399D399-G401 PolarHBondContact O-N 3.22Å
402S48.4Very low48.3Very low113 Ų113168.7 Ų168.779%0.7983%0.832SS**  trans-156.1100.8179.2-167.90000113.9
403M44.1Very low47.2Very low162 Ų162169.8 Ų169.880%0.79883%0.828SS**  trans-103.7100.4176.4-77.3-75.5-86.900111.3F405M403-F405 HydrophobicContact CE-CZ 4.27Å
404R46.2Very low46.1Very low234 Ų234170 Ų17088%0.88383%0.827SS**  trans-131120.1159.2-73.5-167.5177.5-163.61109.6P406R404-P406 WeakPolarHBondContact O-CD 3.49Å
405F40Very low45.6Very low190 Ų190167.6 Ų167.683%0.83382%0.823SS**PPolyproline II helixtrans-72.1128.7-172.8-68.8-96.5000113.6M403M403-F405 HydrophobicContact CE-CZ 4.27Å
406P48.6Very low45.4Very low115 Ų115170.8 Ų170.875%0.74783%0.828SS**PPolyproline II helixtrans-93.3146150.411.48.5000110.3R404R404-P406 WeakPolarHBondContact O-CD 3.49Å
407R43.5Very low44.8Very low250 Ų250163.4 Ų163.494%0.94382%0.823SS**PPolyproline II helixtrans-72.1132.4178.9-70.1175.6172.9148.7-4.1111.3R409R407-R409 PolarHBondContact O-N 3.42Å
408F38.2Very low44.6Very low210 Ų210160.2 Ų160.292%0.92182%0.824SS**PPolyproline II helixtrans-63.2131.4169.3-91.2-99.4000111.4
409R48.1Very low43.8Very low230 Ų230155.8 Ų155.887%0.86882%0.822SS**  trans-129.4139.6152.1-84.1-171.9167.8-167.4-3.6107.6R407R407-R409 PolarHBondContact O-N 3.42Å
410P53.4Low43.6Very low129 Ų129155.1 Ų155.184%0.83882%0.823SS**  trans-68.2142.6177.729.2-34.2000110.6
411R38.4Very low43.5Very low207 Ų207160 Ų16078%0.78182%0.824SS**  trans-108.3103.8-179.3178.4-179.9173.6125.1-5108.8E413R411-E413 HydrophobicContact CG-CG 4.07Å; R411-E413 IonicContact CZ-OE1 3.24Å; R411-E413 VanDerWaalsContact CZ-OE1 3.24Å; R411-E413 IonicContact NE-OE1 2.76Å; R411-E413 PolarHBondContact NE-OE1 3.14Å; R411-E413 IonicContact NH2-OE1 2.84Å; R411-E413 PolarHBondContact NH2-OE1 3.45Å
412C39.1Very low43.5Very low119 Ų119162.5 Ų162.580%0.80483%0.828SS**  trans-76.8123.9165.9-660000108.7
413E38.2Very low43.5Very low135 Ų135161.9 Ų161.963%0.63182%0.824SS**  trans-102.6107.1171.2-62.6-159.2141.600109.6R411R411-E413 HydrophobicContact CG-CG 4.07Å; R411-E413 IonicContact CZ-OE1 3.24Å; R411-E413 VanDerWaalsContact CZ-OE1 3.24Å; R411-E413 IonicContact NE-OE1 2.76Å; R411-E413 PolarHBondContact NE-OE1 3.14Å; R411-E413 IonicContact NH2-OE1 2.84Å; R411-E413 PolarHBondContact NH2-OE1 3.45Å
414T42.8Very low43.8Very low130 Ų130159.1 Ų159.180%0.79882%0.818SS**  trans-119.7100.1168.650.20000108.7Y416T414-Y416 PolarHBondContact O-N 3.23Å
415F39.1Very low43.9Very low194 Ų194153.8 Ų153.885%0.85181%0.813SS**  trans-62.8117.3159.7-92.1-104.1000108.5
416Y47.8Very low44Very low240 Ų240152.1 Ų152.194%0.94181%0.812SS**  trans-158.6145.7137.6-95.1-62.6000109.6T414T414-Y416 PolarHBondContact O-N 3.23Å
417G40.7Very low43.9Very low74 Ų74157.3 Ų157.376%0.76382%0.817SS**  trans-85.9165-168.900000115
418A43.7Very low44Very low107 Ų107149.5 Ų149.588%0.88480%0.798SS**SBendtrans-17.8131.2171.700000118.7
419G34.3Very low44.2Very low77 Ų77146.1 Ų146.179%0.79479%0.79SS**  108.823.1108.300000119.8
420V47.2Very low43.8Very low138 Ų138142.4 Ų142.484%0.83678%0.78SS**  trans-128.6124.8162.4-173.80000110
421R46.2Very low43.4Very low236 Ų236141.6 Ų141.689%0.89177%0.769SS**PPolyproline II helixtrans-79.4124.4168.3-74.4-174.6173.9-146.20.8108.8S423R421-S423 PolarHBondContact O-N 3.19Å
422P46Very low43.9Very low123 Ų123135 Ų13580%0.79976%0.758SS**PPolyproline II helixtrans-68.4125.8160.429.3-31.1000108.4
423S46.8Very low44.6Very low100 Ų100135 Ų13570%0.69976%0.755SS**PPolyproline II helixtrans-60149.6169.1-58.80000110.2R421R421-S423 PolarHBondContact O-N 3.19Å
424P51.8Low45.3Very low104 Ų104134 Ų13468%0.67575%0.749SS**PPolyproline II helixtrans-58.4151.3166.428.7-35.2000109.4I426P424-I426 PolarHBondContact O-N 3.13Å
425P47.7Very low45.8Very low121 Ų121134.4 Ų134.479%0.78674%0.743SS**  trans-60.3113.517326-33.2000108.5R427P425-R427 VanDerWaalsContact C-N 3.32Å; P425-R427 PolarHBondContact O-N 3.38Å
426I42Very low46.6Very low155 Ų155132 Ų13280%0.79573%0.734SS**  trans-65.299.2172.2-60.8175.2000106P424P424-I426 PolarHBondContact O-N 3.13Å
427R46Very low47.3Very low225 Ų225123.1 Ų123.185%0.84971%0.71SS**  trans-55.7129.4164.2-74.3-177.5164.5-135.3-3.7106.7P425 N429P425-R427 VanDerWaalsContact C-N 3.32Å; P425-R427 PolarHBondContact O-N 3.38Å; R427-N429 PolarHBondContact O-N 3.32Å; R427-N429 VanDerWaalsContact O-N 3.1Å
428P46.7Very low48.2Very low86 Ų86124.1 Ų124.156%0.55870%0.697SS**  trans-58.5121.6167.4-16.329000107.1F430P428-F430 HydrophobicContact CB-CD2 3.88Å; P428-F430 HydrophobicContact CB-CE1 4.34Å; P428-F430 HydrophobicContact CB-CE2 3.62Å; P428-F430 HydrophobicContact CB-CG 4.35Å; P428-F430 HydrophobicContact CB-CZ 3.87Å; P428-F430 HydrophobicContact CG-CD2 4.49Å; P428-F430 HydrophobicContact CG-CE2 3.82Å; P428-F430 HydrophobicContact CG-CZ 4.06Å; P428-F430 PolarHBondContact O-N 3.41Å
429N41.4Very low49.6Very low139 Ų139123.2 Ų123.274%0.74368%0.68SS**  trans-73.784.3165.2-171.377.4000106R427 D431R427-N429 PolarHBondContact O-N 3.32Å; R427-N429 VanDerWaalsContact O-N 3.1Å; N429-D431 PolarHBondContact O-N 3.44Å
430F41Very low51.7Low152 Ų152123 Ų12367%0.66767%0.666SS**  trans-65.9105.7174.9-75.3-72.6000107.9P428 A432P428-F430 HydrophobicContact CB-CD2 3.88Å; P428-F430 HydrophobicContact CB-CE1 4.34Å; P428-F430 HydrophobicContact CB-CE2 3.62Å; P428-F430 HydrophobicContact CB-CG 4.35Å; P428-F430 HydrophobicContact CB-CZ 3.87Å; P428-F430 HydrophobicContact CG-CD2 4.49Å; P428-F430 HydrophobicContact CG-CE2 3.82Å; P428-F430 HydrophobicContact CG-CZ 4.06Å; P428-F430 PolarHBondContact O-N 3.41Å; F430-A432 PolarHBondContact O-N 3.27Å
431D44.1Very low53.5Low111 Ų111119.5 Ų119.559%0.59465%0.648SS**  trans-58.4131.2169.6-66.1-52.8000108.8N429 V433 H434N429-D431 PolarHBondContact O-N 3.44Å; D431-V433 PolarHBondContact O-N 2.91Å; D431-H434 PolarHBondContact O-N 3.11Å
432A49.5Very low55.2Low69 Ų69113.9 Ų113.957%0.5763%0.632SS**Hα-helixtrans-54.1-23.6-170.900000114F430 H434 E435 E436F430-A432 PolarHBondContact O-N 3.27Å; A432-H434 PolarHBondContact O-N 3.02Å; A432-E435 PolarHBondContact O-N 3.15Å; A432-E436 PolarHBondContact O-N 3.16Å
433V54.5Low57.2Low119 Ų119113.4 Ų113.472%0.72162%0.622SS**Hα-helixtrans-55.2-30.5174.8-160.90000112.9D431D431-V433 PolarHBondContact O-N 2.91Å
434H52.7Low59.2Low113 Ų113114.4 Ų114.452%0.52362%0.62SS.*Hα-helixtrans-85.9-23.4176.8-159.2-51.3000112.8D431 A432 I438D431-H434 PolarHBondContact O-N 3.11Å; A432-H434 PolarHBondContact O-N 3.02Å; H434-I438 WeakPolarHBondContact O-CG1 3.46Å; H434-I438 PolarHBondContact O-N 3.13Å
435E52.4Low60.7Low140 Ų140114.8 Ų114.865%0.65461%0.614SS**Hα-helixtrans-73.8-43.3176.8-163.6164.9-140.600110.4A432 A437 I438 V439A432-E435 PolarHBondContact O-N 3.15Å; E435-A437 VanDerWaalsContact C-N 3.27Å; E435-A437 PolarHBondContact O-N 3.43Å; E435-I438 PolarHBondContact O-N 3.14Å; E435-V439 WeakPolarHBondContact O-CG2 3.49Å; E435-V439 PolarHBondContact O-N 3.2Å
436E56.7Low62.6Low143 Ų143114 Ų11467%0.66860%0.601SS**Hα-helixtrans-60.9-34172.4-67.1-166.5152.300112.8A432 S440A432-E436 PolarHBondContact O-N 3.16Å; E436-S440 VanDerWaalsContact O-CB 3.26Å; E436-S440 WeakPolarHBondContact O-CB 3.47Å; E436-S440 PolarHBondContact O-N 2.8Å; E436-S440 PolarHBondContact O-OG 3.41Å
437A61.7Low64.6Low53 Ų53109 Ų10944%0.43858%0.583SS.*Hα-helixtrans-67.6-37.7175.800000112.9E435 S441E435-A437 VanDerWaalsContact C-N 3.27Å; E435-A437 PolarHBondContact O-N 3.43Å; A437-S441 WeakPolarHBondContact O-CB 3.19Å; A437-S441 PolarHBondContact O-N 2.83Å; A437-S441 VanDerWaalsContact O-N 3.15Å
438I60.6Low66.4Low96 Ų96100.9 Ų100.949%0.49256%0.564SS.*Hα-helixtrans-68.9-47.9175-67.7165000110H434 E435 S440 S441 E442H434-I438 WeakPolarHBondContact O-CG1 3.46Å; H434-I438 PolarHBondContact O-N 3.13Å; E435-I438 PolarHBondContact O-N 3.14Å; I438-S440 VanDerWaalsContact C-N 3.32Å; I438-S440 PolarHBondContact O-N 3.47Å; I438-S441 PolarHBondContact O-N 2.77Å; I438-E442 PolarHBondContact O-N 2.85Å
439V72.1Confident68Low88 Ų88102.7 Ų102.753%0.53357%0.568SS.*Hα-helixtrans-61.2-40178.7172.90000111.5E435 E442 L443E435-V439 WeakPolarHBondContact O-CG2 3.49Å; E435-V439 PolarHBondContact O-N 3.2Å; V439-E442 PolarHBondContact O-N 3.37Å; V439-L443 WeakPolarHBondContact O-CB 3.35Å; V439-L443 PolarHBondContact O-N 2.98Å
440S79.6Confident69.9Low71 Ų71102 Ų10250%0.49756%0.564SS.*Hα-helixtrans-64.3-43.1176.2-59.50000112.1E436 I438 L443 D444E436-S440 VanDerWaalsContact O-CB 3.26Å; E436-S440 WeakPolarHBondContact O-CB 3.47Å; E436-S440 PolarHBondContact O-N 2.8Å; E436-S440 PolarHBondContact O-OG 3.41Å; I438-S440 VanDerWaalsContact C-N 3.32Å; I438-S440 PolarHBondContact O-N 3.47Å; S440-L443 PolarHBondContact O-N 3.27Å; S440-D444 PolarHBondContact O-N 2.97Å
441S84.9Confident71.6Confident66 Ų6698.4 Ų98.446%0.46256%0.562SS.*Hα-helixtrans-63.8-40.6177.1-1750000112.5A437 I438 M445A437-S441 WeakPolarHBondContact O-CB 3.19Å; A437-S441 PolarHBondContact O-N 2.83Å; A437-S441 VanDerWaalsContact O-N 3.15Å; I438-S441 PolarHBondContact O-N 2.77Å; S441-M445 WeakPolarHBondContact O-CG 3.28Å; S441-M445 PolarHBondContact O-N 3.04Å
442E81.2Confident72.9Confident118 Ų11898 Ų9855%0.55157%0.568SS**Hα-helixtrans-70.4-35.1176.9-166.3164.7-154.100112.3I438 V439 M446I438-E442 PolarHBondContact O-N 2.85Å; V439-E442 PolarHBondContact O-N 3.37Å; E442-M446 PolarHBondContact O-N 3.17Å; E442-M446 VanDerWaalsContact O-N 3.08Å
443L88.1Confident73.7Confident113 Ų11398.3 Ų98.359%0.59257%0.566SS**Hα-helixtrans-66.6-43.9173.8-167.570.4000112.2V439 S440 M446 A447V439-L443 WeakPolarHBondContact O-CB 3.35Å; V439-L443 PolarHBondContact O-N 2.98Å; S440-L443 PolarHBondContact O-N 3.27Å; L443-M446 HydrophobicContact CD1-CE 4.49Å; L443-M446 PolarHBondContact O-N 3.05Å; L443-A447 PolarHBondContact O-N 2.91Å
444D88.2Confident73.9Confident120 Ų120101.7 Ų101.764%0.64257%0.571SS**Hα-helixtrans-64.4-39.1176.3-104.40.4000111.9S440 M446 A447 A448S440-D444 PolarHBondContact O-N 2.97Å; D444-M446 VanDerWaalsContact C-N 3.34Å; D444-M446 PolarHBondContact O-N 3.04Å; D444-A447 PolarHBondContact O-N 3.3Å; D444-A448 WeakPolarHBondContact O-CB 3.33Å; D444-A448 PolarHBondContact O-N 3.32Å
445M84.6Confident73.7Confident112 Ų112102 Ų10255%0.55258%0.581SS**Hα-helixtrans-62.1-40.2172.7-76.8-171.2-73.200112.1S441 L449S441-M445 WeakPolarHBondContact O-CG 3.28Å; S441-M445 PolarHBondContact O-N 3.04Å; M445-L449 VanDerWaalsContact O-CG 3.3Å; M445-L449 WeakPolarHBondContact O-CG 3.29Å; M445-L449 PolarHBondContact O-N 3.16Å; M445-L449 VanDerWaalsContact O-N 3.13Å
446M85.9Confident73.1Confident105 Ų105103.9 Ų103.952%0.51759%0.592SS.*Hα-helixtrans-67.4-38.6173.4-73.7-167-75.700112.6E442 L443 D444 L449 L450E442-M446 PolarHBondContact O-N 3.17Å; E442-M446 VanDerWaalsContact O-N 3.08Å; L443-M446 HydrophobicContact CD1-CE 4.49Å; L443-M446 PolarHBondContact O-N 3.05Å; D444-M446 VanDerWaalsContact C-N 3.34Å; D444-M446 PolarHBondContact O-N 3.04Å; M446-L449 PolarHBondContact O-N 2.64Å; M446-L450 WeakPolarHBondContact O-CG 3.29Å; M446-L450 PolarHBondContact O-N 2.85Å
447A85.7Confident72.4Confident51 Ų51103.5 Ų103.542%0.42160%0.595SS.*Hα-helixtrans-63.7-43.7175.900000112.1L443 D444 L449 L450 A451L443-A447 PolarHBondContact O-N 2.91Å; D444-A447 PolarHBondContact O-N 3.3Å; A447-L449 PolarHBondContact O-N 3.16Å; A447-L450 PolarHBondContact O-N 2.85Å; A447-A451 WeakPolarHBondContact O-CB 3.35Å; A447-A451 PolarHBondContact O-N 3.45Å
448A83.6Confident71.7Confident54 Ų54108 Ų10845%0.44661%0.611SS.*Hα-helixtrans-63.2-39.6176.700000112.5D444 S452D444-A448 WeakPolarHBondContact O-CB 3.33Å; D444-A448 PolarHBondContact O-N 3.32Å; A448-S452 WeakPolarHBondContact O-CB 3.3Å; A448-S452 PolarHBondContact O-N 3.1Å; A448-S452 PolarHBondContact O-OG 3Å
449L79.7Confident71.4Confident124 Ų124111.1 Ų111.165%0.64963%0.629SS**Hα-helixtrans-66.5-41.8174.9-72.9169.9000112.1M445 M446 A447 S452 S453M445-L449 VanDerWaalsContact O-CG 3.3Å; M445-L449 WeakPolarHBondContact O-CG 3.29Å; M445-L449 PolarHBondContact O-N 3.16Å; M445-L449 VanDerWaalsContact O-N 3.13Å; M446-L449 PolarHBondContact O-N 2.64Å; A447-L449 PolarHBondContact O-N 3.16Å; L449-S452 PolarHBondContact O-N 3.19Å; L449-S453 PolarHBondContact O-N 3.35Å; L449-S453 VanDerWaalsContact O-N 3.11Å
450L80.5Confident70Confident125 Ų125112.6 Ų112.665%0.65464%0.642SS**Hα-helixtrans-64.7-44.6175.4-73.2170.4000111.7M446 A447 S452 S453M446-L450 WeakPolarHBondContact O-CG 3.29Å; M446-L450 PolarHBondContact O-N 2.85Å; A447-L450 PolarHBondContact O-N 2.85Å; L450-S452 VanDerWaalsContact C-N 3.32Å; L450-S452 PolarHBondContact O-N 3.14Å; L450-S453 PolarHBondContact O-N 3.45Å; L450-S453 VanDerWaalsContact O-N 3.16Å; L450-S453 PolarHBondContact O-OG 3.41Å
451A77Confident68.5Low76 Ų76118.5 Ų118.563%0.62866%0.658SS**Hα-helixtrans-59.3-42.2174.800000112.1A447 S453A447-A451 WeakPolarHBondContact O-CB 3.35Å; A447-A451 PolarHBondContact O-N 3.45Å; A451-S453 VanDerWaalsContact C-N 3.25Å; A451-S453 PolarHBondContact O-N 3.26Å
452S72.4Confident66.5Low102 Ų102122.9 Ų122.971%0.71368%0.677SS**Hα-helixtrans-69.7-18.2178.3-56.90000114A448 L449 L450A448-S452 WeakPolarHBondContact O-CB 3.3Å; A448-S452 PolarHBondContact O-N 3.1Å; A448-S452 PolarHBondContact O-OG 3Å; L449-S452 PolarHBondContact O-N 3.19Å; L450-S452 VanDerWaalsContact C-N 3.32Å; L450-S452 PolarHBondContact O-N 3.14Å
453S65.6Low64.6Low76 Ų76120.5 Ų120.553%0.53168%0.684SS.*THydrogen-bonded Turntrans-81.9-8-176.6750000114.8L449 L450 A451 T455L449-S453 PolarHBondContact O-N 3.35Å; L449-S453 VanDerWaalsContact O-N 3.11Å; L450-S453 PolarHBondContact O-N 3.45Å; L450-S453 VanDerWaalsContact O-N 3.16Å; L450-S453 PolarHBondContact O-OG 3.41Å; A451-S453 VanDerWaalsContact C-N 3.25Å; A451-S453 PolarHBondContact O-N 3.26Å; S453-T455 VanDerWaalsContact C-N 3.33Å; S453-T455 PolarHBondContact O-N 2.99Å
454K59.4Low62.4Low189 Ų189120.9 Ų120.982%0.82270%0.696SS**  trans-84.569.4-169-160.3160.9-172.8172.50113.2M456K454-M456 PolarHBondContact O-N 2.96Å
455T47.5Very low60Low121 Ų121120.6 Ų120.674%0.74270%0.699SS**  trans-65.6120172.853.20000111.3S453S453-T455 VanDerWaalsContact C-N 3.33Å; S453-T455 PolarHBondContact O-N 2.99Å
456M39.7Very low58.1Low178 Ų178122.3 Ų122.388%0.87771%0.709SS**  trans-48.5131.2171.247.8-157.361.600114.3K454K454-M456 PolarHBondContact O-N 2.96Å
457N42Very low56.6Low136 Ų136122.8 Ų122.873%0.72772%0.72SS**  trans-137.4148.1161.6-89.3-26.8000106.5
458D48.2Very low54.9Low147 Ų147125.9 Ų125.979%0.78674%0.736SS**  trans60.7128.1168.4-41.9-43000115.3
459D53.4Low52.9Low162 Ų162128.1 Ų128.187%0.86675%0.748SS**  cis-148.1150.723.8-111.1-53.7000112.3
460C42.1Very low51.1Low119 Ų119127.7 Ų127.780%0.80476%0.755SS**  trans-118.8103.3177.1-82.70000112.3
461K49.3Very low49.7Very low194 Ų194127 Ų12784%0.84376%0.759SS**  trans-167.5126.2148.6-109.8147.3-171169.70116.5
462N42.8Very low47.9Very low158 Ų158129.3 Ų129.385%0.84577%0.765SS**  trans48.9117.7142.1-60.514.4000121.2
463G40.4Very low46.2Very low69 Ų69130.4 Ų130.471%0.71177%0.771SS**  145.290112.400000119.3
464S41.7Very low45Very low121 Ų121133 Ų13385%0.84678%0.784SS**  trans66.5149.8148.7-63.30000118.4
465T39.2Very low44.1Very low114 Ų114127.2 Ų127.270%0.69978%0.777SS**  cis-161.2138.8-2-114.40000112.1
466I43.7Very low43.6Very low147 Ų147129.2 Ų129.275%0.75478%0.778SS**  trans58.1119.5156.6-62.6170.9000121
467P55.6Low43.7Very low116 Ų116129 Ų12975%0.75378%0.775SS**  trans-102.8175.7152.440-32.5000112.4
468P49.6Very low43.4Very low116 Ų116127 Ų12775%0.75377%0.771SS**  -157.8179115.337.9-18000118.8
469S41.6Very low43.1Very low101 Ų101126.8 Ų126.871%0.70677%0.77SS**  trans76.491.4147.845.90000123.5
470S42.5Very low42.3Very low114 Ų114126.8 Ų126.880%0.79776%0.764SS**  18.7172.9105-12.50000122.5
471P50.8Low42Very low112 Ų112127.5 Ų127.573%0.72776%0.759SS**  cis-147.8-174-6.746.3-27.4000118.5
472T37.6Very low41.4Very low123 Ų123126.4 Ų126.476%0.75576%0.757SS**  trans61.5123144.1-50.60000124.2V474T472-V474 HydrophobicContact CG2-CG1 4.45Å
473C37.9Very low41Very low126 Ų126123.7 Ų123.785%0.85175%0.751SS**  trans-149.7161.8136.2-1590000109.5
474V39.5Very low40.8Very low130 Ų130127.2 Ų127.279%0.78876%0.759SS**  trans-152.3164.6-166.8-69.20000114.6T472T472-V474 HydrophobicContact CG2-CG1 4.45Å
475G41.2Very low40.5Very low67 Ų67126.4 Ų126.469%0.69175%0.753SS**  trans110.6153.916300000116.3
476E36.6Very low41.2Very low163 Ų163126.7 Ų126.776%0.76276%0.757SS**  176.3167.2-62.6-94.2-170.4109.500108.8
477H41.3Very low41.2Very low174 Ų174125.6 Ų125.681%0.80676%0.759SS**  trans72.5151.4170.6-57.1-61.4000119.1
478S37.7Very low40.4Very low93 Ų93128.1 Ų128.165%0.6576%0.761SS**  cis-171.6171.9-24-170.40000110.2
479L40.6Very low39.7Very low144 Ų144129.3 Ų129.375%0.75476%0.76SS**  trans71.4153.3166-51.8-179.6000117.9
480Q37.9Very low39.5Very low162 Ų162132.9 Ų132.976%0.75776%0.764SS**  cis-161.4-177.9-43.2-127.7-178.716.900109.9
481L35Very low39.2Very low133 Ų133131.3 Ų131.370%0.69675%0.752SS**  trans-20.3158.7167.3-62.8156.5000118.2
482E36.6Very low38.7Very low171 Ų171135 Ų13580%0.79976%0.757SS**  cis-160.6178.935.8-154.8149.993.100115.4
483S33.5Very low38.6Very low102 Ų102133.9 Ų133.971%0.71375%0.75SS**  trans-76.5162.6-177-37.20000115.5
484T36.4Very low38.7Very low142 Ų142136.1 Ų136.187%0.87175%0.748SS**  -173.7156.4129.2-79.10000111.9
485S36.7Very low38.6Very low104 Ų104135.1 Ų135.173%0.72774%0.742SS**  trans-96.5169.3-17050.70000115.1
486P52.2Low38.6Very low120 Ų120140.7 Ų140.778%0.77975%0.75SS**  trans-98.7169.1-172.839.2-36.5000114.5
487P45.4Very low38.6Very low124 Ų124137 Ų13781%0.80575%0.748SS**  trans-111.3150.9161.837.4-28.2000113.5
488Q37.5Very low38.6Very low170 Ų170136.3 Ų136.379%0.79475%0.749SS**  trans-88.1169155.1-60.6-166.115.400109.9
489L36.2Very low39.1Very low141 Ų141137.4 Ų137.474%0.73875%0.754SS**  178.4130.3117-112.890.3000112.3
490F36.9Very low39.5Very low176 Ų176136.1 Ų136.177%0.77275%0.754SS**  trans56.8155.9130.1-75.3-136.7000121
491S36.5Very low39.5Very low80 Ų80135.6 Ų135.656%0.55976%0.756SS**  cis-177.3149.7-22.5600000111.3
492K39.4Very low39.8Very low190 Ų190136.8 Ų136.883%0.82676%0.762SS**  trans67.7159.4151.6-71.2177.7178.6-176.80116.8
493T36.7Very low39.8Very low100 Ų100134.7 Ų134.761%0.61376%0.76SS**  cis-160.3150.30.54.80000110.4
494E39.2Very low40.3Very low173 Ų173136.3 Ų136.381%0.80877%0.765SS**  trans60.2155143.8-70.6164.1135.800119.7
495T38Very low40.5Very low109 Ų109137.8 Ų137.867%0.66976%0.763SS**  cis-163.3145.9-4.7-110.90000112.9
496E39.7Very low40.5Very low183 Ų183138.6 Ų138.686%0.85576%0.759SS**  trans51.9162.4156.5-70.7-165.2133.900126.9
497A37.3Very low40Very low87 Ų87143.3 Ų143.372%0.71976%0.761SS**  trans71.499.4157.100000120.7
498I41.3Very low39.7Very low159 Ų159143 Ų14382%0.81576%0.761SS**  55.9133.366.4-56.3-179.8000114.8
499P47.5Very low39.8Very low116 Ų116138.8 Ų138.875%0.75376%0.756SS**  cis-108.4-106-10.429.3-7000110.8
500P50.6Low40.3Very low117 Ų117138.1 Ų138.176%0.7676%0.76SS**  cis-111.2-165.9-843.5-31000114.4
501N36.8Very low40.3Very low151 Ų151136.4 Ų136.481%0.80776%0.759SS**  trans-98.6151.2171.2-84.3-46.5000112.6
502I41.6Very low40.3Very low158 Ų158142.1 Ų142.181%0.8177%0.774SS**  trans-136135.9147.9-65-176.3000108.8V504I502-V504 HydrophobicContact CG2-CG2 4.08Å
503V37.5Very low40.1Very low126 Ų126138.9 Ų138.976%0.76477%0.77SS**  trans-115.4130.8171175.20000108.1
504V43.8Very low40Very low136 Ų136139.5 Ų139.582%0.82477%0.774SS**  trans-141150.4165-175.20000107.9I502I502-V504 HydrophobicContact CG2-CG2 4.08Å
505E39.7Very low39.8Very low174 Ų174137.8 Ų137.881%0.81378%0.776SS**  trans-126.1161.2-158.7-151.2178.4145.300113
506D36.6Very low39.8Very low121 Ų121138.4 Ų138.465%0.64778%0.78SS**  trans74.7150.5157.9-16128.4000120.4
507R41Very low39.8Very low219 Ų219138.3 Ų138.383%0.82678%0.779SS**  trans73.1129.5166.7-45.7-165170.4-153.2-12.1117.3
508S40.9Very low39.8Very low116 Ų116143.5 Ų143.581%0.81179%0.791SS**  cis-159.7153.2747.30000112
509A39.6Very low39.6Very low83 Ų83139.4 Ų139.469%0.68679%0.788SS**  trans-74.3170.7171.200000112.7
510P45.4Very low39.1Very low126 Ų126137.7 Ų137.782%0.81879%0.791SS**  -135.7161.596.239.4-30.4000115
511D36.7Very low38.9Very low141 Ų141138.3 Ų138.375%0.75479%0.792SS**  trans-71.4155.2-179.9-53.1-94.6000114.3
512F37.5Very low39.7Very low199 Ų199136.1 Ų136.187%0.87379%0.786SS**  trans-140.4111.3150.7-138.5-87.6000111.2
513T34.5Very low40.3Very low122 Ų122133.7 Ų133.775%0.74878%0.781SS**  trans-86.5123.1-179.1520000111.5
514T35.8Very low40.9Very low114 Ų114133.6 Ų133.670%0.69979%0.786SS**  trans-130.9104.2166.6-60.90000110.6
515T34.3Very low41.4Very low136 Ų136135.5 Ų135.583%0.83479%0.786SS**  trans-88.7103.2176-60.60000110.5
516T37.6Very low42.5Very low123 Ų123129.8 Ų129.876%0.75577%0.773SS**  trans-121.396.1169.7-56.20000111.1
517Q39.1Very low43.8Very low180 Ų180130.4 Ų130.484%0.84178%0.784SS**  trans-12.2118.5169.8-61.8172.565.700118
518M37.5Very low44.9Very low197 Ų197123.9 Ų123.997%0.9778%0.777SS**  trans-71.1121155.2-70.2-83.3-79.100109.1
519G36.8Very low46.3Very low72 Ų72124.2 Ų124.274%0.74278%0.776SS**  trans-168.121.8-173.400000117.5V521G519-V521 PolarHBondContact O-N 3.47Å
520G37.5Very low47.4Very low80 Ų80132.8 Ų132.883%0.82579%0.791SS**  trans-80.797.6-179.500000113.3
521V47.2Very low48.5Very low130 Ų130137 Ų13779%0.78879%0.79SS**PPolyproline II helixtrans-71.5129.7169.8179.90000109.2G519G519-V521 PolarHBondContact O-N 3.47Å
522P53.9Low50.1Low105 Ų105138.8 Ų138.868%0.68280%0.799SS**PPolyproline II helixtrans-65138.4176.127.3-34.3000110.3S524P522-S524 PolarHBondContact O-N 3.16Å; P522-S524 VanDerWaalsContact O-N 3.16Å
523P54.2Low51.5Low108 Ų108134.7 Ų134.770%0.70179%0.785SS**PPolyproline II helixtrans-64.2120.2-178.625.7-33.6000110.4Q525P523-Q525 VanDerWaalsContact C-N 3.3Å; P523-Q525 PolarHBondContact O-N 2.86Å
524S49.9Very low53Low123 Ų123135 Ų13586%0.8679%0.789SS**  trans-64.988.5171.2-179.10000109.7P522 G526P522-S524 PolarHBondContact O-N 3.16Å; P522-S524 VanDerWaalsContact O-N 3.16Å; S524-G526 PolarHBondContact O-N 3.03Å; S524-G526 VanDerWaalsContact O-N 3.16Å
525Q53.8Low54Low177 Ų177135.5 Ų135.583%0.82779%0.787SS**  trans-71.1107.8172.9-65.3-169.19.600108.4P523P523-Q525 VanDerWaalsContact C-N 3.3Å; P523-Q525 PolarHBondContact O-N 2.86Å
526G62.7Low55.3Low53 Ų53133.9 Ų133.955%0.54677%0.773SS.*PPolyproline II helixtrans-62.6170.3170.800000112.2S524 A528S524-G526 PolarHBondContact O-N 3.03Å; S524-G526 VanDerWaalsContact O-N 3.16Å; G526-A528 PolarHBondContact O-N 2.8Å
527P65Low56.3Low134 Ų134137.3 Ų137.387%0.8778%0.783SS**SBendtrans-54.9126.6-177.923.4-34.1000111.1
528A62.7Low57.5Low82 Ų82134.2 Ų134.268%0.67878%0.777SS**PPolyproline II helixtrans-59.5138.4-174.500000111.4G526 W530G526-A528 PolarHBondContact O-N 2.8Å; A528-W530 PolarHBondContact O-N 2.88Å
529P71.7Confident58.5Low123 Ų123129.2 Ų129.280%0.79976%0.757SS**PPolyproline II helixtrans-65.9125.6-179.426.4-33.8000110.9R531P529-R531 PolarHBondContact O-N 3.24Å
530W61.4Low59.9Low263 Ų263135.3 Ų135.3100%0.99676%0.763SS**PPolyproline II helixtrans-58.3126177.5-65.783.7000111A528A528-W530 PolarHBondContact O-N 2.88Å
531R69.2Low60.9Low214 Ų214135.4 Ų135.481%0.80874%0.744SS**  trans-114.9133.9172.666.4-176.7-177.9-174.8-0.7110.2P529 I533P529-R531 PolarHBondContact O-N 3.24Å; R531-I533 PolarHBondContact O-N 3.29Å
532L70.2Confident61.5Low179 Ų179133 Ų13394%0.93773%0.731SS**  trans-76.3120.9176.1-135.673.2000109.2
533I67.2Low61.5Low113 Ų113137.3 Ų137.358%0.57974%0.735SS**  trans-97.3118.3174-60177.4000107.8R531 L535R531-I533 PolarHBondContact O-N 3.29Å; I533-L535 HydrophobicContact CG2-CD2 4.25Å; I533-L535 PolarHBondContact O-N 3.1Å
534P66.3Low61.8Low128 Ų128137.7 Ų137.783%0.83174%0.737SS**  trans-66.6113.2172.4-17.931.8000109.9
535L56.3Low62.3Low125 Ų125137.9 Ų137.965%0.65473%0.728SS**  trans-93.1121.1173.4-64.9179.6000109.8I533 M537 I541I533-L535 HydrophobicContact CG2-CD2 4.25Å; I533-L535 PolarHBondContact O-N 3.1Å; L535-M537 PolarHBondContact O-N 2.88Å; L535-I541 HydrophobicContact CD2-CD1 3.88Å
536D61Low62.5Low103 Ų103134.2 Ų134.255%0.55171%0.712SS**  trans-66.5117.9169.4-174-34.7000109.3T538 V539D536-T538 VanDerWaalsContact CG-OG1 3.23Å; D536-T538 PolarHBondContact O-N 2.94Å; D536-T538 VanDerWaalsContact OD1-CB 3.3Å; D536-T538 WeakPolarHBondContact OD1-CB 3.22Å; D536-T538 WeakPolarHBondContact OD1-CG2 3.03Å; D536-T538 PolarHBondContact OD1-N 3.18Å; D536-T538 PolarHBondContact OD1-OG1 3.38Å; D536-V539 HydrophobicContact CB-CG2 4.4Å; D536-V539 PolarHBondContact O-N 3.43Å
537M58.7Low62.2Low194 Ų194140.1 Ų140.196%0.95673%0.726SS**THydrogen-bonded Turntrans-64.3-9.4-176.3-62.7-17571.500114.1L535L535-M537 PolarHBondContact O-N 2.88Å
538T64.1Low61.7Low115 Ų115139.2 Ų139.271%0.70671%0.713SS**THydrogen-bonded Turntrans-76.8-22.1173.264.80000113.1D536D536-T538 VanDerWaalsContact CG-OG1 3.23Å; D536-T538 PolarHBondContact O-N 2.94Å; D536-T538 VanDerWaalsContact OD1-CB 3.3Å; D536-T538 WeakPolarHBondContact OD1-CB 3.22Å; D536-T538 WeakPolarHBondContact OD1-CG2 3.03Å; D536-T538 PolarHBondContact OD1-N 3.18Å; D536-T538 PolarHBondContact OD1-OG1 3.38Å
539V58.1Low61.2Low92 Ų92139.7 Ų139.756%0.55871%0.709SS**  trans-91110.6-175.6-1740000111.2D536 I541D536-V539 HydrophobicContact CB-CG2 4.4Å; D536-V539 PolarHBondContact O-N 3.43Å; V539-I541 HydrophobicContact CG1-CG1 3.99Å; V539-I541 PolarHBondContact O-N 3.04Å
540K66.4Low60.5Low200 Ų200137.7 Ų137.787%0.8769%0.694SS**  trans-77.983.2172.4-71.7173.4-177.41340110.8P542K540-P542 VanDerWaalsContact O-CD 3.29Å; K540-P542 WeakPolarHBondContact O-CD 3.49Å
541I59.5Low60.5Low82 Ų82132.5 Ų132.542%0.42169%0.686SS.*  trans-66121.1170.5-57.9178.7000108.8L535 V539 L545L535-I541 HydrophobicContact CD2-CD1 3.88Å; V539-I541 HydrophobicContact CG1-CG1 3.99Å; V539-I541 PolarHBondContact O-N 3.04Å; I541-L545 HydrophobicContact CG2-CB 3.69Å; I541-L545 HydrophobicContact CG2-CD1 4.17Å
542P59.4Low59.6Low81 Ų81129.1 Ų129.153%0.52668%0.684SS.*  trans-65.4140.7172.9-22.635.7000111.5K540 P544 L545K540-P542 VanDerWaalsContact O-CD 3.29Å; K540-P542 WeakPolarHBondContact O-CD 3.49Å; P542-P544 VanDerWaalsContact C-N 3.26Å; P542-P544 WeakPolarHBondContact O-CD 3.23Å; P542-L545 PolarHBondContact O-N 3.17Å
543Y52.8Low58.5Low194 Ų194126.7 Ų126.776%0.76167%0.671SS**G310 helixtrans-46.9-34.7-178.8-129.7-96.8000116L545 M546Y543-L545 PolarHBondContact O-N 2.98Å; Y543-M546 PolarHBondContact O-N 3.34Å
544P61.7Low57.5Low116 Ų116127.2 Ų127.275%0.75368%0.682SS**G310 helixtrans-59.7-23.9174.9-28.437.5000116.1P542 M546P542-P544 VanDerWaalsContact C-N 3.26Å; P542-P544 WeakPolarHBondContact O-CD 3.23Å; P544-M546 PolarHBondContact O-N 3.18Å
545L60.3Low56.6Low127 Ų127129 Ų12967%0.66567%0.674SS**G310 helixtrans-79.58.7179.9-83.7175.5000114.3I541 P542 Y543I541-L545 HydrophobicContact CG2-CB 3.69Å; I541-L545 HydrophobicContact CG2-CD1 4.17Å; P542-L545 PolarHBondContact O-N 3.17Å; Y543-L545 PolarHBondContact O-N 2.98Å
546M58.8Low56.4Low100 Ų100132.2 Ų132.249%0.49368%0.677SS.*G310 helixtrans-93.1-7.8178.9-73.818056.300114.6Y543 P544 L548Y543-M546 PolarHBondContact O-N 3.34Å; P544-M546 PolarHBondContact O-N 3.18Å; M546-L548 HydrophobicContact CB-CG 4.44Å; M546-L548 HydrophobicContact CE-CD1 4.05Å; M546-L548 PolarHBondContact O-N 2.97Å
547E55.6Low56Low178 Ų178137.2 Ų137.283%0.83269%0.694SS**  trans45.327.5173.3-60.9-168.2154.100116.4P549E547-P549 WeakPolarHBondContact O-CD 3.05Å
548L55.4Low55.8Low114 Ų114133.9 Ų133.960%0.59768%0.676SS**  trans-69.2128176.5-65.9178.5000109.8M546 V550M546-L548 HydrophobicContact CB-CG 4.44Å; M546-L548 HydrophobicContact CE-CD1 4.05Å; M546-L548 PolarHBondContact O-N 2.97Å; L548-V550 WeakPolarHBondContact O-CG2 3.4Å; L548-V550 PolarHBondContact O-N 3.18Å
549P51.9Low55.2Low92 Ų92131.6 Ų131.660%0.59766%0.66SS**  trans-53.3122.7173.6-27.335.7000110.9E547E547-P549 WeakPolarHBondContact O-CD 3.05Å
550V56.6Low55.3Low81 Ų81132.2 Ų132.249%0.49167%0.666SS.*SBendtrans-87.7-15-170.3-175.70000111.5L548L548-V550 WeakPolarHBondContact O-CG2 3.4Å; L548-V550 PolarHBondContact O-N 3.18Å
551D60.4Low55.1Low154 Ų154132.8 Ų132.882%0.82466%0.662SS**THydrogen-bonded Turntrans-83.5-23.2-167.2-52.4-75.9000113.9
552D51.1Low55Low143 Ų143134.8 Ų134.877%0.76567%0.673SS**THydrogen-bonded Turntrans-97.126.1-178.7-75.1-46.6000114.2P554D552-P554 VanDerWaalsContact O-CD 3.22Å; D552-P554 WeakPolarHBondContact O-CD 3.37Å
553L46.8Very low54.8Low128 Ų128140.4 Ų140.467%0.6768%0.684SS**  trans-11089.2-179.8-71.5178.8000113.1Y555L553-Y555 VanDerWaalsContact C-N 3.26Å; L553-Y555 PolarHBondContact O-N 3.32Å
554P46Very low54.3Low125 Ų125134.3 Ų134.381%0.81268%0.68SS**  trans-81.741.9-168.435.8-40.2000114.8D552D552-P554 VanDerWaalsContact O-CD 3.22Å; D552-P554 WeakPolarHBondContact O-CD 3.37Å
555Y48.3Very low53.7Low166 Ų166137.3 Ų137.365%0.65168%0.684SS**  trans-15138.3179-139.8-102.9000116L553 F557 E558L553-Y555 VanDerWaalsContact C-N 3.26Å; L553-Y555 PolarHBondContact O-N 3.32Å; Y555-F557 VanDerWaalsContact C-N 3.35Å; Y555-F557 PolarHBondContact O-N 3.19Å; Y555-E558 HydrophobicContact CD1-CB 4.45Å; Y555-E558 HydrophobicContact CE1-CB 3.89Å; Y555-E558 HydrophobicContact CE1-CG 4.5Å; Y555-E558 PolarHBondContact OH-OE2 3.01Å
556R51.2Low52.9Low192 Ų192138.9 Ų138.973%0.72569%0.692SS**THydrogen-bonded Turntrans-81.51.4-172.2-143.1-175-172.8137.67116.6
557F53Low52.1Low207 Ų207139.9 Ų139.991%0.90870%0.704SS**THydrogen-bonded Turntrans-99.8-10.5-172.4-119.8-87.6000115.6Y555Y555-F557 VanDerWaalsContact C-N 3.35Å; Y555-F557 PolarHBondContact O-N 3.19Å
558E53.9Low51.3Low125 Ų125137.5 Ų137.558%0.58470%0.702SS**  trans-123.7-2.1-168.5-66.6-171.6-159.800115.8Y555 P560Y555-E558 HydrophobicContact CD1-CB 4.45Å; Y555-E558 HydrophobicContact CE1-CB 3.89Å; Y555-E558 HydrophobicContact CE1-CG 4.5Å; Y555-E558 PolarHBondContact OH-OE2 3.01Å; E558-P560 WeakPolarHBondContact O-CD 3.43Å
559D51.3Low50.7Low67 Ų67141.7 Ų141.736%0.35872%0.716SS.*  trans-57.7110.4177.7-179.22.3000111.5R561 L562D559-R561 PolarHBondContact O-N 2.95Å; D559-R561 VanDerWaalsContact O-N 3.09Å; D559-R561 WeakPolarHBondContact OD1-CB 3.33Å; D559-R561 WeakPolarHBondContact OD1-CD 3.45Å; D559-R561 WeakPolarHBondContact OD1-CG 3.26Å; D559-R561 PolarHBondContact OD1-N 2.95Å; D559-L562 HydrophobicContact CB-CD1 4.42Å; D559-L562 PolarHBondContact O-N 2.89Å
560P60.6Low50.1Low104 Ų104148.8 Ų148.868%0.67573%0.731SS**G310 helixtrans-63.2-22.1-177.1-21.634.8000112.9E558 L562 R563E558-P560 WeakPolarHBondContact O-CD 3.43Å; P560-L562 VanDerWaalsContact C-N 3.26Å; P560-L562 PolarHBondContact O-N 3.44Å; P560-R563 VanDerWaalsContact O-CB 3.3Å; P560-R563 WeakPolarHBondContact O-CB 3.36Å; P560-R563 PolarHBondContact O-N 3.35Å
561R61.6Low49.5Very low212 Ų212152.5 Ų152.580%0.875%0.747SS**G310 helixtrans-68.5-24.4-177.4-57.6167.761.2177.7-3.5112.7D559D559-R561 PolarHBondContact O-N 2.95Å; D559-R561 VanDerWaalsContact O-N 3.09Å; D559-R561 WeakPolarHBondContact OD1-CB 3.33Å; D559-R561 WeakPolarHBondContact OD1-CD 3.45Å; D559-R561 WeakPolarHBondContact OD1-CG 3.26Å; D559-R561 PolarHBondContact OD1-N 2.95Å
562L58.4Low48.6Very low125 Ų125153.6 Ų153.665%0.65475%0.747SS**G310 helixtrans-87.3-8.4177-68.9172.6000113.3D559 P560 G564D559-L562 HydrophobicContact CB-CD1 4.42Å; D559-L562 PolarHBondContact O-N 2.89Å; P560-L562 VanDerWaalsContact C-N 3.26Å; P560-L562 PolarHBondContact O-N 3.44Å; L562-G564 PolarHBondContact O-N 3.08Å
563R56Low48.5Very low198 Ų198152.1 Ų152.175%0.74775%0.745SS**  trans-74-13-175.9-150.9165.6-174.6150.9-0.7113.8P560 Q565P560-R563 VanDerWaalsContact O-CB 3.3Å; P560-R563 WeakPolarHBondContact O-CB 3.36Å; P560-R563 PolarHBondContact O-N 3.35Å; R563-Q565 PolarHBondContact O-N 2.99Å
564G40.6Very low48.8Very low66 Ų66152.1 Ų152.168%0.6875%0.753SS**THydrogen-bonded Turntrans-72.243.5-173.100000117.6L562L562-G564 PolarHBondContact O-N 3.08Å
565Q49.7Very low48.5Very low180 Ų180151.6 Ų151.684%0.84175%0.752SS**THydrogen-bonded Turntrans-166.4-5.6160.4-120.7151.910400115.9R563 T567R563-Q565 PolarHBondContact O-N 2.99Å; Q565-T567 PolarHBondContact O-N 3.06Å
566L43.5Very low48.3Very low160 Ų160152.9 Ų152.984%0.83876%0.761SS**  trans-98.166.9-174.1-67.4177.4000112.8
567T41.3Very low47.9Very low120 Ų120150 Ų15074%0.73677%0.767SS**  trans-133.863.9178.357.30000112.5Q565Q565-T567 PolarHBondContact O-N 3.06Å
568T39.8Very low47.3Very low128 Ų128144.9 Ų144.979%0.78576%0.757SS**SBendtrans-15816.1165.5-4.70000116.2
569F42.5Very low46.7Very low202 Ų202145.1 Ų145.189%0.88677%0.772SS**  trans-124.376.6172.6-74.4-72.8000111.8L571F569-L571 PolarHBondContact O-N 2.7Å; F569-L571 VanDerWaalsContact O-N 3.17Å
570R39Very low46.1Very low242 Ų242144.8 Ų144.891%0.91379%0.785SS**  trans-75.195.8163-172.8179.9-170173.54107.8Q572R570-Q572 PolarHBondContact O-N 2.88Å
571L43.8Very low45.3Very low158 Ų158145.1 Ų145.183%0.82779%0.79SS**PPolyproline II helixtrans-55.3127169.6-70.7168.5000108.8F569F569-L571 PolarHBondContact O-N 2.7Å; F569-L571 VanDerWaalsContact O-N 3.17Å
572Q41.4Very low44.4Very low178 Ų178142.4 Ų142.483%0.83279%0.791SS**PPolyproline II helixtrans-68.3137167.6-76-176.2-24.700108.8R570R570-Q572 PolarHBondContact O-N 2.88Å
573P49.5Very low43.9Very low111 Ų111141.4 Ų141.472%0.72179%0.792SS**PPolyproline II helixtrans-64.8142.3162.930-33.2000108.7S575P573-S575 PolarHBondContact O-N 3.22Å
574P53.1Low43.3Very low128 Ų128139.9 Ų139.983%0.83179%0.793SS**PPolyproline II helixtrans-63.5126.8177.426.2-33.6000110.1
575S40.5Very low43.3Very low115 Ų115143 Ų14380%0.80479%0.794SS**PPolyproline II helixtrans-67.9133174.640.10000110.6P573P573-S575 PolarHBondContact O-N 3.22Å
576K43.3Very low43.2Very low193 Ų193138.8 Ų138.884%0.83979%0.785SS**PPolyproline II helixtrans-72.3135170-63.3177.2-179.6177.50109
577P44.1Very low43.1Very low130 Ų130142.9 Ų142.984%0.84479%0.79SS**PPolyproline II helixtrans-70.6139.4159.131.1-32.2000109.3
578S39.1Very low43Very low100 Ų100142 Ų14270%0.69979%0.787SS**  trans-150.4142.3178.9580000110.9
579S42Very low43Very low130 Ų130142.7 Ų142.791%0.90979%0.786SS**  trans62.7142.4-174.868.90000115.3
580G39.2Very low43Very low60 Ų60140.4 Ų140.462%0.61978%0.783SS**  cis162.1164.5-7.300000111.6
581S42.4Very low43.5Very low111 Ų111137.4 Ų137.478%0.77678%0.779SS**  trans59.4145.7171.444.70000117.1
582D42.9Very low43.9Very low155 Ų155134.2 Ų134.283%0.82977%0.768SS**  cis-155.9175.8-11.5-106.9-25.9000109.6
583P49.1Very low43.8Very low105 Ų105134.2 Ų134.268%0.68277%0.768SS**  trans-97.8174.8-155.138.6-37.9000115.1
584E43.5Very low43.5Very low165 Ų165132.3 Ų132.377%0.77176%0.762SS**  -178.2166.2119.8-92.9-10551.900114.4
585N40.5Very low43.2Very low131 Ų131133.7 Ų133.770%0.70176%0.757SS**  trans-52.1131.4-166.2-78-75.4000120
586S45.9Very low43.2Very low93 Ų93134.4 Ų134.465%0.6575%0.752SS**  trans0.5135.8135.760.30000120.9
587R41.4Very low43.3Very low246 Ų246132.9 Ų132.993%0.92875%0.748SS**  -163178.5120.8-107.7165.4-166.9-158.82.5112.3
588C40.6Very low43.2Very low102 Ų102132.8 Ų132.869%0.68974%0.74SS**  trans-119.9151.1-155.1-310000113.2
589N38.7Very low43.2Very low142 Ų142136 Ų13676%0.75974%0.744SS**  trans63.1162159-41.4-9.8000115.6
590D43.4Very low43.4Very low153 Ų153136.8 Ų136.882%0.81874%0.743SS**  cis-141.5-179.816.4-91.2-67.7000112.4
591E50Low43.4Very low179 Ų179141 Ų14184%0.83675%0.752SS**  trans-84.1-179.5175.5-103.2-157.3116.600113.5
592P51.4Low43.4Very low91 Ų91141.2 Ų141.259%0.59175%0.751SS**  cis-138.8-146.9-33.935.6-13.4000112.3
593E39.9Very low43.3Very low178 Ų178141.7 Ų141.783%0.83275%0.752SS**  trans72.6148.2167.3-66.9-162.486.800119.2
594A43.5Very low42.7Very low72 Ų72140.2 Ų140.260%0.59576%0.756SS**  cis-164.7163.8-26.700000111.6
595Q46.4Very low42.8Very low156 Ų156139 Ų13973%0.72976%0.759SS**  trans66.9103.8154-68.3175.240.700122.1
596N41Very low42.6Very low130 Ų130139.7 Ų139.770%0.69576%0.763SS**  81.8164.9119.8-69.6-33.5000123.4
597H45.6Very low42.6Very low162 Ų162142.6 Ų142.675%0.7577%0.772SS**  trans99.580.9157.6-52.8-63.6000119.3
598N41.6Very low42.8Very low128 Ų128138.2 Ų138.268%0.68477%0.766SS**  trans35.8129.3137.6-69.942.4000123.2
599E38.6Very low42.9Very low166 Ų166140.9 Ų140.978%0.77677%0.774SS**  47.1119.8125.4-53.9178.1105.700120.9
600T45.6Very low43Very low147 Ų147140 Ų14090%0.90278%0.776SS**  -159.9153.5127.5-82.10000110.3
601N40.6Very low42.8Very low148 Ų148136.6 Ų136.679%0.79178%0.777SS**  trans-83.2163.5-178.1-96.8-73.5000113.2
602P41.5Very low42.2Very low117 Ų117132 Ų13276%0.7678%0.778SS**  trans-81150.3-165.532.2-36.8000114.8
603I40.7Very low41.6Very low165 Ų165135.7 Ų135.785%0.84679%0.792SS**  trans-126.2137.9162.6-65.3177000106.9
604G37.1Very low41.7Very low74 Ų74134 Ų13476%0.76379%0.793SS**  trans-98150.4178.600000112.9
605T44.1Very low41.8Very low139 Ų139139.2 Ų139.285%0.85381%0.806SS**  trans-129.1152.5163.449.80000108.9
606N36.6Very low41.6Very low145 Ų145143.6 Ų143.678%0.77582%0.815SS**  trans-78.8171.2167.5-47.7-73.1000109.2
607D46.2Very low41.6Very low155 Ų155148.3 Ų148.383%0.82982%0.823SS**  -179.9165.7113.9-81.9-11.1000110.5
608D45Very low41.9Very low153 Ų153146.1 Ų146.182%0.81882%0.824SS**  trans-76.6149.8-155-58.3-91.1000118
609N42.5Very low42.2Very low159 Ų159148.3 Ų148.385%0.8583%0.834SS**  trans-157.9123.7140-147.4-29.9000111.8
610P42.8Very low42.7Very low122 Ų122149.4 Ų149.479%0.79284%0.836SS**  trans-99.9141.9-172.836-33.8000115.3
611G39.1Very low42.9Very low83 Ų83150.1 Ų150.186%0.85683%0.833SS**  trans177.2145.5166.500000114.4
612G36.8Very low43.7Very low82 Ų82150 Ų15085%0.84583%0.828SS**  trans99.880.216900000116.7T614G612-T614 PolarHBondContact O-N 3.15Å
613L39.1Very low44.3Very low169 Ų169151.9 Ų151.989%0.88583%0.831SS**  trans-78.1108.7170.8-79.1165.1000112.2
614T40.5Very low45Very low141 Ų141151.4 Ų151.487%0.86583%0.825SS**  trans-139.8123.8148.651.50000110.7G612G612-T614 PolarHBondContact O-N 3.15Å
615Q45.6Very low45.8Very low183 Ų183154.9 Ų154.986%0.85582%0.821SS**PPolyproline II helixtrans-83.9152178.2-67.5-174.31.400111.8R617Q615-R617 PolarHBondContact O-N 3.4Å
616R43Very low46.2Very low247 Ų247154.4 Ų154.493%0.93281%0.811SS**PPolyproline II helixtrans-58.2129.7175.3-66.3175.6170.8-172.8-3.2111.5
617R41.8Very low46.9Very low229 Ų229150.3 Ų150.386%0.86480%0.797SS**PPolyproline II helixtrans-97135.2152.8-73.5-174.3174-177.3-1.3109.6Q615Q615-R617 PolarHBondContact O-N 3.4Å
618P50.4Low47.1Very low117 Ų117149.4 Ų149.476%0.7679%0.792SS**PPolyproline II helixtrans-76.7142.9-178.830.7-34.4000111.9K620P618-K620 PolarHBondContact O-N 3.22Å
619I49.8Very low47.5Very low174 Ų174147.2 Ų147.289%0.89278%0.784SS**SBendtrans-72.893-176.1-56.4172.1000110.8
620K48.7Very low47.6Very low189 Ų189148.3 Ų148.382%0.82278%0.782SS**  trans-161.1144.1166.4-121.2179.7176.8-171.60109.3P618P618-K620 PolarHBondContact O-N 3.22Å
621L48.1Very low47.7Very low161 Ų161146.3 Ų146.384%0.84378%0.776SS**  trans6362.1178.5-65.1161.5000115.4
622Q57.6Low47.7Very low145 Ų145149.6 Ų149.668%0.67877%0.774SS**  trans-107.428.3164.3-155.5172.97.600112.1
623L55.3Low48Very low157 Ų157152.3 Ų152.382%0.82277%0.774SS**SBendtrans-115.63.4-177.7-85.2171.1000114
624H54.1Low48.2Very low156 Ų156149.6 Ų149.672%0.72277%0.769SS**SBendtrans-105.6-29.6172.2-156.548.6000111.8M626 A627H624-M626 VanDerWaalsContact C-N 3.28Å; H624-M626 PolarHBondContact O-N 3.09Å; H624-A627 WeakPolarHBondContact O-CB 3.3Å; H624-A627 PolarHBondContact O-N 3.25Å
625E55.1Low48.1Very low146 Ų146148.4 Ų148.468%0.68277%0.767SS**THydrogen-bonded Turntrans-72.7-18.7179.5-148.5165.1-148.300113.3
626M53.2Low47.9Very low130 Ų130147.7 Ų147.764%0.6477%0.769SS**THydrogen-bonded Turntrans-89.81.4176.3-53.1-170.280.700113.6H624H624-M626 VanDerWaalsContact C-N 3.28Å; H624-M626 PolarHBondContact O-N 3.09Å
627A50.6Low47.7Very low58 Ų58143.2 Ų143.248%0.47976%0.758SS.*SBendtrans-86.2-34.4-177.500000112.9H624H624-A627 WeakPolarHBondContact O-CB 3.3Å; H624-A627 PolarHBondContact O-N 3.25Å
628N50.9Low47.7Very low137 Ų137141 Ų14173%0.73376%0.762SS**SBendtrans-88.1-4.8-172.6-70.612.5000114.3F630N628-F630 PolarHBondContact O-N 2.87Å
629T53Low46.9Very low107 Ų107142.7 Ų142.766%0.65676%0.76SS**THydrogen-bonded Turntrans-83.216.3-177.858.30000114.4
630F44.6Very low46.4Very low181 Ų181140.8 Ų140.879%0.79476%0.756SS**THydrogen-bonded Turntrans-122.12.3179.6-75.2-77000114.3N628N628-F630 PolarHBondContact O-N 2.87Å
631A43.8Very low46.4Very low81 Ų81137 Ų13767%0.66975%0.751SS**SBendtrans-87.3-37-179.400000114
632N40.7Very low45.8Very low152 Ų152133.3 Ų133.381%0.81374%0.738SS**  trans-118.878-163.1-68.7-7.1000113.6
633T42.1Very low45Very low139 Ų139138.3 Ų138.385%0.85375%0.751SS**  trans-137.891.3154.655.70000109.2
634S42.7Very low44.3Very low112 Ų112139.4 Ų139.478%0.78375%0.752SS**  trans-74.9152.3174.1410000111.9
635S39.6Very low43.8Very low115 Ų115135.1 Ų135.180%0.80475%0.75SS**  trans45.1102.5154.5-53.50000118.9
636D40.5Very low43.3Very low169 Ų169136 Ų13690%0.90476%0.76SS**  -148.8158.1123.1-134.9-31.7000112.3
637H38.6Very low42.9Very low153 Ų153141.5 Ų141.571%0.70877%0.773SS**  trans-123.9102.2-143.3-174.6-73.7000114.8
638L41.5Very low43.1Very low181 Ų181144 Ų14495%0.94879%0.787SS**  trans-131.2143.2167.8-74.2178.4000112.7
639H35.3Very low43.1Very low154 Ų154145.4 Ų145.471%0.71378%0.783SS**  trans-118.7119.2-153179.8-69.1000112.4
640V39.4Very low43.3Very low134 Ų134148.1 Ų148.181%0.81279%0.793SS**  trans-131134.7172.5-177.60000109.1
641P48.2Very low44Very low109 Ų109145.7 Ų145.771%0.70879%0.788SS**  trans-71.1144.2-166.9-20.133.7000114.9
642S35.2Very low44.6Very low83 Ų83143.1 Ų143.158%0.5876%0.763SS**  trans-65.7138.9172.7-177.30000112.4Q644S642-Q644 PolarHBondContact OG-N 3Å; S642-Q644 PolarHBondContact OG-OE1 3.42Å
643R40.9Very low45.7Very low250 Ų250140.8 Ų140.894%0.94376%0.756SS**  trans-120.495151.9-81-167.9170.7-158.9-2108.6
644Q41.1Very low47.1Very low180 Ų180143.7 Ų143.784%0.84175%0.752SS**  trans-75.5126.2168.9-80.7139.2-83.800109.9S642S642-Q644 PolarHBondContact OG-N 3Å; S642-Q644 PolarHBondContact OG-OE1 3.42Å
645G43.9Very low47.9Very low67 Ų67144.8 Ų144.869%0.69174%0.742SS**  trans155.762.3-179.900000112.8
646D43.5Very low48.5Very low164 Ų164149.4 Ų149.488%0.87774%0.742SS**  trans-179.368.9155.6-97.1-23.5000111.3
647R44.6Very low48.8Very low246 Ų246152.4 Ų152.493%0.92874%0.741SS**  trans-134.267171.9-90.2-173.2164.7-179.8-4.7110.8
648S54.6Low49.3Very low110 Ų110156.5 Ų156.577%0.76975%0.75SS**  trans-123-4.1-177.3-1690000114.2
649Y51.4Low49.4Very low166 Ų166158.7 Ų158.765%0.65175%0.746SS**SBendtrans-95.3-5.6-170.6-147.5-90.3000115.3F655Y649-F655 AromaticContact CE1-CE2 3.94Å; Y649-F655 HydrophobicContact CE1-CE2 3.94Å; Y649-F655 HydrophobicContact CE1-CZ 4.22Å
650L58Low49.8Very low165 Ų165158.4 Ų158.486%0.86475%0.748SS**SBendtrans-83.6-20.1-176.6-81.2168.3000114.1
651D57.8Low49.9Very low129 Ų129159.9 Ų159.969%0.6975%0.748SS**  trans-99.23.6-174.2-69.9-77.4000114.7P653D651-P653 WeakPolarHBondContact O-CD 3.4Å; D651-P653 VanDerWaalsContact O-N 3.1Å
652D56.3Low49.8Very low27 Ų27160.6 Ų160.614%0.14475%0.75CS.*  trans-59.7113.1175.6179.5-15.6000110.6R654 F655D652-R654 PolarHBondContact O-N 2.94Å; D652-R654 WeakPolarHBondContact OD1-CB 3.42Å; D652-R654 VanDerWaalsContact OD1-CG 3.24Å; D652-R654 WeakPolarHBondContact OD1-CG 3.32Å; D652-R654 IonicContact OD1-CZ 3.68Å; D652-R654 PolarHBondContact OD1-N 3.47Å; D652-R654 IonicContact OD1-NE 3.98Å; D652-R654 PolarHBondContact OD1-NE 3.13Å; D652-R654 IonicContact OD1-NH2 2.69Å; D652-R654 IonicContact OD2-CZ 3.09Å; D652-R654 VanDerWaalsContact OD2-CZ 3.23Å; D652-R654 IonicContact OD2-NE 3.88Å; D652-R654 PolarHBondContact OD2-NE 3.22Å; D652-R654 IonicContact OD2-NH2 3.83Å; D652-R654 PolarHBondContact OD2-NH2 2.69Å; D652-F655 HydrophobicContact CB-CD2 3.89Å; D652-F655 HydrophobicContact CB-CE2 4.22Å; D652-F655 PolarHBondContact O-N 3.31Å; D652-F655 VanDerWaalsContact O-N 3.14Å
653P65.8Low50.7Low103 Ų103162 Ų16267%0.66976%0.758SS**G310 helixtrans-59.4-21.7-173.5-2635.9000113.9D651 F655 R656D651-P653 WeakPolarHBondContact O-CD 3.4Å; D651-P653 VanDerWaalsContact O-N 3.1Å; P653-F655 PolarHBondContact O-N 3.48Å; P653-R656 PolarHBondContact O-N 3.39Å
654R70.9Confident51Low200 Ų200154 Ų15476%0.75575%0.745SS**G310 helixtrans-64.8-19.3-178.5-60.8176.4-70-1700.4113D652D652-R654 PolarHBondContact O-N 2.94Å; D652-R654 WeakPolarHBondContact OD1-CB 3.42Å; D652-R654 VanDerWaalsContact OD1-CG 3.24Å; D652-R654 WeakPolarHBondContact OD1-CG 3.32Å; D652-R654 IonicContact OD1-CZ 3.68Å; D652-R654 PolarHBondContact OD1-N 3.47Å; D652-R654 IonicContact OD1-NE 3.98Å; D652-R654 PolarHBondContact OD1-NE 3.13Å; D652-R654 IonicContact OD1-NH2 2.69Å; D652-R654 IonicContact OD2-CZ 3.09Å; D652-R654 VanDerWaalsContact OD2-CZ 3.23Å; D652-R654 IonicContact OD2-NE 3.88Å; D652-R654 PolarHBondContact OD2-NE 3.22Å; D652-R654 IonicContact OD2-NH2 3.83Å; D652-R654 PolarHBondContact OD2-NH2 2.69Å
655F59.2Low51.6Low135 Ų135151.2 Ų151.259%0.59274%0.742SS**G310 helixtrans-93.2-5178.3-64.5-81.7000114.5Y649 D652 P653 R657Y649-F655 AromaticContact CE1-CE2 3.94Å; Y649-F655 HydrophobicContact CE1-CE2 3.94Å; Y649-F655 HydrophobicContact CE1-CZ 4.22Å; D652-F655 HydrophobicContact CB-CD2 3.89Å; D652-F655 HydrophobicContact CB-CE2 4.22Å; D652-F655 PolarHBondContact O-N 3.31Å; D652-F655 VanDerWaalsContact O-N 3.14Å; P653-F655 PolarHBondContact O-N 3.48Å; F655-R657 PolarHBondContact O-N 3.34Å
656R51.7Low51.7Low213 Ų213154.4 Ų154.480%0.80475%0.748SS**  trans-72.165171.5-72.1-172175.7-176.70.6112.1P653 R658P653-R656 PolarHBondContact O-N 3.39Å; R656-R658 PolarHBondContact O-N 3.16Å
657R48.3Very low52Low231 Ų231151.4 Ų151.487%0.87274%0.74SS**  trans-63.4122.8165.4-73.9-167.1178.3-162.63.5108.8F655 R659F655-R657 PolarHBondContact O-N 3.34Å; R657-R659 PolarHBondContact O-N 3.11Å
658R47.3Very low51.9Low239 Ų239149 Ų14990%0.90274%0.739SS**  trans-40.7108.4-172.7-58.8175.9-172.1171.71.2112.3R656 I660R656-R658 PolarHBondContact O-N 3.16Å; R658-I660 PolarHBondContact O-N 2.87Å; R658-I660 VanDerWaalsContact O-N 3.11Å
659R44.7Very low51.4Low228 Ų228148.2 Ų148.286%0.8673%0.734SS**  trans-63109.8160.7-178.1-177.5-73.7179-3106R657 M661R657-R659 PolarHBondContact O-N 3.11Å; R659-M661 PolarHBondContact O-N 3.42Å; R659-M661 VanDerWaalsContact O-N 3.08Å
660I43.1Very low50.9Low147 Ų147145.6 Ų145.675%0.75475%0.747SS**  trans-63.4114.4178.5-62.3175.3000107R658 V662R658-I660 PolarHBondContact O-N 2.87Å; R658-I660 VanDerWaalsContact O-N 3.11Å; I660-V662 PolarHBondContact O-N 2.89Å
661M42.2Very low50.5Low166 Ų166142.9 Ų142.982%0.81874%0.741SS**  trans-74.9108.3173.9-61.9-139.671.600108.1R659R659-M661 PolarHBondContact O-N 3.42Å; R659-M661 VanDerWaalsContact O-N 3.08Å
662V46.6Very low49.8Very low124 Ų124144.4 Ų144.475%0.75275%0.75SS**PPolyproline II helixtrans-69.4122.2165179.70000106.3I660 A664I660-V662 PolarHBondContact O-N 2.89Å; V662-A664 PolarHBondContact O-N 2.72Å
663P53.1Low49.3Very low113 Ų113149.3 Ų149.373%0.73478%0.78SS**PPolyproline II helixtrans-64.3127.4174.926.8-32.8000108.9
664A47.3Very low48.3Very low81 Ų81151.8 Ų151.867%0.66979%0.787SS**PPolyproline II helixtrans-63.5141.7173.600000109.8V662 T666V662-A664 PolarHBondContact O-N 2.72Å; A664-T666 PolarHBondContact O-N 3.38Å; A664-T666 VanDerWaalsContact O-N 3.11Å
665P53.3Low47Very low121 Ų121149 Ų14979%0.78679%0.787SS**  trans-67.7112175.428.2-33.3000109.5S667P665-S667 VanDerWaalsContact C-N 3.29Å; P665-S667 PolarHBondContact O-N 2.97Å
666T46.3Very low46.3Very low134 Ų134151.3 Ų151.382%0.82280%0.8SS**  trans-72.583.2174.251.40000110.2A664 Q668A664-T666 PolarHBondContact O-N 3.38Å; A664-T666 VanDerWaalsContact O-N 3.11Å; T666-Q668 PolarHBondContact O-N 3.31Å
667S49.3Very low46.3Very low101 Ų101148.8 Ų148.871%0.70680%0.802SS**  trans-67.8107.7167.7510000109.4P665 S669P665-S667 VanDerWaalsContact C-N 3.29Å; P665-S667 PolarHBondContact O-N 2.97Å; S667-S669 PolarHBondContact O-N 2.94Å
668Q43.4Very low46.2Very low195 Ų195145 Ų14591%0.91180%0.799SS**  trans-72112.9169.5-65.4178.26.500109T666T666-Q668 PolarHBondContact O-N 3.31Å
669S44.2Very low46.2Very low94 Ų94138.1 Ų138.166%0.65779%0.786SS**  trans-140.2102.3169.554.90000108.5S667 S671S667-S669 PolarHBondContact O-N 2.94Å; S669-S671 PolarHBondContact O-N 2.96Å
670A40.3Very low46.3Very low112 Ų112133.8 Ų133.893%0.92678%0.78SS**  trans-71.8126171.700000109.3
671S48.8Very low46.3Very low107 Ų107133.1 Ų133.175%0.74878%0.778SS**  trans-131.5123.7170.3390000108.1S669S669-S671 PolarHBondContact O-N 2.96Å
672N44.6Very low46.5Very low162 Ų162131.1 Ų131.187%0.86678%0.775SS**  trans-69139.7-177.7-73.1-31.5000110.7L674N672-L674 PolarHBondContact O-N 2.68Å
673V45.9Very low46.4Very low129 Ų129130.5 Ų130.578%0.78277%0.774SS**  trans-69.2123.4163.91770000108
674L44Very low46.2Very low156 Ų156134 Ų13482%0.81778%0.78SS**  trans-129.9100.9164.2-158.585.2000107.4N672N672-L674 PolarHBondContact O-N 2.68Å
675N44.4Very low46.1Very low142 Ų142135 Ų13576%0.75978%0.778SS**  trans-67.2137.3169.1-9010.1000108.9
676Q44.6Very low46.1Very low183 Ų183134.8 Ų134.886%0.85578%0.775SS**  trans-91.4124.4168.2-61178.923.100108.3
677D50.1Low46.4Very low160 Ų160135.3 Ų135.386%0.85677%0.768SS**  trans-135.8121.3153.5-92.6-53.6000108.4
678N47.1Very low46.6Very low150 Ų150137.7 Ų137.780%0.80277%0.768SS**  trans-89.6158.3175.8-143.816.7000107.1
679P46.7Very low46.7Very low96 Ų96134 Ų13462%0.62376%0.762SS**  cis-139.4162.11741-22.9000117.6
680N46.7Very low46.9Very low136 Ų136135 Ų13573%0.72777%0.769SS**  174.8144.5118.2-95.2-59.1000114.6
681N43.1Very low47.4Very low133 Ų133141.3 Ų141.371%0.71179%0.787SS**  trans53.5102.5154.5-82-64.8000122.5
682T46.4Very low47.3Very low124 Ų124143.1 Ų143.176%0.76179%0.789SS**  74.3130.6114-51.40000120
683P45Very low47.5Very low112 Ų112142.1 Ų142.173%0.72779%0.785SS**  trans-108.4163.7-16441.8-37.3000117
684Q48Very low47.6Very low186 Ų186142.8 Ų142.887%0.86979%0.786SS**  trans171.9156.8155.5-98.9170.267.200107.8
685T46.4Very low47.8Very low102 Ų102142 Ų14263%0.62678%0.784SS**  cis-170.9128.2-18.5-107.90000109.9
686T52.4Low48Very low117 Ų117142 Ų14272%0.71879%0.785SS**  trans54.4167.9161.561.10000118.6
687Q52.8Low48.2Very low144 Ų144139.3 Ų139.367%0.67378%0.781SS**  cis-153.5170.1-17.3-126.9162.1-85.200108
688E54.5Low48.1Very low152 Ų152137.8 Ų137.871%0.7178%0.775SS**  trans57.4115.5153.2-73.5152.8-156.400119.3
689C44.3Very low48.1Very low116 Ų116136.8 Ų136.878%0.78477%0.773SS**  92.113457.7-75.20000114.6
690S49.9Very low48.3Very low116 Ų116140.3 Ų140.381%0.81179%0.786SS**  trans75.887160.8-53.30000119.4
691N49.6Very low48.4Very low245 Ų245140.6 Ų140.6100%1.3179%0.791SS**  -150.90125.3-106.7-30.6000109.5

Retrieved 691 of 691 residues in 317.6 ms (Link to these results)