A0A096MD83_POEFO Loading...

TAF15 RNA polymerase II, TATA box binding protein (TBP)-associated factor

AlphaFold DB , UniProt , Accession A0A096MD83, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 471 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.3Very low41.6Very low252 Ų252136.9 Ų136.9100%1.24186%0.862SS**  0165.70-68.2171.3177.700107.9
2A47.1Very low41Very low88 Ų88134.7 Ų134.773%0.72786%0.855SS**  trans-102-162.7-16400000114
3T47.3Very low40.5Very low138 Ų138142.5 Ų142.585%0.84786%0.86SS**  trans75.8151.6-179.976.40000114.8
4D44.5Very low40.2Very low137 Ų137137.4 Ų137.473%0.73385%0.85SS**  cis-147.6176.810.5-164.5-148.1000114.6
5S48.8Very low40.1Very low104 Ų104136.2 Ų136.273%0.72785%0.85SS**  trans-26.9170.1157-51.60000118.5
6G42.5Very low39.6Very low69 Ų69141.7 Ų141.771%0.71185%0.851SS**  cis165.7171.6-2.700000113.9
7Y40.7Very low39.3Very low242 Ų242138.1 Ų138.195%0.94985%0.85SS**  trans8122.6166.8-82.3-95.7000123.3
8G38.9Very low39.2Very low81 Ų81134.3 Ų134.384%0.83584%0.843SS**  76153.9102.700000122.5
9G37.9Very low39.1Very low86 Ų86136.4 Ų136.489%0.88784%0.841SS**  trans159.7141.2168.500000114.5
10A39.1Very low39.1Very low107 Ų107137 Ų13788%0.88483%0.834SS**  trans-141.9177-174.900000114.1
11Q37.8Very low38.8Very low202 Ų202136.4 Ų136.494%0.94484%0.836SS**  trans-90.7173.5-168.2-60.9169.9-64.500114.5
12S34.7Very low39Very low110 Ų110127.6 Ų127.677%0.76981%0.81SS**  trans-153.1178.3-177.8-1680000113.6
13Y34Very low38.5Very low237 Ų237133 Ų13393%0.92982%0.82SS**  trans82132.5-172.7-70.3-89.2000117.4
14G36.3Very low37.8Very low70 Ų70129.6 Ų129.672%0.72281%0.812SS**  cis165.2135.6-15.500000117.6
15S38.3Very low37.2Very low120 Ų120134 Ų13484%0.83982%0.821SS**  trans65.9149.9162.5-115.20000119.6
16Y33.1Very low36.5Very low224 Ų224132.7 Ų132.788%0.87882%0.823SS**  cis-153.1166.112.451.5-90.7000111.8
17G34.3Very low36.1Very low80 Ų80139.6 Ų139.683%0.82584%0.837SS**  cis169.48.5-7.200000120.2
18G36Very low35.6Very low71 Ų71131.7 Ų131.773%0.73283%0.829SS**  trans-169.8161.3-179.600000114.5
19Q38.8Very low35.5Very low173 Ų173136.3 Ų136.381%0.80884%0.835SS**  cis-158.5165.92.5-58.6-179.4-96.200108.2
20Q38.8Very low35.1Very low148 Ų148135.7 Ų135.769%0.69283%0.828SS**  cis-167.6153.9-22.4-107.3170-113.900110
21S33.3Very low34.7Very low126 Ų126134.3 Ų134.388%0.88182%0.824SS**  trans59.7147.4158.655.90000121.8
22G35.8Very low34.5Very low67 Ų67129.5 Ų129.569%0.69182%0.819SS**  cis155.494.4-12.800000118.1
23Q37Very low34.4Very low200 Ų200131.6 Ų131.694%0.93583%0.827SS**  trans45.2146.3136.4-63.3175-27.200124.8
24G32.6Very low34.4Very low67 Ų67123.9 Ų123.969%0.69182%0.82SS**  trans100.6157.315500000115.7
25Y32.7Very low34.2Very low231 Ų231126.1 Ų126.191%0.90682%0.824SS**  cis-164.6177.9-7.525.9-110.9000107.8
26G33.8Very low33.9Very low75 Ų75131.5 Ų131.577%0.77383%0.828SS**  trans-140.7-159.5-174.200000116.2
27Q33.7Very low33.9Very low214 Ų214124.3 Ų124.3100%182%0.822SS**  trans95.1135.1176.5-160.2176.996.800117.2
28G30.8Very low33.9Very low76 Ų76124.3 Ų124.378%0.78482%0.822SS**  trans162.614717700000112.5
29N36.1Very low33.7Very low179 Ų179130.3 Ų130.396%0.95783%0.831SS**  trans-152.9154.7-170.6-169.511.3000113.8
30G29.9Very low33.3Very low73 Ų73129.3 Ų129.375%0.75383%0.831SS**  trans10614817400000115.4
31G30.7Very low33.1Very low78 Ų78132 Ų13280%0.80484%0.836SS**  cis174.6109.2-8.300000116.4
32A33.8Very low33.6Very low100 Ų100130.5 Ų130.583%0.82682%0.823SS**  trans61.2112.1149.100000124
33T31.6Very low33.3Very low154 Ų154129.9 Ų129.995%0.94582%0.817SS**  trans179.3141.7137.1180000106.2
34G34.3Very low33Very low76 Ų76130.7 Ų130.778%0.78481%0.813SS**  cis119.8137.215.400000109.2
35S32.8Very low32.9Very low116 Ų116131 Ų13181%0.81182%0.816SS**  cis-172.2119-12175.80000111.3
36Y31.4Very low32.9Very low234 Ų234127.3 Ų127.392%0.91881%0.807SS**  trans-179.3145.3152.861.2-89.7000109.1
37G32.9Very low32.9Very low73 Ų73131.9 Ų131.975%0.75381%0.808SS**  cis-170.5133.9-14.200000106.2
38G34.6Very low32.7Very low79 Ų79125.5 Ų125.581%0.81480%0.8SS**  79.4129.492.500000111.7
39Q33Very low33.1Very low198 Ų198126.7 Ų126.793%0.92580%0.802SS**  cis-157.7179.220.5-58.9173.8-0.600109.6
40N29.5Very low33.5Very low152 Ų152124.2 Ų124.281%0.81380%0.796SS**  -159.4165.7-53.3-167.722.3000110.4
41Y34.1Very low33.4Very low205 Ų205130.2 Ų130.280%0.80481%0.805SS**  trans-73.2171.2176.4-94.3-93.4000114
42P43.9Very low33.3Very low93 Ų93130.2 Ų130.260%0.60481%0.805SS**  cis-124.8-179.545.6197.4000114.8Y44P42-Y44 HydrophobicContact CB-CD2 4.49Å; P42-Y44 HydrophobicContact CB-CE1 4.26Å; P42-Y44 HydrophobicContact CB-CE2 3.73Å; P42-Y44 HydrophobicContact CG-CE2 4.45Å
43G29.8Very low33.3Very low54 Ų54131.1 Ų131.156%0.55781%0.805SS**  cis93.7142.830.900000110.3
44Y30.3Very low33.1Very low218 Ų218131 Ų13186%0.85579%0.793SS**  cis-162.2171.39-37-99.9000109.4P42P42-Y44 HydrophobicContact CB-CD2 4.49Å; P42-Y44 HydrophobicContact CB-CE1 4.26Å; P42-Y44 HydrophobicContact CB-CE2 3.73Å; P42-Y44 HydrophobicContact CG-CE2 4.45Å
45G30.5Very low32.9Very low72 Ų72129.9 Ų129.974%0.74278%0.782SS**  trans98.5119.4141.900000121
46Q33Very low32.9Very low155 Ų155134.3 Ų134.372%0.72478%0.783SS**  26.5132.5129.8-69.5-81.463.700122.4
47Q35Very low33Very low170 Ų170126.8 Ų126.879%0.79478%0.776SS**  trans43.5123.3133.5-63.1172.1-2.400120.8
48G29.4Very low33.1Very low80 Ų80131.1 Ų131.183%0.82578%0.777SS**  trans158.4125152.900000114.8
49A38Very low33.1Very low102 Ų102132.4 Ų132.484%0.84377%0.773SS**  trans-111.5136160.700000109
50P44.1Very low33.2Very low127 Ų127129.3 Ų129.383%0.82576%0.759SS**  trans-110.9171.3160.635.2-26000112.4
51Q28.7Very low33.3Very low199 Ų199128.8 Ų128.893%0.9375%0.752SS**  trans-122.5166.7-172.2-61.3171.9-33.800112
52G29.6Very low33.2Very low78 Ų78127.3 Ų127.380%0.80475%0.752SS**  trans89.1154.9168.700000114.7
53S32.1Very low32.6Very low119 Ų119128.3 Ų128.383%0.83276%0.761SS**  cis-164.8170.7-9.857.70000107.8
54E29Very low32.5Very low151 Ų151136.6 Ų136.671%0.70678%0.777SS**  cis-135.4178.65.4-98.1-157.7108.200108.5Y56E54-Y56 WeakPolarHBondContact OE1-CE2 3.46Å; E54-Y56 PolarHBondContact OE1-OH 2.92Å; E54-Y56 VanDerWaalsContact OE1-OH 3.1Å
55G29.9Very low32.5Very low53 Ų53129.5 Ų129.555%0.54677%0.771SS.*  cis166.7159.5-3.800000111.3
56Y31.4Very low32.3Very low209 Ų209130.4 Ų130.482%0.8277%0.766SS**  trans60.7136.5174.1-45.4-84.3000117.6E54E54-Y56 WeakPolarHBondContact OE1-CE2 3.46Å; E54-Y56 PolarHBondContact OE1-OH 2.92Å; E54-Y56 VanDerWaalsContact OE1-OH 3.1Å
57G34.5Very low32.1Very low76 Ų76133.7 Ų133.778%0.78477%0.773SS**  cis163.2157-5.900000110.5
58Q35.2Very low31.9Very low163 Ų163128.4 Ų128.476%0.76276%0.764SS**  cis-115.3-113-1.1-161.7-165.910200109.9
59S33.3Very low32Very low106 Ų106134.1 Ų134.174%0.74177%0.769SS**  cis-141.8-134.6-4.3660000111.7
60Q35Very low31.5Very low134 Ų134136.1 Ų136.163%0.62677%0.766SS**  trans-151.2152.2-161.2-75.2-18065.200108.9
61Q32.2Very low30.8Very low141 Ų141134.4 Ų134.466%0.65976%0.757SS**  cis-149.5146.62.2-107.6153.9-11.300106.9
62Q32.4Very low31Very low173 Ų173130.7 Ų130.781%0.80875%0.753SS**  53.2139.687.2-54.2180-5.500114.6
63S30.4Very low31Very low114 Ų114130.8 Ų130.880%0.79775%0.754SS**  cis-149.4-177.518.4-155.70000115.6
64Y29.7Very low30.8Very low228 Ų228136.4 Ų136.489%0.89476%0.759SS**  trans-74156.4-162.7-92.9-110.3000119.5
65G29.1Very low31Very low70 Ų70132.4 Ų132.472%0.72276%0.758SS**  113.916112100000118.4
66S26.5Very low31Very low91 Ų91136.2 Ų136.264%0.63677%0.766SS**  cis-170.5138.3-20.8-160.50000110.1
67Y28.2Very low31.1Very low223 Ų223134.1 Ų134.188%0.87576%0.761SS**  trans51.3158.8174.564.5-99.1000117.9
68G30.9Very low30.8Very low60 Ų60136.5 Ų136.562%0.61977%0.766SS**  cis153.8141.8-9.900000111.2
69Q31.9Very low30.9Very low199 Ų199133.6 Ų133.693%0.9377%0.77SS**  trans64.9171.1-178.9-68.8176.561.900114.9
70D28Very low30.7Very low144 Ų144133.6 Ų133.677%0.7777%0.77SS**  -160.4170.2-56.2115.1-46.8000107.1
71S29.9Very low30.4Very low92 Ų92138.4 Ų138.464%0.64378%0.784SS**  cis-167.8-173.3-20.3-178.30000108.8
72S31.6Very low30.3Very low120 Ų120135.7 Ų135.784%0.83979%0.793SS**  trans67.7123.4164.9-58.30000119.6
73G30.4Very low30.4Very low80 Ų80135.8 Ų135.883%0.82579%0.794SS**  trans-160.3126.8166.500000110.9
74Y27.9Very low31.4Very low238 Ų238136 Ų13693%0.93379%0.792SS**  trans-110.9147.7-167.8-120.6-95000112.9
75G32.2Very low31.4Very low67 Ų67129.3 Ų129.369%0.69178%0.784SS**  trans83.3160.4161.600000116.4
76D30.9Very low31.6Very low133 Ų133130.6 Ų130.671%0.71179%0.788SS**  cis-150.5-170.2-20.2-153.4-81000109.4
77K32.5Very low31.8Very low164 Ų164131.5 Ų131.571%0.71380%0.801SS**  trans-81145.6-163.6-53.1156.5-153.275.70112.4
78S29.4Very low32Very low127 Ų127126.4 Ų126.489%0.88880%0.798SS**  157.6164.1110.956.20000112.2
79A36.9Very low31.8Very low102 Ų102134.5 Ų134.584%0.84381%0.811SS**  trans-123.9153.2-175.100000111.6
80S29.1Very low31.8Very low106 Ų106128.1 Ų128.174%0.74180%0.799SS**  trans-155.9125.1168.6-1640000113.6
81Y29.2Very low31.9Very low235 Ų235124.9 Ų124.992%0.92280%0.8SS**  trans20.7140.4148.6-66.1-96.5000123
82G29.6Very low32Very low83 Ų83129.3 Ų129.386%0.85681%0.81SS**  trans168.4105.8155.100000116.5
83Q34.2Very low32.1Very low176 Ų176127.9 Ų127.982%0.82280%0.801SS**  trans-111.1152.7167.2-105.8-88.4-24.800108.3
84P50.4Low32Very low118 Ų118133.5 Ų133.577%0.76681%0.805SS**  -157.1157.793.840-20.6000118.9
85A31.7Very low32Very low87 Ų87126.1 Ų126.172%0.71980%0.801SS**  trans18.4167.8130.800000123.5
86A32Very low31.9Very low98 Ų98127 Ų12781%0.8181%0.811SS**  cis177.8147.2-31.200000109.5
87A31.3Very low31.8Very low109 Ų109124.7 Ų124.790%0.90182%0.818SS**  trans-163.4161.5169.900000113.3
88S32Very low31.7Very low116 Ų116120.1 Ų120.181%0.81182%0.818SS**  trans-158.8134.9178.6179.60000113.9
89Y27.5Very low31.8Very low230 Ų230124.6 Ų124.690%0.90282%0.822SS**  trans-177.3153.9161.9-123.1-85.8000110.3
90G31.6Very low31.7Very low65 Ų65122.9 Ų122.967%0.6781%0.814SS**  cis146.967.3-19.900000117.7
91G30.6Very low31.9Very low77 Ų77125.9 Ų125.979%0.79482%0.816SS**  trans-177.6113.9173.600000121.4
92Q31.6Very low32.1Very low184 Ų184122.3 Ų122.386%0.8681%0.808SS**  61.895.7122.8-162159.6-2.900125.1
93S32.6Very low32.2Very low91 Ų91123.2 Ų123.264%0.63680%0.801SS**  66.2134.9126.180.40000127
94Q29.8Very low32.2Very low198 Ų198118.9 Ų118.993%0.92579%0.79SS**  trans75.1131.6146.6-71.5-179.115.800122.7
95G28Very low31.2Very low82 Ų82124.3 Ų124.385%0.84580%0.797SS**  trans148.398.814600000121
96G29.4Very low31.2Very low86 Ų86124 Ų12489%0.88780%0.803SS**  trans88.3131.7136.400000123.5
97G29.1Very low31.1Very low84 Ų84122.5 Ų122.587%0.86680%0.797SS**  trans81.4144.3163.100000116.5
98G29.6Very low31.1Very low69 Ų69126.7 Ų126.771%0.71180%0.798SS**  cis107.4122.29.800000110.8
99F31.8Very low30.9Very low221 Ų221126.6 Ų126.697%0.96980%0.797SS**  cis-150.4172.320.5-79.5-101.8000112.4
100G35.1Very low31.1Very low66 Ų66119.8 Ų119.868%0.6880%0.797SS**  trans87.1110.8167.300000115.1
101Q33.4Very low30.9Very low168 Ų168120.4 Ų120.479%0.78580%0.803SS**  cis67.113622.5-58.5-165.510.300113.9
102Q32.9Very low30.8Very low160 Ų160127.4 Ų127.475%0.74881%0.807SS**  cis-169.6177.84.5-119.6176.89.900109.1
103S31.8Very low30.7Very low103 Ų103123.4 Ų123.472%0.7281%0.806SS**  cis-160.7-174.7-12.3-155.90000110.3
104S34Very low30.6Very low84 Ų84123 Ų12359%0.58782%0.816SS**  trans-123.3171.1159.7-174.70000110.9
105Y28.6Very low30.6Very low232 Ų232118.3 Ų118.391%0.9181%0.811SS**  trans67.8156.4179.1-54.2-85.1000116.2
106G32.2Very low30.6Very low81 Ų81123.3 Ų123.384%0.83581%0.813SS**  cis165.6168.2-6.300000113.2
107G29.7Very low30.6Very low67 Ų67123.6 Ų123.669%0.69181%0.806SS**  trans173.4134.1174.700000111.4
108Q31.7Very low30.6Very low196 Ų196128.8 Ų128.892%0.91681%0.808SS**  78.7136.760.3-71.9-178.4-4.100113.4
109S29Very low30.6Very low114 Ų114129.5 Ų129.580%0.79782%0.815SS**  cis-166.5155.42.848.10000114.3
110G30Very low30.5Very low87 Ų87123.4 Ų123.490%0.89781%0.806SS**  trans68157.2154.300000120.9
111G28.3Very low30.3Very low78 Ų78126 Ų12680%0.80481%0.813SS**  cis151.4107.4-17.700000117.1
112Y28.7Very low30.1Very low224 Ų224123.3 Ų123.388%0.87881%0.813SS**  trans-167.8140.3156.162.9-90.4000108.1
113A28.9Very low29.9Very low100 Ų100119.8 Ų119.883%0.82682%0.82SS**  cis91.1112.546.500000114.1
114G30.1Very low29.8Very low83 Ų83118.4 Ų118.486%0.85682%0.822SS**  trans170.7148.8179.100000111.7
115A31.4Very low29.7Very low100 Ų100119.4 Ų119.483%0.82684%0.835SS**  trans-144.4149.6-165.600000116.6
116Q28.1Very low29.7Very low187 Ų187113.8 Ų113.887%0.87483%0.83SS**  trans4599141.6-170.2178.1-22.700121.3
117A29.1Very low29.6Very low91 Ų91121.1 Ų121.175%0.75283%0.834SS**  trans-161.8138.6141.900000106.9
118Q29.1Very low29.7Very low194 Ų194120.9 Ų120.991%0.90783%0.831SS**  59.999.951.7-71.1-165.2-7.700114.5
119G29.1Very low29.5Very low84 Ų84119.5 Ų119.587%0.86683%0.825SS**  trans-175.7139.3172.700000110.3
120A28.7Very low29.4Very low93 Ų93121.5 Ų121.577%0.76982%0.821SS**  trans-148.3170.4-176.400000110.8
121S31.3Very low29.3Very low119 Ų119122.2 Ų122.283%0.83281%0.813SS**  trans71.8153.7176.985.20000115.1
122S29.9Very low29.3Very low113 Ų113124.2 Ų124.279%0.7981%0.809SS**  cis-170.6156.7-12.336.60000112.6
123G28.1Very low29.2Very low85 Ų85124.5 Ų124.588%0.87681%0.811SS**  trans87158.1152.900000117.3
124G29.5Very low29.2Very low75 Ų75123.4 Ų123.477%0.77381%0.809SS**  cis165161.3-8.200000115
125A31.7Very low29.2Very low104 Ų104122.7 Ų122.786%0.8680%0.801SS**  trans68.2142.9175.600000118.2
126S29.7Very low29.2Very low114 Ų114127.6 Ų127.680%0.79781%0.807SS**  cis107.5103.4-2.4-172.50000119
127Y29.6Very low29.3Very low236 Ų236123.9 Ų123.993%0.92580%0.802SS**  trans-177.7158.3141.855.5-100.3000109
128G31Very low29.4Very low61 Ų61125.2 Ų125.263%0.62981%0.805SS**  cis-149.6170.1-7.400000109
129Q28.7Very low29.4Very low168 Ų168120.1 Ų120.179%0.78581%0.805SS**  65.8132.854.4-59.6-76.830.100112.2
130Q27Very low29.4Very low155 Ų155118.9 Ų118.972%0.72479%0.793SS**  cis-169.5-178.13.4-149.1163.1-300112.7
131S28Very low29.5Very low103 Ų103125.1 Ų125.172%0.7280%0.798SS**  trans76.8130160.7-54.80000119
132T26.8Very low29.3Very low119 Ų119127.1 Ų127.173%0.7380%0.799SS**  cis100.1139.80.6-34.70000118.6
133Y28.1Very low29.4Very low231 Ų231124.9 Ų124.991%0.90679%0.794SS**  trans73.3140.1179.9-75-81.8000117.7
134G27.3Very low29.7Very low76 Ų76126 Ų12678%0.78479%0.788SS**  cis-173-178.8-4.900000109.4
135G30.4Very low29.9Very low68 Ų68131.7 Ų131.770%0.70180%0.795SS**  cis168.4169.8-3.500000111.1
136Q32.5Very low29.9Very low204 Ų204130 Ų13095%0.95379%0.787SS**  trans72.2155174.7-52.8173.5-10.300118
137S29Very low30.1Very low108 Ų108134.5 Ų134.576%0.75580%0.796SS**  cis-176.3138-32.8-174.80000111
138S31.5Very low30.2Very low119 Ų119127 Ų12783%0.83279%0.79SS**  trans164.3128.8135.646.10000115.6
139G29.8Very low30.2Very low87 Ų87128.4 Ų128.490%0.89780%0.804SS**  trans69.3138.4156.900000120.2
140G29.8Very low30.3Very low59 Ų59124.2 Ų124.261%0.60881%0.806SS**  cis158.6112-14.100000115.2
141Y30.1Very low30.5Very low224 Ų224121 Ų12188%0.87882%0.815SS**  trans53.7148.9156.373.7-94.7000121.5
142D26.8Very low30.6Very low160 Ų160120.1 Ų120.186%0.85682%0.822SS**  cis-167.3168.2-24.8-104.1127.5000108.7
143G31.9Very low30.8Very low67 Ų67118.5 Ų118.569%0.69183%0.829SS**  cis163.9-2.5-3.600000117.8
144S33.9Very low31.2Very low107 Ų107113.9 Ų113.975%0.74883%0.831SS**  trans-88.9113.5-161.661.10000118.4
145Q33.6Very low31.3Very low196 Ų196113.9 Ų113.992%0.91683%0.831SS**  trans51.9136.1134.3-52.1179.71900121.1
146G32.8Very low31.4Very low67 Ų67121.7 Ų121.769%0.69184%0.84SS**  cis159.2157.4-7.900000114.4
147Q34.3Very low31.2Very low210 Ų210115.8 Ų115.898%0.98183%0.834SS**  trans71.8134.1173.2-48176.92600117
148G31.1Very low31Very low78 Ų78120 Ų12080%0.80483%0.834SS**  cis169.2129.2-13.300000115.7
149G31.2Very low30.7Very low90 Ų90123.9 Ų123.993%0.92883%0.83SS**  trans83.3143.6160.600000118.2
150G29.5Very low30.6Very low80 Ų80124.7 Ų124.783%0.82582%0.822SS**  cis156.1108.8-14.400000116
151G31.3Very low30.6Very low88 Ų88131.6 Ų131.691%0.90784%0.838SS**  trans71.7156.9163.500000117.6
152G30.4Very low30.5Very low85 Ų85123.9 Ų123.988%0.87683%0.827SS**  cis136.9132.7-9.900000114
153G31.9Very low30.6Very low84 Ų84126.5 Ų126.587%0.86683%0.834SS**  trans124.9133.9164.800000116.4
154S35.3Very low30.4Very low135 Ų135127.2 Ų127.294%0.94484%0.841SS**  trans-96.5152.8172-54.60000111.1
155G29.5Very low30.2Very low76 Ų76126.2 Ų126.278%0.78485%0.848SS**  trans-166.1150174.800000114.4
156Y32.6Very low30.2Very low232 Ų232120.7 Ų120.791%0.9184%0.844SS**  trans-121.2146.4-179.843.4-96.8000109.5
157G29.9Very low30.3Very low80 Ų80127.2 Ų127.283%0.82586%0.856SS**  trans-177.6111.6-179.400000117.1
158R24.3Very low30.2Very low197 Ų197120.9 Ų120.974%0.74385%0.847SS**  trans-76.6151.8157.8-135.8171.5173-173.70.7107.1
159W24.3Very low30.6Very low200 Ų200120.9 Ų120.976%0.75885%0.847SS**  cis-158.3-171.345.8-83.5103.1000112.4
160S29Very low30.5Very low103 Ų103128.4 Ų128.472%0.7285%0.848SS**  trans-96.7151.1-169.5-320000116.1
161E29Very low30.7Very low204 Ų204135 Ų13595%0.95385%0.854SS**  trans-172.2145.7138.6-102177.6141.700106.7
162G28Very low30.6Very low63 Ų63134.4 Ų134.465%0.64985%0.848SS**  cis-167.8173.8-700000110.6
163E27.7Very low30.5Very low215 Ų215140.8 Ų140.8100%1.00585%0.846SS**  trans65.3154.6176.1-55-169.682.800118.3
164G29Very low30.5Very low81 Ų81143.3 Ų143.384%0.83584%0.84SS**  trans153.6-34.4171.500000119.1
165G29.5Very low30.4Very low86 Ų86140.6 Ų140.689%0.88783%0.833SS**  trans77.8122.1172.600000117.4
166G33.2Very low30.5Very low80 Ų80141.4 Ų141.483%0.82583%0.832SS**  trans-175.666.5-179.900000114.3
167Q34.3Very low30.6Very low205 Ų205138.2 Ų138.296%0.95883%0.831SS**  trans-79.3145.5177.3-54.2171.427.500110.3
168G32.4Very low30.6Very low77 Ų77146.2 Ų146.279%0.79484%0.836SS**  cis157.799.7-4.900000111.3
169G39.6Very low30.9Very low78 Ų78141.3 Ų141.380%0.80483%0.832SS**  trans-93.8141.1179.400000113.6
170R30.4Very low31.2Very low247 Ų247140.3 Ų140.393%0.93284%0.835SS**  trans-143.2160.3167.6-69.3-167.3-172.2-97.33.2111.2
171F32.4Very low31.2Very low219 Ų219139.2 Ų139.296%0.96184%0.841SS**  trans-101.6161.4-172.3-63.1-98.6000113
172G29.3Very low31.3Very low76 Ų76133.5 Ų133.578%0.78484%0.837SS**  trans124.1144.2174.500000111.8
173R28.5Very low31.5Very low218 Ų218134.7 Ų134.782%0.82385%0.849SS**  cis-158.2171.61.7-153.9-160-111.9-150.4-0.1109.6
174D32.2Very low31.6Very low138 Ų138128.1 Ų128.174%0.73884%0.838SS**  trans66119.1160.1-53.2-43.1000118.4
175G33.9Very low31.9Very low78 Ų78134 Ų13480%0.80484%0.842SS**  trans-104.8152.8158.500000110
176A30.9Very low32.1Very low93 Ų93142.1 Ų142.177%0.76985%0.846SS**  trans-153.3100.7174.300000111.1
177D34.2Very low32.1Very low165 Ų165141.6 Ų141.688%0.88284%0.84SS**  trans-67.5129.8171.6-46.3-97.9000110.4
178R30.6Very low32Very low248 Ų248143.6 Ų143.694%0.93684%0.839SS**  trans-141149.4164.6-74.7-161.6171.5164.70.9112
179S31.6Very low32Very low93 Ų93143.6 Ų143.665%0.6584%0.839SS**  trans-99.6170.7-161.8-158.50000114
180E30.2Very low31.8Very low179 Ų179151.8 Ų151.884%0.83685%0.846SS**  trans51.1114.3151.3-76.5150.795.500121
181G28.4Very low31.9Very low81 Ų81144 Ų14484%0.83584%0.842SS**  102.3156.8106.200000119
182G30.8Very low32.1Very low84 Ų84136.5 Ų136.587%0.86683%0.827SS**  trans92112.7164.500000116.4
183G32.4Very low32.4Very low87 Ų87142.6 Ų142.690%0.89783%0.832SS**  trans-94.715315700000110.8
184G29.2Very low32.8Very low77 Ų77139.6 Ų139.679%0.79483%0.832SS**  trans-177.8127.917700000115.1
185F36.5Very low32.8Very low205 Ų205145.2 Ų145.290%0.89984%0.843SS**  trans-85.7135177.8-58.6-100.7000112.4
186R33.7Very low32.7Very low257 Ų257144.6 Ų144.697%0.9784%0.837SS**  trans172.6139.4146-101.1167.4-99.7-154.2-2.5110
187G33.2Very low33.2Very low69 Ų69145.9 Ų145.971%0.71184%0.841SS**  cis164.5162.7-12.400000113.9
188R31.4Very low33.3Very low246 Ų246148.2 Ų148.293%0.92884%0.838SS**  trans58.2100.3159.5-171.9-177.9-74.8-147.3-2.5118.7
189G31.8Very low33.4Very low78 Ų78142.7 Ų142.780%0.80483%0.828SS**  trans-130.5142.5151.300000109.9
190R35.4Very low33.3Very low250 Ų250149.3 Ų149.394%0.94384%0.838SS**  trans-93148.8-179.4-68.4-179-179.7-102.412.1111.4
191G33.7Very low33.4Very low83 Ų83146.8 Ų146.886%0.85684%0.84SS**  trans165.4114.6160.200000112.9
192G36.8Very low33.5Very low62 Ų62147 Ų14764%0.63984%0.842SS**  trans-175.3134.1174.600000111.7
193F35.1Very low33.5Very low204 Ų204146.3 Ų146.390%0.89584%0.836SS**  trans-145.8142.6169.1-27.2-79.7000108.7
194D37.5Very low33.6Very low155 Ų155152.8 Ų152.883%0.82984%0.835SS**  trans-94-174.9-170.8-56.2-101.2000114.6
195R31.8Very low33.9Very low255 Ų255156.2 Ų156.296%0.96284%0.835SS**  trans88.7145.4171.7-50.5175.9-172.2-167.92.5115.2
196G31.4Very low33.9Very low66 Ų66158.4 Ų158.468%0.6884%0.837SS**  cis175.2159.2-4.700000112.8
197S41.2Very low33.9Very low120 Ų120149.8 Ų149.884%0.83983%0.829SS**  trans-70.6140.3-177.2-174.70000113.6
198Y36.2Very low34Very low213 Ų213149.6 Ų149.684%0.83583%0.826SS**  trans-161.5170.214560.7-94.1000112.1
199D34.2Very low34.2Very low133 Ų133147.6 Ų147.671%0.71182%0.82SS**  trans-96.8154.9-156.8-57.5-120.3000116.1
200R29.6Very low34.3Very low231 Ų231150.9 Ų150.987%0.87282%0.82SS**  46.7109.2126.5-172.3-169.5-163.5169.84.2119.5
201S32Very low34.5Very low126 Ų126151 Ų15188%0.88182%0.82SS**  trans-163.4162.2136-85.60000111.5
202G30.9Very low34.5Very low85 Ų85150.2 Ų150.288%0.87681%0.812SS**  trans-73.4-177.4-171.700000115.4
203G30.5Very low34.5Very low71 Ų71151.2 Ų151.273%0.73282%0.823SS**  cis133.5127.71.500000112.1
204Y34.5Very low34.6Very low222 Ų222151.4 Ų151.487%0.87182%0.819SS**  trans-163.6161.7166.352.9-101.9000112.4
205D33.7Very low34.8Very low150 Ų150152 Ų15280%0.80282%0.822SS**  trans-89.8148.1-162.6-53.7-108.7000116.3
206R37.5Very low35.1Very low250 Ų250151.1 Ų151.194%0.94382%0.819SS**  trans178.5135137-97.4165.4-166.8-163.94.6108.2
207G33.2Very low35.4Very low77 Ų77151.6 Ų151.679%0.79482%0.824SS**  cis111.188.78.200000110.8
208G35.6Very low35.5Very low64 Ų64149.3 Ų149.366%0.6682%0.819SS**  trans-172.658-168.300000116
209Y35.8Very low35.6Very low205 Ų205151.4 Ų151.480%0.80483%0.825SS**  trans12.8129158.954.3-91.8000122.4
210D34.7Very low35.6Very low147 Ų147149 Ų14979%0.78683%0.832SS**  36.4112129.5-58.8-92.7000122.2
211R38Very low36.5Very low251 Ų251141.8 Ų141.895%0.94783%0.829SS**  -160.6116.998.1-107.8-178-173.3-170.93.4112.3
212G35.4Very low37.1Very low68 Ų68142.1 Ų142.170%0.70183%0.828SS**  trans-84.6134.7173.100000112.6
213G35Very low37.6Very low83 Ų83142.9 Ų142.986%0.85683%0.827SS**  trans-86.5127.8156.800000109.2
214Y37.9Very low38.4Very low207 Ų207143.3 Ų143.381%0.81283%0.83SS**  trans-116.9116.1174.351.5-93.1000110.8R216Y214-R216 PolarHBondContact O-N 3.09Å
215D42.4Very low38.8Very low169 Ų169142.2 Ų142.290%0.90484%0.836SS**  trans-66.5126.6164.3-71.5-85.2000110.2
216R38.2Very low39.1Very low236 Ų236138.8 Ų138.889%0.89184%0.836SS**  trans-139.593159.8-172.7-179.6-72.6-166.2-0.9109.5Y214Y214-R216 PolarHBondContact O-N 3.09Å
217G37.5Very low39.6Very low76 Ų76130.7 Ų130.778%0.78483%0.831SS**  trans-78.5153.5-179.100000114.5
218G43.3Very low39.9Very low71 Ų71130.5 Ų130.573%0.73283%0.828SS**  trans81.3100.5140.400000119.2
219R36.7Very low40.6Very low258 Ų258135 Ų13597%0.97484%0.837SS**  175.8150.1116.4-94165.1-163.2-123.84.6111
220G34.2Very low41.1Very low83 Ų83136.9 Ų136.986%0.85684%0.843SS**  trans95.1102.2169.500000114.4
221G48.7Very low41.3Very low78 Ų78133.2 Ų133.280%0.80484%0.839SS**  trans-107.414516400000110.5
222P45.9Very low41.6Very low133 Ų133125.3 Ų125.386%0.86484%0.837SS**PPolyproline II helixtrans-93.5172.5169.736-31.9000112.5
223A40.2Very low41.9Very low102 Ų102131.8 Ų131.884%0.84384%0.841SS**PPolyproline II helixtrans-74.9162.2-174.600000114.2
224G48.4Very low42.6Very low79 Ų79136.5 Ų136.581%0.81484%0.838SS**PPolyproline II helixtrans-81.5134.6-17700000114.8
225M42.8Very low42.8Very low199 Ų199132.7 Ų132.798%0.9883%0.832SS**  trans-142.1148.5157.7-62.3-179.5-179.200106.9
226G40.7Very low42.8Very low78 Ų78134.1 Ų134.180%0.80483%0.83SS**  cis144.871.4-2.500000112.7
227G48Very low42.8Very low81 Ų81126.6 Ų126.684%0.83583%0.827SS**  trans79.2158.417700000114.8
228G38.6Very low42.7Very low72 Ų72126.3 Ų126.374%0.74282%0.824SS**  trans164.245.3-173.800000115.1
229D49.8Very low42.6Very low159 Ų159127.2 Ų127.285%0.8582%0.818SS**  trans-60.2129.6-168.9-59.7-108.3000114.7
230R47Very low43.2Very low245 Ų245125.7 Ų125.793%0.92581%0.813SS**  trans-141115.7159.6-75.1-167-179.6172.92.2112.3
231G38.7Very low43.5Very low69 Ų69128.1 Ų128.171%0.71181%0.806SS**  trans74.352.7143.900000117.7Y233G231-Y233 PolarHBondContact O-N 2.98Å
232G44.7Very low43.3Very low86 Ų86135 Ų13589%0.88781%0.809SS**  trans-73.6120.2161.900000111.7
233Y41.6Very low42.9Very low203 Ų203131.6 Ų131.680%0.79680%0.798SS**  trans-140.8117.8158.356.1-92.4000112.3G231G231-Y233 PolarHBondContact O-N 2.98Å
234K49.9Very low43.1Very low182 Ų182130.6 Ų130.679%0.79179%0.785SS**  trans49.1105.1140.1-58.9173.6-172.6178.20115.5
235N41.3Very low43.2Very low128 Ų128138.5 Ų138.568%0.68479%0.79SS**  cis-168.4171.642.8-78.3-41.8000113.8
236F42.4Very low43.5Very low198 Ų198135.9 Ų135.987%0.86878%0.781SS**  trans58.653.1159.2-51.3-52.4000118.6G238F236-G238 PolarHBondContact O-N 2.97Å
237G38.1Very low43.6Very low79 Ų79140.2 Ų140.281%0.81478%0.78SS**  trans-73.7109148.100000109.9
238G36Very low43.3Very low70 Ų70141.5 Ų141.572%0.72278%0.776SS**  trans-60.7144.7171.800000111.5F236F236-G238 PolarHBondContact O-N 2.97Å
239S40.8Very low44Very low89 Ų89143.6 Ų143.662%0.62279%0.786SS**  trans-61.4143-173.9-1710000112D241S239-D241 VanDerWaalsContact CB-OD1 3.3Å; S239-D241 WeakPolarHBondContact CB-OD1 3.49Å; S239-D241 WeakPolarHBondContact CB-OD2 3.49Å; S239-D241 PolarHBondContact O-N 2.75Å; S239-D241 VanDerWaalsContact O-N 3.12Å; S239-D241 VanDerWaalsContact OG-CG 3.3Å; S239-D241 PolarHBondContact OG-OD1 2.85Å
240R50.5Low44.1Very low227 Ų227138 Ų13886%0.85777%0.766SS**  trans-86.762.3168.7-71.4-177.8177.8159.90.3109.2Y242R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 2.77Å
241D39.8Very low44.4Very low134 Ų134134 Ų13472%0.71776%0.763SS**  trans-68.195.8174.8-58.9-36.3000108.1S239 G243S239-D241 VanDerWaalsContact CB-OD1 3.3Å; S239-D241 WeakPolarHBondContact CB-OD1 3.49Å; S239-D241 WeakPolarHBondContact CB-OD2 3.49Å; S239-D241 PolarHBondContact O-N 2.75Å; S239-D241 VanDerWaalsContact O-N 3.12Å; S239-D241 VanDerWaalsContact OG-CG 3.3Å; S239-D241 PolarHBondContact OG-OD1 2.85Å; D241-G243 PolarHBondContact O-N 2.88Å
242Y43.3Very low45.3Very low222 Ų222138.7 Ų138.787%0.87177%0.766SS**  trans-68.878.2165.5-94.7-92.9000108R240R240-Y242 VanDerWaalsContact C-N 3.33Å; R240-Y242 PolarHBondContact O-N 2.77Å
243G38.9Very low45.8Very low61 Ų61141 Ų14163%0.62976%0.758SS**  trans-52.3142.3173.400000111D241 R245D241-G243 PolarHBondContact O-N 2.88Å; G243-R245 PolarHBondContact O-N 2.96Å
244S44.5Very low46.7Very low81 Ų81132.7 Ų132.757%0.56673%0.728SS**  trans-27.8109.6-171.3-1660000114D246 E247S244-D246 VanDerWaalsContact C-N 3.31Å; S244-D246 PolarHBondContact OG-O 3.29Å; S244-E247 WeakPolarHBondContact CB-OE2 3.42Å; S244-E247 PolarHBondContact OG-OE2 3.35Å
245R49.6Very low47.2Very low245 Ų245126.7 Ų126.793%0.92571%0.708SS**SBendtrans-101.138.8167.2-160.5-153.1156.7108.50.6110.9G243G243-R245 PolarHBondContact O-N 2.96Å
246D49.5Very low48.4Very low145 Ų145127 Ų12778%0.77571%0.71SS**  trans-151.878.5165.9-167.1-134.3000109.4S244S244-D246 VanDerWaalsContact C-N 3.31Å; S244-D246 PolarHBondContact OG-O 3.29Å
247E41.8Very low50.2Low168 Ų168117.7 Ų117.779%0.78567%0.67SS**  trans-146.4154.9167-114.1157.7129.100110.3S244S244-E247 WeakPolarHBondContact CB-OE2 3.42Å; S244-E247 PolarHBondContact OG-OE2 3.35Å
248S42.5Very low52.5Low109 Ų109115.9 Ų115.976%0.76264%0.641SS**  trans-62.5153.8-147.1-164.10000116G250S248-G250 PolarHBondContact O-N 3.19Å
249A53.2Low55Low116 Ų116114 Ų11496%0.95962%0.615SS**SBendtrans-75.946.516100000111.6
250G52.7Low57.4Low40 Ų40109.7 Ų109.741%0.41259%0.586SS.*  trans-103.1151.4172.900000110.8S248S248-G250 PolarHBondContact O-N 3.19Å
251D53.1Low59.4Low163 Ų163101.4 Ų101.487%0.87256%0.556SS**  trans41.479.5159.9-54.3-66.1000116.2D253D251-D253 PolarHBondContact O-N 3.06Å
252Q56.8Low61.8Low167 Ų16795 Ų9578%0.7852%0.522SS*.  trans-56.6122.5150.4-70.9178.637.200107N254Q252-N254 VanDerWaalsContact C-N 3.34Å; Q252-N254 WeakPolarHBondContact O-CB 3.44Å; Q252-N254 PolarHBondContact O-N 3.28Å
253D54.9Low64Low134 Ų13488.5 Ų88.572%0.71750%0.499SS*.  trans-61.696.6-178.9-159.7-40.1000109.6D251 S255D251-D253 PolarHBondContact O-N 3.06Å; D253-S255 PolarHBondContact O-N 3.32Å; D253-S255 VanDerWaalsContact OD1-CB 3.3Å; D253-S255 WeakPolarHBondContact OD1-CB 3.39Å; D253-S255 PolarHBondContact OD1-OG 2.93Å
254N61.6Low66.3Low29 Ų2986.7 Ų86.716%0.15548%0.481CS..  trans-90.89.2-164.1-147.632.6000111.3Q252 D256 N257 F341 A342Q252-N254 VanDerWaalsContact C-N 3.34Å; Q252-N254 WeakPolarHBondContact O-CB 3.44Å; Q252-N254 PolarHBondContact O-N 3.28Å; N254-D256 PolarHBondContact O-N 3.21Å; N254-N257 VanDerWaalsContact CG-ND2 3.31Å; N254-N257 PolarHBondContact ND2-ND2 3.38Å; N254-N257 WeakPolarHBondContact O-CB 3.35Å; N254-N257 PolarHBondContact O-N 2.81Å; N254-N257 VanDerWaalsContact OD1-CG 3.24Å; N254-N257 PolarHBondContact OD1-ND2 3.11Å; N254-F341 HydrophobicContact CB-CB 4.16Å; N254-F341 HydrophobicContact CB-CG 4.41Å; N254-F341 VanDerWaalsContact ND2-CB 3.34Å; N254-F341 WeakPolarHBondContact ND2-CB 3.33Å; N254-F341 WeakPolarHBondContact O-CD1 3.12Å; N254-A342 PolarHBondContact ND2-O 3.23Å
255S60.1Low68.1Low55 Ų5582.9 Ų82.939%0.38545%0.454SS..THydrogen-bonded Turntrans-58.7-26.7-172.7-59.40000114D253 N257D253-S255 PolarHBondContact O-N 3.32Å; D253-S255 VanDerWaalsContact OD1-CB 3.3Å; D253-S255 WeakPolarHBondContact OD1-CB 3.39Å; D253-S255 PolarHBondContact OD1-OG 2.93Å; S255-N257 VanDerWaalsContact C-N 3.31Å; S255-N257 PolarHBondContact O-N 2.06Å
256D66Low69.4Low134 Ų13471.5 Ų71.572%0.71741%0.413SS*.THydrogen-bonded Turntrans-78.3-8175.8-67.6-28.9000113.8N254 N258N254-D256 PolarHBondContact O-N 3.21Å; D256-N258 PolarHBondContact O-N 2.88Å
257N80.1Confident70.8Confident4 Ų468.8 Ų68.82%0.02140%0.396CS..  trans-78.1106.4179.4-75.25.6000111.2N254 S255 T259 F341 A342 R344N254-N257 VanDerWaalsContact CG-ND2 3.31Å; N254-N257 PolarHBondContact ND2-ND2 3.38Å; N254-N257 WeakPolarHBondContact O-CB 3.35Å; N254-N257 PolarHBondContact O-N 2.81Å; N254-N257 VanDerWaalsContact OD1-CG 3.24Å; N254-N257 PolarHBondContact OD1-ND2 3.11Å; S255-N257 VanDerWaalsContact C-N 3.31Å; S255-N257 PolarHBondContact O-N 2.06Å; N257-T259 PolarHBondContact O-N 3.11Å; N257-F341 HydrophobicContact CB-CD1 4.33Å; N257-A342 PolarHBondContact ND2-O 3.45Å; N257-R344 PolarHBondContact ND2-NE 2.82Å; N257-R344 PolarHBondContact OD1-NE 3.12Å; N257-R344 PolarHBondContact OD1-NH2 3.09Å
258N87.1Confident72.5Confident41 Ų4165.3 Ų65.322%0.21938%0.383CS..  trans-66.213.8164.866.8-4.7000114.7D256 F314 D315 P317D256-N258 PolarHBondContact O-N 2.88Å; N258-F314 PolarHBondContact ND2-O 3.41Å; N258-F314 VanDerWaalsContact ND2-O 3.13Å; N258-F314 WeakPolarHBondContact O-CA 3.36Å; N258-F314 WeakPolarHBondContact O-CB 3.48Å; N258-F314 PolarHBondContact O-N 2.75Å; N258-D315 PolarHBondContact ND2-O 3.19Å; N258-D315 VanDerWaalsContact ND2-O 3.11Å; N258-P317 HydrophobicContact CB-CB 4.41Å; N258-P317 HydrophobicContact CB-CG 4.14Å
259T88.8Confident74.3Confident29 Ų2960.7 Ų60.718%0.17835%0.351CS..EExtended strand (participates in β ladder)trans-119.7125.4178.5-51.60000109.6N257 V312 A342N257-T259 PolarHBondContact O-N 3.11Å; T259-V312 WeakPolarHBondContact CA-O 3.24Å; T259-A342 HydrophobicContact CG2-CB 3.79Å; T259-A342 VanDerWaalsContact O-CB 3.24Å; T259-A342 WeakPolarHBondContact O-CB 3.28Å; T259-A342 PolarHBondContact O-N 3.43Å
260I91.4Very high75.8Confident0 Ų058.2 Ų58.20%032%0.324CS..EExtended strand (participates in β ladder)trans-101.2153.7174.363.8166.4000110.8V262 F278 T311 V312 F314 A320 A323 I324 V339 S340I260-V262 HydrophobicContact CD1-CG2 3.77Å; I260-V262 HydrophobicContact CG1-CG2 4.19Å; I260-F278 HydrophobicContact CD1-CD1 3.55Å; I260-F278 HydrophobicContact CD1-CE1 3.4Å; I260-F278 HydrophobicContact CD1-CG 4.33Å; I260-F278 HydrophobicContact CD1-CZ 4.09Å; I260-T311 WeakPolarHBondContact O-CA 3.21Å; I260-V312 HydrophobicContact CD1-CB 4.16Å; I260-V312 HydrophobicContact CG1-CB 3.75Å; I260-V312 HydrophobicContact CG1-CG2 4.43Å; I260-V312 PolarHBondContact N-O 3.48Å; I260-V312 PolarHBondContact O-N 2.65Å; I260-F314 HydrophobicContact CD1-CE2 3.69Å; I260-F314 HydrophobicContact CD1-CZ 4.24Å; I260-F314 HydrophobicContact CG1-CD2 4.48Å; I260-F314 HydrophobicContact CG1-CE2 3.82Å; I260-F314 HydrophobicContact CG2-CD2 4.38Å; I260-F314 HydrophobicContact CG2-CE2 4.02Å; I260-A320 HydrophobicContact CG2-CB 4.04Å; I260-A320 WeakPolarHBondContact CG2-O 3.32Å; I260-A323 HydrophobicContact CD1-CB 4.47Å; I260-I324 HydrophobicContact CG2-CD1 4.06Å; I260-I324 HydrophobicContact CG2-CG1 3.84Å; I260-V339 HydrophobicContact CB-CG1 4.21Å; I260-V339 HydrophobicContact CD1-CG1 3.75Å; I260-S340 CarbonylContact C-O 3.58Å; I260-S340 WeakPolarHBondContact CA-O 3.45Å; I260-S340 WeakPolarHBondContact CB-O 3.46Å
261F91.5Very high77.4Confident52 Ų5258.7 Ų58.723%0.22832%0.319CS..EExtended strand (participates in β ladder)trans-108.4133.6166.9-175.7-94.6000108.4Q263 Y298 E309 T311 V339 S340 A342F261-Q263 HydrophobicContact CE1-CB 4.05Å; F261-Y298 HydrophobicContact CE2-CE2 4.39Å; F261-E309 HydrophobicContact CE1-CG 4.26Å; F261-E309 HydrophobicContact CE2-CB 4.47Å; F261-E309 HydrophobicContact CZ-CB 3.97Å; F261-E309 HydrophobicContact CZ-CG 3.81Å; F261-T311 HydrophobicContact CD2-CG2 3.74Å; F261-V339 WeakPolarHBondContact O-CA 3.32Å; F261-S340 PolarHBondContact N-O 3.13Å; F261-S340 PolarHBondContact O-N 2.59Å; F261-A342 HydrophobicContact CB-CB 4.16Å
262V90.4Very high78.9Confident0 Ų057 Ų570%031%0.306CS..EExtended strand (participates in β ladder)trans-122.8130.9-178.2-171.90000107.7I260 L265 F278 E309 A310 V312 I337 K338 V339I260-V262 HydrophobicContact CD1-CG2 3.77Å; I260-V262 HydrophobicContact CG1-CG2 4.19Å; V262-L265 HydrophobicContact CB-CD1 4.07Å; V262-L265 HydrophobicContact CB-CG 4.49Å; V262-L265 HydrophobicContact CG1-CD1 3.8Å; V262-L265 HydrophobicContact CG1-CD2 3.88Å; V262-L265 HydrophobicContact CG1-CG 3.7Å; V262-F278 HydrophobicContact CB-CZ 4.4Å; V262-F278 HydrophobicContact CG1-CE2 4.23Å; V262-F278 HydrophobicContact CG1-CZ 3.97Å; V262-F278 HydrophobicContact CG2-CE1 4.18Å; V262-F278 HydrophobicContact CG2-CE2 3.84Å; V262-F278 HydrophobicContact CG2-CZ 3.5Å; V262-E309 CarbonylContact O-C 3.52Å; V262-E309 VanDerWaalsContact O-CA 3.26Å; V262-E309 WeakPolarHBondContact O-CA 3.26Å; V262-A310 PolarHBondContact N-O 3.33Å; V262-A310 PolarHBondContact O-N 3.02Å; V262-V312 HydrophobicContact CG2-CG2 4.25Å; V262-I337 HydrophobicContact CG1-CB 4.37Å; V262-I337 HydrophobicContact CG1-CG2 4.42Å; V262-K338 CarbonylContact C-O 3.47Å; V262-K338 WeakPolarHBondContact CA-O 3.26Å; V262-V339 HydrophobicContact CG1-CG2 4.23Å; V262-V339 HydrophobicContact CG2-CG1 4.39Å; V262-V339 HydrophobicContact CG2-CG2 4.43Å
263Q89.7Confident80.4Confident85 Ų8553.2 Ų53.240%0.39729%0.288SS..EExtended strand (participates in β ladder)trans-125.9149.4177.5-179.4172.262.700109.2F261 G308 E309 I337 K338F261-Q263 HydrophobicContact CE1-CB 4.05Å; Q263-G308 CarbonylContact C-O 3.59Å; Q263-G308 WeakPolarHBondContact CA-O 3.26Å; Q263-E309 HydrophobicContact CB-CG 4.08Å; Q263-E309 HydrophobicContact CG-CG 3.85Å; Q263-E309 PolarHBondContact NE2-OE1 3.19Å; Q263-I337 CarbonylContact O-C 3.51Å; Q263-I337 WeakPolarHBondContact O-CA 3.5Å; Q263-I337 WeakPolarHBondContact O-CB 3.45Å; Q263-K338 HydrophobicContact CB-CB 4.45Å; Q263-K338 PolarHBondContact N-O 3.37Å; Q263-K338 PolarHBondContact O-N 3.23Å
264G86.9Confident81.9Confident24 Ų2446.8 Ų46.825%0.24725%0.254CS..  trans96.42.1177.900000115.9G266 G308 K335G264-G266 PolarHBondContact O-N 3.2Å; G264-G308 PolarHBondContact N-O 3.38Å; G264-K335 WeakPolarHBondContact O-CB 3.35Å
265L82.7Confident83.2Confident0 Ų045.6 Ų45.60%025%0.249CC..  trans-60.7-7.7-174.4-72.6166.4000116V262 A269 V274 G308 A310 F332 I337V262-L265 HydrophobicContact CB-CD1 4.07Å; V262-L265 HydrophobicContact CB-CG 4.49Å; V262-L265 HydrophobicContact CG1-CD1 3.8Å; V262-L265 HydrophobicContact CG1-CD2 3.88Å; V262-L265 HydrophobicContact CG1-CG 3.7Å; L265-A269 HydrophobicContact CB-CB 3.76Å; L265-A269 WeakPolarHBondContact O-CB 3.45Å; L265-V274 HydrophobicContact CD1-CG2 4.09Å; L265-V274 HydrophobicContact CD2-CG2 4.11Å; L265-G308 WeakPolarHBondContact CB-O 3.22Å; L265-G308 PolarHBondContact N-O 2.82Å; L265-A310 HydrophobicContact CD1-CB 3.61Å; L265-F332 HydrophobicContact CB-CD1 4.43Å; L265-F332 HydrophobicContact CD2-CB 4.41Å; L265-F332 HydrophobicContact CD2-CD1 3.77Å; L265-F332 HydrophobicContact CD2-CD2 4.14Å; L265-F332 HydrophobicContact CD2-CE1 4Å; L265-F332 HydrophobicContact CD2-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CG 3.85Å; L265-F332 HydrophobicContact CD2-CZ 4.29Å; L265-F332 WeakPolarHBondContact O-CD1 3.46Å; L265-I337 HydrophobicContact CD2-CG2 4Å; L265-I337 HydrophobicContact CG-CG2 4.25Å
266G75.6Confident84.5Confident7 Ų747.4 Ų47.47%0.07225%0.254CS..  trans82.5-170.8-179.400000114.8G264 D268 G308G264-G266 PolarHBondContact O-N 3.2Å; G266-D268 VanDerWaalsContact C-N 3.34Å; G266-G308 WeakPolarHBondContact O-CA 3.3Å
267E79.3Confident85.6Confident87 Ų8743.7 Ų43.741%0.40723%0.23SC..SBendtrans-91.1-6.9179.4-64.1-171.115400111.5R305 P306E267-R305 WeakPolarHBondContact OE1-CB 3.27Å; E267-R305 WeakPolarHBondContact OE1-CD 3.33Å; E267-R305 VanDerWaalsContact OE1-CG 3.28Å; E267-R305 WeakPolarHBondContact OE1-CG 3.38Å; E267-R305 IonicContact OE1-CZ 3.92Å; E267-R305 IonicContact OE1-NE 3.66Å; E267-R305 IonicContact OE1-NH1 2.72Å; E267-R305 PolarHBondContact OE1-NH1 2.94Å; E267-R305 IonicContact OE2-NH1 2.98Å; E267-R305 PolarHBondContact OE2-NH1 2.86Å; E267-P306 WeakPolarHBondContact O-CG 3.37Å
268D77.3Confident85.9Confident95 Ų9543.5 Ų43.551%0.50823%0.229SC..SBendtrans-106.4-5.8-164.7-34.9-89000112.1G266 T270 K335G266-D268 VanDerWaalsContact C-N 3.34Å; D268-T270 PolarHBondContact O-N 3.28Å; D268-K335 IonicContact OD2-NZ 3.85Å
269A80.4Confident86Confident12 Ų1246.8 Ų46.810%0.09924%0.242CC..  trans-75.1113.5-17100000113.6L265 V274 I297 F332L265-A269 HydrophobicContact CB-CB 3.76Å; L265-A269 WeakPolarHBondContact O-CB 3.45Å; A269-V274 HydrophobicContact CB-CG2 4.18Å; A269-I297 VanDerWaalsContact O-CD1 3.3Å; A269-I297 WeakPolarHBondContact O-CD1 3.36Å; A269-F332 HydrophobicContact CB-CE1 3.84Å; A269-F332 HydrophobicContact CB-CZ 4.47Å
270T86.3Confident85.9Confident65 Ų6550.6 Ų50.640%0.39926%0.257SS..  trans-88.3157.9171.3720000112.8D268 Q272 E273 V274D268-T270 PolarHBondContact O-N 3.28Å; T270-Q272 PolarHBondContact O-N 2.72Å; T270-Q272 PolarHBondContact OG1-N 3.49Å; T270-E273 WeakPolarHBondContact CB-OE2 3.27Å; T270-E273 VanDerWaalsContact CG2-OE2 3.26Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.22Å; T270-E273 PolarHBondContact N-OE2 2.98Å; T270-E273 PolarHBondContact O-N 2.83Å; T270-E273 VanDerWaalsContact OG1-CD 3.24Å; T270-E273 WeakPolarHBondContact OG1-CG 3.3Å; T270-E273 PolarHBondContact OG1-N 3Å; T270-E273 VanDerWaalsContact OG1-N 3.13Å; T270-E273 PolarHBondContact OG1-OE2 2.82Å; T270-V274 WeakPolarHBondContact O-CG2 3.47Å; T270-V274 PolarHBondContact O-N 2.79Å
271V85Confident85.6Confident49 Ų4953 Ų5330%0.29727%0.27SS..Hα-helixtrans-58.6-28.4171.1166.80000112.2G275 P293 I295 I297V271-G275 PolarHBondContact O-N 2.64Å; V271-G275 VanDerWaalsContact O-N 3.13Å; V271-P293 HydrophobicContact CG1-CG 4.19Å; V271-I295 HydrophobicContact CG1-CB 4.27Å; V271-I295 HydrophobicContact CG2-CG2 4.48Å; V271-I297 HydrophobicContact CG2-CD1 3.8Å; V271-I297 HydrophobicContact CG2-CG1 4.03Å
272Q85.9Confident85.3Confident128 Ų12851.1 Ų51.160%0.59827%0.265SS*.Hα-helixtrans-73.5-51.1178.8-65.5-97.1-105.800110.7T270 G275 D276T270-Q272 PolarHBondContact O-N 2.72Å; T270-Q272 PolarHBondContact OG1-N 3.49Å; Q272-G275 CarbonylContact O-C 3.57Å; Q272-G275 WeakPolarHBondContact O-CA 3.29Å; Q272-G275 PolarHBondContact O-N 2.83Å; Q272-G275 VanDerWaalsContact O-N 3.17Å; Q272-D276 WeakPolarHBondContact O-CB 3.38Å; Q272-D276 PolarHBondContact O-N 2.86Å
273E87.6Confident85.2Confident87 Ų8757.2 Ų57.241%0.40730%0.296SS..Hα-helixtrans-66.7-40.7-179-64.4150.9138.900112.2T270 G275 D276 Y277 F332T270-E273 WeakPolarHBondContact CB-OE2 3.27Å; T270-E273 VanDerWaalsContact CG2-OE2 3.26Å; T270-E273 WeakPolarHBondContact CG2-OE2 3.22Å; T270-E273 PolarHBondContact N-OE2 2.98Å; T270-E273 PolarHBondContact O-N 2.83Å; T270-E273 VanDerWaalsContact OG1-CD 3.24Å; T270-E273 WeakPolarHBondContact OG1-CG 3.3Å; T270-E273 PolarHBondContact OG1-N 3Å; T270-E273 VanDerWaalsContact OG1-N 3.13Å; T270-E273 PolarHBondContact OG1-OE2 2.82Å; E273-G275 VanDerWaalsContact C-N 3.28Å; E273-G275 PolarHBondContact O-N 3.45Å; E273-D276 PolarHBondContact O-N 2.98Å; E273-Y277 VanDerWaalsContact O-CB 3.25Å; E273-Y277 WeakPolarHBondContact O-CB 3.22Å; E273-Y277 PolarHBondContact O-N 2.75Å; E273-F332 HydrophobicContact CB-CZ 4.28Å
274V87.2Confident85.3Confident0 Ų053.8 Ų53.80%028%0.28CS..Hα-helixtrans-62.6-40.3173.5178.40000109.9L265 A269 T270 F278 I295 I297 V312 F332L265-V274 HydrophobicContact CD1-CG2 4.09Å; L265-V274 HydrophobicContact CD2-CG2 4.11Å; A269-V274 HydrophobicContact CB-CG2 4.18Å; T270-V274 WeakPolarHBondContact O-CG2 3.47Å; T270-V274 PolarHBondContact O-N 2.79Å; V274-F278 HydrophobicContact CG1-CD2 3.74Å; V274-F278 HydrophobicContact CG1-CE2 4.02Å; V274-F278 VanDerWaalsContact O-CD2 3.31Å; V274-F278 WeakPolarHBondContact O-CD2 3.37Å; V274-F278 PolarHBondContact O-N 2.8Å; V274-I295 HydrophobicContact CB-CD1 4.21Å; V274-I295 HydrophobicContact CB-CG2 4.46Å; V274-I295 HydrophobicContact CG1-CD1 4.01Å; V274-I295 HydrophobicContact CG1-CG2 4.03Å; V274-I297 HydrophobicContact CG2-CD1 4.42Å; V274-V312 HydrophobicContact CG1-CG2 3.7Å; V274-F332 HydrophobicContact CG2-CZ 4.43Å
275G87.9Confident85.3Confident4 Ų456.6 Ų56.64%0.04129%0.286CS..Hα-helixtrans-61.5-44.6172.800000112.8V271 Q272 E273 K279 I284 I295V271-G275 PolarHBondContact O-N 2.64Å; V271-G275 VanDerWaalsContact O-N 3.13Å; Q272-G275 CarbonylContact O-C 3.57Å; Q272-G275 WeakPolarHBondContact O-CA 3.29Å; Q272-G275 PolarHBondContact O-N 2.83Å; Q272-G275 VanDerWaalsContact O-N 3.17Å; E273-G275 VanDerWaalsContact C-N 3.28Å; E273-G275 PolarHBondContact O-N 3.45Å; G275-K279 VanDerWaalsContact O-CB 3.24Å; G275-K279 WeakPolarHBondContact O-CB 3.28Å; G275-K279 WeakPolarHBondContact O-CG 3.38Å; G275-K279 PolarHBondContact O-N 2.87Å; G275-I284 WeakPolarHBondContact O-CD1 3.49Å; G275-I295 VanDerWaalsContact CA-CD1 3.43Å; G275-I295 VanDerWaalsContact N-CD1 3.31Å
276D88.3Confident85.6Confident92 Ų9260.2 Ų60.249%0.49231%0.308SS..Hα-helixtrans-76.2-23.9-175.3-84.116.3000113.8Q272 E273 K279Q272-D276 WeakPolarHBondContact O-CB 3.38Å; Q272-D276 PolarHBondContact O-N 2.86Å; E273-D276 PolarHBondContact O-N 2.98Å; D276-K279 WeakPolarHBondContact O-CE 3.27Å; D276-K279 WeakPolarHBondContact O-CG 3.2Å; D276-K279 WeakPolarHBondContact OD1-CE 3.03Å; D276-K279 IonicContact OD1-NZ 2.72Å; D276-K279 PolarHBondContact OD1-NZ 3.08Å; D276-K279 IonicContact OD2-NZ 2.84Å; D276-K279 PolarHBondContact OD2-NZ 3.47Å
277Y87.6Confident86Confident57 Ų5762.9 Ų62.922%0.22432%0.321CS..Hα-helixtrans-76.1-56.3169.9-167.8-110.6000110.8E273 K279 Q280 F327 F332 I337E273-Y277 VanDerWaalsContact O-CB 3.25Å; E273-Y277 WeakPolarHBondContact O-CB 3.22Å; E273-Y277 PolarHBondContact O-N 2.75Å; Y277-K279 VanDerWaalsContact C-N 3.34Å; Y277-K279 PolarHBondContact O-N 3.35Å; Y277-Q280 WeakPolarHBondContact O-CG 3.26Å; Y277-Q280 PolarHBondContact O-N 2.82Å; Y277-Q280 PolarHBondContact O-NE2 3.42Å; Y277-F327 HydrophobicContact CD1-CD1 4.02Å; Y277-F327 AromaticContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CZ 4.01Å; Y277-F327 HydrophobicContact CD2-CE1 4.48Å; Y277-F327 AromaticContact CE1-CD1 3.21Å; Y277-F327 HydrophobicContact CE1-CD1 3.21Å; Y277-F327 AromaticContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CG 4.04Å; Y277-F327 AromaticContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE2-CE1 4.09Å; Y277-F327 HydrophobicContact CG-CE1 4.3Å; Y277-F327 AromaticContact CZ-CD1 3.59Å; Y277-F327 AromaticContact CZ-CE1 3.43Å; Y277-F327 VanDerWaalsContact CZ-CE1 3.43Å; Y277-F332 HydrophobicContact CD1-CD2 4.33Å; Y277-F332 HydrophobicContact CE1-CD2 4.41Å; Y277-F332 HydrophobicContact CG-CD2 4.4Å; Y277-F332 HydrophobicContact CG-CE2 4.3Å; Y277-I337 HydrophobicContact CE1-CD1 4.05Å
278F87.6Confident86Confident0 Ų069.1 Ų69.10%035%0.346CS..Hα-helixtrans-72.1-22-174.1-76.8-80000113.9I260 V262 V274 Q280 I281 I284 V312 F314 A323 F327 I337 V339I260-F278 HydrophobicContact CD1-CD1 3.55Å; I260-F278 HydrophobicContact CD1-CE1 3.4Å; I260-F278 HydrophobicContact CD1-CG 4.33Å; I260-F278 HydrophobicContact CD1-CZ 4.09Å; V262-F278 HydrophobicContact CB-CZ 4.4Å; V262-F278 HydrophobicContact CG1-CE2 4.23Å; V262-F278 HydrophobicContact CG1-CZ 3.97Å; V262-F278 HydrophobicContact CG2-CE1 4.18Å; V262-F278 HydrophobicContact CG2-CE2 3.84Å; V262-F278 HydrophobicContact CG2-CZ 3.5Å; V274-F278 HydrophobicContact CG1-CD2 3.74Å; V274-F278 HydrophobicContact CG1-CE2 4.02Å; V274-F278 VanDerWaalsContact O-CD2 3.31Å; V274-F278 WeakPolarHBondContact O-CD2 3.37Å; V274-F278 PolarHBondContact O-N 2.8Å; F278-Q280 PolarHBondContact O-N 2.69Å; F278-Q280 VanDerWaalsContact O-N 3.13Å; F278-I281 PolarHBondContact O-N 2.77Å; F278-I284 HydrophobicContact CB-CD1 3.78Å; F278-V312 HydrophobicContact CB-CG1 4.33Å; F278-V312 HydrophobicContact CD2-CG2 4.2Å; F278-F314 HydrophobicContact CB-CE1 4.4Å; F278-F314 HydrophobicContact CB-CZ 4.03Å; F278-F314 HydrophobicContact CD1-CZ 4.17Å; F278-A323 HydrophobicContact CD1-CB 4.44Å; F278-F327 AromaticContact CD1-CD2 3.4Å; F278-F327 HydrophobicContact CD1-CD2 3.4Å; F278-F327 AromaticContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CE2 3.44Å; F278-F327 VanDerWaalsContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CG 4.26Å; F278-F327 HydrophobicContact CD1-CZ 4.32Å; F278-F327 HydrophobicContact CE1-CB 3.92Å; F278-F327 AromaticContact CE1-CD2 3.27Å; F278-F327 HydrophobicContact CE1-CD2 3.27Å; F278-F327 AromaticContact CE1-CE2 3.82Å; F278-F327 HydrophobicContact CE1-CE2 3.82Å; F278-F327 AromaticContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CG-CD2 4.5Å; F278-F327 HydrophobicContact CG-CE2 4.22Å; F278-F327 HydrophobicContact CZ-CB 4.39Å; F278-F327 HydrophobicContact CZ-CD2 4.3Å; F278-F327 HydrophobicContact CZ-CG 4.41Å; F278-I337 HydrophobicContact CZ-CD1 4.4Å; F278-V339 HydrophobicContact CE1-CG1 4.45Å; F278-V339 HydrophobicContact CE1-CG2 4.32Å; F278-V339 HydrophobicContact CZ-CG2 4.18Å
279K88.3Confident86Confident110 Ų11074.4 Ų74.448%0.47837%0.365SS..THydrogen-bonded Turntrans-63.5-15.7176.173.9-175.9177.7-1660114.6G275 D276 Y277 I281 G282 I284G275-K279 VanDerWaalsContact O-CB 3.24Å; G275-K279 WeakPolarHBondContact O-CB 3.28Å; G275-K279 WeakPolarHBondContact O-CG 3.38Å; G275-K279 PolarHBondContact O-N 2.87Å; D276-K279 WeakPolarHBondContact O-CE 3.27Å; D276-K279 WeakPolarHBondContact O-CG 3.2Å; D276-K279 WeakPolarHBondContact OD1-CE 3.03Å; D276-K279 IonicContact OD1-NZ 2.72Å; D276-K279 PolarHBondContact OD1-NZ 3.08Å; D276-K279 IonicContact OD2-NZ 2.84Å; D276-K279 PolarHBondContact OD2-NZ 3.47Å; Y277-K279 VanDerWaalsContact C-N 3.34Å; Y277-K279 PolarHBondContact O-N 3.35Å; K279-I281 VanDerWaalsContact C-N 3.26Å; K279-I281 PolarHBondContact O-N 3.2Å; K279-G282 WeakPolarHBondContact CA-O 3.42Å; K279-I284 HydrophobicContact CB-CD1 4.31Å; K279-I284 HydrophobicContact CB-CG1 4.49Å
280Q86.3Confident85.9Confident108 Ų10877.9 Ų77.951%0.50539%0.385SS..THydrogen-bonded Turntrans-69.4-23-178.882.5-168-113.100113Y277 F278 F327Y277-Q280 WeakPolarHBondContact O-CG 3.26Å; Y277-Q280 PolarHBondContact O-N 2.82Å; Y277-Q280 PolarHBondContact O-NE2 3.42Å; F278-Q280 PolarHBondContact O-N 2.69Å; F278-Q280 VanDerWaalsContact O-N 3.13Å; Q280-F327 HydrophobicContact CG-CE1 4.49Å; Q280-F327 HydrophobicContact CG-CZ 3.72Å
281I86.7Confident85.5Confident51 Ų5177.7 Ų77.726%0.26240%0.395SS..THydrogen-bonded Turntrans-100.6-29.3-179.4-58.6-57.7000112.2F278 K279 A322 A323 W326 F327F278-I281 PolarHBondContact O-N 2.77Å; K279-I281 VanDerWaalsContact C-N 3.26Å; K279-I281 PolarHBondContact O-N 3.2Å; I281-A322 HydrophobicContact CG2-CB 3.71Å; I281-A323 HydrophobicContact CB-CB 4.44Å; I281-A323 HydrophobicContact CG2-CB 4.21Å; I281-W326 HydrophobicContact CD1-CB 4.29Å; I281-W326 HydrophobicContact CD1-CD2 4.23Å; I281-W326 HydrophobicContact CD1-CG 3.8Å; I281-W326 HydrophobicContact CG1-CB 4.43Å; I281-W326 HydrophobicContact CG1-CG 4.23Å; I281-F327 HydrophobicContact CB-CE2 4.29Å; I281-F327 HydrophobicContact CG1-CD2 4.35Å; I281-F327 HydrophobicContact CG1-CE2 3.52Å; I281-F327 HydrophobicContact CG1-CZ 3.85Å
282G85.4Confident85.2Confident13 Ų1380.3 Ų80.313%0.13441%0.405CS..SBendtrans-172.1168.6177.400000114.1K279 I284K279-G282 WeakPolarHBondContact CA-O 3.42Å; G282-I284 PolarHBondContact O-N 3.49Å
283I87.8Confident85.2Confident127 Ų12775.4 Ų75.465%0.65138%0.384SS*.  trans-69.1114.6-175.6-58.7176.2000109.5F314 D315I283-F314 WeakPolarHBondContact O-CA 3.45Å; I283-D315 HydrophobicContact CB-CB 4.48Å; I283-D315 HydrophobicContact CG2-CB 4.32Å; I283-D315 PolarHBondContact O-N 2.85Å
284I90.3Very high85.1Confident13 Ų1374 Ų747%0.06738%0.378CS..BIsolated β-bridgetrans-73.9130.4170.9-55.7178.3000108.5G275 F278 K279 G282 V286 P293 I295 V312 S313 F314G275-I284 WeakPolarHBondContact O-CD1 3.49Å; F278-I284 HydrophobicContact CB-CD1 3.78Å; K279-I284 HydrophobicContact CB-CD1 4.31Å; K279-I284 HydrophobicContact CB-CG1 4.49Å; G282-I284 PolarHBondContact O-N 3.49Å; I284-V286 PolarHBondContact O-N 3.42Å; I284-P293 HydrophobicContact CB-CB 4.34Å; I284-P293 HydrophobicContact CG2-CB 3.64Å; I284-I295 HydrophobicContact CD1-CD1 4.44Å; I284-I295 HydrophobicContact CG2-CG1 4.49Å; I284-V312 HydrophobicContact CD1-CG1 4.02Å; I284-V312 HydrophobicContact CG1-CG1 4.24Å; I284-V312 HydrophobicContact CG2-CG1 4.02Å; I284-S313 WeakPolarHBondContact CG2-O 3.23Å; I284-F314 HydrophobicContact CG1-CD1 4.06Å; I284-F314 HydrophobicContact CG1-CE1 3.9Å
285K88Confident85.2Confident83 Ų8374.9 Ų74.936%0.36138%0.382SS..PPolyproline II helixtrans-62.9133.1179.8-175174178.7170.70109.9M294 S313K285-M294 HydrophobicContact CB-CB 4.4Å; K285-M294 HydrophobicContact CB-CG 4.43Å; K285-M294 HydrophobicContact CB-SD 4.37Å; K285-M294 HydrophobicContact CD-SD 3.69Å; K285-M294 HydrophobicContact CG-CG 4.27Å; K285-M294 HydrophobicContact CG-SD 3.71Å; K285-M294 VanDerWaalsContact O-CB 3.25Å; K285-M294 WeakPolarHBondContact O-CB 3.25Å; K285-M294 VanDerWaalsContact O-CG 3.32Å; K285-M294 WeakPolarHBondContact O-CG 3.39Å; K285-M294 PolarHBondContact O-N 2.92Å; K285-S313 VanDerWaalsContact CB-O 3.26Å; K285-S313 WeakPolarHBondContact CB-O 3.36Å; K285-S313 PolarHBondContact N-O 3.33Å
286V88.4Confident85.3Confident77 Ų7778.6 Ų78.647%0.46740%0.401SS..BIsolated β-bridgetrans-100.2134.7-176178.40000111.4I284 K288 G291I284-V286 PolarHBondContact O-N 3.42Å; V286-K288 PolarHBondContact O-N 2.92Å; V286-G291 VanDerWaalsContact CG1-C 3.43Å; V286-G291 WeakPolarHBondContact CG1-O 3.35Å
287N84Confident85.3Confident63 Ų6376.2 Ų76.234%0.33739%0.388SS..  trans-66.5103.6171.1-93.9-47.8000110K289 T290 G291 Q292 M294N287-K289 PolarHBondContact O-N 2.77Å; N287-T290 WeakPolarHBondContact CB-OG1 3.15Å; N287-T290 PolarHBondContact O-N 2.87Å; N287-G291 PolarHBondContact O-N 3.12Å; N287-Q292 WeakPolarHBondContact CB-O 3.39Å; N287-Q292 PolarHBondContact N-O 2.81Å; N287-M294 HydrophobicContact CB-CG 4.34Å
288K79.1Confident85.2Confident217 Ų21778.2 Ų78.294%0.94340%0.396SS*.THydrogen-bonded Turntrans-56.5-9.2179.2-64.4-169.3177.5-1730115.5V286V286-K288 PolarHBondContact O-N 2.92Å
289K77.8Confident84.9Confident207 Ų20781.4 Ų81.490%0.942%0.418SS*.THydrogen-bonded Turntrans-94.5-22.7175.3-66.7-173177.3-175.80114.7N287N287-K289 PolarHBondContact O-N 2.77Å
290T78.3Confident84.5Confident85 Ų8578.9 Ų78.952%0.52141%0.41SS..THydrogen-bonded Turntrans-128.9-10.1-173.660.20000114N287 Q292N287-T290 WeakPolarHBondContact CB-OG1 3.15Å; N287-T290 PolarHBondContact O-N 2.87Å; T290-Q292 PolarHBondContact O-N 2.81Å; T290-Q292 VanDerWaalsContact O-N 3.16Å
291G78.7Confident83.9Confident60 Ų6083.3 Ų83.362%0.61943%0.428SS*.SBendtrans71-0.3-174.900000114.4V286 N287V286-G291 VanDerWaalsContact CG1-C 3.43Å; V286-G291 WeakPolarHBondContact CG1-O 3.35Å; N287-G291 PolarHBondContact O-N 3.12Å
292Q78.9Confident83.2Confident105 Ų10585.4 Ų85.449%0.49145%0.452SS..SBendtrans-90.4151.1-177.6-68168-28.100111.7N287 T290N287-Q292 WeakPolarHBondContact CB-O 3.39Å; N287-Q292 PolarHBondContact N-O 2.81Å; T290-Q292 PolarHBondContact O-N 2.81Å; T290-Q292 VanDerWaalsContact O-N 3.16Å
293P86.2Confident82.7Confident24 Ų2488.9 Ų88.916%0.15647%0.471CS..BIsolated β-bridgetrans-58.1146.6173.325.2-34.8000111.8V271 I284 I295V271-P293 HydrophobicContact CG1-CG 4.19Å; I284-P293 HydrophobicContact CB-CB 4.34Å; I284-P293 HydrophobicContact CG2-CB 3.64Å; P293-I295 HydrophobicContact CB-CD1 3.83Å; P293-I295 HydrophobicContact CB-CG1 4.08Å; P293-I295 HydrophobicContact CG-CD1 3.84Å; P293-I295 HydrophobicContact CG-CG1 4.42Å; P293-I295 PolarHBondContact O-N 3.4Å
294M84.6Confident81.8Confident58 Ų5885.6 Ų85.629%0.28647%0.469SS..SBendtrans-76.773.2178.2-73.9-162.371.600110.7K285 N287 S313K285-M294 HydrophobicContact CB-CB 4.4Å; K285-M294 HydrophobicContact CB-CG 4.43Å; K285-M294 HydrophobicContact CB-SD 4.37Å; K285-M294 HydrophobicContact CD-SD 3.69Å; K285-M294 HydrophobicContact CG-CG 4.27Å; K285-M294 HydrophobicContact CG-SD 3.71Å; K285-M294 VanDerWaalsContact O-CB 3.25Å; K285-M294 WeakPolarHBondContact O-CB 3.25Å; K285-M294 VanDerWaalsContact O-CG 3.32Å; K285-M294 WeakPolarHBondContact O-CG 3.39Å; K285-M294 PolarHBondContact O-N 2.92Å; N287-M294 HydrophobicContact CB-CG 4.34Å; M294-S313 PolarHBondContact O-N 2.97Å; M294-S313 PolarHBondContact O-OG 2.88Å
295I89.9Confident80.9Confident19 Ų1991.6 Ų91.610%0.09749%0.49CS..EExtended strand (participates in β ladder)trans-119.3131178.4-59.5170000108.3V271 V274 G275 I284 P293 I297 A310 T311 V312V271-I295 HydrophobicContact CG1-CB 4.27Å; V271-I295 HydrophobicContact CG2-CG2 4.48Å; V274-I295 HydrophobicContact CB-CD1 4.21Å; V274-I295 HydrophobicContact CB-CG2 4.46Å; V274-I295 HydrophobicContact CG1-CD1 4.01Å; V274-I295 HydrophobicContact CG1-CG2 4.03Å; G275-I295 VanDerWaalsContact CA-CD1 3.43Å; G275-I295 VanDerWaalsContact N-CD1 3.31Å; I284-I295 HydrophobicContact CD1-CD1 4.44Å; I284-I295 HydrophobicContact CG2-CG1 4.49Å; P293-I295 HydrophobicContact CB-CD1 3.83Å; P293-I295 HydrophobicContact CB-CG1 4.08Å; P293-I295 HydrophobicContact CG-CD1 3.84Å; P293-I295 HydrophobicContact CG-CG1 4.42Å; P293-I295 PolarHBondContact O-N 3.4Å; I295-I297 HydrophobicContact CG2-CG1 3.97Å; I295-A310 HydrophobicContact CG2-CB 4.44Å; I295-T311 VanDerWaalsContact CA-O 3.29Å; I295-T311 WeakPolarHBondContact CA-O 3.12Å; I295-V312 HydrophobicContact CD1-CG1 4.5Å; I295-V312 HydrophobicContact CG1-CB 4.39Å; I295-V312 HydrophobicContact CG1-CG1 4.07Å; I295-V312 HydrophobicContact CG1-CG2 4.12Å; I295-V312 HydrophobicContact CG2-CG2 4.33Å
296N88.5Confident80.3Confident81 Ų8189.8 Ų89.843%0.43349%0.488SS..EExtended strand (participates in β ladder)trans-123.7106.3176177.675.4000109.3Y298 A310 T311N296-Y298 VanDerWaalsContact ND2-CE1 3.26Å; N296-Y298 WeakPolarHBondContact ND2-CE1 3.36Å; N296-Y298 WeakPolarHBondContact ND2-CE2 3.18Å; N296-Y298 PolarHBondContact ND2-OH 3.27Å; N296-A310 CarbonylContact O-C 3.55Å; N296-A310 VanDerWaalsContact O-CA 3.28Å; N296-A310 WeakPolarHBondContact O-CA 3.4Å; N296-T311 PolarHBondContact N-O 2.89Å; N296-T311 PolarHBondContact O-N 2.66Å
297I88.3Confident79.8Confident42 Ų4291.9 Ų91.922%0.21549%0.49CS..EExtended strand (participates in β ladder)trans-89.1130179.3-52.1-173.9000109A269 V271 V274 I295 A310A269-I297 VanDerWaalsContact O-CD1 3.3Å; A269-I297 WeakPolarHBondContact O-CD1 3.36Å; V271-I297 HydrophobicContact CG2-CD1 3.8Å; V271-I297 HydrophobicContact CG2-CG1 4.03Å; V274-I297 HydrophobicContact CG2-CD1 4.42Å; I295-I297 HydrophobicContact CG2-CG1 3.97Å; I297-A310 HydrophobicContact CB-CB 4.41Å; I297-A310 HydrophobicContact CG1-CB 3.97Å
298Y86.5Confident79.8Confident99 Ų9989.1 Ų89.139%0.38848%0.477SS..EExtended strand (participates in β ladder)trans-93.9112.3179.4-61.1-86.2000109.9F261 N296 K307 E309 T311F261-Y298 HydrophobicContact CE2-CE2 4.39Å; N296-Y298 VanDerWaalsContact ND2-CE1 3.26Å; N296-Y298 WeakPolarHBondContact ND2-CE1 3.36Å; N296-Y298 WeakPolarHBondContact ND2-CE2 3.18Å; N296-Y298 PolarHBondContact ND2-OH 3.27Å; Y298-K307 WeakPolarHBondContact O-CB 3.47Å; Y298-K307 PolarHBondContact O-N 2.81Å; Y298-E309 HydrophobicContact CD2-CB 4.39Å; Y298-E309 PolarHBondContact N-O 2.99Å; Y298-T311 HydrophobicContact CE2-CG2 4.18Å
299S81Confident80.2Confident67 Ų6779.8 Ų79.847%0.46944%0.436SS..EExtended strand (participates in β ladder)trans-90.5147.7163.851.70000111.6K301S299-K301 PolarHBondContact O-N 2.76Å
300D80.6Confident80.8Confident58 Ų5869.9 Ų69.931%0.3139%0.393SS..  trans-72.6125.7167.2171.238.3000109.6A302 T303 G304 R305D300-A302 VanDerWaalsContact C-N 3.33Å; D300-A302 PolarHBondContact OD1-N 3.1Å; D300-A302 PolarHBondContact OD2-N 2.94Å; D300-T303 WeakPolarHBondContact OD2-CB 3.46Å; D300-T303 WeakPolarHBondContact OD2-CG2 3.15Å; D300-T303 PolarHBondContact OD2-N 2.79Å; D300-T303 PolarHBondContact OD2-OG1 2.9Å; D300-G304 VanDerWaalsContact O-CA 3.27Å; D300-G304 WeakPolarHBondContact O-CA 3.4Å; D300-G304 PolarHBondContact O-N 3.46Å; D300-R305 PolarHBondContact N-O 2.89Å
301K72.1Confident81.4Confident201 Ų20167 Ų6787%0.87438%0.376SS*.THydrogen-bonded Turntrans-80.8-13.8-179.2-60.8-173.6179.4-173.60113.1S299S299-K301 PolarHBondContact O-N 2.76Å
302A72.7Confident81.9Confident94 Ų9464.1 Ų64.178%0.77735%0.346SS*.THydrogen-bonded Turntrans-83.6-40.817800000112.3D300D300-A302 VanDerWaalsContact C-N 3.33Å; D300-A302 PolarHBondContact OD1-N 3.1Å; D300-A302 PolarHBondContact OD2-N 2.94Å
303T74.8Confident82.5Confident86 Ų8660.1 Ų60.153%0.52833%0.329SS..THydrogen-bonded Turntrans-103-13.1-179.760.50000114.5D300 R305D300-T303 WeakPolarHBondContact OD2-CB 3.46Å; D300-T303 WeakPolarHBondContact OD2-CG2 3.15Å; D300-T303 PolarHBondContact OD2-N 2.79Å; D300-T303 PolarHBondContact OD2-OG1 2.9Å; T303-R305 PolarHBondContact O-N 2.92Å; T303-R305 PolarHBondContact OG1-N 3.19Å
304G68.4Low82.7Confident59 Ų5959 Ų5961%0.60832%0.322SS*.  trans74.5-8-17300000114.3D300D300-G304 VanDerWaalsContact O-CA 3.27Å; D300-G304 WeakPolarHBondContact O-CA 3.4Å; D300-G304 PolarHBondContact O-N 3.46Å
305R71.9Confident82.9Confident138 Ų13861 Ų6152%0.52133%0.334SS..  trans-73138.5179.7-67168.1173.7-87.2-2.1110.5E267 D300 T303 K307E267-R305 WeakPolarHBondContact OE1-CB 3.27Å; E267-R305 WeakPolarHBondContact OE1-CD 3.33Å; E267-R305 VanDerWaalsContact OE1-CG 3.28Å; E267-R305 WeakPolarHBondContact OE1-CG 3.38Å; E267-R305 IonicContact OE1-CZ 3.92Å; E267-R305 IonicContact OE1-NE 3.66Å; E267-R305 IonicContact OE1-NH1 2.72Å; E267-R305 PolarHBondContact OE1-NH1 2.94Å; E267-R305 IonicContact OE2-NH1 2.98Å; E267-R305 PolarHBondContact OE2-NH1 2.86Å; D300-R305 PolarHBondContact N-O 2.89Å; T303-R305 PolarHBondContact O-N 2.92Å; T303-R305 PolarHBondContact OG1-N 3.19Å; R305-K307 PolarHBondContact O-N 2.76Å
306P74.7Confident82.9Confident46 Ų4663.1 Ų63.130%0.29935%0.346SS..EExtended strand (participates in β ladder)trans-60.2134.6168.9-25.337.9000110.2E267 G308E267-P306 WeakPolarHBondContact O-CG 3.37Å; P306-G308 PolarHBondContact O-N 3.16Å; P306-G308 VanDerWaalsContact O-N 3.1Å
307K78.8Confident82.8Confident120 Ų12061.3 Ų61.352%0.52234%0.338SS..EExtended strand (participates in β ladder)trans-74.61.4-177.4-156.7-171.8168.5-1440112.3Y298 R305 E309Y298-K307 WeakPolarHBondContact O-CB 3.47Å; Y298-K307 PolarHBondContact O-N 2.81Å; R305-K307 PolarHBondContact O-N 2.76Å; K307-E309 HydrophobicContact CB-CB 4.45Å; K307-E309 HydrophobicContact CD-CG 4.45Å; K307-E309 WeakPolarHBondContact CD-OE2 3.31Å; K307-E309 VanDerWaalsContact CE-OE1 3.29Å; K307-E309 WeakPolarHBondContact CE-OE1 3.49Å; K307-E309 WeakPolarHBondContact CE-OE2 3.28Å; K307-E309 IonicContact NZ-OE1 2.77Å; K307-E309 PolarHBondContact NZ-OE1 3.29Å; K307-E309 IonicContact NZ-OE2 2.69Å; K307-E309 PolarHBondContact NZ-OE2 2.85Å; K307-E309 PolarHBondContact O-N 2.84Å
308G83.1Confident82.8Confident5 Ų563.5 Ų63.55%0.05236%0.355CS..EExtended strand (participates in β ladder)trans61.920.4-168.600000113.4Q263 G264 L265 G266 P306Q263-G308 CarbonylContact C-O 3.59Å; Q263-G308 WeakPolarHBondContact CA-O 3.26Å; G264-G308 PolarHBondContact N-O 3.38Å; L265-G308 WeakPolarHBondContact CB-O 3.22Å; L265-G308 PolarHBondContact N-O 2.82Å; G266-G308 WeakPolarHBondContact O-CA 3.3Å; P306-G308 PolarHBondContact O-N 3.16Å; P306-G308 VanDerWaalsContact O-N 3.1Å
309E88.4Confident83Confident21 Ų2159.9 Ų59.910%0.09835%0.345CS..EExtended strand (participates in β ladder)trans-117.2137.8-177.4-76.4175.1-165.200111.1F261 V262 Q263 Y298 K307F261-E309 HydrophobicContact CE1-CG 4.26Å; F261-E309 HydrophobicContact CE2-CB 4.47Å; F261-E309 HydrophobicContact CZ-CB 3.97Å; F261-E309 HydrophobicContact CZ-CG 3.81Å; V262-E309 CarbonylContact O-C 3.52Å; V262-E309 VanDerWaalsContact O-CA 3.26Å; V262-E309 WeakPolarHBondContact O-CA 3.26Å; Q263-E309 HydrophobicContact CB-CG 4.08Å; Q263-E309 HydrophobicContact CG-CG 3.85Å; Q263-E309 PolarHBondContact NE2-OE1 3.19Å; Y298-E309 HydrophobicContact CD2-CB 4.39Å; Y298-E309 PolarHBondContact N-O 2.99Å; K307-E309 HydrophobicContact CB-CB 4.45Å; K307-E309 HydrophobicContact CD-CG 4.45Å; K307-E309 WeakPolarHBondContact CD-OE2 3.31Å; K307-E309 VanDerWaalsContact CE-OE1 3.29Å; K307-E309 WeakPolarHBondContact CE-OE1 3.49Å; K307-E309 WeakPolarHBondContact CE-OE2 3.28Å; K307-E309 IonicContact NZ-OE1 2.77Å; K307-E309 PolarHBondContact NZ-OE1 3.29Å; K307-E309 IonicContact NZ-OE2 2.69Å; K307-E309 PolarHBondContact NZ-OE2 2.85Å; K307-E309 PolarHBondContact O-N 2.84Å
310A89.9Confident83.3Confident0 Ų056.7 Ų56.70%032%0.322CS..EExtended strand (participates in β ladder)trans-147.2153176.900000112.1V262 L265 I295 N296 I297V262-A310 PolarHBondContact N-O 3.33Å; V262-A310 PolarHBondContact O-N 3.02Å; L265-A310 HydrophobicContact CD1-CB 3.61Å; I295-A310 HydrophobicContact CG2-CB 4.44Å; N296-A310 CarbonylContact O-C 3.55Å; N296-A310 VanDerWaalsContact O-CA 3.28Å; N296-A310 WeakPolarHBondContact O-CA 3.4Å; I297-A310 HydrophobicContact CB-CB 4.41Å; I297-A310 HydrophobicContact CG1-CB 3.97Å
311T91.1Very high83.7Confident24 Ų2459 Ų5915%0.14733%0.329CS..EExtended strand (participates in β ladder)trans-105.1132.6161.442.60000110.1I260 F261 I295 N296 Y298 A342I260-T311 WeakPolarHBondContact O-CA 3.21Å; F261-T311 HydrophobicContact CD2-CG2 3.74Å; I295-T311 VanDerWaalsContact CA-O 3.29Å; I295-T311 WeakPolarHBondContact CA-O 3.12Å; N296-T311 PolarHBondContact N-O 2.89Å; N296-T311 PolarHBondContact O-N 2.66Å; Y298-T311 HydrophobicContact CE2-CG2 4.18Å; T311-A342 HydrophobicContact CG2-CB 4.31Å
312V90.6Very high84.6Confident0 Ų051.4 Ų51.40%031%0.305CS..EExtended strand (participates in β ladder)trans-116.1123.4176.3-178.50000107.9T259 I260 V262 V274 F278 I284 I295 F314T259-V312 WeakPolarHBondContact CA-O 3.24Å; I260-V312 HydrophobicContact CD1-CB 4.16Å; I260-V312 HydrophobicContact CG1-CB 3.75Å; I260-V312 HydrophobicContact CG1-CG2 4.43Å; I260-V312 PolarHBondContact N-O 3.48Å; I260-V312 PolarHBondContact O-N 2.65Å; V262-V312 HydrophobicContact CG2-CG2 4.25Å; V274-V312 HydrophobicContact CG1-CG2 3.7Å; F278-V312 HydrophobicContact CB-CG1 4.33Å; F278-V312 HydrophobicContact CD2-CG2 4.2Å; I284-V312 HydrophobicContact CD1-CG1 4.02Å; I284-V312 HydrophobicContact CG1-CG1 4.24Å; I284-V312 HydrophobicContact CG2-CG1 4.02Å; I295-V312 HydrophobicContact CD1-CG1 4.5Å; I295-V312 HydrophobicContact CG1-CB 4.39Å; I295-V312 HydrophobicContact CG1-CG1 4.07Å; I295-V312 HydrophobicContact CG1-CG2 4.12Å; I295-V312 HydrophobicContact CG2-CG2 4.33Å; V312-F314 HydrophobicContact CG1-CE2 4.42Å; V312-F314 HydrophobicContact CG1-CZ 4.47Å
313S90.1Very high85.4Confident20 Ų2047 Ų4714%0.1427%0.268CS..EExtended strand (participates in β ladder)trans-98.6113.6175.7-47.30000110.2I284 K285 M294I284-S313 WeakPolarHBondContact CG2-O 3.23Å; K285-S313 VanDerWaalsContact CB-O 3.26Å; K285-S313 WeakPolarHBondContact CB-O 3.36Å; K285-S313 PolarHBondContact N-O 3.33Å; M294-S313 PolarHBondContact O-N 2.97Å; M294-S313 PolarHBondContact O-OG 2.88Å
314F90.8Very high86.2Confident0 Ų043.8 Ų43.80%025%0.247CC..BIsolated β-bridgetrans-75.8162165.4-65.3-81.8000111.1N258 I260 F278 I283 I284 V312 A320 A323N258-F314 PolarHBondContact ND2-O 3.41Å; N258-F314 VanDerWaalsContact ND2-O 3.13Å; N258-F314 WeakPolarHBondContact O-CA 3.36Å; N258-F314 WeakPolarHBondContact O-CB 3.48Å; N258-F314 PolarHBondContact O-N 2.75Å; I260-F314 HydrophobicContact CD1-CE2 3.69Å; I260-F314 HydrophobicContact CD1-CZ 4.24Å; I260-F314 HydrophobicContact CG1-CD2 4.48Å; I260-F314 HydrophobicContact CG1-CE2 3.82Å; I260-F314 HydrophobicContact CG2-CD2 4.38Å; I260-F314 HydrophobicContact CG2-CE2 4.02Å; F278-F314 HydrophobicContact CB-CE1 4.4Å; F278-F314 HydrophobicContact CB-CZ 4.03Å; F278-F314 HydrophobicContact CD1-CZ 4.17Å; I283-F314 WeakPolarHBondContact O-CA 3.45Å; I284-F314 HydrophobicContact CG1-CD1 4.06Å; I284-F314 HydrophobicContact CG1-CE1 3.9Å; V312-F314 HydrophobicContact CG1-CE2 4.42Å; V312-F314 HydrophobicContact CG1-CZ 4.47Å; F314-A320 HydrophobicContact CB-CB 4.33Å; F314-A320 HydrophobicContact CD2-CB 3.57Å; F314-A320 HydrophobicContact CE2-CB 4.26Å; F314-A320 HydrophobicContact CG-CB 4.25Å; F314-A323 HydrophobicContact CE2-CB 3.71Å; F314-A323 HydrophobicContact CZ-CB 3.54Å
315D89.3Confident87.3Confident101 Ų10146.6 Ų46.654%0.5425%0.248SC..SBendtrans-74.9-40.5168.8-146.751.9000109.9N258 I283N258-D315 PolarHBondContact ND2-O 3.19Å; N258-D315 VanDerWaalsContact ND2-O 3.11Å; I283-D315 HydrophobicContact CB-CB 4.48Å; I283-D315 HydrophobicContact CG2-CB 4.32Å; I283-D315 PolarHBondContact O-N 2.85Å
316D88.5Confident88.1Confident64 Ų6446.5 Ų46.534%0.34225%0.248SC..SBendtrans-107.4131.2-170.5174.767.4000113.8P318 S319 A320D316-P318 WeakPolarHBondContact OD1-CD 3.34Å; D316-P318 WeakPolarHBondContact OD2-CD 3.46Å; D316-P318 VanDerWaalsContact OD2-CG 3.31Å; D316-P318 WeakPolarHBondContact OD2-CG 3.46Å; D316-S319 WeakPolarHBondContact OD2-CB 3.32Å; D316-S319 PolarHBondContact OD2-N 2.61Å; D316-S319 PolarHBondContact OD2-OG 2.88Å; D316-A320 PolarHBondContact O-N 2.82Å
317P87.1Confident88.8Confident43 Ų4344.3 Ų44.328%0.27923%0.234SC..Hα-helixtrans-64.9-50.5179-20.230.7000116.6N258 S319 A320 K321N258-P317 HydrophobicContact CB-CB 4.41Å; N258-P317 HydrophobicContact CB-CG 4.14Å; P317-S319 VanDerWaalsContact C-N 3.26Å; P317-S319 PolarHBondContact O-N 2.94Å; P317-A320 WeakPolarHBondContact O-CA 3.46Å; P317-A320 VanDerWaalsContact O-CB 3.31Å; P317-A320 WeakPolarHBondContact O-CB 3.45Å; P317-A320 PolarHBondContact O-N 3.21Å; P317-K321 PolarHBondContact O-N 3.17Å; P317-K321 VanDerWaalsContact O-N 3.14Å
318P89.1Confident89.4Confident87 Ų8742.3 Ų42.357%0.56523%0.229SC*.Hα-helixtrans-63-30.8178.319.3-28.5000113.1D316 A320 K321 A322D316-P318 WeakPolarHBondContact OD1-CD 3.34Å; D316-P318 WeakPolarHBondContact OD2-CD 3.46Å; D316-P318 VanDerWaalsContact OD2-CG 3.31Å; D316-P318 WeakPolarHBondContact OD2-CG 3.46Å; P318-A320 VanDerWaalsContact C-N 3.32Å; P318-A320 PolarHBondContact O-N 3.24Å; P318-K321 PolarHBondContact O-N 2.96Å; P318-A322 PolarHBondContact O-N 3.16Å
319S89.7Confident89.5Confident24 Ų2444.8 Ų44.817%0.16826%0.255CS..Hα-helixtrans-58.9-40.8168.5-63.10000112.6D316 P317 K321 A322 A323D316-S319 WeakPolarHBondContact OD2-CB 3.32Å; D316-S319 PolarHBondContact OD2-N 2.61Å; D316-S319 PolarHBondContact OD2-OG 2.88Å; P317-S319 VanDerWaalsContact C-N 3.26Å; P317-S319 PolarHBondContact O-N 2.94Å; S319-K321 VanDerWaalsContact C-N 3.33Å; S319-K321 PolarHBondContact O-N 2.79Å; S319-A322 PolarHBondContact O-N 3.34Å; S319-A323 WeakPolarHBondContact O-CB 3.25Å; S319-A323 PolarHBondContact O-N 2.96Å
320A88.8Confident89.5Confident0 Ų048.1 Ų48.10%027%0.269CS..Hα-helixtrans-65.4-36.1175.800000112.2I260 F314 D316 P317 P318 A323 I324I260-A320 HydrophobicContact CG2-CB 4.04Å; I260-A320 WeakPolarHBondContact CG2-O 3.32Å; F314-A320 HydrophobicContact CB-CB 4.33Å; F314-A320 HydrophobicContact CD2-CB 3.57Å; F314-A320 HydrophobicContact CE2-CB 4.26Å; F314-A320 HydrophobicContact CG-CB 4.25Å; D316-A320 PolarHBondContact O-N 2.82Å; P317-A320 WeakPolarHBondContact O-CA 3.46Å; P317-A320 VanDerWaalsContact O-CB 3.31Å; P317-A320 WeakPolarHBondContact O-CB 3.45Å; P317-A320 PolarHBondContact O-N 3.21Å; P318-A320 VanDerWaalsContact C-N 3.32Å; P318-A320 PolarHBondContact O-N 3.24Å; A320-A323 PolarHBondContact O-N 2.96Å; A320-I324 WeakPolarHBondContact O-CG1 3.32Å; A320-I324 PolarHBondContact O-N 2.79Å
321K89Confident89.3Confident105 Ų10554.9 Ų54.946%0.45730%0.3SS..Hα-helixtrans-64.8-50.8171.8-171.7-176172.5-174.40111.7P317 P318 S319 A323 I324 D325 F341P317-K321 PolarHBondContact O-N 3.17Å; P317-K321 VanDerWaalsContact O-N 3.14Å; P318-K321 PolarHBondContact O-N 2.96Å; S319-K321 VanDerWaalsContact C-N 3.33Å; S319-K321 PolarHBondContact O-N 2.79Å; K321-A323 PolarHBondContact O-N 3.39Å; K321-I324 WeakPolarHBondContact O-CB 3.29Å; K321-I324 PolarHBondContact O-N 3.21Å; K321-D325 WeakPolarHBondContact CE-OD2 3.31Å; K321-D325 PolarHBondContact O-N 3.37Å; K321-D325 VanDerWaalsContact O-N 3.09Å; K321-F341 HydrophobicContact CB-CE1 4.34Å; K321-F341 HydrophobicContact CB-CZ 3.8Å; K321-F341 HydrophobicContact CG-CE2 4.44Å; K321-F341 HydrophobicContact CG-CZ 3.87Å
322A90.6Very high88.8Confident43 Ų4354.4 Ų54.436%0.35530%0.296SS..Hα-helixtrans-59.1-33178.900000112.1I281 P318 S319 W326I281-A322 HydrophobicContact CG2-CB 3.71Å; P318-A322 PolarHBondContact O-N 3.16Å; S319-A322 PolarHBondContact O-N 3.34Å; A322-W326 VanDerWaalsContact O-CB 3.22Å; A322-W326 WeakPolarHBondContact O-CB 3.38Å; A322-W326 PolarHBondContact O-N 2.92Å
323A90.1Very high88.2Confident0 Ų058.5 Ų58.50%032%0.318CS..Hα-helixtrans-66.8-35173.800000112.9I260 F278 I281 F314 S319 A320 K321 F327I260-A323 HydrophobicContact CD1-CB 4.47Å; F278-A323 HydrophobicContact CD1-CB 4.44Å; I281-A323 HydrophobicContact CB-CB 4.44Å; I281-A323 HydrophobicContact CG2-CB 4.21Å; F314-A323 HydrophobicContact CE2-CB 3.71Å; F314-A323 HydrophobicContact CZ-CB 3.54Å; S319-A323 WeakPolarHBondContact O-CB 3.25Å; S319-A323 PolarHBondContact O-N 2.96Å; A320-A323 PolarHBondContact O-N 2.96Å; K321-A323 PolarHBondContact O-N 3.39Å; A323-F327 HydrophobicContact CB-CD2 4.08Å; A323-F327 HydrophobicContact CB-CE2 4.38Å; A323-F327 VanDerWaalsContact O-CB 3.25Å; A323-F327 WeakPolarHBondContact O-CB 2.9Å; A323-F327 WeakPolarHBondContact O-CD2 3.3Å; A323-F327 PolarHBondContact O-N 2.94Å
324I90.6Very high87.7Confident19 Ų1960.7 Ų60.710%0.09734%0.344CS..Hα-helixtrans-64.4-56172.1-65.8156.5000109.5I260 A320 K321 W326 F327 D328 V339 F341I260-I324 HydrophobicContact CG2-CD1 4.06Å; I260-I324 HydrophobicContact CG2-CG1 3.84Å; A320-I324 WeakPolarHBondContact O-CG1 3.32Å; A320-I324 PolarHBondContact O-N 2.79Å; K321-I324 WeakPolarHBondContact O-CB 3.29Å; K321-I324 PolarHBondContact O-N 3.21Å; I324-W326 PolarHBondContact O-N 2.95Å; I324-W326 VanDerWaalsContact O-N 3.12Å; I324-F327 PolarHBondContact O-N 2.73Å; I324-D328 WeakPolarHBondContact O-CB 3.47Å; I324-D328 PolarHBondContact O-N 2.87Å; I324-V339 HydrophobicContact CB-CG1 4.42Å; I324-V339 HydrophobicContact CG1-CG1 3.93Å; I324-F341 HydrophobicContact CD1-CB 4.13Å; I324-F341 HydrophobicContact CD1-CD1 3.58Å; I324-F341 HydrophobicContact CD1-CD2 3.43Å; I324-F341 VanDerWaalsContact CD1-CD2 3.43Å; I324-F341 HydrophobicContact CD1-CE1 3.76Å; I324-F341 HydrophobicContact CD1-CE2 3.6Å; I324-F341 HydrophobicContact CD1-CG 3.41Å; I324-F341 VanDerWaalsContact CD1-CG 3.41Å; I324-F341 HydrophobicContact CD1-CZ 3.77Å; I324-F341 VanDerWaalsContact CD1-N 3.26Å
325D90.8Very high87.4Confident119 Ų11964.7 Ų64.764%0.63636%0.361SS*.Hα-helixtrans-62.1-23.8-174.8-62.5-22000112.9K321K321-D325 WeakPolarHBondContact CE-OD2 3.31Å; K321-D325 PolarHBondContact O-N 3.37Å; K321-D325 VanDerWaalsContact O-N 3.09Å
326W89.3Confident87.3Confident135 Ų13564.1 Ų64.151%0.51136%0.363SS..Hα-helixtrans-93.4-34.2178.1-175.9-102000114.7I281 A322 I324 K330I281-W326 HydrophobicContact CD1-CB 4.29Å; I281-W326 HydrophobicContact CD1-CD2 4.23Å; I281-W326 HydrophobicContact CD1-CG 3.8Å; I281-W326 HydrophobicContact CG1-CB 4.43Å; I281-W326 HydrophobicContact CG1-CG 4.23Å; A322-W326 VanDerWaalsContact O-CB 3.22Å; A322-W326 WeakPolarHBondContact O-CB 3.38Å; A322-W326 PolarHBondContact O-N 2.92Å; I324-W326 PolarHBondContact O-N 2.95Å; I324-W326 VanDerWaalsContact O-N 3.12Å; W326-K330 WeakPolarHBondContact O-CE 3.1Å; W326-K330 WeakPolarHBondContact O-CG 3.25Å
327F89.3Confident87.5Confident0 Ų061.2 Ų61.20%035%0.348CS..Hα-helixtrans-105.6-15.1-172.1-65.5-62.1000115.1Y277 F278 Q280 I281 A323 I324 G329 K330 I337 V339Y277-F327 HydrophobicContact CD1-CD1 4.02Å; Y277-F327 AromaticContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CE1 3.66Å; Y277-F327 HydrophobicContact CD1-CZ 4.01Å; Y277-F327 HydrophobicContact CD2-CE1 4.48Å; Y277-F327 AromaticContact CE1-CD1 3.21Å; Y277-F327 HydrophobicContact CE1-CD1 3.21Å; Y277-F327 AromaticContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CE1 3.18Å; Y277-F327 HydrophobicContact CE1-CG 4.04Å; Y277-F327 AromaticContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE1-CZ 3.99Å; Y277-F327 HydrophobicContact CE2-CE1 4.09Å; Y277-F327 HydrophobicContact CG-CE1 4.3Å; Y277-F327 AromaticContact CZ-CD1 3.59Å; Y277-F327 AromaticContact CZ-CE1 3.43Å; Y277-F327 VanDerWaalsContact CZ-CE1 3.43Å; F278-F327 AromaticContact CD1-CD2 3.4Å; F278-F327 HydrophobicContact CD1-CD2 3.4Å; F278-F327 AromaticContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CE2 3.44Å; F278-F327 VanDerWaalsContact CD1-CE2 3.44Å; F278-F327 HydrophobicContact CD1-CG 4.26Å; F278-F327 HydrophobicContact CD1-CZ 4.32Å; F278-F327 HydrophobicContact CE1-CB 3.92Å; F278-F327 AromaticContact CE1-CD2 3.27Å; F278-F327 HydrophobicContact CE1-CD2 3.27Å; F278-F327 AromaticContact CE1-CE2 3.82Å; F278-F327 HydrophobicContact CE1-CE2 3.82Å; F278-F327 AromaticContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CE1-CG 3.75Å; F278-F327 HydrophobicContact CG-CD2 4.5Å; F278-F327 HydrophobicContact CG-CE2 4.22Å; F278-F327 HydrophobicContact CZ-CB 4.39Å; F278-F327 HydrophobicContact CZ-CD2 4.3Å; F278-F327 HydrophobicContact CZ-CG 4.41Å; Q280-F327 HydrophobicContact CG-CE1 4.49Å; Q280-F327 HydrophobicContact CG-CZ 3.72Å; I281-F327 HydrophobicContact CB-CE2 4.29Å; I281-F327 HydrophobicContact CG1-CD2 4.35Å; I281-F327 HydrophobicContact CG1-CE2 3.52Å; I281-F327 HydrophobicContact CG1-CZ 3.85Å; A323-F327 HydrophobicContact CB-CD2 4.08Å; A323-F327 HydrophobicContact CB-CE2 4.38Å; A323-F327 VanDerWaalsContact O-CB 3.25Å; A323-F327 WeakPolarHBondContact O-CB 2.9Å; A323-F327 WeakPolarHBondContact O-CD2 3.3Å; A323-F327 PolarHBondContact O-N 2.94Å; I324-F327 PolarHBondContact O-N 2.73Å; F327-G329 PolarHBondContact O-N 2.86Å; F327-K330 HydrophobicContact CD1-CG 4.41Å; F327-K330 WeakPolarHBondContact O-CB 3.22Å; F327-K330 PolarHBondContact O-N 3.24Å; F327-K330 VanDerWaalsContact O-N 3.16Å; F327-I337 HydrophobicContact CB-CD1 4.34Å; F327-V339 HydrophobicContact CB-CG2 3.75Å
328D90.9Very high87.7Confident78 Ų7865.2 Ų65.242%0.41736%0.361SS..THydrogen-bonded Turntrans-62.8128.3175-163.838.5000110.7I324 K330 K338 V339I324-D328 WeakPolarHBondContact O-CB 3.47Å; I324-D328 PolarHBondContact O-N 2.87Å; D328-K330 VanDerWaalsContact C-N 3.3Å; D328-K330 PolarHBondContact O-N 2.81Å; D328-K338 VanDerWaalsContact OD1-CA 3.23Å; D328-K338 WeakPolarHBondContact OD1-CA 3.39Å; D328-K338 WeakPolarHBondContact OD1-CG 3.45Å; D328-V339 HydrophobicContact CB-CB 4.3Å; D328-V339 PolarHBondContact OD1-N 2.9Å
329G86.7Confident87.8Confident58 Ų5861.2 Ų61.260%0.59834%0.335SS*.THydrogen-bonded Turntrans74.96.8-176.500000115.9F327 I337F327-G329 PolarHBondContact O-N 2.86Å; G329-I337 WeakPolarHBondContact CA-O 3.39Å; G329-I337 PolarHBondContact N-O 3.13Å
330K87.5Confident87.8Confident90 Ų9062.4 Ų62.439%0.39134%0.343SS..  trans-72.1163.8168.1-64.7-62.3-178.3-177.20111.1W326 F327 D328 P336 I337W326-K330 WeakPolarHBondContact O-CE 3.1Å; W326-K330 WeakPolarHBondContact O-CG 3.25Å; F327-K330 HydrophobicContact CD1-CG 4.41Å; F327-K330 WeakPolarHBondContact O-CB 3.22Å; F327-K330 PolarHBondContact O-N 3.24Å; F327-K330 VanDerWaalsContact O-N 3.16Å; D328-K330 VanDerWaalsContact C-N 3.3Å; D328-K330 PolarHBondContact O-N 2.81Å; K330-P336 CarbonylContact O-C 3.47Å; K330-P336 WeakPolarHBondContact O-CA 3.24Å; K330-I337 HydrophobicContact CB-CD1 4.33Å; K330-I337 HydrophobicContact CB-CG1 4.14Å; K330-I337 WeakPolarHBondContact O-CG1 3.19Å; K330-I337 PolarHBondContact O-N 3Å
331E86.5Confident87.8Confident142 Ų14264.4 Ų64.466%0.66435%0.352SS*.EExtended strand (participates in β ladder)trans-99.2133.4171-63.5-174.9129.700111K335E331-K335 CarbonylContact C-O 3.36Å; E331-K335 WeakPolarHBondContact CA-O 3.4Å
332F79.7Confident87.6Confident14 Ų1459.7 Ų59.76%0.06133%0.332CS..EExtended strand (participates in β ladder)trans-122.6124171.5-170.8-86.6000107.7L265 A269 E273 V274 Y277 G334 K335 I337L265-F332 HydrophobicContact CB-CD1 4.43Å; L265-F332 HydrophobicContact CD2-CB 4.41Å; L265-F332 HydrophobicContact CD2-CD1 3.77Å; L265-F332 HydrophobicContact CD2-CD2 4.14Å; L265-F332 HydrophobicContact CD2-CE1 4Å; L265-F332 HydrophobicContact CD2-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CG 3.85Å; L265-F332 HydrophobicContact CD2-CZ 4.29Å; L265-F332 WeakPolarHBondContact O-CD1 3.46Å; A269-F332 HydrophobicContact CB-CE1 3.84Å; A269-F332 HydrophobicContact CB-CZ 4.47Å; E273-F332 HydrophobicContact CB-CZ 4.28Å; V274-F332 HydrophobicContact CG2-CZ 4.43Å; Y277-F332 HydrophobicContact CD1-CD2 4.33Å; Y277-F332 HydrophobicContact CE1-CD2 4.41Å; Y277-F332 HydrophobicContact CG-CD2 4.4Å; Y277-F332 HydrophobicContact CG-CE2 4.3Å; F332-G334 PolarHBondContact O-N 2.81Å; F332-G334 VanDerWaalsContact O-N 3.16Å; F332-K335 PolarHBondContact N-O 2.95Å; F332-K335 PolarHBondContact O-N 3.21Å; F332-K335 VanDerWaalsContact O-O 3.14Å; F332-I337 HydrophobicContact CB-CD1 4.5Å; F332-I337 HydrophobicContact CB-CG1 4.42Å; F332-I337 HydrophobicContact CB-CG2 3.55Å; F332-I337 HydrophobicContact CG-CG2 4.47Å
333N78.3Confident86.9Confident87 Ų8763.3 Ų63.347%0.46535%0.35SS..THydrogen-bonded Turntrans47.841.9-175.9-62.8-9.3000113.9K335N333-K335 VanDerWaalsContact C-N 3.3Å; N333-K335 PolarHBondContact O-N 3.45Å
334G80Confident85.6Confident65 Ų6571.8 Ų71.867%0.6738%0.382SS*.THydrogen-bonded Turntrans71.616.9179.200000115.2F332F332-G334 PolarHBondContact O-N 2.81Å; F332-G334 VanDerWaalsContact O-N 3.16Å
335K83.4Confident83.8Confident84 Ų8482.4 Ų82.437%0.36542%0.421SS..EExtended strand (participates in β ladder)trans-124.4134.4176-68.6162.2-174.8158.80109.3G264 D268 E331 F332 N333 I337G264-K335 WeakPolarHBondContact O-CB 3.35Å; D268-K335 IonicContact OD2-NZ 3.85Å; E331-K335 CarbonylContact C-O 3.36Å; E331-K335 WeakPolarHBondContact CA-O 3.4Å; F332-K335 PolarHBondContact N-O 2.95Å; F332-K335 PolarHBondContact O-N 3.21Å; F332-K335 VanDerWaalsContact O-O 3.14Å; N333-K335 VanDerWaalsContact C-N 3.3Å; N333-K335 PolarHBondContact O-N 3.45Å; K335-I337 PolarHBondContact O-N 3.07Å
336P87.9Confident81.8Confident90 Ų9080 Ų8058%0.58442%0.418SS*.EExtended strand (participates in β ladder)trans-66.3123.4175.826.8-33.4000110K330K330-P336 CarbonylContact O-C 3.47Å; K330-P336 WeakPolarHBondContact O-CA 3.24Å
337I92Very high79.7Confident3 Ų380.3 Ų80.32%0.01542%0.424CS..  trans-87.1141.8171.152.5161.8000110.9V262 Q263 L265 Y277 F278 F327 G329 K330 F332 K335 V339V262-I337 HydrophobicContact CG1-CB 4.37Å; V262-I337 HydrophobicContact CG1-CG2 4.42Å; Q263-I337 CarbonylContact O-C 3.51Å; Q263-I337 WeakPolarHBondContact O-CA 3.5Å; Q263-I337 WeakPolarHBondContact O-CB 3.45Å; L265-I337 HydrophobicContact CD2-CG2 4Å; L265-I337 HydrophobicContact CG-CG2 4.25Å; Y277-I337 HydrophobicContact CE1-CD1 4.05Å; F278-I337 HydrophobicContact CZ-CD1 4.4Å; F327-I337 HydrophobicContact CB-CD1 4.34Å; G329-I337 WeakPolarHBondContact CA-O 3.39Å; G329-I337 PolarHBondContact N-O 3.13Å; K330-I337 HydrophobicContact CB-CD1 4.33Å; K330-I337 HydrophobicContact CB-CG1 4.14Å; K330-I337 WeakPolarHBondContact O-CG1 3.19Å; K330-I337 PolarHBondContact O-N 3Å; F332-I337 HydrophobicContact CB-CD1 4.5Å; F332-I337 HydrophobicContact CB-CG1 4.42Å; F332-I337 HydrophobicContact CB-CG2 3.55Å; F332-I337 HydrophobicContact CG-CG2 4.47Å; K335-I337 PolarHBondContact O-N 3.07Å; I337-V339 HydrophobicContact CD1-CG2 4.12Å
338K91.1Very high77.4Confident127 Ų12790.4 Ų90.455%0.55247%0.469SS*.EExtended strand (participates in β ladder)trans-106.5131.2167.1-164.2176.6-176.7159.60109.2V262 Q263 D328V262-K338 CarbonylContact C-O 3.47Å; V262-K338 WeakPolarHBondContact CA-O 3.26Å; Q263-K338 HydrophobicContact CB-CB 4.45Å; Q263-K338 PolarHBondContact N-O 3.37Å; Q263-K338 PolarHBondContact O-N 3.23Å; D328-K338 VanDerWaalsContact OD1-CA 3.23Å; D328-K338 WeakPolarHBondContact OD1-CA 3.39Å; D328-K338 WeakPolarHBondContact OD1-CG 3.45Å
339V91.4Very high75.4Confident3 Ų391.4 Ų91.42%0.01848%0.478CS..EExtended strand (participates in β ladder)trans-121132.1178.8-170.50000109.2I260 F261 V262 F278 I324 F327 D328 I337I260-V339 HydrophobicContact CB-CG1 4.21Å; I260-V339 HydrophobicContact CD1-CG1 3.75Å; F261-V339 WeakPolarHBondContact O-CA 3.32Å; V262-V339 HydrophobicContact CG1-CG2 4.23Å; V262-V339 HydrophobicContact CG2-CG1 4.39Å; V262-V339 HydrophobicContact CG2-CG2 4.43Å; F278-V339 HydrophobicContact CE1-CG1 4.45Å; F278-V339 HydrophobicContact CE1-CG2 4.32Å; F278-V339 HydrophobicContact CZ-CG2 4.18Å; I324-V339 HydrophobicContact CB-CG1 4.42Å; I324-V339 HydrophobicContact CG1-CG1 3.93Å; F327-V339 HydrophobicContact CB-CG2 3.75Å; D328-V339 HydrophobicContact CB-CB 4.3Å; D328-V339 PolarHBondContact OD1-N 2.9Å; I337-V339 HydrophobicContact CD1-CG2 4.12Å
340S89.9Confident73.7Confident48 Ų4896.4 Ų96.434%0.33649%0.486SS..EExtended strand (participates in β ladder)trans-142164.7175.962.90000110.4I260 F261 A342I260-S340 CarbonylContact C-O 3.58Å; I260-S340 WeakPolarHBondContact CA-O 3.45Å; I260-S340 WeakPolarHBondContact CB-O 3.46Å; F261-S340 PolarHBondContact N-O 3.13Å; F261-S340 PolarHBondContact O-N 2.59Å; S340-A342 PolarHBondContact O-N 2.87Å
341F89.3Confident71.8Confident43 Ų43102 Ų10219%0.18950%0.504CS..EExtended strand (participates in β ladder)trans-57.6130.1164.9-74.2-76.3000107.9N254 N257 K321 I324 T343N254-F341 HydrophobicContact CB-CB 4.16Å; N254-F341 HydrophobicContact CB-CG 4.41Å; N254-F341 VanDerWaalsContact ND2-CB 3.34Å; N254-F341 WeakPolarHBondContact ND2-CB 3.33Å; N254-F341 WeakPolarHBondContact O-CD1 3.12Å; N257-F341 HydrophobicContact CB-CD1 4.33Å; K321-F341 HydrophobicContact CB-CE1 4.34Å; K321-F341 HydrophobicContact CB-CZ 3.8Å; K321-F341 HydrophobicContact CG-CE2 4.44Å; K321-F341 HydrophobicContact CG-CZ 3.87Å; I324-F341 HydrophobicContact CD1-CB 4.13Å; I324-F341 HydrophobicContact CD1-CD1 3.58Å; I324-F341 HydrophobicContact CD1-CD2 3.43Å; I324-F341 VanDerWaalsContact CD1-CD2 3.43Å; I324-F341 HydrophobicContact CD1-CE1 3.76Å; I324-F341 HydrophobicContact CD1-CE2 3.6Å; I324-F341 HydrophobicContact CD1-CG 3.41Å; I324-F341 VanDerWaalsContact CD1-CG 3.41Å; I324-F341 HydrophobicContact CD1-CZ 3.77Å; I324-F341 VanDerWaalsContact CD1-N 3.26Å; F341-T343 PolarHBondContact O-N 2.9Å
342A83.6Confident69.5Low6 Ų699.5 Ų99.55%0.0552%0.517CS..  trans-59.9115.9169.300000106.6N254 N257 T259 F261 T311 S340 R344N254-A342 PolarHBondContact ND2-O 3.23Å; N257-A342 PolarHBondContact ND2-O 3.45Å; T259-A342 HydrophobicContact CG2-CB 3.79Å; T259-A342 VanDerWaalsContact O-CB 3.24Å; T259-A342 WeakPolarHBondContact O-CB 3.28Å; T259-A342 PolarHBondContact O-N 3.43Å; F261-A342 HydrophobicContact CB-CB 4.16Å; T311-A342 HydrophobicContact CG2-CB 4.31Å; S340-A342 PolarHBondContact O-N 2.87Å; A342-R344 VanDerWaalsContact C-N 3.31Å; A342-R344 PolarHBondContact O-N 3.1Å
343T77.1Confident68.3Low118 Ų118101.2 Ų101.272%0.72454%0.538SS*.  trans-56.8109.5156.747.60000104.3F341 R345F341-T343 PolarHBondContact O-N 2.9Å; T343-R345 PolarHBondContact O-N 3.28Å
344R61.8Low66.8Low178 Ų178105.8 Ų105.867%0.67255%0.554SS**  trans-52116.1162.4-87.8-177.5-78.9162.5-6.5103.5N257 A342 A346N257-R344 PolarHBondContact ND2-NE 2.82Å; N257-R344 PolarHBondContact OD1-NE 3.12Å; N257-R344 PolarHBondContact OD1-NH2 3.09Å; A342-R344 VanDerWaalsContact C-N 3.31Å; A342-R344 PolarHBondContact O-N 3.1Å; R344-A346 PolarHBondContact O-N 3.12Å
345R54Low64.9Low243 Ų243115 Ų11592%0.91757%0.568SS**  trans-64.383.5164.3-178.9175.8180159.10.3104.5T343 E347T343-R345 PolarHBondContact O-N 3.28Å; R345-E347 PolarHBondContact O-N 3.02Å
346A49Very low62.9Low69 Ų69114.8 Ų114.857%0.5759%0.59SS**  trans-50.2129.9-18000000105.4R344 F348R344-A346 PolarHBondContact O-N 3.12Å; A346-F348 VanDerWaalsContact C-N 3.31Å; A346-F348 PolarHBondContact O-N 2.97Å
347E43.4Very low60.9Low140 Ų140114 Ų11465%0.65460%0.599SS**  trans-58.3104.4176.7-92-151.987.700107.6R345 T349 Q350R345-E347 PolarHBondContact O-N 3.02Å; E347-T349 PolarHBondContact O-N 3.02Å; E347-T349 VanDerWaalsContact OE1-CB 3.31Å; E347-T349 WeakPolarHBondContact OE1-CB 3.2Å; E347-T349 PolarHBondContact OE1-OG1 3.25Å; E347-Q350 PolarHBondContact O-N 2.62Å
348F42.5Very low58.2Low212 Ų212126.1 Ų126.193%0.9364%0.644SS**THydrogen-bonded Turntrans-71.427.4166.3-165-103.9000111.1A346A346-F348 VanDerWaalsContact C-N 3.31Å; A346-F348 PolarHBondContact O-N 2.97Å
349T47.4Very low55.7Low99 Ų99123.9 Ų123.961%0.60766%0.658SS**THydrogen-bonded Turntrans-89.8-30.8162.3-37.90000109.8E347E347-T349 PolarHBondContact O-N 3.02Å; E347-T349 VanDerWaalsContact OE1-CB 3.31Å; E347-T349 WeakPolarHBondContact OE1-CB 3.2Å; E347-T349 PolarHBondContact OE1-OG1 3.25Å
350Q52Low53.4Low163 Ų163126.6 Ų126.676%0.76269%0.686SS**SBendtrans-149.271.5-171.2-62-167.71000116.5E347E347-Q350 PolarHBondContact O-N 2.62Å
351R47.4Very low50.9Low209 Ų209134.3 Ų134.379%0.78971%0.714SS**  trans-153.583.2146.8-141.5175.7-170.6-173.12.3116
352G37.3Very low49Very low89 Ų89144.7 Ų144.792%0.91875%0.752SS**  trans-106.378.9156.700000110.1
353G55.7Low46.8Very low49 Ų49147.9 Ų147.951%0.50579%0.785SS.*  trans-87.6162.8-16900000116.1
354F46.8Very low44.9Very low184 Ų184154.1 Ų154.181%0.80780%0.796SS**  trans68.987.3158.1-54.3-76.2000119.6
355R40.3Very low43.6Very low257 Ų257149.5 Ų149.597%0.9780%0.803SS**  -161.8136.9127.4-98.2162.9-172.3175.72.1106.4
356G41.8Very low42.8Very low80 Ų80141.8 Ų141.883%0.82580%0.8SS**  cis142.771.57.400000109.9
357G44.5Very low42.6Very low75 Ų75142.8 Ų142.877%0.77382%0.816SS**  trans103.8165.3173.300000116.8
358R36.9Very low42.4Very low256 Ų256138.7 Ų138.797%0.96681%0.812SS**  trans64.676.2167.6-149.2171.7-159.41494.1116.7
359G38.1Very low42.3Very low81 Ų81131.8 Ų131.884%0.83580%0.801SS**  trans-82.3-168.9174.400000115
360G43.4Very low42.1Very low59 Ų59132.2 Ų132.261%0.60881%0.805SS**  trans163.4140.6173.200000113.5
361F37.3Very low41.8Very low210 Ų210130.8 Ų130.892%0.92180%0.803SS**  trans65.8114.1153.6-47.9-70000120.4
362R48.1Very low41.8Very low261 Ų261128.8 Ų128.899%0.98580%0.8SS**  trans-64.5135.2156.1-65.9170170.7154.1-5.2109
363G37.4Very low42.4Very low73 Ų73132.1 Ų132.175%0.75380%0.797SS**  trans-147.344.9-164.200000118.4
364R37.4Very low42.4Very low249 Ų249133.4 Ų133.494%0.9479%0.791SS**  trans49.387.5151-166.3-170.7-178.6-172.90.6119.5
365G34.3Very low42.8Very low81 Ų81133.5 Ų133.584%0.83579%0.791SS**  trans85.2171.4135.400000119.3
366G37.8Very low43.7Very low82 Ų82124.9 Ų124.985%0.84578%0.783SS**  trans95.3110.6179.300000113.8
367G45.6Very low45.1Very low89 Ų89122.4 Ų122.492%0.91876%0.757SS**  trans-86.4138.6164.100000110
368G38.2Very low47.1Very low54 Ų54120.7 Ų120.756%0.55773%0.73SS**  trans-165.629.8-171.100000116N371G368-N371 PolarHBondContact O-ND2 3.5Å
369G39.9Very low49.3Very low68 Ų68108.8 Ų108.870%0.70169%0.685SS**  trans64.3179.8177.400000115.3N371G369-N371 PolarHBondContact O-N 3.22Å
370P43.5Very low51.7Low108 Ų108108.6 Ų108.670%0.70167%0.67SS**  trans-76.975.7167.733.9-33.5000109.1F372P370-F372 HydrophobicContact CB-CD2 4.34Å; P370-F372 HydrophobicContact CB-CE2 3.9Å; P370-F372 HydrophobicContact CB-CZ 4.27Å; P370-F372 HydrophobicContact CG-CE2 4.27Å; P370-F372 VanDerWaalsContact O-CD2 3.25Å; P370-F372 WeakPolarHBondContact O-CD2 3.24Å; P370-F372 PolarHBondContact O-N 2.82Å
371N47Very low53.7Low133 Ų133106.2 Ų106.271%0.71164%0.643SS**  trans-65.188.9156.9-89.6-76.6000107.2G368 G369 D373G368-N371 PolarHBondContact O-ND2 3.5Å; G369-N371 PolarHBondContact O-N 3.22Å; N371-D373 PolarHBondContact O-N 3.37Å
372F46.3Very low55.8Low167 Ų16799.7 Ų99.773%0.73262%0.622SS**  trans-60.2117.2164.1-63-87.8000106.8P370 I374P370-F372 HydrophobicContact CB-CD2 4.34Å; P370-F372 HydrophobicContact CB-CE2 3.9Å; P370-F372 HydrophobicContact CB-CZ 4.27Å; P370-F372 HydrophobicContact CG-CE2 4.27Å; P370-F372 VanDerWaalsContact O-CD2 3.25Å; P370-F372 WeakPolarHBondContact O-CD2 3.24Å; P370-F372 PolarHBondContact O-N 2.82Å; F372-I374 VanDerWaalsContact C-N 3.29Å; F372-I374 PolarHBondContact O-N 2.95Å
373D51Low57.3Low158 Ų15891 Ų9185%0.84560%0.595SS**  trans-58.795173.1-67-77000109.3N371 K375N371-D373 PolarHBondContact O-N 3.37Å; D373-K375 PolarHBondContact O-N 3.49Å
374I55.2Low59.2Low76 Ų7693.3 Ų93.339%0.3960%0.6SS.*  trans-58.6105.8176-71.6-65.8000106.7F372 G376 D378 M389F372-I374 VanDerWaalsContact C-N 3.29Å; F372-I374 PolarHBondContact O-N 2.95Å; I374-G376 VanDerWaalsContact C-N 3.33Å; I374-G376 PolarHBondContact O-N 2.93Å; I374-D378 WeakPolarHBondContact CG2-O 3.48Å; I374-M389 HydrophobicContact CD1-CE 4.02Å
375K55.9Low61.2Low186 Ų18686.3 Ų86.381%0.80959%0.589SS**G310 helixtrans-69.691.3-166.3-145.4169-171169.60109.4D373 G377D373-K375 PolarHBondContact O-N 3.49Å; K375-G377 PolarHBondContact O-N 3.18Å
376G58.8Low63.7Low76 Ų7683 Ų8378%0.78455%0.553SS**G310 helixtrans46.157.9176.300000116.2I374I374-G376 VanDerWaalsContact C-N 3.33Å; I374-G376 PolarHBondContact O-N 2.93Å
377G71.4Confident65.6Low28 Ų2882.1 Ų82.129%0.28954%0.544SS..G310 helixtrans101-1163.300000117.8K375 A392K375-G377 PolarHBondContact O-N 3.18Å; G377-A392 VanDerWaalsContact O-CA 3.22Å; G377-A392 WeakPolarHBondContact O-CA 3.46Å; G377-A392 VanDerWaalsContact O-CB 3.27Å; G377-A392 WeakPolarHBondContact O-CB 3.36Å
378D84.6Confident67.6Low40 Ų4080.2 Ų80.221%0.21451%0.512CS..  trans-62.4138.3171-73.9-3.2000110.7I374 M389 N390 F391 A392I374-D378 WeakPolarHBondContact CG2-O 3.48Å; D378-M389 HydrophobicContact CB-CG 4.43Å; D378-N390 CarbonylContact C-O 3.52Å; D378-N390 VanDerWaalsContact CA-O 3.3Å; D378-N390 WeakPolarHBondContact CA-O 3.4Å; D378-F391 VanDerWaalsContact OD1-CA 3.22Å; D378-F391 WeakPolarHBondContact OD1-CA 3.42Å; D378-A392 PolarHBondContact OD1-N 2.96Å
379W84.9Confident69.8Low5 Ų583 Ų832%0.01951%0.513CS..EExtended strand (participates in β ladder)trans-131.3136.7-166.562.5-86.5000113.6N390 R394 C397 K404W379-N390 HydrophobicContact CD2-CB 3.9Å; W379-N390 HydrophobicContact CE3-CB 4.43Å; W379-N390 HydrophobicContact CG-CB 4.31Å; W379-N390 HydrophobicContact CH2-CB 4.36Å; W379-N390 HydrophobicContact CZ2-CB 3.81Å; W379-N390 WeakPolarHBondContact CZ3-ND2 3.34Å; W379-N390 PolarHBondContact N-O 2.84Å; W379-N390 WeakPolarHBondContact O-CB 3.49Å; W379-N390 PolarHBondContact O-N 3.17Å; W379-N390 PolarHBondContact O-ND2 2.72Å; W379-R394 PolarHBondContact NE1-O 2.61Å; W379-C397 HydrophobicContact CH2-CB 3.96Å; W379-C397 HydrophobicContact CZ3-CB 4.45Å; W379-K404 HydrophobicContact CD2-CB 4.15Å; W379-K404 HydrophobicContact CD2-CD 4.39Å; W379-K404 HydrophobicContact CD2-CG 3.77Å; W379-K404 HydrophobicContact CE3-CB 4.39Å; W379-K404 HydrophobicContact CE3-CG 4.25Å; W379-K404 HydrophobicContact CG-CD 4.27Å; W379-K404 HydrophobicContact CG-CG 4.01Å; W379-K404 HydrophobicContact CH2-CB 3.97Å; W379-K404 HydrophobicContact CZ2-CB 3.69Å; W379-K404 HydrophobicContact CZ2-CG 4.19Å; W379-K404 HydrophobicContact CZ3-CB 4.31Å
380P87.4Confident71.9Confident78 Ų7879.9 Ų79.951%0.50648%0.479SS..EExtended strand (participates in β ladder)trans-75.2141177.230.8-34.3000112.3
381C85.5Confident73.9Confident8 Ų880.5 Ų80.55%0.05447%0.471CS..  trans-56.5126.4170.4170.70000109.5N383 C386 N388 N390 C397 C400C381-N383 PolarHBondContact O-N 2.91Å; C381-N383 VanDerWaalsContact SG-CB 3.59Å; C381-N383 PolarHBondContact SG-N 3.03Å; C381-N383 VanDerWaalsContact SG-N 3.41Å; C381-C386 HydrophobicContact CB-CB 4.06Å; C381-C386 VanDerWaalsContact SG-CB 3.5Å; C381-N388 PolarHBondContact N-O 2.79Å; C381-N390 PolarHBondContact N-ND2 3.49Å; C381-C397 HydrophobicContact CB-CB 4.06Å; C381-C400 WeakPolarHBondContact CB-SG 3.35Å; C381-C400 WeakPolarHBondContact SG-CB 3.48Å; C381-C400 CovalentContact SG-SG 2.06Å; C381-C400 PolarHBondContact SG-SG 3.18Å
382P82Confident75.6Confident74 Ų7475.7 Ų75.748%0.48145%0.45SS..SBendtrans-69.1-13.4-178.527.7-35.3000113.3S384P382-S384 PolarHBondContact O-N 2.85Å
383N80.1Confident77.2Confident77 Ų7778 Ų7841%0.41245%0.454SS..  trans-78.6109.5171.6-177.3-14.6000110.5C381 S385 C386 G387C381-N383 PolarHBondContact O-N 2.91Å; C381-N383 VanDerWaalsContact SG-CB 3.59Å; C381-N383 PolarHBondContact SG-N 3.03Å; C381-N383 VanDerWaalsContact SG-N 3.41Å; N383-S385 VanDerWaalsContact CG-OG 3.27Å; N383-S385 PolarHBondContact ND2-OG 3.49Å; N383-S385 PolarHBondContact O-N 3.4Å; N383-S385 VanDerWaalsContact O-N 3.11Å; N383-S385 WeakPolarHBondContact OD1-CB 3.32Å; N383-S385 PolarHBondContact OD1-N 2.73Å; N383-S385 PolarHBondContact OD1-OG 3.21Å; N383-C386 HydrophobicContact CB-CB 4.41Å; N383-C386 VanDerWaalsContact O-CB 3.28Å; N383-C386 WeakPolarHBondContact O-CB 3.25Å; N383-C386 PolarHBondContact O-N 3.35Å; N383-G387 PolarHBondContact O-N 2.86Å
384S77.1Confident78.7Confident122 Ų12274.2 Ų74.285%0.85343%0.428SS*.THydrogen-bonded Turntrans-56.5-24.8-179.6-48.20000114.8P382 C386P382-S384 PolarHBondContact O-N 2.85Å; S384-C386 VanDerWaalsContact C-N 3.28Å; S384-C386 PolarHBondContact O-N 2.75Å
385S79.6Confident80.1Confident102 Ų10276.9 Ų76.971%0.71344%0.439SS*.THydrogen-bonded Turntrans-73.5-18.417468.90000113.6N383N383-S385 VanDerWaalsContact CG-OG 3.27Å; N383-S385 PolarHBondContact ND2-OG 3.49Å; N383-S385 PolarHBondContact O-N 3.4Å; N383-S385 VanDerWaalsContact O-N 3.11Å; N383-S385 WeakPolarHBondContact OD1-CB 3.32Å; N383-S385 PolarHBondContact OD1-N 2.73Å; N383-S385 PolarHBondContact OD1-OG 3.21Å
386C85.2Confident81.7Confident13 Ų1374.3 Ų74.39%0.08843%0.43CS..THydrogen-bonded Turntrans-91-49.8-177.4-178.90000112.6C381 N383 S384 N388 K399 C400C381-C386 HydrophobicContact CB-CB 4.06Å; C381-C386 VanDerWaalsContact SG-CB 3.5Å; N383-C386 HydrophobicContact CB-CB 4.41Å; N383-C386 VanDerWaalsContact O-CB 3.28Å; N383-C386 WeakPolarHBondContact O-CB 3.25Å; N383-C386 PolarHBondContact O-N 3.35Å; S384-C386 VanDerWaalsContact C-N 3.28Å; S384-C386 PolarHBondContact O-N 2.75Å; C386-N388 PolarHBondContact O-N 2.95Å; C386-N388 VanDerWaalsContact O-N 3.08Å; C386-N388 VanDerWaalsContact SG-CB 3.5Å; C386-K399 PolarHBondContact O-NZ 3.32Å; C386-C400 HydrophobicContact CB-CB 3.62Å; C386-C400 WeakPolarHBondContact SG-CB 3.36Å
387G79.1Confident83.2Confident62 Ų6271 Ų7164%0.63940%0.395SS*.  trans62.65.2-178.400000116.2N383N383-G387 PolarHBondContact O-N 2.86Å
388N86.4Confident83.9Confident49 Ų4974.6 Ų74.626%0.26241%0.407SS..  trans-79.2127.7-169-169.981.9000113.1C381 C386 N390 K399C381-N388 PolarHBondContact N-O 2.79Å; C386-N388 PolarHBondContact O-N 2.95Å; C386-N388 VanDerWaalsContact O-N 3.08Å; C386-N388 VanDerWaalsContact SG-CB 3.5Å; N388-N390 PolarHBondContact ND2-OD1 2.83Å; N388-N390 PolarHBondContact O-ND2 2.75Å; N388-K399 HydrophobicContact CB-CB 4Å; N388-K399 HydrophobicContact CB-CD 4.08Å
389M85.4Confident83.9Confident114 Ų11479.4 Ų79.456%0.56243%0.426SS*.EExtended strand (participates in β ladder)trans-76.8129.5169.1-171.1172.2-76.500110.7I374 D378I374-M389 HydrophobicContact CD1-CE 4.02Å; D378-M389 HydrophobicContact CB-CG 4.43Å
390N84.3Confident84Confident1 Ų181.1 Ų81.11%0.00544%0.438CS..EExtended strand (participates in β ladder)trans-114.9140.7-174.4-54.9-63.8000110.9D378 W379 C381 N388 C397 N398D378-N390 CarbonylContact C-O 3.52Å; D378-N390 VanDerWaalsContact CA-O 3.3Å; D378-N390 WeakPolarHBondContact CA-O 3.4Å; W379-N390 HydrophobicContact CD2-CB 3.9Å; W379-N390 HydrophobicContact CE3-CB 4.43Å; W379-N390 HydrophobicContact CG-CB 4.31Å; W379-N390 HydrophobicContact CH2-CB 4.36Å; W379-N390 HydrophobicContact CZ2-CB 3.81Å; W379-N390 WeakPolarHBondContact CZ3-ND2 3.34Å; W379-N390 PolarHBondContact N-O 2.84Å; W379-N390 WeakPolarHBondContact O-CB 3.49Å; W379-N390 PolarHBondContact O-N 3.17Å; W379-N390 PolarHBondContact O-ND2 2.72Å; C381-N390 PolarHBondContact N-ND2 3.49Å; N388-N390 PolarHBondContact ND2-OD1 2.83Å; N388-N390 PolarHBondContact O-ND2 2.75Å; N390-C397 WeakPolarHBondContact OD1-CA 3.44Å; N390-C397 PolarHBondContact OD1-SG 3.22Å; N390-N398 PolarHBondContact OD1-N 3.47Å
391F85.3Confident83.9Confident121 Ų12179.6 Ų79.653%0.53144%0.437SS..  trans-62.1140.9177.3-62.8-68000112.6D378 R393 R394D378-F391 VanDerWaalsContact OD1-CA 3.22Å; D378-F391 WeakPolarHBondContact OD1-CA 3.42Å; F391-R393 HydrophobicContact CB-CG 4.26Å; F391-R393 PolarHBondContact O-N 2.85Å; F391-R394 WeakPolarHBondContact O-CB 3.3Å; F391-R394 PolarHBondContact O-N 2.91Å
392A81.4Confident83.9Confident33 Ų3380.4 Ų80.427%0.27344%0.444SS..THydrogen-bonded Turntrans-46.4-38-174.500000114.8G377 D378 R394 K404G377-A392 VanDerWaalsContact O-CA 3.22Å; G377-A392 WeakPolarHBondContact O-CA 3.46Å; G377-A392 VanDerWaalsContact O-CB 3.27Å; G377-A392 WeakPolarHBondContact O-CB 3.36Å; D378-A392 PolarHBondContact OD1-N 2.96Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 3.16Å; A392-K404 PolarHBondContact O-NZ 2.98Å; A392-K404 VanDerWaalsContact O-NZ 3.11Å
393R81.4Confident84Confident214 Ų21481.3 Ų81.381%0.80845%0.45SS*.THydrogen-bonded Turntrans-71.5-6.4-179.668.6179.5177.7116-6.7115.6F391F391-R393 HydrophobicContact CB-CG 4.26Å; F391-R393 PolarHBondContact O-N 2.85Å
394R80.9Confident84.1Confident79 Ų7980.6 Ų80.630%0.29844%0.443SS..  trans-97135.1179.4-65.9178.8169.4-1059109.9W379 F391 A392 E396 N398W379-R394 PolarHBondContact NE1-O 2.61Å; F391-R394 WeakPolarHBondContact O-CB 3.3Å; F391-R394 PolarHBondContact O-N 2.91Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 3.16Å; R394-E396 WeakPolarHBondContact CB-O 3.21Å; R394-N398 PolarHBondContact NH1-OD1 2.95Å; R394-N398 PolarHBondContact NH2-OD1 2.98Å
395Q85.6Confident84.3Confident133 Ų13377.1 Ų77.162%0.62142%0.418SS*.SBendtrans-93.8-5.3170.5-51.2-62.129.900112.9P403 K404Q395-P403 CarbonylContact O-C 3.58Å; Q395-P403 WeakPolarHBondContact O-CA 3.31Å; Q395-K404 WeakPolarHBondContact O-CB 3.47Å; Q395-K404 PolarHBondContact O-N 3.13Å
396E88.6Confident83.6Confident131 Ų13181.8 Ų81.861%0.61243%0.428SS*.BIsolated β-bridgetrans-136.9148.3179.6-69.8164.9-150.600109.8R394R394-E396 WeakPolarHBondContact CB-O 3.21Å
397C90.4Very high82.4Confident7 Ų788.5 Ų88.55%0.04746%0.463CS..  trans-76135-178.9172.80000112.7W379 C381 N390 K399 C400 G401 A402W379-C397 HydrophobicContact CH2-CB 3.96Å; W379-C397 HydrophobicContact CZ3-CB 4.45Å; C381-C397 HydrophobicContact CB-CB 4.06Å; N390-C397 WeakPolarHBondContact OD1-CA 3.44Å; N390-C397 PolarHBondContact OD1-SG 3.22Å; C397-K399 PolarHBondContact O-N 3.39Å; C397-K399 PolarHBondContact SG-N 3.32Å; C397-C400 HydrophobicContact CB-CB 4.41Å; C397-C400 WeakPolarHBondContact CB-SG 3.41Å; C397-C400 PolarHBondContact SG-N 3.5Å; C397-C400 PolarHBondContact SG-SG 3.14Å; C397-G401 WeakPolarHBondContact O-CA 3.38Å; C397-G401 PolarHBondContact O-N 3.39Å; C397-G401 VanDerWaalsContact O-N 3.09Å; C397-A402 PolarHBondContact N-O 2.93Å
398N87.3Confident81.3Confident104 Ų10487.3 Ų87.356%0.55645%0.447SS*.THydrogen-bonded Turntrans-65.8-3.2178.8-165.273000115.4N390 R394N390-N398 PolarHBondContact OD1-N 3.47Å; R394-N398 PolarHBondContact NH1-OD1 2.95Å; R394-N398 PolarHBondContact NH2-OD1 2.98Å
399K84.8Confident79.8Confident141 Ų14188.4 Ų88.461%0.61347%0.471SS*.THydrogen-bonded Turntrans-132.7-39-177.2-179.4-175.7169-161.90113.4C386 N388 C397C386-K399 PolarHBondContact O-NZ 3.32Å; N388-K399 HydrophobicContact CB-CB 4Å; N388-K399 HydrophobicContact CB-CD 4.08Å; C397-K399 PolarHBondContact O-N 3.39Å; C397-K399 PolarHBondContact SG-N 3.32Å
400C86.7Confident78.2Confident40 Ų4091 Ų9127%0.2748%0.479SS..THydrogen-bonded Turntrans-100.4-9.4-18065.60000114.4C381 C386 C397 A402C381-C400 WeakPolarHBondContact CB-SG 3.35Å; C381-C400 WeakPolarHBondContact SG-CB 3.48Å; C381-C400 CovalentContact SG-SG 2.06Å; C381-C400 PolarHBondContact SG-SG 3.18Å; C386-C400 HydrophobicContact CB-CB 3.62Å; C386-C400 WeakPolarHBondContact SG-CB 3.36Å; C397-C400 HydrophobicContact CB-CB 4.41Å; C397-C400 WeakPolarHBondContact CB-SG 3.41Å; C397-C400 PolarHBondContact SG-N 3.5Å; C397-C400 PolarHBondContact SG-SG 3.14Å; C400-A402 HydrophobicContact CB-CB 4.43Å; C400-A402 PolarHBondContact O-N 2.83Å; C400-A402 WeakPolarHBondContact SG-CB 3.36Å
401G84.8Confident76.5Confident46 Ų4694.6 Ų94.647%0.47452%0.516SS..  trans66-17.6-171.500000115.1C397C397-G401 WeakPolarHBondContact O-CA 3.38Å; C397-G401 PolarHBondContact O-N 3.39Å; C397-G401 VanDerWaalsContact O-N 3.09Å
402A85.4Confident74.5Confident25 Ų2592.5 Ų92.521%0.20753%0.528CS..PPolyproline II helixtrans-55.6143.3-177.100000111.9C397 C400C397-A402 PolarHBondContact N-O 2.93Å; C400-A402 HydrophobicContact CB-CB 4.43Å; C400-A402 PolarHBondContact O-N 2.83Å; C400-A402 WeakPolarHBondContact SG-CB 3.36Å
403P84.6Confident72.9Confident93 Ų9393.7 Ų93.760%0.60454%0.544SS*.BIsolated β-bridgetrans-64.7157.7-17928-35.9000111.7Q395Q395-P403 CarbonylContact O-C 3.58Å; Q395-P403 WeakPolarHBondContact O-CA 3.31Å
404K82.8Confident71.5Confident62 Ų6290.6 Ų90.627%0.2754%0.543SS..PPolyproline II helixtrans-63.3126.3168.6-176.3175.4-170.6175.30108.7W379 A392 Q395 E406W379-K404 HydrophobicContact CD2-CB 4.15Å; W379-K404 HydrophobicContact CD2-CD 4.39Å; W379-K404 HydrophobicContact CD2-CG 3.77Å; W379-K404 HydrophobicContact CE3-CB 4.39Å; W379-K404 HydrophobicContact CE3-CG 4.25Å; W379-K404 HydrophobicContact CG-CD 4.27Å; W379-K404 HydrophobicContact CG-CG 4.01Å; W379-K404 HydrophobicContact CH2-CB 3.97Å; W379-K404 HydrophobicContact CZ2-CB 3.69Å; W379-K404 HydrophobicContact CZ2-CG 4.19Å; W379-K404 HydrophobicContact CZ3-CB 4.31Å; A392-K404 PolarHBondContact O-NZ 2.98Å; A392-K404 VanDerWaalsContact O-NZ 3.11Å; Q395-K404 WeakPolarHBondContact O-CB 3.47Å; Q395-K404 PolarHBondContact O-N 3.13Å; K404-E406 PolarHBondContact O-N 3.39Å
405P79.6Confident69.8Low49 Ų4999 Ų9932%0.31858%0.575SS.*PPolyproline II helixtrans-62.9121.5174.323.5-30000109.5D407 A408P405-D407 VanDerWaalsContact C-N 3.26Å; P405-D407 PolarHBondContact O-N 3.11Å; P405-A408 HydrophobicContact CG-CB 4.2Å; P405-A408 VanDerWaalsContact O-CB 3.27Å; P405-A408 WeakPolarHBondContact O-CB 3.31Å; P405-A408 PolarHBondContact O-N 3.13Å
406E66.4Low67.6Low201 Ų20196.5 Ų96.594%0.93959%0.585SS**THydrogen-bonded Turntrans-66.1-27.4-177.458.1-154114.800113.1K404 A408K404-E406 PolarHBondContact O-N 3.39Å; E406-A408 PolarHBondContact O-N 2.87Å
407D60.2Low65.3Low154 Ų15493.9 Ų93.982%0.82459%0.593SS**THydrogen-bonded Turntrans-797.6175.2-157.3-124.2000114.1P405 G409P405-D407 VanDerWaalsContact C-N 3.26Å; P405-D407 PolarHBondContact O-N 3.11Å; D407-G409 PolarHBondContact O-N 3.06Å
408A55.4Low63.1Low36 Ų36105.9 Ų105.930%0.29864%0.637SS.*  trans-74.854.9174.300000112.7P405 E406 F410P405-A408 HydrophobicContact CG-CB 4.2Å; P405-A408 VanDerWaalsContact O-CB 3.27Å; P405-A408 WeakPolarHBondContact O-CB 3.31Å; P405-A408 PolarHBondContact O-N 3.13Å; E406-A408 PolarHBondContact O-N 2.87Å; A408-F410 HydrophobicContact CB-CD2 4.38Å; A408-F410 PolarHBondContact O-N 3.46Å
409G53.8Low60.7Low73 Ų73104.3 Ų104.375%0.75365%0.646SS**  trans-69.236.4-176.600000115.8D407 G411D407-G409 PolarHBondContact O-N 3.06Å; G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.4Å
410F51.8Low58.6Low169 Ų169101.1 Ų101.174%0.74165%0.653SS**SBendtrans-78.373.3-178.8-66.3-74.8000112.4A408 G412A408-F410 HydrophobicContact CB-CD2 4.38Å; A408-F410 PolarHBondContact O-N 3.46Å; F410-G412 VanDerWaalsContact C-N 3.33Å; F410-G412 PolarHBondContact O-N 2.62Å; F410-G412 VanDerWaalsContact O-N 3.12Å
411G49.3Very low56.5Low75 Ų75108.6 Ų108.677%0.77368%0.681SS**  trans64.325.1154.600000117.1G409 G413G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.4Å; G411-G413 VanDerWaalsContact C-N 3.25Å; G411-G413 PolarHBondContact O-N 3.48Å
412G42.8Very low54.1Low77 Ų77110.1 Ų110.179%0.79470%0.697SS**  trans-73.565.2-179.600000114.5F410F410-G412 VanDerWaalsContact C-N 3.33Å; F410-G412 PolarHBondContact O-N 2.62Å; F410-G412 VanDerWaalsContact O-N 3.12Å
413G48.8Very low52Low58 Ų58112 Ų11260%0.59872%0.719SS**  trans-60150.9168.100000112.6G411G411-G413 VanDerWaalsContact C-N 3.25Å; G411-G413 PolarHBondContact O-N 3.48Å
414D52Low50Low149 Ų149115.3 Ų115.380%0.79773%0.731SS**SBendtrans64.666.3161.8-56.3-67.7000118.6
415R45.8Very low48.1Very low256 Ų256125.1 Ų125.197%0.96677%0.767SS**  -177.2125.7121.4-104.5165.3-75.2-173.5-4.2116.3
416G39.4Very low46.1Very low80 Ų80126.2 Ų126.283%0.82579%0.787SS**  trans147.5119148.200000117
417G39.3Very low44.7Very low77 Ų77120 Ų12079%0.79478%0.777SS**  trans79.9124.9172.400000114.2
418R43.8Very low43.6Very low258 Ų258117.2 Ų117.297%0.97477%0.77SS**  cis70.982.710.7-155.5-169.5-163.4-148.85.7116.3
419G38.1Very low42.9Very low71 Ų71124.1 Ų124.173%0.73279%0.793SS**  trans145.1116.5165.800000111.3
420G39.2Very low42.4Very low74 Ų74132.4 Ų132.476%0.76380%0.802SS**  trans157.787.7-173.900000111.5
421F43.4Very low41.6Very low198 Ų198127.8 Ų127.887%0.86880%0.801SS**  trans-124123.4-172.110.7-110.7000110.3
422G35.1Very low41.2Very low77 Ų77136.5 Ų136.579%0.79481%0.811SS**  trans155.3124.9172.500000112.7
423G41Very low40.9Very low65 Ų65135.9 Ų135.967%0.6780%0.804SS**  trans72.3138.8175.400000115.8
424D41Very low40.4Very low163 Ų163136.4 Ų136.487%0.87281%0.81SS**  cis-143.3122.9-13.6-84.8-65.8000110.1
425R44.2Very low39.8Very low267 Ų267138.6 Ų138.6100%1.00881%0.813SS**  trans-96.981.1165.5-76.4-172.9179.9173.11.2108.9
426G36.6Very low39.6Very low73 Ų73138.2 Ų138.275%0.75381%0.811SS**  trans-123.1135177.800000113.2
427G37.8Very low39.6Very low70 Ų70138.6 Ų138.672%0.72282%0.815SS**  trans92.248.9144.600000120.7
428S37.1Very low39.5Very low96 Ų96138 Ų13867%0.67181%0.809SS**  61.4154.6127.8-54.30000123.9
429F41.3Very low39.4Very low181 Ų181131.9 Ų131.979%0.79480%0.796SS**  trans98.1109.4149.7-53.3-57.1000121.8
430R42.2Very low39.6Very low247 Ų247139 Ų13993%0.93280%0.8SS**  trans68.7129.4151-53.1173.4-165.6-146.33.9117.6
431G36.1Very low39.6Very low71 Ų71138.8 Ų138.873%0.73280%0.798SS**  cis159.8168.7-8.700000113.6
432R39.5Very low39.4Very low259 Ų259132.4 Ų132.498%0.97779%0.788SS**  trans67.3131.3171.3-176.7-172.2-75.5-156.1-3116.7
433G36.1Very low39.6Very low63 Ų63138.8 Ų138.865%0.64979%0.794SS**  cis151.3130.1-13.500000115
434G39.3Very low39.4Very low69 Ų69139.5 Ų139.571%0.71180%0.801SS**  trans76.2167.3173.100000115.7
435F40.3Very low39.3Very low196 Ų196136 Ų13686%0.8680%0.803SS**  cis-150137.1-3.1-68.6-88.7000107.8
436R41.5Very low39.1Very low247 Ų247126.3 Ų126.393%0.93279%0.787SS**  61.6123.286.8-96.6-168.8-176.8-1702.7118
437G38Very low39.3Very low88 Ų88128.9 Ų128.991%0.90778%0.783SS**  trans96.2148.2165.500000115.6
438G37.9Very low39.4Very low64 Ų64135.8 Ų135.866%0.6679%0.787SS**  cis164153.7-900000112.6
439D42.1Very low39.3Very low131 Ų131134.5 Ų134.570%0.70179%0.789SS**  trans66.1156.9156.7-69.3-94000119.8
440R42Very low39.2Very low221 Ų221136.3 Ų136.383%0.83480%0.797SS**  cis-171.8153.1-16.9177.9-174.3-56.7177.42.6111.1
441G39.7Very low38.8Very low69 Ų69128.3 Ų128.371%0.71179%0.792SS**  trans89.4157.7170.200000115.7
442G37.8Very low38.9Very low63 Ų63129 Ų12965%0.64980%0.799SS**  cis125.7142.7500000111.1
443F40.2Very low38.7Very low212 Ų212120.4 Ų120.493%0.9379%0.791SS**  cis-159.5177.3-2.3-49.6-85.5000107.4
444G37.4Very low39Very low79 Ų79127.6 Ų127.681%0.81480%0.8SS**  cis155.9118.8-7.900000113.1
445G39.1Very low39.2Very low89 Ų89134.3 Ų134.392%0.91881%0.81SS**  trans94.9158.9179.300000115.2
446G38.9Very low39.3Very low64 Ų64134 Ų13466%0.6681%0.813SS**  cis170.1155.8-800000113.1
447D40.2Very low39.1Very low128 Ų128126.2 Ų126.268%0.68481%0.81SS**  trans67156.3159.1-56.2-57.5000119.8
448R40.5Very low39Very low214 Ų214126.1 Ų126.181%0.80881%0.809SS**  cis-164142.7-17.9-115.4172.7-116.3161.610.5111.7
449G35.9Very low39.1Very low69 Ų69135.3 Ų135.371%0.71182%0.824SS**  trans77.2172155.700000119.3
450F38.7Very low38.8Very low219 Ų219131.9 Ų131.996%0.96182%0.819SS**  cis-166.1139.7-19.4-134-78.9000111.5
451G34.1Very low38.6Very low79 Ų79129 Ų12981%0.81482%0.82SS**  trans74.3160169.300000117
452G37.5Very low38.7Very low87 Ų87137.6 Ų137.690%0.89783%0.831SS**  cis14393.3-6.900000113.2
453G36.4Very low39Very low78 Ų78145.5 Ų145.580%0.80484%0.841SS**  trans-167.5141.8179.800000114.3
454Y42.5Very low39.3Very low214 Ų214142.7 Ų142.784%0.83984%0.836SS**  trans-123.8147.8-168.345.6-92.3000112.3
455K42.6Very low39.6Very low209 Ų209147 Ų14791%0.90984%0.84SS**  trans-167.7146.6150.8-107.8154.8-173.9177.30110.8
456M41.8Very low40.1Very low190 Ų190154.3 Ų154.394%0.93684%0.84SS**  trans-125.4154.2-169.9-85.1-81.5-138.400111.4
457G38.2Very low40.4Very low84 Ų84163.1 Ų163.187%0.86685%0.853SS**  trans89143.914400000118.2
458G35.3Very low40.6Very low85 Ų85164.6 Ų164.688%0.87686%0.861SS**  trans143.679.9175.100000112.5
459R40.5Very low40.6Very low258 Ų258165.7 Ų165.797%0.97487%0.866SS**  trans-147.7121.9-179.3-161.4-174.5-159.8-166.77.1110.5
460G35.2Very low41.7Very low58 Ų58167.4 Ų167.460%0.59886%0.864SS**  trans128.9151.2-170.700000110.3
461D38.7Very low41.6Very low160 Ų160171.1 Ų171.186%0.85687%0.874SS**  cis-149.2129.5-9.3-72.5-64.9000108.6
462R40.8Very low42Very low251 Ų251175.8 Ų175.895%0.94788%0.877SS**  trans-151.490170.2-68.9-164.5-171.5179.83.7111.5
463R45.4Very low42.2Very low228 Ų228180.4 Ų180.486%0.8688%0.876SS**  trans-135.9169.1155.8-80.2-170171-174.8-3.1107.8
464D45.2Very low42.5Very low154 Ų154186.1 Ų186.182%0.82488%0.88SS**  trans75.148.1167.4-52.2-59.1000117.7
465D43.6Very low42.5Very low169 Ų169184.5 Ų184.590%0.90488%0.882SS**  trans-114.669.3154.8-82.5-56.3000110.7
466R49.3Very low42.5Very low243 Ų243182.9 Ų182.992%0.91788%0.88SS**  trans-144.887.1164.5-84.8-162.3-178.7-168.72.3110.3
467R45.7Very low42.6Very low248 Ų248182.5 Ų182.594%0.93688%0.877SS**  trans-143.8158.4159.6-77-159.9173.8-155.3-2.6110.7
468D45.1Very low42.9Very low159 Ų159189.5 Ų189.585%0.8588%0.878SS**  trans-78.2169.5-163.6-58.9-102.6000115.7
469R41Very low43.5Very low238 Ų238197.5 Ų197.590%0.89888%0.878SS**  trans-49.2170155.7-94.7175.7165.2177.7-5.4113
470P57.1Low43.7Very low105 Ų105192.5 Ų192.568%0.68287%0.87SS**  cis-132.4168.6-1.939.7-24.6000115.2
471Y37.8Very low44.5Very low297 Ų297204.7 Ų204.7100%1.16589%0.894SS**  -152.90112-134.1-89.4000110

Retrieved 471 of 471 residues in 309.8 ms (Link to these results)