A0A096NKV4_PAPAN Loading...

Transcription factor AP-2-alpha

AlphaFold DB (A0A663D6N8), UniProt , Accession A0A096NKV4, Species PAPAN (Papio anubis, Olive baboon), Gene TFAP2A, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M30.6Very low35.2Very low243 Ų243174.9 Ų174.9100%1.19785%0.854SS**  0134.80-74.1162.1168.600108.3
2K39.3Very low34.6Very low206 Ų206175.4 Ų175.490%0.89685%0.848SS**  trans-90110.5177.3-69.4-179175-173.80108.9L4K2-L4 PolarHBondContact O-N 2.89Å
3M31.8Very low34.4Very low182 Ų182179.1 Ų179.190%0.89785%0.85SS**  trans-86.788.6166-70.6-60.3-114.500108.1
4L37.5Very low34.2Very low141 Ų141179.1 Ų179.174%0.73885%0.85SS**  trans-68.1137.6177.5-173.371.2000109.8K2 K6K2-L4 PolarHBondContact O-N 2.89Å; L4-K6 VanDerWaalsContact C-N 3.27Å; L4-K6 PolarHBondContact O-N 3.36Å
5W32.7Very low33.9Very low228 Ų228177.4 Ų177.486%0.86485%0.848SS**  trans-64.581.2174.2-66.792.6000111.6L7W5-L7 VanDerWaalsContact C-N 3.33Å; W5-L7 PolarHBondContact O-N 3.29Å
6K34.2Very low33.8Very low186 Ų186173.9 Ų173.981%0.80985%0.846SS**  trans-89.369.6173.4-117.8-174.9179.2-175.70110.6L4 T8L4-K6 VanDerWaalsContact C-N 3.27Å; L4-K6 PolarHBondContact O-N 3.36Å; K6-T8 PolarHBondContact O-N 3.06Å
7L37.7Very low33.6Very low158 Ų158174.3 Ų174.383%0.82785%0.846SS**  trans-83.995163.4-167.569.8000108W5 D9W5-L7 VanDerWaalsContact C-N 3.33Å; W5-L7 PolarHBondContact O-N 3.29Å; L7-D9 PolarHBondContact O-N 3.1Å
8T34.1Very low33.5Very low125 Ų125172.9 Ų172.977%0.76784%0.843SS**  trans-11.8109.5176.936.30000117K6 N10K6-T8 PolarHBondContact O-N 3.06Å; T8-N10 PolarHBondContact O-N 3.5Å
9D37.1Very low33.5Very low156 Ų156176.3 Ų176.383%0.83485%0.846SS**  trans-63115.6160.1-57.5-72.8000110.2L7L7-D9 PolarHBondContact O-N 3.1Å
10N35Very low33.5Very low146 Ų146176.2 Ų176.278%0.78184%0.844SS**  trans-156.261.6156.3-136.2-17.2000111.8T8T8-N10 PolarHBondContact O-N 3.5Å
11I36.9Very low33.6Very low153 Ų153175.6 Ų175.679%0.78585%0.845SS**  trans-112.996.9159.4-61.4177.9000106Y13I11-Y13 PolarHBondContact O-N 3.27Å
12K28.7Very low33.7Very low181 Ų181167.5 Ų167.579%0.78782%0.824SS**  trans-58.1122163.2-83.2-174.9170.8-173.80107.8E14K12-E14 PolarHBondContact O-N 3.01Å
13Y31.6Very low33.4Very low223 Ų223164.8 Ų164.888%0.87583%0.825SS**  trans-68.9115154.1-82.1-104.5000106.5I11I11-Y13 PolarHBondContact O-N 3.27Å
14E31.1Very low33.5Very low180 Ų180160.8 Ų160.884%0.84182%0.815SS**  trans-76.7124.6155.9-79.1-170.7139.300107.2K12K12-E14 PolarHBondContact O-N 3.01Å
15D29.9Very low33.3Very low153 Ų153161.8 Ų161.882%0.81882%0.821SS**  trans-75.6127175.3-153.67.8000108.2E17D15-E17 PolarHBondContact O-N 2.96Å; D15-E17 VanDerWaalsContact O-N 3.12Å
16C31.8Very low33.3Very low122 Ų122153.9 Ų153.982%0.82481%0.811SS**  trans-82.589.5175.8-80.20000108.6D18C16-D18 PolarHBondContact O-N 3.47Å; C16-D18 VanDerWaalsContact O-N 3.16Å
17E30.8Very low33.2Very low180 Ų180152 Ų15284%0.84182%0.815SS**  trans-58.4118172.8-72.1-170.5128.800111.1D15 R19D15-E17 PolarHBondContact O-N 2.96Å; D15-E17 VanDerWaalsContact O-N 3.12Å; E17-R19 PolarHBondContact O-N 3.25Å
18D33Very low33.1Very low149 Ų149149 Ų14980%0.79781%0.813SS**  trans-75.3110179.8-138.9-11.3000109.6C16 H20C16-D18 PolarHBondContact O-N 3.47Å; C16-D18 VanDerWaalsContact O-N 3.16Å; D18-H20 PolarHBondContact O-N 3.02Å
19R32.4Very low33.1Very low237 Ų237155 Ų15589%0.89482%0.821SS**  trans-71.499.5179.5-92-173.2167.8144.3-0.3111E17 D21E17-R19 PolarHBondContact O-N 3.25Å; R19-D21 PolarHBondContact O-N 2.63Å
20H34Very low32.9Very low174 Ų174155.2 Ų155.281%0.80682%0.822SS**  trans-65.7111.6161.9-83.253.7000110.6D18D18-H20 PolarHBondContact O-N 3.02Å
21D36Very low33.6Very low164 Ų164152.9 Ų152.988%0.87782%0.815SS**  trans-95106.4153.7-90.7-42.8000108.8R19R19-D21 PolarHBondContact O-N 2.63Å
22G31.4Very low33.3Very low73 Ų73153.6 Ų153.675%0.75382%0.815SS**  trans-96.7119.4177.200000111.8
23T34.3Very low33.5Very low149 Ų149153 Ų15391%0.91482%0.819SS**  trans-129.4136.3157.245.60000110.3
24S33.4Very low33.5Very low99 Ų99146.2 Ų146.269%0.69282%0.817SS**  trans-101.9144.3-163.849.90000113.6
25N32.8Very low33.5Very low162 Ų162143.7 Ų143.787%0.86681%0.814SS**  148.9150.8123.8-81-26.8000113.7
26G32.8Very low33.7Very low62 Ų62143.3 Ų143.364%0.63982%0.817SS**  trans114.472.714500000118.9
27T32.4Very low33.7Very low147 Ų147140.6 Ų140.690%0.90281%0.81SS**  trans39126.7136.349.80000122.2
28A35.8Very low33.9Very low94 Ų94140.1 Ų140.178%0.77781%0.808SS**  trans-51.2151.9174.100000118.4
29R33.5Very low34.1Very low251 Ų251137.8 Ų137.895%0.94780%0.803SS**  179.8138.3121-97.2164.6-172.9-159.42.2113.5
30L34.3Very low35Very low160 Ų160131 Ų13184%0.83879%0.789SS**  trans-81.5167.5151.3-92122.9000108.7
31P48.5Very low35.1Very low98 Ų98133 Ų13364%0.63679%0.792SS**  cis-147.8-175.728.742.8-21.9000118.9
32Q30.6Very low35.1Very low167 Ų167131.3 Ų131.378%0.7879%0.787SS**  trans75122.7144.3-87.9174.4-42.600124.4
33L33.9Very low35.5Very low169 Ų169133.2 Ų133.289%0.88579%0.789SS**  39.7130.3129.5-106.469000121.9
34G30Very low35.5Very low81 Ų81130.7 Ų130.784%0.83578%0.783SS**  trans-179.982.5170.800000118
35T32.7Very low36.1Very low127 Ų127131.4 Ų131.478%0.77979%0.786SS**  trans-56.3141.1177.3-45.90000118.7
36V33Very low36.6Very low144 Ų144129.9 Ų129.987%0.87378%0.784SS**  trans73.4137.7146.2162.90000123.9
37G31.9Very low36.9Very low65 Ų65135.1 Ų135.167%0.6780%0.797SS**  trans128.596.2151.200000115.5
38Q35.1Very low37.1Very low171 Ų171132.9 Ų132.980%0.79979%0.787SS**  91.2104.977.5-82.3-79.4200115.9
39S37.8Very low37.2Very low100 Ų100137.4 Ų137.470%0.69979%0.792SS**  trans43.7145.8134.4-46.90000121.8
40P50.9Low37.4Very low94 Ų94131.8 Ų131.861%0.6179%0.786SS**  -149.9136.17239.7-20.1000116.3
41Y36.9Very low38Very low217 Ų217129.2 Ų129.285%0.85178%0.779SS**  157.9164.895.8-79.9-55.4000106.3
42T34.3Very low37.7Very low128 Ų128132.4 Ų132.479%0.78579%0.79SS**  cis-159.7163.3-15.9-91.10000106.7
43S39.7Very low38.3Very low113 Ų113128.9 Ų128.979%0.7979%0.79SS**  trans-127.9157.9-168.754.10000115
44A35.5Very low39Very low96 Ų96128.2 Ų128.279%0.79379%0.787SS**  trans-173.1165152.300000110.4
45P44.9Very low39.8Very low114 Ų114133.8 Ų133.874%0.7479%0.789SS**  -120.4166.2-68.238.5-26.4000112.4
46P44Very low41Very low129 Ų129135.8 Ų135.884%0.83879%0.789SS**PPolyproline II helixtrans-85.7138.5176.633.8-32.5000112.5
47L38.4Very low42.6Very low172 Ų172133.9 Ų133.990%0.90178%0.78SS**PPolyproline II helixtrans-102.3125167.1-88.3168.7000110.8
48S36.4Very low44Very low101 Ų101136.5 Ų136.571%0.70679%0.785SS**PPolyproline II helixtrans-94.7126.5-178.151.90000112.2
49H39.7Very low45.5Very low188 Ų188137.5 Ų137.587%0.8778%0.783SS**  trans-135.3143.4154.7-81.7-77.2000109.8
50T37.5Very low46.8Very low134 Ų134141.5 Ų141.582%0.82279%0.788SS**  trans-103.8-165.2-171.156.20000110.6
51P46.4Very low47.7Very low106 Ų106141.2 Ų141.269%0.68879%0.786SS**  -112153.1-10734.3-17.6000113.8
52N41.8Very low49.1Very low164 Ų164135 Ų13588%0.87777%0.772SS**  trans178.5100143.7-97.9-6.7000111.2
53A43.3Very low50.2Low94 Ų94134.9 Ų134.978%0.77777%0.774SS**  trans-163.5104.415700000107.7F55A53-F55 PolarHBondContact O-N 3.47Å
54D47.9Very low50.9Low155 Ų155139.9 Ų139.983%0.82978%0.777SS**  trans-63.798.9177.8-73.7-69.7000111Q56D54-Q56 VanDerWaalsContact C-N 3.31Å; D54-Q56 PolarHBondContact O-N 3.46Å
55F48.5Very low51.8Low197 Ų197143.5 Ų143.586%0.86478%0.777SS**  trans-81.378.7176.6-152.1-83.5000109.8A53 P57A53-F55 PolarHBondContact O-N 3.47Å; F55-P57 WeakPolarHBondContact O-CD 3.31Å
56Q57.3Low51.8Low170 Ų170143.6 Ų143.679%0.79478%0.778SS**PPolyproline II helixtrans-67.8123.3172.9-74.6-172.5-25.600110.4D54D54-Q56 VanDerWaalsContact C-N 3.31Å; D54-Q56 PolarHBondContact O-N 3.46Å
57P65.5Low51.8Low104 Ų104144.6 Ų144.668%0.67578%0.775SS**PPolyproline II helixtrans-66.4151.4168.629.4-33.9000110.1F55 Y59F55-P57 WeakPolarHBondContact O-CD 3.31Å; P57-Y59 PolarHBondContact O-N 3.48Å; P57-Y59 VanDerWaalsContact O-N 3.15Å
58P61.9Low51.9Low119 Ų119146.4 Ų146.477%0.77377%0.771SS**PPolyproline II helixtrans-62.7118.8-175.924.5-33.6000111.6F60P58-F60 PolarHBondContact O-N 3.44Å
59Y66.4Low52.4Low192 Ų192147.2 Ų147.275%0.75377%0.774SS**PPolyproline II helixtrans-67119.1178.7179.5-98.7000111.2P57 P61P57-Y59 PolarHBondContact O-N 3.48Å; P57-Y59 VanDerWaalsContact O-N 3.15Å; Y59-P61 HydrophobicContact CE1-CB 4.36Å
60F65.8Low52.3Low185 Ų185146.8 Ų146.881%0.81177%0.772SS**PPolyproline II helixtrans-84.5122.7166.8-100-100.6000109.3P58P58-F60 PolarHBondContact O-N 3.44Å
61P68.9Low52.4Low88 Ų88145.6 Ų145.657%0.57177%0.769SS**PPolyproline II helixtrans-67.9147.5176.628.7-34.1000111Y59Y59-P61 HydrophobicContact CE1-CB 4.36Å
62P66.5Low52.1Low86 Ų86148.6 Ų148.656%0.55877%0.774SS**PPolyproline II helixtrans-64.2153.6175.328-34.8000111.3Y64P62-Y64 PolarHBondContact O-N 3.26Å
63P57.6Low52Low125 Ų125147.7 Ų147.781%0.81277%0.769SS**PPolyproline II helixtrans-62.3131.3179.225.9-33.9000111Q65P63-Q65 PolarHBondContact O-N 2.78Å
64Y53.6Low52Low218 Ų218147.8 Ų147.886%0.85576%0.762SS**PPolyproline II helixtrans-58.2130.1178.1-80.1-95.5000111.4P62P62-Y64 PolarHBondContact O-N 3.26Å
65Q55.2Low51.7Low172 Ų172149.2 Ų149.280%0.80476%0.757SS**PPolyproline II helixtrans-73.7145.6161.7-66.7-155.6-14.200109.9P63 I67P63-Q65 PolarHBondContact O-N 2.78Å; Q65-I67 PolarHBondContact O-N 2.64Å; Q65-I67 VanDerWaalsContact O-N 3.12Å
66P45.4Very low51.6Low117 Ų117145.3 Ų145.376%0.7675%0.754SS**  trans-68.8110.9-178.627.1-33.6000111.1
67I43.8Very low51.2Low149 Ų149144 Ų14476%0.76475%0.748SS**  trans-76.8121.1166.2-62.7173.7000107.5Q65 P69Q65-I67 PolarHBondContact O-N 2.64Å; Q65-I67 VanDerWaalsContact O-N 3.12Å; I67-P69 WeakPolarHBondContact O-CD 3.11Å
68Y40.8Very low50.2Low211 Ų211145.3 Ų145.383%0.82775%0.754SS**  trans-68.7122.8168.4-76.6-93.8000109.3Q70Y68-Q70 PolarHBondContact O-N 3.48Å; Y68-Q70 VanDerWaalsContact O-N 3.16Å
69P46.6Very low49.2Very low118 Ų118147.1 Ų147.177%0.76676%0.757SS**  trans-75107.4176.929.1-32.3000110.4I67 S71I67-P69 WeakPolarHBondContact O-CD 3.11Å; P69-S71 PolarHBondContact O-N 3.15Å
70Q37.8Very low48.1Very low178 Ų178142.8 Ų142.883%0.83275%0.747SS**  trans-74.1103.9164-174.4169-6.400108.1Y68 Q72Y68-Q70 PolarHBondContact O-N 3.48Å; Y68-Q70 VanDerWaalsContact O-N 3.16Å; Q70-Q72 PolarHBondContact O-N 3.43Å
71S39.3Very low47Very low109 Ų109139.6 Ų139.676%0.76275%0.745SS**  trans-71.9118.2-172.155.80000112.6P69P69-S71 PolarHBondContact O-N 3.15Å
72Q40.9Very low45.9Very low169 Ų169145.1 Ų145.179%0.7976%0.756SS**  trans-151.364.2172-151.1150.711.300112Q70Q70-Q72 PolarHBondContact O-N 3.43Å
73D38.1Very low44.7Very low145 Ų145145.8 Ų145.878%0.77576%0.762SS**  trans-86.1123.8178.2-87.9-55.1000112.8Y75D73-Y75 VanDerWaalsContact C-N 3.33Å; D73-Y75 PolarHBondContact O-N 3.03Å
74P43.5Very low43.8Very low97 Ų97147.8 Ų147.863%0.6377%0.765SS**SBendtrans-78.20.8-176.1-18.233.2000117.1
75Y42.6Very low43Very low184 Ų184144.1 Ų144.172%0.72276%0.76SS**  trans-117.734.7-165.3-78.5-79.5000115.1D73 H77D73-Y75 VanDerWaalsContact C-N 3.33Å; D73-Y75 PolarHBondContact O-N 3.03Å; Y75-H77 PolarHBondContact O-N 3.21Å
76S46.3Very low42.4Very low115 Ų115142 Ų14280%0.80476%0.761SS**THydrogen-bonded Turntrans-73.616.9-176.252.80000116.8
77H49.1Very low41.9Very low143 Ų143143.8 Ų143.866%0.66276%0.764SS**THydrogen-bonded Turntrans-123.518.7-17049.4-89.3000115.4Y75Y75-H77 PolarHBondContact O-N 3.21Å
78V45.2Very low41.6Very low131 Ų131145 Ų14579%0.79477%0.766SS**  trans-101.4109.6163.7-86.20000110.1
79N40.4Very low41.4Very low158 Ų158139.6 Ų139.685%0.84577%0.765SS**  trans-86.4120.7-172.9-158.810.6000110.5
80D43.2Very low40.8Very low101 Ų101142.1 Ų142.154%0.5477%0.766SS.*  trans-89.7118.3-177.6-170.7-16.6000111.2Y82D80-Y82 PolarHBondContact O-N 3.01Å; D80-Y82 PolarHBondContact OD1-N 3.38Å
81P42.9Very low40.9Very low118 Ų118139.1 Ų139.177%0.76676%0.762SS**THydrogen-bonded Turntrans-69.68.4-172.428.4-36.6000116.4
82Y44.5Very low40.6Very low204 Ų204143 Ų14380%0.877%0.769SS**THydrogen-bonded Turntrans-115.413.6179.7-74.1-79.6000115.7D80 L84D80-Y82 PolarHBondContact O-N 3.01Å; D80-Y82 PolarHBondContact OD1-N 3.38Å; Y82-L84 PolarHBondContact O-N 2.91Å
83S42Very low40.9Very low99 Ų99140.6 Ų140.669%0.69277%0.768SS**  trans-75.5105.1179.6-61.90000112.9
84L39.2Very low40.6Very low167 Ų167142.9 Ų142.987%0.87477%0.774SS**  trans-87.1131174.3-78162.9000112.1Y82 P86Y82-L84 PolarHBondContact O-N 2.91Å; L84-P86 WeakPolarHBondContact O-CD 3.39Å
85N37.2Very low40.2Very low142 Ų142147.1 Ų147.176%0.75979%0.785SS**  trans-57.2130.8178.5-87.4-13.4000114.1
86P41.1Very low40.4Very low126 Ų126144.4 Ų144.482%0.81879%0.789SS**  trans-99.688161.134.3-26.7000111.5L84 H88L84-P86 WeakPolarHBondContact O-CD 3.39Å; P86-H88 PolarHBondContact O-N 3.39Å
87L36.2Very low39.6Very low155 Ų155142.1 Ų142.181%0.81278%0.784SS**  trans-94.672.5171.9-92.9171000112
88H37.6Very low38.7Very low174 Ų174147.8 Ų147.881%0.80680%0.8SS**  trans-170.2119.3147.6-127.9100.6000111.5P86P86-H88 PolarHBondContact O-N 3.39Å
89A35.6Very low38.7Very low99 Ų99147.2 Ų147.282%0.81880%0.799SS**  trans-127.5116.4165.100000108.8
90Q33.8Very low38.3Very low170 Ų170143.2 Ų143.279%0.79480%0.795SS**PPolyproline II helixtrans-80.6135.8173.6-95-96.9-26.600110
91P40.2Very low37.8Very low115 Ų115148 Ų14875%0.74781%0.814SS**PPolyproline II helixtrans-85.9130.9175.132.6-31.7000112.3
92Q33.4Very low37.3Very low192 Ų192153.7 Ų153.790%0.89782%0.82SS**PPolyproline II helixtrans-87157.9171.4-113.8-179.4-34.300112
93P46Very low36.9Very low118 Ų118153.2 Ų153.277%0.76683%0.825SS**PPolyproline II helixtrans-75.8165-167-16.931.7000116.8
94Q32.5Very low36.3Very low192 Ų192153 Ų15390%0.89782%0.824SS**PPolyproline II helixtrans-79.7149.1-177-59.8170.6-3.800113.4
95H34.4Very low36Very low187 Ų187153.7 Ų153.787%0.86682%0.822SS**  trans-110.6149.1159.3-75.8-89.7000110.2
96P46.8Very low35.7Very low126 Ų126155.3 Ų155.382%0.81883%0.826SS**  trans-102140.7-160.836.5-34000116.6
97G29.7Very low35.3Very low67 Ų67155.3 Ų155.369%0.69183%0.829SS**  trans89.4113.913100000120.2
98W30.8Very low35Very low262 Ų262151 Ų15199%0.99282%0.821SS**  -151.3151.2129.5-90.993.9000108.1
99P44.3Very low34.9Very low119 Ų119150.1 Ų150.177%0.77382%0.822SS**  trans-103.8150.4-164.437.2-28.3000114
100G32.7Very low34.7Very low74 Ų74151.7 Ų151.776%0.76382%0.816SS**  trans-176.3116172.100000116
101Q33.7Very low34.6Very low203 Ų203151 Ų15195%0.94981%0.812SS**  trans84.3139.1154.7-148.6150.8-26.200119.4
102R32.7Very low34.1Very low236 Ų236150.2 Ų150.289%0.89181%0.805SS**  trans-101.2154.3-167.2-60.6169.7167.2-136.10.3112.2
103Q34.1Very low34Very low194 Ų194149 Ų14991%0.90780%0.799SS**  trans140.6147.7145.2-84.3-179.6-17.500109.5
104S30.7Very low33.3Very low94 Ų94155 Ų15566%0.65781%0.807SS**  cis-169.6159.1-17.7-172.70000108.3
105Q33.2Very low33Very low182 Ų182149.6 Ų149.685%0.8580%0.803SS**  trans74.7149.4160.7-83.3168.1-12.500120.5
106E30.2Very low33.1Very low177 Ų177148.8 Ų148.883%0.82780%0.804SS**  trans-112.4-174.2-158.6-59.7155.281.500111.9
107S31.8Very low33.7Very low126 Ų126147.4 Ų147.488%0.88180%0.795SS**  trans81.6139.6164.4-46.10000115.8
108G31.3Very low33.8Very low64 Ų64152.2 Ų152.266%0.6680%0.799SS**  cis176.8134.6-5.700000112.5
109L34.1Very low33.9Very low156 Ų156146.4 Ų146.482%0.81778%0.783SS**  trans53.1111.7131.7-63.4179.6000121.4
110L32.4Very low33.4Very low132 Ų132147.1 Ų147.169%0.69178%0.78SS**  95.2134.4121.8-64.7174.1000123.2
111H31.5Very low33.2Very low155 Ų155149.3 Ų149.372%0.71878%0.783SS**  trans68.9102.9141.9-69.8-46.2000123.3
112T29.9Very low33Very low98 Ų98143.5 Ų143.560%0.60178%0.778SS**  39.4110.797.8-63.90000119.1
113H31Very low33.1Very low166 Ų166140.8 Ų140.877%0.76978%0.78SS**  174.5129.3112.5-94.8-54.7000115.1
114R30.9Very low33.4Very low244 Ų244138.1 Ų138.192%0.92177%0.772SS**  54.4119125.9-154.6-177.1-157.1173.54.8120.9
115G27.8Very low34.3Very low79 Ų79139.1 Ų139.181%0.81478%0.776SS**  trans167.9127.2157.600000117.7
116L34.7Very low34.5Very low170 Ų170140.3 Ų140.389%0.8977%0.773SS**  trans-134.2172.1165.8-91.2161000106.3
117P61.3Low35Very low98 Ų98142.1 Ų142.164%0.63677%0.772SS**  cis-128.9-163.6-33.439.8-23.4000111.6
118H30.8Very low35.2Very low167 Ų167141.3 Ų141.377%0.77376%0.758SS**  trans133.9153.1159.7-81.266.4000111.8
119Q32.8Very low35.5Very low140 Ų140146.7 Ų146.765%0.65476%0.76SS**  cis-168.7152.6-21.8-106.2-7241.200109
120L32.9Very low35.7Very low135 Ų135146.7 Ų146.771%0.70775%0.749SS**  trans62.3125.6150.3-62.2173.3000125.8
121S29.7Very low35.9Very low119 Ų119151.6 Ų151.683%0.83276%0.758SS**  71.5129.8128.1-62.20000124
122G30Very low35.8Very low82 Ų82151.2 Ų151.285%0.84576%0.757SS**  trans-176.680.7170.300000116.1
123L33.3Very low36.2Very low179 Ų179153.8 Ų153.894%0.93776%0.762SS**  trans-8.2140.9168.1-61167.7000122.3
124D41.1Very low36.4Very low138 Ų138153 Ų15374%0.73876%0.763SS**  trans-93.1155.7167.7167.951.3000112.8R126D124-R126 PolarHBondContact OD2-N 3.1Å
125P49.3Very low36.8Very low114 Ų114147.4 Ų147.474%0.7475%0.751SS**  trans-132.698.4151.433-15.4000115.5
126R38.3Very low37.2Very low207 Ų207149.6 Ų149.678%0.78174%0.743SS**  44.7137.8123.9-67.1-176170.3135-1.2119.5D124D124-R126 PolarHBondContact OD2-N 3.1Å
127R40.3Very low37.1Very low216 Ų216149.7 Ų149.782%0.81574%0.739SS**  -168.5125.367.3-128.1149.1-177-142.31.2110.2
128D36Very low35.7Very low109 Ų109148.5 Ų148.558%0.58374%0.744SS**  69.5147.999-61.9-23.3000114.6
129Y37.4Very low36.5Very low176 Ų176145.6 Ų145.669%0.6974%0.74SS**  cis-165.2165-2.9-125.5-148.8000106.3
130R38.7Very low36.5Very low157 Ų157147.5 Ų147.559%0.59275%0.749SS**  cis-160.8168.4-6.2-145.2-167.9-158.6-154.95.3108.3H132R130-H132 PolarHBondContact NH1-CE1 3.32Å; R130-H132 PolarHBondContact NH1-NE2 3.12Å
131R35.8Very low36.3Very low234 Ų234145 Ų14588%0.88375%0.748SS**  trans-95.9169.5147.1-89.2-176.3178.9157.3-1.8108.6
132H30.8Very low36.6Very low148 Ų148147.7 Ų147.769%0.68575%0.752SS**  trans-120.7138.5159.5-116.7-92.1000111.1R130R130-H132 PolarHBondContact NH1-CE1 3.32Å; R130-H132 PolarHBondContact NH1-NE2 3.12Å
133E38.2Very low36.6Very low151 Ų151149.7 Ų149.771%0.70675%0.753SS**  trans-98.1172.4164.5-63.5-169.6128.300109.7
134D35.3Very low36.8Very low151 Ų151146.7 Ų146.781%0.80775%0.747SS**  trans-150.5103.3136-87.5-42.1000111
135L37.5Very low36.3Very low126 Ų126144 Ų14466%0.6675%0.752SS**  19.1150.2116.2-60.2177.7000118.3
136L36.7Very low35.8Very low125 Ų125147.7 Ų147.765%0.65477%0.765SS**  cis-173.7175.518.2-123.7166.4000112.3
137H33.6Very low35.5Very low171 Ų171141.3 Ų141.379%0.79276%0.763SS**  trans94.1127161.4-57.3104.9000121.2
138G30.4Very low35.1Very low73 Ų73137.8 Ų137.875%0.75376%0.761SS**  trans-111.5-138.6168.100000111.2
139P47.9Very low35Very low107 Ų107139.3 Ų139.370%0.69577%0.768SS**  cis-133.8-166.5-14.127.1-1.8000113.8
140H32.8Very low34.7Very low179 Ų179135.5 Ų135.583%0.82977%0.767SS**  trans74.2154.2172.5-49.4-75.4000117.1
141A28.2Very low34.7Very low84 Ų84134.7 Ų134.769%0.69477%0.773SS**  cis-163.5158.9-23.400000110.7
142L36Very low34.7Very low174 Ų174132.4 Ų132.491%0.91177%0.772SS**  trans19.4127.4156.1-53.2174.3000121.5
143S30.6Very low34.6Very low124 Ų124129.9 Ų129.987%0.86777%0.771SS**  -178.3146.1117.1-167.90000113.6
144S37.1Very low34.4Very low117 Ų117130.3 Ų130.382%0.81878%0.777SS**  trans-77.3164.6161.9-52.90000112
145G31.6Very low34.8Very low82 Ų82128.4 Ų128.485%0.84577%0.773SS**  trans177.2128.7167.200000115.4
146L37.8Very low34.5Very low191 Ų191131.3 Ų131.3100%178%0.783SS**  trans-94.5166.3178.5-84.8145.6000113.1
147G31.9Very low34.2Very low72 Ų72130.1 Ų130.174%0.74279%0.791SS**  trans129.8115.7164.800000112
148D33.3Very low34.3Very low143 Ų143129.2 Ų129.277%0.76579%0.79SS**  cis102144.431.6-165.728.7000113.6
149L33.1Very low34.4Very low141 Ų141134.3 Ų134.374%0.73879%0.794SS**  trans71153.3172.8-48.4177.1000118.7
150S31.8Very low33.5Very low96 Ų96137.9 Ų137.967%0.67180%0.802SS**  cis-168144.1-30.3-102.20000112.6
151I38.3Very low33.7Very low139 Ų139135.6 Ų135.671%0.71380%0.8SS**  trans12.9130.3142.6-58.8172.1000120.8
152H35.6Very low34.2Very low187 Ų187137.2 Ų137.287%0.86680%0.804SS**  trans-164.3127.4135.4-96.4-83.1000107
153S28.5Very low33.9Very low94 Ų94136.9 Ų136.966%0.65780%0.797SS**  cis99.3122.739.9-67.90000113.9
154L33.4Very low34.3Very low160 Ų160136.2 Ų136.284%0.83879%0.787SS**  trans-51.6-179.3179.8-85.873.2000116.6
155P44.2Very low34Very low111 Ų111139.5 Ų139.572%0.72179%0.79SS**  cis-142.4-179.611.127.7-1000119.4
156H32.4Very low34.4Very low187 Ų187142.6 Ų142.687%0.86679%0.787SS**  trans16.7143.6150.9-68.81.4000124.5
157A29.1Very low34.7Very low100 Ų100139.1 Ų139.183%0.82678%0.776SS**  -171.1149.2112.700000115.6
158I35.6Very low34.6Very low153 Ų153139 Ų13979%0.78578%0.775SS**  trans-58.8151.5-178.737.4170.1000120.7
159E33.1Very low34.8Very low179 Ų179139.6 Ų139.684%0.83678%0.776SS**  trans64.5129.1130.9-163.6163.7-136.200123
160E28.8Very low34.8Very low183 Ų183140.2 Ų140.286%0.85578%0.781SS**  171.5158116.4-168.3159.8-148.800112.4
161V36.6Very low35.2Very low130 Ų130142.2 Ų142.279%0.78878%0.782SS**  trans-132.2134-177.6176.10000111.5
162P40.3Very low35.5Very low119 Ų119141.6 Ų141.677%0.77379%0.787SS**  trans-136.1132.2136.326.5-8.7000111.7
163H29.9Very low35.4Very low167 Ų167139.6 Ų139.677%0.77378%0.783SS**  81100.868.9-155.679.5000115.5
164V36.9Very low35.6Very low109 Ų109143 Ų14366%0.66179%0.789SS**  trans52.7123141.8-176.10000120.2
165E32.6Very low35.7Very low186 Ų186141.1 Ų141.187%0.86978%0.783SS**  -169.1143111.3-98.2-173.9153.100111.6
166D38.3Very low35.1Very low147 Ų147141.8 Ų141.879%0.78679%0.785SS**  trans-102.4137163.9171.842.5000106.9
167P44Very low35.3Very low119 Ų119139.5 Ų139.577%0.77378%0.778SS**  -150.1155.4113.736.8-21.4000114.9
168G30.3Very low35.6Very low69 Ų69143.5 Ų143.571%0.71178%0.777SS**  trans157.377.3149.200000118N170G168-N170 PolarHBondContact O-N 3.09Å
169I38.4Very low35.6Very low155 Ų155146.1 Ų146.180%0.79578%0.782SS**  trans-63.6129.9162.7-67.2165.5000109.6
170N32.7Very low35.5Very low155 Ų155140.9 Ų140.983%0.82978%0.777SS**  trans-149.7132.8152.1-124.9-97000112.5G168G168-N170 PolarHBondContact O-N 3.09Å
171I39.9Very low36.5Very low138 Ų138138.3 Ų138.371%0.70878%0.776SS**  trans-115.7138.9175.5-61.5165000106.2
172P45.3Very low36.3Very low126 Ų126138.6 Ų138.682%0.81878%0.778SS**  -130149.2126.811.68.8000113
173D33.5Very low36.2Very low144 Ų144138.6 Ų138.677%0.7778%0.781SS**  trans-114.7174.9175.8-173.916.7000109.6
174Q33Very low36.3Very low167 Ų167138.9 Ų138.978%0.7879%0.787SS**  trans77.8142-176.9-43.4179.318.800114
175T34.9Very low36.1Very low119 Ų119138.7 Ų138.773%0.7379%0.791SS**  cis-144.112820.350.90000111.2
176V30.7Very low36Very low125 Ų125139.6 Ų139.676%0.75879%0.792SS**  72.5108.389.51770000118.1
177I37.8Very low35.6Very low140 Ų140137.6 Ų137.672%0.71879%0.789SS**  trans93.2113.7143.1-72.8171.8000124.4
178K35.5Very low34.9Very low183 Ų183139.2 Ų139.280%0.79679%0.791SS**  trans41.4122.3139.6-55.5174.5-175.9172.20122.6
179K34.5Very low35Very low208 Ų208139.9 Ų139.990%0.90479%0.785SS**  179.8156.9102.7-96.2171.5-178.1177.80111.2
180G31.3Very low34.9Very low70 Ų70140.1 Ų140.172%0.72279%0.788SS**  trans-92.9-148.9179.300000114
181P49.5Very low35Very low129 Ų129137.3 Ų137.384%0.83879%0.786SS**  -121.8147.7-78.537-30.2000112.5
182V32.5Very low35Very low136 Ų136137.7 Ų137.782%0.82479%0.794SS**  trans-147.2129.4167.3-1570000111.3
183S38Very low34.4Very low119 Ų119137.1 Ų137.183%0.83279%0.793SS**  trans-78.9140.9168.1-640000111.1
184L31.7Very low34.7Very low173 Ų173134.5 Ų134.591%0.90679%0.792SS**  trans-142.1131.5160-101.4145.2000110
185S33.4Very low35.1Very low105 Ų105133.7 Ų133.773%0.73479%0.791SS**  trans-106.7138.7-171.749.70000111.7
186K31.5Very low35.1Very low205 Ų205133.4 Ų133.489%0.89179%0.792SS**  trans-178.3130.9136.1-105.1163.5-177.9177.40113.9
187S28.9Very low35.7Very low105 Ų105135 Ų13573%0.73479%0.794SS**  trans52.1115.3134.3-170.70000120.3
188N28.7Very low35.4Very low152 Ų152135 Ų13581%0.81380%0.796SS**  -164.3-177.984.9-1507.8000112.7
189S34.3Very low35.5Very low84 Ų84135.4 Ų135.459%0.58780%0.798SS**  trans-73.5169.5-167.650.20000118.2
190N34.7Very low35.6Very low159 Ų159132.3 Ų132.385%0.8579%0.791SS**  trans67.885.9160-65-2.2000118.9
191A34.7Very low35.5Very low96 Ų96136.6 Ų136.679%0.79380%0.797SS**  trans-141.1126.7146.700000110.1
192V40.9Very low35.4Very low146 Ų146138.2 Ų138.289%0.88580%0.798SS**  trans-66.7133.3168-1800000107.7A194V192-A194 VanDerWaalsContact C-N 3.33Å; V192-A194 PolarHBondContact O-N 3.45Å
193S33.4Very low35.8Very low114 Ų114141.2 Ų141.280%0.79780%0.8SS**  trans-65.281.6-169-49.40000114.1I195S193-I195 PolarHBondContact O-N 3.34Å
194A38.6Very low36Very low90 Ų90138.4 Ų138.474%0.74479%0.791SS**  trans-61.7120.1156.500000107.9V192 P196V192-A194 VanDerWaalsContact C-N 3.33Å; V192-A194 PolarHBondContact O-N 3.45Å; A194-P196 VanDerWaalsContact O-CD 3.28Å; A194-P196 WeakPolarHBondContact O-CD 3.43Å
195I42.1Very low36.7Very low149 Ų149133.1 Ų133.176%0.76478%0.777SS**  trans-65.2118.6178.6-62.3175.7000107.8S193 I197S193-I195 PolarHBondContact O-N 3.34Å; I195-I197 PolarHBondContact O-N 3.09Å; I195-I197 VanDerWaalsContact O-N 3.13Å
196P34.9Very low37.6Very low113 Ų113135.4 Ų135.473%0.73479%0.787SS**  trans-70.2114171.525.8-25.5000107.8A194 N198A194-P196 VanDerWaalsContact O-CD 3.28Å; A194-P196 WeakPolarHBondContact O-CD 3.43Å; P196-N198 PolarHBondContact O-N 2.89Å
197I43.8Very low39.5Very low159 Ų159127.3 Ų127.382%0.81576%0.755SS**  trans-64.3102.9168.8-64.8174.4000106.4I195 K199I195-I197 PolarHBondContact O-N 3.09Å; I195-I197 VanDerWaalsContact O-N 3.13Å; I197-K199 PolarHBondContact O-N 2.74Å
198N30Very low42.2Very low141 Ų141126.5 Ų126.575%0.75474%0.742SS**  trans-68.1106.5179.9-154.2-8.1000108.1P196 D200P196-N198 PolarHBondContact O-N 2.89Å; N198-D200 PolarHBondContact O-N 3.11Å
199K38.1Very low44.9Very low191 Ų191121.8 Ų121.883%0.8372%0.72SS**SBendtrans-82.847-168.3-165.8-166.2169.4-178.60111.7I197I197-K199 PolarHBondContact O-N 2.74Å
200D35.9Very low47.4Very low143 Ų143121.5 Ų121.577%0.76571%0.712SS**  trans-145.458.5-178.3-81.4-52.5000111.7N198N198-D200 PolarHBondContact O-N 3.11Å
201N30.7Very low50.1Low160 Ų160118.7 Ų118.786%0.85669%0.693SS**  trans-139.368.7166.1-113.6113.1000110.8F203N201-F203 PolarHBondContact O-N 3.44Å
202L46.4Very low53Low162 Ų162116.9 Ų116.985%0.84867%0.672SS**  trans-66.593170.4178.367.4000110
203F41.8Very low55.6Low199 Ų199111.8 Ų111.887%0.87364%0.638SS**  trans167.5122.1141.6-108-85.2000110N201N201-F203 PolarHBondContact O-N 3.44Å
204G40.8Very low58.5Low61 Ų61108.2 Ų108.263%0.62961%0.613SS**  trans140.6112.7178.400000110.9
205G46.3Very low61.3Low61 Ų61107.4 Ų107.463%0.62960%0.602SS**  trans-61.5142.3-175.300000112.5V207G205-V207 WeakPolarHBondContact O-CG2 3.38Å; G205-V207 PolarHBondContact O-N 2.97Å
206V53.1Low63.8Low154 Ų154100.4 Ų100.493%0.93357%0.566SS**  trans-67.198.6172.9-1790000108.1
207V71.8Confident66.6Low35 Ų3598.2 Ų98.221%0.21255%0.551CS.*  trans-78.2138.5-179.8-174.30000110G205 P209 E211 V233 I274G205-V207 WeakPolarHBondContact O-CG2 3.38Å; G205-V207 PolarHBondContact O-N 2.97Å; V207-P209 WeakPolarHBondContact O-CD 3.23Å; V207-E211 WeakPolarHBondContact CG1-OE2 3.42Å; V207-V233 HydrophobicContact CG1-CG2 4.24Å; V207-I274 HydrophobicContact CB-CB 4.35Å; V207-I274 HydrophobicContact CG1-CB 4.15Å; V207-I274 HydrophobicContact CG1-CG2 4.34Å; V207-I274 HydrophobicContact CG2-CB 3.91Å; V207-I274 HydrophobicContact CG2-CG2 4.45Å; V207-I274 WeakPolarHBondContact CG2-O 3.45Å
208N84.5Confident69Low87 Ų8791.3 Ų91.347%0.46552%0.52SS..  trans-63.5118-179.5-176.7-6.8000109.2N210 E211N208-N210 PolarHBondContact O-N 2.98Å; N208-N210 VanDerWaalsContact OD1-CB 3.3Å; N208-N210 WeakPolarHBondContact OD1-CB 3.49Å; N208-N210 PolarHBondContact OD1-N 3.4Å; N208-N210 VanDerWaalsContact OD1-N 3.11Å; N208-N210 PolarHBondContact OD1-ND2 3.26Å; N208-E211 HydrophobicContact CB-CB 4.38Å; N208-E211 VanDerWaalsContact O-CB 3.23Å; N208-E211 WeakPolarHBondContact O-CB 3.4Å; N208-E211 PolarHBondContact O-N 3.34Å
209P85.9Confident72Confident54 Ų5489.4 Ų89.435%0.35150%0.502SS..THydrogen-bonded Turntrans-61.1-21.9-178.524.1-34.2000112.6V207 E211 A234V207-P209 WeakPolarHBondContact O-CD 3.23Å; P209-E211 VanDerWaalsContact C-N 3.32Å; P209-A234 HydrophobicContact CB-CB 4.09Å; P209-A234 VanDerWaalsContact O-CB 3.28Å; P209-A234 WeakPolarHBondContact O-CB 3.39Å; P209-A234 PolarHBondContact O-N 3.37Å
210N86.8Confident74.5Confident78 Ų7885.9 Ų85.942%0.41749%0.491SS..THydrogen-bonded Turntrans-80.8-9.1178-51.8-51.5000113.5N208 N363N208-N210 PolarHBondContact O-N 2.98Å; N208-N210 VanDerWaalsContact OD1-CB 3.3Å; N208-N210 WeakPolarHBondContact OD1-CB 3.49Å; N208-N210 PolarHBondContact OD1-N 3.4Å; N208-N210 VanDerWaalsContact OD1-N 3.11Å; N208-N210 PolarHBondContact OD1-ND2 3.26Å; N210-N363 WeakPolarHBondContact OD1-CB 3.29Å; N210-N363 PolarHBondContact OD1-ND2 3.24Å; N210-N363 VanDerWaalsContact OD1-ND2 3.16Å
211E92.3Very high76.9Confident99 Ų9980.7 Ų80.746%0.46347%0.466SS..SBendtrans-64.4143.4178.9-171.4177.4162.600111.1V207 N208 P209 F213 T232 V233V207-E211 WeakPolarHBondContact CG1-OE2 3.42Å; N208-E211 HydrophobicContact CB-CB 4.38Å; N208-E211 VanDerWaalsContact O-CB 3.23Å; N208-E211 WeakPolarHBondContact O-CB 3.4Å; N208-E211 PolarHBondContact O-N 3.34Å; P209-E211 VanDerWaalsContact C-N 3.32Å; E211-F213 PolarHBondContact O-N 2.92Å; E211-T232 CarbonylContact O-C 3.49Å; E211-T232 VanDerWaalsContact O-CA 3.23Å; E211-T232 WeakPolarHBondContact O-CA 3.46Å; E211-V233 HydrophobicContact CB-CG2 4.03Å; E211-V233 PolarHBondContact O-N 3.3Å
212V94.4Very high79.5Confident58 Ų5879.3 Ų79.335%0.35246%0.458SS..EExtended strand (participates in β ladder)trans-82.5108.5177.9-178.90000109.1C214 K230 V231V212-C214 VanDerWaalsContact CG1-O 3.31Å; V212-C214 WeakPolarHBondContact CG1-O 3.38Å; V212-K230 HydrophobicContact CG1-CB 3.98Å; V212-K230 HydrophobicContact CG1-CG 4.15Å; V212-K230 HydrophobicContact CG2-CB 4.05Å; V212-K230 HydrophobicContact CG2-CD 3.92Å; V212-K230 HydrophobicContact CG2-CG 4.12Å; V212-V231 CarbonylContact C-O 3.33Å
213F95.1Very high81.1Confident40 Ų4079.7 Ų79.718%0.17546%0.46CS..EExtended strand (participates in β ladder)trans-66.8-41.6176.8-178.2-109.7000112.1E211 V231 V233 V236 L255 L267 K270 L271 I274E211-F213 PolarHBondContact O-N 2.92Å; F213-V231 PolarHBondContact N-O 3.02Å; F213-V233 HydrophobicContact CB-CG2 4.41Å; F213-V236 HydrophobicContact CB-CG2 4.14Å; F213-V236 HydrophobicContact CD1-CG2 3.81Å; F213-V236 HydrophobicContact CE1-CG2 4.47Å; F213-V236 HydrophobicContact CG-CG2 4.05Å; F213-L255 HydrophobicContact CD1-CD1 4.29Å; F213-L255 HydrophobicContact CD1-CD2 4.21Å; F213-L255 HydrophobicContact CE1-CD1 3.75Å; F213-L255 HydrophobicContact CE1-CD2 4.48Å; F213-L267 HydrophobicContact CE1-CD1 4.23Å; F213-L267 HydrophobicContact CZ-CD1 4.15Å; F213-K270 HydrophobicContact CE2-CB 4.35Å; F213-K270 HydrophobicContact CZ-CB 4.21Å; F213-L271 HydrophobicContact CE1-CD2 4.42Å; F213-L271 HydrophobicContact CE2-CD2 3.98Å; F213-L271 HydrophobicContact CZ-CD2 3.75Å; F213-L271 HydrophobicContact CZ-CG 4.34Å; F213-I274 HydrophobicContact CD2-CD1 3.53Å; F213-I274 HydrophobicContact CE2-CD1 3.71Å; F213-I274 HydrophobicContact CE2-CG1 4.39Å
214C95.5Very high82.9Confident38 Ų3875.6 Ų75.626%0.25746%0.457SS..EExtended strand (participates in β ladder)trans-161168.8166.367.40000111.3V212 V231V212-C214 VanDerWaalsContact CG1-O 3.31Å; V212-C214 WeakPolarHBondContact CG1-O 3.38Å; C214-V231 PolarHBondContact N-O 3.45Å; C214-V231 PolarHBondContact O-N 2.82Å
215S96.6Very high84.7Confident73 Ų7376.4 Ų76.451%0.5145%0.452SS..EExtended strand (participates in β ladder)trans-104.1137.7163.4-62.40000109.8Y229S215-Y229 CarbonylContact C-O 3.57Å; S215-Y229 VanDerWaalsContact CA-O 3.31Å; S215-Y229 WeakPolarHBondContact CA-O 3.46Å
216V95.8Very high86.3Confident3 Ų377.5 Ų77.52%0.01845%0.447CS..EExtended strand (participates in β ladder)trans-118.1145.5176.7-59.40000110.1K228 Y229 V231 R256 V295V216-K228 CarbonylContact O-C 3.59Å; V216-K228 VanDerWaalsContact O-CA 3.31Å; V216-K228 WeakPolarHBondContact O-CA 3.44Å; V216-Y229 PolarHBondContact N-O 3.43Å; V216-Y229 PolarHBondContact O-N 2.94Å; V216-V231 HydrophobicContact CG1-CG2 4.04Å; V216-V231 HydrophobicContact CG2-CG2 3.98Å; V216-R256 HydrophobicContact CB-CG 4.47Å; V216-V295 HydrophobicContact CG2-CG1 4.1Å; V216-V295 HydrophobicContact CG2-CG2 3.96Å
217P93.6Very high87.9Confident66 Ų6672.4 Ų72.443%0.42942%0.418SS..EExtended strand (participates in β ladder)trans-60.8165166.727.4-35.6000110.8S227 R256P217-S227 CarbonylContact C-O 3.11Å; P217-S227 WeakPolarHBondContact CA-O 3.31Å; P217-R256 PolarHBondContact O-NE 3.36Å; P217-R256 VanDerWaalsContact O-NE 3.08Å; P217-R256 PolarHBondContact O-NH1 3.33Å; P217-R256 PolarHBondContact O-NH2 3.35Å
218G93.4Very high88.9Confident14 Ų1478.7 Ų78.714%0.14444%0.443CS..  trans-76.2152.1171.400000113.6S227 R256 E298G218-S227 PolarHBondContact N-O 3.17Å; G218-R256 PolarHBondContact O-NH1 2.98Å; G218-E298 WeakPolarHBondContact CA-OE1 3.38Å
219R92.6Very high89.5Confident101 Ų10176 Ų7638%0.38143%0.427SS..SBendtrans-87-37.3173-71.7-160.5-161.1-86.4-5.9110.8S221 G253 R256 S293 E298R219-S221 VanDerWaalsContact C-N 3.34Å; R219-G253 PolarHBondContact NH2-O 3.32Å; R219-R256 VanDerWaalsContact CG-CZ 3.49Å; R219-S293 VanDerWaalsContact CZ-O 3.26Å; R219-S293 PolarHBondContact NE-O 3.16Å; R219-S293 PolarHBondContact NH2-O 2.91Å; R219-E298 PolarHBondContact N-OE1 3.47Å
220L90.5Very high89.9Confident117 Ų11780.6 Ų80.661%0.61344%0.441SS*.SBendtrans-94.25.3-177.5-52.2-179.5000112L294 L302L220-L294 HydrophobicContact CD1-CD2 4.32Å; L220-L302 HydrophobicContact CD1-CD1 4.04Å; L220-L302 HydrophobicContact CD1-CD2 4.07Å; L220-L302 HydrophobicContact CD1-CG 4.5Å
221S86.6Confident90.4Very high34 Ų3476.9 Ų76.924%0.23842%0.421CS..  trans-80.3131.2176.7-69.80000111.4R219 S225 S227R219-S221 VanDerWaalsContact C-N 3.34Å; S221-S225 WeakPolarHBondContact CB-O 3.19Å; S221-S225 PolarHBondContact OG-O 3.43Å; S221-S227 WeakPolarHBondContact OG-CB 3.31Å; S221-S227 PolarHBondContact OG-N 3.3Å
222L86.4Confident90.5Very high132 Ų13273.1 Ų73.169%0.69141%0.405SS*.  trans-77.6160.7166.9-60.8179000110.8S224 S225 T226L222-S224 VanDerWaalsContact C-N 3.32Å; L222-S224 PolarHBondContact O-N 3.03Å; L222-S225 CarbonylContact O-C 3.44Å; L222-S225 VanDerWaalsContact O-C 3.25Å; L222-S225 PolarHBondContact O-N 3.32Å; L222-T226 PolarHBondContact O-N 3.26Å
223L80.3Confident90.5Very high169 Ų16970.5 Ų70.589%0.88539%0.389SS*.G310 helixtrans-51.6-46.4-173.2-64.7171.7000113.3S225 T226L223-S225 VanDerWaalsContact C-N 3.3Å; L223-S225 PolarHBondContact O-N 2.88Å; L223-T226 PolarHBondContact O-OG1 3.31Å
224S78.1Confident90.4Very high114 Ų11468.7 Ų68.780%0.79738%0.381SS*.G310 helixtrans-71.6-19.4178.949.40000114.5L222L222-S224 VanDerWaalsContact C-N 3.32Å; L222-S224 PolarHBondContact O-N 3.03Å
225S78.6Confident90.5Very high77 Ų7767 Ų6754%0.53837%0.37SS..G310 helixtrans-121.846.7-175.5-54.80000110.7S221 L222 L223 S227S221-S225 WeakPolarHBondContact CB-O 3.19Å; S221-S225 PolarHBondContact OG-O 3.43Å; L222-S225 CarbonylContact O-C 3.44Å; L222-S225 VanDerWaalsContact O-C 3.25Å; L222-S225 PolarHBondContact O-N 3.32Å; L223-S225 VanDerWaalsContact C-N 3.3Å; L223-S225 PolarHBondContact O-N 2.88Å; S225-S227 PolarHBondContact O-N 3.11Å
226T81Confident90.4Very high85 Ų8563.6 Ų63.652%0.52135%0.346SS..  trans-69.590.6-177.4-64.10000111.1L222 L223L222-T226 PolarHBondContact O-N 3.26Å; L223-T226 PolarHBondContact O-OG1 3.31Å
227S86.8Confident90.3Very high47 Ų4768 Ų6833%0.32937%0.366SS..  trans-71.2144.8172.3-56.90000110.9P217 G218 S221 S225P217-S227 CarbonylContact C-O 3.11Å; P217-S227 WeakPolarHBondContact CA-O 3.31Å; G218-S227 PolarHBondContact N-O 3.17Å; S221-S227 WeakPolarHBondContact OG-CB 3.31Å; S221-S227 PolarHBondContact OG-N 3.3Å; S225-S227 PolarHBondContact O-N 3.11Å
228K93Very high90.3Very high167 Ų16765.7 Ų65.773%0.72635%0.349SS*.EExtended strand (participates in β ladder)trans-115.1126.1168.3-70.3177.3-176.5169.10109.5V216V216-K228 CarbonylContact O-C 3.59Å; V216-K228 VanDerWaalsContact O-CA 3.31Å; V216-K228 WeakPolarHBondContact O-CA 3.44Å
229Y95.3Very high90.3Very high31 Ų3165.1 Ų65.112%0.12234%0.342CS..EExtended strand (participates in β ladder)trans-103.8130.2-178.1-66.7-83.8000110.4S215 V216 V295 G297 E298 H301S215-Y229 CarbonylContact C-O 3.57Å; S215-Y229 VanDerWaalsContact CA-O 3.31Å; S215-Y229 WeakPolarHBondContact CA-O 3.46Å; V216-Y229 PolarHBondContact N-O 3.43Å; V216-Y229 PolarHBondContact O-N 2.94Å; Y229-V295 HydrophobicContact CG-CG2 4.27Å; Y229-G297 VanDerWaalsContact CD1-C 3.43Å; Y229-G297 VanDerWaalsContact CE1-C 3.47Å; Y229-G297 WeakPolarHBondContact CE1-O 3.29Å; Y229-E298 HydrophobicContact CD1-CG 4.05Å; Y229-E298 HydrophobicContact CD2-CG 3.46Å; Y229-E298 VanDerWaalsContact CD2-CG 3.46Å; Y229-E298 HydrophobicContact CE1-CG 4.04Å; Y229-E298 HydrophobicContact CE2-CG 3.47Å; Y229-E298 VanDerWaalsContact CE2-CG 3.47Å; Y229-E298 HydrophobicContact CG-CG 3.76Å; Y229-H301 HydrophobicContact CE1-CB 4.4Å; Y229-H301 AromaticContact CE1-CE1 3.91Å; Y229-H301 AromaticContact CE1-CG 3.91Å; Y229-H301 AromaticContact CE1-ND1 3.46Å; Y229-H301 WeakPolarHBondContact CE1-ND1 3.5Å; Y229-H301 AromaticContact CZ-ND1 3.81Å; Y229-H301 PolarHBondContact OH-ND1 3.43Å
230K95.6Very high90.3Very high149 Ų14960.9 Ų60.965%0.64833%0.327SS*.EExtended strand (participates in β ladder)trans-78.8123.3173.7-66.8173.3176.7178.90108.6V212V212-K230 HydrophobicContact CG1-CB 3.98Å; V212-K230 HydrophobicContact CG1-CG 4.15Å; V212-K230 HydrophobicContact CG2-CB 4.05Å; V212-K230 HydrophobicContact CG2-CD 3.92Å; V212-K230 HydrophobicContact CG2-CG 4.12Å
231V96.4Very high90.4Very high1 Ų157.6 Ų57.61%0.00631%0.314CS..EExtended strand (participates in β ladder)trans-98.6119.4171.6-178.30000107.5V212 F213 C214 V216 E235 V236 L255 V295V212-V231 CarbonylContact C-O 3.33Å; F213-V231 PolarHBondContact N-O 3.02Å; C214-V231 PolarHBondContact N-O 3.45Å; C214-V231 PolarHBondContact O-N 2.82Å; V216-V231 HydrophobicContact CG1-CG2 4.04Å; V216-V231 HydrophobicContact CG2-CG2 3.98Å; V231-E235 HydrophobicContact CG1-CB 4.33Å; V231-E235 HydrophobicContact CG1-CG 4.21Å; V231-V236 HydrophobicContact CG1-CG2 3.85Å; V231-L255 HydrophobicContact CB-CD2 4.31Å; V231-L255 HydrophobicContact CG1-CD2 3.82Å; V231-L255 HydrophobicContact CG2-CD2 4.36Å; V231-V295 HydrophobicContact CG2-CB 4.08Å; V231-V295 HydrophobicContact CG2-CG1 3.67Å; V231-V295 HydrophobicContact CG2-CG2 4.38Å
232T95.3Very high90.6Very high19 Ų1960.5 Ų60.512%0.11733%0.332CS..EExtended strand (participates in β ladder)trans-87.2161.5-176.962.20000112.4E211 A234 E235 V236 N363E211-T232 CarbonylContact O-C 3.49Å; E211-T232 VanDerWaalsContact O-CA 3.23Å; E211-T232 WeakPolarHBondContact O-CA 3.46Å; T232-A234 PolarHBondContact O-N 3.29Å; T232-E235 PolarHBondContact O-N 2.79Å; T232-E235 PolarHBondContact OG1-N 3.14Å; T232-V236 WeakPolarHBondContact O-CG2 3.44Å; T232-V236 PolarHBondContact O-N 3.18Å; T232-V236 VanDerWaalsContact O-N 3.07Å; T232-N363 PolarHBondContact OG1-OD1 2.74Å
233V94.3Very high90.9Very high4 Ų455 Ų552%0.02430%0.304CS..Hα-helixtrans-56-39.1168.9172.60000110.6V207 E211 F213 V236 Q237 I274 L276V207-V233 HydrophobicContact CG1-CG2 4.24Å; E211-V233 HydrophobicContact CB-CG2 4.03Å; E211-V233 PolarHBondContact O-N 3.3Å; F213-V233 HydrophobicContact CB-CG2 4.41Å; V233-V236 PolarHBondContact O-N 2.85Å; V233-Q237 WeakPolarHBondContact O-CB 3.38Å; V233-Q237 PolarHBondContact O-N 2.9Å; V233-I274 HydrophobicContact CG1-CD1 4.15Å; V233-I274 HydrophobicContact CG2-CD1 3.86Å; V233-L276 HydrophobicContact CG1-CD1 4.22Å
234A93.6Very high91.5Very high1 Ų147.2 Ų47.21%0.00826%0.263CS..Hα-helixtrans-58.9-46.7174.400000113.4P209 T232 Q237 R238 G362P209-A234 HydrophobicContact CB-CB 4.09Å; P209-A234 VanDerWaalsContact O-CB 3.28Å; P209-A234 WeakPolarHBondContact O-CB 3.39Å; P209-A234 PolarHBondContact O-N 3.37Å; T232-A234 PolarHBondContact O-N 3.29Å; A234-Q237 PolarHBondContact O-N 3.22Å; A234-R238 VanDerWaalsContact O-CB 3.3Å; A234-R238 WeakPolarHBondContact O-CB 3.38Å; A234-R238 PolarHBondContact O-N 2.71Å; A234-G362 WeakPolarHBondContact CB-O 3.33Å
235E95.8Very high92.2Very high4 Ų442.7 Ų42.72%0.01923%0.231CC..Hα-helixtrans-60.7-49.7175172.6170.6-170.700110.1V231 T232 Q237 R238 R239 V295 E296V231-E235 HydrophobicContact CG1-CB 4.33Å; V231-E235 HydrophobicContact CG1-CG 4.21Å; T232-E235 PolarHBondContact O-N 2.79Å; T232-E235 PolarHBondContact OG1-N 3.14Å; E235-Q237 VanDerWaalsContact C-N 3.34Å; E235-Q237 PolarHBondContact O-N 3.37Å; E235-R238 WeakPolarHBondContact O-CB 3.4Å; E235-R238 PolarHBondContact O-N 3.18Å; E235-R239 HydrophobicContact CG-CG 4.35Å; E235-R239 VanDerWaalsContact O-CG 3.27Å; E235-R239 WeakPolarHBondContact O-CG 3.39Å; E235-R239 PolarHBondContact O-N 2.88Å; E235-R239 IonicContact OE1-NH1 3.72Å; E235-R239 PolarHBondContact OE1-NH1 3.45Å; E235-V295 VanDerWaalsContact OE1-CA 3.28Å; E235-V295 WeakPolarHBondContact OE1-CA 3.44Å; E235-V295 WeakPolarHBondContact OE1-CB 3.41Å; E235-E296 WeakPolarHBondContact CB-OE1 3.41Å; E235-E296 HydrophobicContact CG-CG 4.23Å; E235-E296 WeakPolarHBondContact CG-OE1 3.34Å; E235-E296 PolarHBondContact OE1-N 2.93Å; E235-E296 VanDerWaalsContact OE1-N 3.1Å; E235-E296 PolarHBondContact OE2-N 2.92Å
236V95.2Very high92.9Very high1 Ų139.2 Ų39.21%0.00621%0.206CC..Hα-helixtrans-57.8-47.8-179.7176.40000111F213 V231 T232 V233 R238 R239 L240 L251 L255 L271 L276F213-V236 HydrophobicContact CB-CG2 4.14Å; F213-V236 HydrophobicContact CD1-CG2 3.81Å; F213-V236 HydrophobicContact CE1-CG2 4.47Å; F213-V236 HydrophobicContact CG-CG2 4.05Å; V231-V236 HydrophobicContact CG1-CG2 3.85Å; T232-V236 WeakPolarHBondContact O-CG2 3.44Å; T232-V236 PolarHBondContact O-N 3.18Å; T232-V236 VanDerWaalsContact O-N 3.07Å; V233-V236 PolarHBondContact O-N 2.85Å; V236-R238 PolarHBondContact O-N 3.26Å; V236-R239 PolarHBondContact O-N 3.31Å; V236-L240 HydrophobicContact CG1-CD1 4.5Å; V236-L240 WeakPolarHBondContact O-CG 2.89Å; V236-L240 PolarHBondContact O-N 2.95Å; V236-L240 VanDerWaalsContact O-N 3.15Å; V236-L251 HydrophobicContact CG1-CD2 4.06Å; V236-L255 HydrophobicContact CG2-CD2 4.5Å; V236-L271 HydrophobicContact CG1-CD2 3.5Å; V236-L271 VanDerWaalsContact CG1-CD2 3.5Å; V236-L276 HydrophobicContact CB-CD1 4.26Å; V236-L276 HydrophobicContact CG1-CD1 3.85Å
237Q93.4Very high93.3Very high96 Ų9637.2 Ų37.245%0.44919%0.193SC..Hα-helixtrans-59.4-47.2178.3-172.1171.929.100111.7V233 A234 E235 R239 L240 S241 L276V233-Q237 WeakPolarHBondContact O-CB 3.38Å; V233-Q237 PolarHBondContact O-N 2.9Å; A234-Q237 PolarHBondContact O-N 3.22Å; E235-Q237 VanDerWaalsContact C-N 3.34Å; E235-Q237 PolarHBondContact O-N 3.37Å; Q237-R239 VanDerWaalsContact C-N 3.28Å; Q237-R239 PolarHBondContact O-N 2.94Å; Q237-L240 PolarHBondContact O-N 3.4Å; Q237-L240 VanDerWaalsContact O-N 3.12Å; Q237-S241 PolarHBondContact O-N 2.86Å; Q237-S241 VanDerWaalsContact O-N 3.16Å; Q237-S241 PolarHBondContact O-OG 2.83Å; Q237-L276 HydrophobicContact CB-CD1 4.1Å; Q237-L276 HydrophobicContact CB-CD2 3.88Å; Q237-L276 HydrophobicContact CG-CD2 3.71Å
238R94.1Very high93.5Very high17 Ų1735.6 Ų35.66%0.06418%0.182CC..Hα-helixtrans-55.4-41.3176.7-177.4-165.265.274-11.7112.3A234 E235 V236 L240 S241 E244 E296 L383 H386A234-R238 VanDerWaalsContact O-CB 3.3Å; A234-R238 WeakPolarHBondContact O-CB 3.38Å; A234-R238 PolarHBondContact O-N 2.71Å; E235-R238 WeakPolarHBondContact O-CB 3.4Å; E235-R238 PolarHBondContact O-N 3.18Å; V236-R238 PolarHBondContact O-N 3.26Å; R238-L240 VanDerWaalsContact C-N 3.34Å; R238-S241 VanDerWaalsContact C-OG 3.31Å; R238-S241 WeakPolarHBondContact CA-OG 3.43Å; R238-S241 PolarHBondContact O-N 2.83Å; R238-S241 PolarHBondContact O-OG 3.5Å; R238-E244 IonicContact CZ-OE2 3.98Å; R238-E244 IonicContact NH1-OE2 3.04Å; R238-E244 PolarHBondContact NH1-OE2 3.02Å; R238-E244 IonicContact NH2-OE2 3.15Å; R238-E296 IonicContact CZ-OE1 3.24Å; R238-E296 VanDerWaalsContact CZ-OE1 3.27Å; R238-E296 IonicContact NE-OE1 3.65Å; R238-E296 PolarHBondContact NE-OE1 3.37Å; R238-E296 IonicContact NH2-OE1 3.63Å; R238-E296 PolarHBondContact NH2-OE1 3.22Å; R238-L383 VanDerWaalsContact CD-CD2 3.42Å; R238-L383 HydrophobicContact CG-CD2 3.71Å; R238-L383 PolarHBondContact NH1-O 3.49Å; R238-L383 VanDerWaalsContact NH1-O 3.09Å; R238-H386 PolarHBondContact NH2-ND1 3.35Å
239R94.3Very high93.3Very high1 Ų132.4 Ų32.40%0.00418%0.181CC..Hα-helixtrans-77.7-18.6-178.2-60-170.185.7164-3.3113.4E235 V236 Q237 E244 L246 V254 T292 L294 H386E235-R239 HydrophobicContact CG-CG 4.35Å; E235-R239 VanDerWaalsContact O-CG 3.27Å; E235-R239 WeakPolarHBondContact O-CG 3.39Å; E235-R239 PolarHBondContact O-N 2.88Å; E235-R239 IonicContact OE1-NH1 3.72Å; E235-R239 PolarHBondContact OE1-NH1 3.45Å; V236-R239 PolarHBondContact O-N 3.31Å; Q237-R239 VanDerWaalsContact C-N 3.28Å; Q237-R239 PolarHBondContact O-N 2.94Å; R239-E244 WeakPolarHBondContact CG-OE2 3.39Å; R239-E244 IonicContact CZ-OE1 3.37Å; R239-E244 IonicContact CZ-OE2 3.88Å; R239-E244 IonicContact NE-OE1 3.79Å; R239-E244 PolarHBondContact NE-OE1 3.37Å; R239-E244 IonicContact NE-OE2 2.74Å; R239-E244 PolarHBondContact NE-OE2 3.5Å; R239-E244 IonicContact NH2-OE1 2.8Å; R239-E244 PolarHBondContact NH2-OE1 3.2Å; R239-L246 HydrophobicContact CB-CD1 3.97Å; R239-L246 HydrophobicContact CB-CG 4.25Å; R239-L246 WeakPolarHBondContact O-CB 3.35Å; R239-L246 PolarHBondContact O-N 3.07Å; R239-V254 VanDerWaalsContact NH1-CG1 3.34Å; R239-T292 PolarHBondContact NH2-O 3.24Å; R239-L294 PolarHBondContact NH1-O 3.34Å; R239-H386 PolarHBondContact NH2-CE1 2.87Å; R239-H386 PolarHBondContact NH2-NE2 2.93Å
240L92.6Very high93.2Very high13 Ų1333.4 Ų33.47%0.06819%0.188CC..Hα-helixtrans-81.3-27.5170.3-65.6-173.7000112.8V236 Q237 R238 L246 L251 L271 L278 R282V236-L240 HydrophobicContact CG1-CD1 4.5Å; V236-L240 WeakPolarHBondContact O-CG 2.89Å; V236-L240 PolarHBondContact O-N 2.95Å; V236-L240 VanDerWaalsContact O-N 3.15Å; Q237-L240 PolarHBondContact O-N 3.4Å; Q237-L240 VanDerWaalsContact O-N 3.12Å; R238-L240 VanDerWaalsContact C-N 3.34Å; L240-L246 WeakPolarHBondContact CD2-O 3.43Å; L240-L251 HydrophobicContact CD2-CD2 3.87Å; L240-L251 HydrophobicContact CG-CD2 4.48Å; L240-L271 HydrophobicContact CD1-CD1 4.35Å; L240-L278 HydrophobicContact CD1-CB 4.41Å; L240-L278 HydrophobicContact CD2-CD1 3.79Å; L240-L278 HydrophobicContact CD2-CD2 4.02Å; L240-L278 HydrophobicContact CD2-CG 4.38Å; L240-R282 PolarHBondContact O-NH1 3.49Å
241S91.6Very high93.1Very high48 Ų4826.4 Ų26.434%0.33616%0.158SC..SBendtrans-80.4169.817147.50000113.2Q237 R238 E244 C245Q237-S241 PolarHBondContact O-N 2.86Å; Q237-S241 VanDerWaalsContact O-N 3.16Å; Q237-S241 PolarHBondContact O-OG 2.83Å; R238-S241 VanDerWaalsContact C-OG 3.31Å; R238-S241 WeakPolarHBondContact CA-OG 3.43Å; R238-S241 PolarHBondContact O-N 2.83Å; R238-S241 PolarHBondContact O-OG 3.5Å; S241-E244 PolarHBondContact O-N 3.18Å; S241-C245 PolarHBondContact O-N 2.99Å
242P91.4Very high93Very high94 Ų9427 Ų2761%0.6116%0.163SC*.THydrogen-bonded Turntrans-54.9149.7164-24.735.1000111.5C245P242-C245 VanDerWaalsContact N-SG 3.42Å
243P92.6Very high92.9Very high16 Ų1627.9 Ų27.910%0.10418%0.176CC..THydrogen-bonded Turncis-81.9-21.55.931.1-35.6000115A286 L383 I384P243-A286 VanDerWaalsContact O-CB 3.31Å; P243-A286 WeakPolarHBondContact O-CB 3.36Å; P243-A286 PolarHBondContact O-N 2.9Å; P243-L383 HydrophobicContact CG-CB 3.88Å; P243-L383 HydrophobicContact CG-CD1 4.46Å; P243-I384 HydrophobicContact CB-CG2 4.03Å; P243-I384 HydrophobicContact CG-CG2 3.53Å
244E92.5Very high93Very high7 Ų728 Ų283%0.03318%0.177CC..THydrogen-bonded Turntrans-74.5-45.8-171.2-72.5179.981.900113.6R238 R239 S241 L246 A285 H386R238-E244 IonicContact CZ-OE2 3.98Å; R238-E244 IonicContact NH1-OE2 3.04Å; R238-E244 PolarHBondContact NH1-OE2 3.02Å; R238-E244 IonicContact NH2-OE2 3.15Å; R239-E244 WeakPolarHBondContact CG-OE2 3.39Å; R239-E244 IonicContact CZ-OE1 3.37Å; R239-E244 IonicContact CZ-OE2 3.88Å; R239-E244 IonicContact NE-OE1 3.79Å; R239-E244 PolarHBondContact NE-OE1 3.37Å; R239-E244 IonicContact NE-OE2 2.74Å; R239-E244 PolarHBondContact NE-OE2 3.5Å; R239-E244 IonicContact NH2-OE1 2.8Å; R239-E244 PolarHBondContact NH2-OE1 3.2Å; S241-E244 PolarHBondContact O-N 3.18Å; E244-L246 VanDerWaalsContact C-N 3.32Å; E244-L246 HydrophobicContact CB-CD2 3.98Å; E244-L246 HydrophobicContact CB-CG 4.02Å; E244-L246 PolarHBondContact O-N 3.49Å; E244-A285 PolarHBondContact O-N 2.8Å; E244-H386 VanDerWaalsContact CD-CE1 3.46Å; E244-H386 IonicContact OE1-CE1 3.27Å; E244-H386 PolarHBondContact OE1-CE1 2.93Å; E244-H386 IonicContact OE1-NE2 2.65Å; E244-H386 IonicContact OE2-CE1 3.48Å; E244-H386 PolarHBondContact OE2-CE1 3.4Å; E244-H386 IonicContact OE2-ND1 3.75Å
245C92.3Very high93.1Very high18 Ų1828.3 Ų28.312%0.12218%0.179CC..  trans4849.1-173.3-67.30000113.1S241 P242 A285S241-C245 PolarHBondContact O-N 2.99Å; P242-C245 VanDerWaalsContact N-SG 3.42Å; C245-A285 HydrophobicContact CB-CB 3.69Å
246L92.8Very high93Very high4 Ų430.8 Ų30.82%0.02119%0.188CC..  trans-58.9141.6-175.6-62.9-169.4000112.1R239 L240 E244 L250 L251 V254 T292R239-L246 HydrophobicContact CB-CD1 3.97Å; R239-L246 HydrophobicContact CB-CG 4.25Å; R239-L246 WeakPolarHBondContact O-CB 3.35Å; R239-L246 PolarHBondContact O-N 3.07Å; L240-L246 WeakPolarHBondContact CD2-O 3.43Å; E244-L246 VanDerWaalsContact C-N 3.32Å; E244-L246 HydrophobicContact CB-CD2 3.98Å; E244-L246 HydrophobicContact CB-CG 4.02Å; E244-L246 PolarHBondContact O-N 3.49Å; L246-L250 HydrophobicContact CB-CB 4.43Å; L246-L250 HydrophobicContact CD2-CB 4.2Å; L246-L250 HydrophobicContact CD2-CD1 4.19Å; L246-L251 HydrophobicContact CB-CB 4.44Å; L246-V254 HydrophobicContact CD1-CG2 4.14Å; L246-T292 HydrophobicContact CD2-CG2 4.34Å
247N91.1Very high92.8Very high44 Ų4434.6 Ų34.624%0.23520%0.202CC..  trans-87.3168.7169.170.242.6000111S249 L250 L251 R282N247-S249 PolarHBondContact O-N 3.44Å; N247-S249 VanDerWaalsContact O-N 3.17Å; N247-S249 WeakPolarHBondContact OD1-CB 3.5Å; N247-S249 PolarHBondContact OD1-N 3Å; N247-L250 PolarHBondContact O-N 3.38Å; N247-L250 PolarHBondContact OD1-N 2.81Å; N247-L251 WeakPolarHBondContact O-CB 3.37Å; N247-L251 PolarHBondContact O-N 3.06Å; N247-R282 WeakPolarHBondContact CB-O 3.44Å
248A90.9Very high92.6Very high12 Ų1234.2 Ų34.210%0.09922%0.215CC..Hα-helixtrans-58.9-30.1-176.500000114.2G252 L267 L278A248-G252 PolarHBondContact O-N 3.4Å; A248-L267 HydrophobicContact CB-CD2 4.25Å; A248-L267 VanDerWaalsContact O-CD2 3.31Å; A248-L267 WeakPolarHBondContact O-CD2 3.31Å; A248-L278 HydrophobicContact CB-CD2 3.75Å; A248-L278 HydrophobicContact CB-CG 4.46Å
249S89.1Confident92.3Very high101 Ų10143.9 Ų43.971%0.70626%0.258SS*.Hα-helixtrans-74.4-45178.8-54.70000111.6N247 G252 G253N247-S249 PolarHBondContact O-N 3.44Å; N247-S249 VanDerWaalsContact O-N 3.17Å; N247-S249 WeakPolarHBondContact OD1-CB 3.5Å; N247-S249 PolarHBondContact OD1-N 3Å; S249-G252 PolarHBondContact O-N 3.37Å; S249-G253 PolarHBondContact O-N 2.93Å
250L92.2Very high92Very high52 Ų5247.2 Ų47.227%0.27228%0.281SS..Hα-helixtrans-66.3-47.2176.9-69.1173.2000111.1L246 N247 G252 G253 V254 K284 V288L246-L250 HydrophobicContact CB-CB 4.43Å; L246-L250 HydrophobicContact CD2-CB 4.2Å; L246-L250 HydrophobicContact CD2-CD1 4.19Å; N247-L250 PolarHBondContact O-N 3.38Å; N247-L250 PolarHBondContact OD1-N 2.81Å; L250-G252 VanDerWaalsContact C-N 3.31Å; L250-G252 PolarHBondContact O-N 3.07Å; L250-G253 PolarHBondContact O-N 3.02Å; L250-G253 VanDerWaalsContact O-N 3.07Å; L250-V254 PolarHBondContact O-N 3.42Å; L250-K284 HydrophobicContact CD1-CB 4.25Å; L250-K284 HydrophobicContact CD1-CD 4.21Å; L250-K284 HydrophobicContact CD1-CG 4.35Å; L250-V288 HydrophobicContact CD1-CG2 4.17Å; L250-V288 HydrophobicContact CD2-CG2 4.14Å
251L94.1Very high91.8Very high2 Ų256.7 Ų56.71%0.0132%0.322CS..Hα-helixtrans-59.9-41.7174.4-178.861.8000111V236 L240 L246 N247 G253 V254 L255 L267 L271 L278V236-L251 HydrophobicContact CG1-CD2 4.06Å; L240-L251 HydrophobicContact CD2-CD2 3.87Å; L240-L251 HydrophobicContact CG-CD2 4.48Å; L246-L251 HydrophobicContact CB-CB 4.44Å; N247-L251 WeakPolarHBondContact O-CB 3.37Å; N247-L251 PolarHBondContact O-N 3.06Å; L251-G253 VanDerWaalsContact C-N 3.28Å; L251-G253 PolarHBondContact O-N 3.1Å; L251-V254 PolarHBondContact O-N 3.29Å; L251-L255 HydrophobicContact CD1-CD1 3.99Å; L251-L255 HydrophobicContact CD1-CG 4.06Å; L251-L255 HydrophobicContact CD2-CD1 4.47Å; L251-L255 HydrophobicContact CG-CD1 3.78Å; L251-L255 HydrophobicContact CG-CG 4.29Å; L251-L255 WeakPolarHBondContact O-CB 3.43Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.06Å; L251-L267 HydrophobicContact CB-CD2 4.27Å; L251-L267 HydrophobicContact CD2-CD2 4.13Å; L251-L267 HydrophobicContact CG-CD2 4.18Å; L251-L271 HydrophobicContact CD2-CD1 4.06Å; L251-L278 HydrophobicContact CD2-CD2 4.33Å
252G94.1Very high91.8Very high12 Ų1259 Ų5912%0.12433%0.33CS..Hα-helixtrans-57.9-37173.300000113.9A248 S249 L250 L255 R256 R257A248-G252 PolarHBondContact O-N 3.4Å; S249-G252 PolarHBondContact O-N 3.37Å; L250-G252 VanDerWaalsContact C-N 3.31Å; L250-G252 PolarHBondContact O-N 3.07Å; G252-L255 CarbonylContact O-C 3.54Å; G252-R256 PolarHBondContact O-N 2.98Å; G252-R256 VanDerWaalsContact O-N 3.08Å; G252-R257 PolarHBondContact O-N 2.94Å
253G93.6Very high91.7Very high38 Ų3855.2 Ų55.239%0.39231%0.309SS..Hα-helixtrans-73.8-36.3175.700000114.4R219 S249 L250 L251 R256R219-G253 PolarHBondContact NH2-O 3.32Å; S249-G253 PolarHBondContact O-N 2.93Å; L250-G253 PolarHBondContact O-N 3.02Å; L250-G253 VanDerWaalsContact O-N 3.07Å; L251-G253 VanDerWaalsContact C-N 3.28Å; L251-G253 PolarHBondContact O-N 3.1Å; G253-R256 PolarHBondContact O-N 3.25Å
254V95.4Very high91.6Very high7 Ų756 Ų564%0.04232%0.32CS..Hα-helixtrans-60.7-47.8169.2168.60000110.2R239 L246 L250 L251 R256 T292 V295R239-V254 VanDerWaalsContact NH1-CG1 3.34Å; L246-V254 HydrophobicContact CD1-CG2 4.14Å; L250-V254 PolarHBondContact O-N 3.42Å; L251-V254 PolarHBondContact O-N 3.29Å; V254-R256 WeakPolarHBondContact O-CG 3.49Å; V254-R256 PolarHBondContact O-N 2.9Å; V254-T292 WeakPolarHBondContact CG2-O 3.49Å; V254-V295 HydrophobicContact CG1-CG1 3.83Å
255L95.9Very high91.5Very high8 Ų863.4 Ų63.44%0.04235%0.348CS..THydrogen-bonded Turntrans-75.61.8177.9-59.7171.6000114F213 V231 V236 L251 G252 R257 L267F213-L255 HydrophobicContact CD1-CD1 4.29Å; F213-L255 HydrophobicContact CD1-CD2 4.21Å; F213-L255 HydrophobicContact CE1-CD1 3.75Å; F213-L255 HydrophobicContact CE1-CD2 4.48Å; V231-L255 HydrophobicContact CB-CD2 4.31Å; V231-L255 HydrophobicContact CG1-CD2 3.82Å; V231-L255 HydrophobicContact CG2-CD2 4.36Å; V236-L255 HydrophobicContact CG2-CD2 4.5Å; L251-L255 HydrophobicContact CD1-CD1 3.99Å; L251-L255 HydrophobicContact CD1-CG 4.06Å; L251-L255 HydrophobicContact CD2-CD1 4.47Å; L251-L255 HydrophobicContact CG-CD1 3.78Å; L251-L255 HydrophobicContact CG-CG 4.29Å; L251-L255 WeakPolarHBondContact O-CB 3.43Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.06Å; G252-L255 CarbonylContact O-C 3.54Å; L255-R257 HydrophobicContact CB-CG 4.1Å; L255-R257 PolarHBondContact O-N 3.39Å; L255-R257 VanDerWaalsContact O-N 3.09Å; L255-L267 HydrophobicContact CD1-CD1 3.86Å
256R94.6Very high91.5Very high56 Ų5664.3 Ų64.321%0.21135%0.354CS..THydrogen-bonded Turntrans54.431.5175.5-49.7174.4-154.1-130.5-4.2113.9V216 P217 G218 R219 G252 G253 V254 E298V216-R256 HydrophobicContact CB-CG 4.47Å; P217-R256 PolarHBondContact O-NE 3.36Å; P217-R256 VanDerWaalsContact O-NE 3.08Å; P217-R256 PolarHBondContact O-NH1 3.33Å; P217-R256 PolarHBondContact O-NH2 3.35Å; G218-R256 PolarHBondContact O-NH1 2.98Å; R219-R256 VanDerWaalsContact CG-CZ 3.49Å; G252-R256 PolarHBondContact O-N 2.98Å; G252-R256 VanDerWaalsContact O-N 3.08Å; G253-R256 PolarHBondContact O-N 3.25Å; V254-R256 WeakPolarHBondContact O-CG 3.49Å; V254-R256 PolarHBondContact O-N 2.9Å; R256-E298 IonicContact CZ-OE1 3.66Å; R256-E298 IonicContact CZ-OE2 4Å; R256-E298 IonicContact NH1-OE1 3.74Å; R256-E298 IonicContact NH2-OE1 2.76Å; R256-E298 PolarHBondContact NH2-OE1 2.89Å; R256-E298 IonicContact NH2-OE2 2.72Å; R256-E298 PolarHBondContact NH2-OE2 3.35Å
257R90.9Very high91.6Very high80 Ų8064.2 Ų64.230%0.30235%0.354SS..PPolyproline II helixtrans-74.1132.6177.8-66.1-176.160.9170.4-3.4109.3G252 L255 K259 S266 L267G252-R257 PolarHBondContact O-N 2.94Å; L255-R257 HydrophobicContact CB-CG 4.1Å; L255-R257 PolarHBondContact O-N 3.39Å; L255-R257 VanDerWaalsContact O-N 3.09Å; R257-K259 PolarHBondContact O-N 3.38Å; R257-S266 PolarHBondContact NH2-OG 3.4Å; R257-L267 VanDerWaalsContact NH1-CA 3.33Å
258A88.1Confident91.7Very high88 Ų8864.9 Ų64.973%0.72735%0.353SS*.PPolyproline II helixtrans-56138.6173.600000111.4S260A258-S260 PolarHBondContact O-N 3.31Å
259K87.8Confident91.8Very high221 Ų22169 Ų6996%0.96137%0.37SS*.PPolyproline II helixtrans-65.9121.5178.1-170.9178.9-178.9-177.40109.2R257R257-K259 PolarHBondContact O-N 3.38Å
260S88.9Confident92Very high70 Ų7069.7 Ų69.749%0.4936%0.36SS..  trans-140149.9-179.550.10000110.1A258 N262 G263A258-S260 PolarHBondContact O-N 3.31Å; S260-N262 PolarHBondContact O-N 2.78Å; S260-N262 VanDerWaalsContact O-N 3.13Å; S260-G263 PolarHBondContact O-N 2.93Å; S260-G263 VanDerWaalsContact OG-CA 3.28Å; S260-G263 WeakPolarHBondContact OG-CA 3.39Å; S260-G263 PolarHBondContact OG-N 3.12Å
261K88.8Confident92.1Very high212 Ų21267.2 Ų67.292%0.92235%0.347SS*.THydrogen-bonded Turntrans-51.3-39.7-176.4-172.9176.9-179.9177.60112.9
262N90.1Very high92Very high96 Ų9671.2 Ų71.251%0.51337%0.369SS..THydrogen-bonded Turntrans-1039.1-179.6-62.9-18.8000113.4S260 G264 R265 S266S260-N262 PolarHBondContact O-N 2.78Å; S260-N262 VanDerWaalsContact O-N 3.13Å; N262-G264 VanDerWaalsContact C-N 3.33Å; N262-G264 PolarHBondContact O-N 3.04Å; N262-R265 WeakPolarHBondContact O-CB 3.46Å; N262-R265 PolarHBondContact O-N 2.69Å; N262-S266 PolarHBondContact O-N 3.15Å
263G89.5Confident92Very high15 Ų1579.1 Ų79.116%0.15540%0.4CS..Hα-helixtrans-58.5-40.5-171.100000113.9S260 L267S260-G263 PolarHBondContact O-N 2.93Å; S260-G263 VanDerWaalsContact OG-CA 3.28Å; S260-G263 WeakPolarHBondContact OG-CA 3.39Å; S260-G263 PolarHBondContact OG-N 3.12Å; G263-L267 WeakPolarHBondContact O-CB 3.45Å; G263-L267 PolarHBondContact O-N 3.15Å
264G90.1Very high91.9Very high33 Ų3378.6 Ų78.634%0.3439%0.388SS..Hα-helixtrans-67.2-33.9175.700000113.7N262 R268N262-G264 VanDerWaalsContact C-N 3.33Å; N262-G264 PolarHBondContact O-N 3.04Å; G264-R268 WeakPolarHBondContact O-CD 3.48Å; G264-R268 VanDerWaalsContact O-CG 3.3Å; G264-R268 WeakPolarHBondContact O-CG 3.49Å; G264-R268 PolarHBondContact O-N 3.04Å
265R91.6Very high91.6Very high162 Ų16280.7 Ų80.761%0.61141%0.411SS*.Hα-helixtrans-70.9-50175.2-166.1-168.4-69.5176.4-3.4110.7N262 L267 R268 E269N262-R265 WeakPolarHBondContact O-CB 3.46Å; N262-R265 PolarHBondContact O-N 2.69Å; R265-L267 PolarHBondContact O-N 3.44Å; R265-R268 WeakPolarHBondContact O-CB 3.29Å; R265-R268 PolarHBondContact O-N 3.4Å; R265-E269 VanDerWaalsContact CD-OE1 3.28Å; R265-E269 WeakPolarHBondContact CD-OE1 3.31Å; R265-E269 VanDerWaalsContact CG-OE1 3.27Å; R265-E269 WeakPolarHBondContact CG-OE1 3.46Å; R265-E269 WeakPolarHBondContact O-CG 3.34Å; R265-E269 PolarHBondContact O-N 3.21Å
266S93Very high91.4Very high37 Ų3780.9 Ų80.926%0.25941%0.412SS..Hα-helixtrans-59.1-30.6174.8169.10000113.3R257 N262 K270R257-S266 PolarHBondContact NH2-OG 3.4Å; N262-S266 PolarHBondContact O-N 3.15Å; S266-K270 WeakPolarHBondContact O-CB 3.5Å; S266-K270 WeakPolarHBondContact O-CG 3.17Å; S266-K270 PolarHBondContact O-N 3Å
267L93.4Very high91.1Very high2 Ų283.9 Ų83.91%0.0143%0.432CS..Hα-helixtrans-68.7-45.8172.1-177.560.3000111.4F213 A248 L251 L255 R257 G263 R265 K270 L271F213-L267 HydrophobicContact CE1-CD1 4.23Å; F213-L267 HydrophobicContact CZ-CD1 4.15Å; A248-L267 HydrophobicContact CB-CD2 4.25Å; A248-L267 VanDerWaalsContact O-CD2 3.31Å; A248-L267 WeakPolarHBondContact O-CD2 3.31Å; L251-L267 HydrophobicContact CB-CD2 4.27Å; L251-L267 HydrophobicContact CD2-CD2 4.13Å; L251-L267 HydrophobicContact CG-CD2 4.18Å; L255-L267 HydrophobicContact CD1-CD1 3.86Å; R257-L267 VanDerWaalsContact NH1-CA 3.33Å; G263-L267 WeakPolarHBondContact O-CB 3.45Å; G263-L267 PolarHBondContact O-N 3.15Å; R265-L267 PolarHBondContact O-N 3.44Å; L267-K270 PolarHBondContact O-N 3.5Å; L267-L271 HydrophobicContact CD1-CD1 4.2Å; L267-L271 HydrophobicContact CD1-CG 4.26Å; L267-L271 HydrophobicContact CG-CD1 3.96Å; L267-L271 HydrophobicContact CG-CG 4.45Å; L267-L271 VanDerWaalsContact O-CG 3.23Å; L267-L271 WeakPolarHBondContact O-CG 3.27Å; L267-L271 PolarHBondContact O-N 3.02Å
268R93.3Very high91Very high59 Ų5980.2 Ų80.222%0.22342%0.418CS..Hα-helixtrans-58.4-53.3175.7-65.9150.9178.6-74.9-25.5111.2G264 R265 K270 L271 D272 L278 P279G264-R268 WeakPolarHBondContact O-CD 3.48Å; G264-R268 VanDerWaalsContact O-CG 3.3Å; G264-R268 WeakPolarHBondContact O-CG 3.49Å; G264-R268 PolarHBondContact O-N 3.04Å; R265-R268 WeakPolarHBondContact O-CB 3.29Å; R265-R268 PolarHBondContact O-N 3.4Å; R268-K270 PolarHBondContact O-N 2.89Å; R268-K270 VanDerWaalsContact O-N 3.1Å; R268-L271 CarbonylContact O-C 3.55Å; R268-L271 WeakPolarHBondContact O-CA 3.47Å; R268-L271 WeakPolarHBondContact O-CB 3.41Å; R268-L271 PolarHBondContact O-N 3.42Å; R268-D272 PolarHBondContact O-N 3.3Å; R268-D272 VanDerWaalsContact O-OD2 3.1Å; R268-L278 PolarHBondContact NH1-O 3.37Å; R268-L278 PolarHBondContact NH2-O 2.87Å; R268-P279 PolarHBondContact NH1-O 2.89Å; R268-P279 PolarHBondContact NH2-O 3.42Å
269E93.9Very high90.7Very high98 Ų9878.3 Ų78.346%0.45840%0.399SS..Hα-helixtrans-54.9-33.6177.4-67.6162.3-17200113.3R265 K273R265-E269 VanDerWaalsContact CD-OE1 3.28Å; R265-E269 WeakPolarHBondContact CD-OE1 3.31Å; R265-E269 VanDerWaalsContact CG-OE1 3.27Å; R265-E269 WeakPolarHBondContact CG-OE1 3.46Å; R265-E269 WeakPolarHBondContact O-CG 3.34Å; R265-E269 PolarHBondContact O-N 3.21Å; E269-K273 WeakPolarHBondContact O-CD 3.34Å; E269-K273 VanDerWaalsContact O-CG 3.23Å; E269-K273 WeakPolarHBondContact O-CG 3.48Å; E269-K273 PolarHBondContact O-N 2.99Å
270K93.3Very high90.5Very high115 Ų11571.7 Ų71.750%0.539%0.385SS..Hα-helixtrans-74.9-35.2173.9-80.3-167.8175.7-158.10113.2F213 S266 L267 R268F213-K270 HydrophobicContact CE2-CB 4.35Å; F213-K270 HydrophobicContact CZ-CB 4.21Å; S266-K270 WeakPolarHBondContact O-CB 3.5Å; S266-K270 WeakPolarHBondContact O-CG 3.17Å; S266-K270 PolarHBondContact O-N 3Å; L267-K270 PolarHBondContact O-N 3.5Å; R268-K270 PolarHBondContact O-N 2.89Å; R268-K270 VanDerWaalsContact O-N 3.1Å
271L93.9Very high89.8Confident0 Ų072.1 Ų72.10%040%0.4CS..Hα-helixtrans-73.6-43177.3-65.7169.6000111F213 V236 L240 L251 L267 R268 K273 I274 G275 L276 L278F213-L271 HydrophobicContact CE1-CD2 4.42Å; F213-L271 HydrophobicContact CE2-CD2 3.98Å; F213-L271 HydrophobicContact CZ-CD2 3.75Å; F213-L271 HydrophobicContact CZ-CG 4.34Å; V236-L271 HydrophobicContact CG1-CD2 3.5Å; V236-L271 VanDerWaalsContact CG1-CD2 3.5Å; L240-L271 HydrophobicContact CD1-CD1 4.35Å; L251-L271 HydrophobicContact CD2-CD1 4.06Å; L267-L271 HydrophobicContact CD1-CD1 4.2Å; L267-L271 HydrophobicContact CD1-CG 4.26Å; L267-L271 HydrophobicContact CG-CD1 3.96Å; L267-L271 HydrophobicContact CG-CG 4.45Å; L267-L271 VanDerWaalsContact O-CG 3.23Å; L267-L271 WeakPolarHBondContact O-CG 3.27Å; L267-L271 PolarHBondContact O-N 3.02Å; R268-L271 CarbonylContact O-C 3.55Å; R268-L271 WeakPolarHBondContact O-CA 3.47Å; R268-L271 WeakPolarHBondContact O-CB 3.41Å; R268-L271 PolarHBondContact O-N 3.42Å; L271-K273 VanDerWaalsContact C-N 3.29Å; L271-K273 PolarHBondContact O-N 3.38Å; L271-I274 HydrophobicContact CD2-CD1 4.43Å; L271-I274 CarbonylContact O-C 3.25Å; L271-I274 WeakPolarHBondContact O-CA 3.47Å; L271-I274 WeakPolarHBondContact O-CG1 3.46Å; L271-I274 PolarHBondContact O-N 3.5Å; L271-G275 PolarHBondContact O-N 3.03Å; L271-L276 CarbonylContact C-O 3.5Å; L271-L276 HydrophobicContact CB-CB 4.08Å; L271-L276 WeakPolarHBondContact CB-O 3.13Å; L271-L276 HydrophobicContact CD2-CB 4.31Å; L271-L276 HydrophobicContact CD2-CD1 4.22Å; L271-L276 PolarHBondContact O-N 3.2Å; L271-L278 HydrophobicContact CD1-CB 3.9Å; L271-L278 HydrophobicContact CD1-CD2 3.67Å; L271-L278 HydrophobicContact CD1-CG 4.47Å
272D92.7Very high89.4Confident86 Ų8666.2 Ų66.246%0.4637%0.372SS..Hα-helixtrans-61.2-38.7177.8-60.1-36.9000111.1R268 I274 G275 L276R268-D272 PolarHBondContact O-N 3.3Å; R268-D272 VanDerWaalsContact O-OD2 3.1Å; D272-I274 PolarHBondContact O-N 3.01Å; D272-G275 PolarHBondContact O-N 2.93Å; D272-L276 PolarHBondContact N-O 3.26Å
273K92.6Very high88.6Confident179 Ų17972.4 Ų72.478%0.77839%0.388SS*.THydrogen-bonded Turntrans-59.6-25.2171.7-80.6176-177.6-170.70114.2E269 L271E269-K273 WeakPolarHBondContact O-CD 3.34Å; E269-K273 VanDerWaalsContact O-CG 3.23Å; E269-K273 WeakPolarHBondContact O-CG 3.48Å; E269-K273 PolarHBondContact O-N 2.99Å; L271-K273 VanDerWaalsContact C-N 3.29Å; L271-K273 PolarHBondContact O-N 3.38Å
274I91.6Very high87.8Confident26 Ų2675.9 Ų75.913%0.13340%0.399CS..THydrogen-bonded Turntrans-106.421.5175.764.5159.2000113.1V207 F213 V233 L271 D272 L276V207-I274 HydrophobicContact CB-CB 4.35Å; V207-I274 HydrophobicContact CG1-CB 4.15Å; V207-I274 HydrophobicContact CG1-CG2 4.34Å; V207-I274 HydrophobicContact CG2-CB 3.91Å; V207-I274 HydrophobicContact CG2-CG2 4.45Å; V207-I274 WeakPolarHBondContact CG2-O 3.45Å; F213-I274 HydrophobicContact CD2-CD1 3.53Å; F213-I274 HydrophobicContact CE2-CD1 3.71Å; F213-I274 HydrophobicContact CE2-CG1 4.39Å; V233-I274 HydrophobicContact CG1-CD1 4.15Å; V233-I274 HydrophobicContact CG2-CD1 3.86Å; L271-I274 HydrophobicContact CD2-CD1 4.43Å; L271-I274 CarbonylContact O-C 3.25Å; L271-I274 WeakPolarHBondContact O-CA 3.47Å; L271-I274 WeakPolarHBondContact O-CG1 3.46Å; L271-I274 PolarHBondContact O-N 3.5Å; D272-I274 PolarHBondContact O-N 3.01Å; I274-L276 HydrophobicContact CD1-CD1 3.78Å; I274-L276 HydrophobicContact CD1-CG 4.08Å; I274-L276 HydrophobicContact CG1-CB 4.37Å; I274-L276 HydrophobicContact CG1-CD1 4.39Å; I274-L276 HydrophobicContact CG1-CG 4.17Å; I274-L276 PolarHBondContact O-N 2.96Å
275G89.6Confident87Confident51 Ų5177.6 Ų77.653%0.52641%0.41SS..THydrogen-bonded Turntrans70.311.1177.200000115.2L271 D272L271-G275 PolarHBondContact O-N 3.03Å; D272-G275 PolarHBondContact O-N 2.93Å
276L91.1Very high86.2Confident13 Ų1371.2 Ų71.27%0.06839%0.392CS..  trans-100111.1177.9-64.8-171.3000111.1V233 V236 Q237 L271 D272 I274V233-L276 HydrophobicContact CG1-CD1 4.22Å; V236-L276 HydrophobicContact CB-CD1 4.26Å; V236-L276 HydrophobicContact CG1-CD1 3.85Å; Q237-L276 HydrophobicContact CB-CD1 4.1Å; Q237-L276 HydrophobicContact CB-CD2 3.88Å; Q237-L276 HydrophobicContact CG-CD2 3.71Å; L271-L276 CarbonylContact C-O 3.5Å; L271-L276 HydrophobicContact CB-CB 4.08Å; L271-L276 WeakPolarHBondContact CB-O 3.13Å; L271-L276 HydrophobicContact CD2-CB 4.31Å; L271-L276 HydrophobicContact CD2-CD1 4.22Å; L271-L276 PolarHBondContact O-N 3.2Å; D272-L276 PolarHBondContact N-O 3.26Å; I274-L276 HydrophobicContact CD1-CD1 3.78Å; I274-L276 HydrophobicContact CD1-CG 4.08Å; I274-L276 HydrophobicContact CG1-CB 4.37Å; I274-L276 HydrophobicContact CG1-CD1 4.39Å; I274-L276 HydrophobicContact CG1-CG 4.17Å; I274-L276 PolarHBondContact O-N 2.96Å
277N88.7Confident85.9Confident119 Ų11975.8 Ų75.864%0.63641%0.413SS*.  trans-84.6128.9177-179.70.7000111.9
278L88.4Confident85.6Confident3 Ų379 Ų792%0.01643%0.433CS..  trans-121.895.4171.6-179.847.3000111.3L240 A248 L251 R268 L271L240-L278 HydrophobicContact CD1-CB 4.41Å; L240-L278 HydrophobicContact CD2-CD1 3.79Å; L240-L278 HydrophobicContact CD2-CD2 4.02Å; L240-L278 HydrophobicContact CD2-CG 4.38Å; A248-L278 HydrophobicContact CB-CD2 3.75Å; A248-L278 HydrophobicContact CB-CG 4.46Å; L251-L278 HydrophobicContact CD2-CD2 4.33Å; R268-L278 PolarHBondContact NH1-O 3.37Å; R268-L278 PolarHBondContact NH2-O 2.87Å; L271-L278 HydrophobicContact CD1-CB 3.9Å; L271-L278 HydrophobicContact CD1-CD2 3.67Å; L271-L278 HydrophobicContact CD1-CG 4.47Å
279P83.5Confident85.6Confident48 Ų4879.6 Ų79.631%0.31244%0.443SS..  trans-65.7156.2-173.323.4-33000114R268 R282R268-P279 PolarHBondContact NH1-O 2.89Å; R268-P279 PolarHBondContact NH2-O 3.42Å; P279-R282 HydrophobicContact CG-CB 4.46Å
280A82.2Confident85.7Confident82 Ų8282.2 Ų82.268%0.67846%0.46SS*.THydrogen-bonded Turntrans-70.6149.2176.400000110.5R282A280-R282 PolarHBondContact O-N 2.98Å; A280-R282 VanDerWaalsContact O-N 3.07Å
281G75.2Confident85.7Confident78 Ų7879.4 Ų79.480%0.80445%0.45SS*.THydrogen-bonded Turntrans66.95.4177.500000116.6R283G281-R283 PolarHBondContact O-N 3.08Å
282R79.2Confident85.8Confident88 Ų8880 Ų8033%0.33245%0.453SS..PPolyproline II helixtrans-54123.2177.4178.4173.1-72.7-141.40111L240 N247 P279 A280L240-R282 PolarHBondContact O-NH1 3.49Å; N247-R282 WeakPolarHBondContact CB-O 3.44Å; P279-R282 HydrophobicContact CG-CB 4.46Å; A280-R282 PolarHBondContact O-N 2.98Å; A280-R282 VanDerWaalsContact O-N 3.07Å
283R73Confident85.8Confident227 Ų22777.9 Ų77.986%0.85745%0.445SS*.PPolyproline II helixtrans-78.8143.9171.5-62-176.5-178.2-175.90.7110G281G281-R283 PolarHBondContact O-N 3.08Å
284K73.9Confident86Confident88 Ų8869.7 Ų69.738%0.38341%0.41SS..PPolyproline II helixtrans-64.1143.4170.2158.8-163.4160.4-162.50109.4L250 A286 V288L250-K284 HydrophobicContact CD1-CB 4.25Å; L250-K284 HydrophobicContact CD1-CD 4.21Å; L250-K284 HydrophobicContact CD1-CG 4.35Å; K284-A286 WeakPolarHBondContact CE-O 3.38Å; K284-A286 WeakPolarHBondContact CG-O 3.3Å; K284-V288 HydrophobicContact CD-CG2 3.94Å
285A72.3Confident86.3Confident68 Ų6868.5 Ų68.556%0.56240%0.404SS*.  trans-102.3-61.7178.800000113E244 C245E244-A285 PolarHBondContact O-N 2.8Å; C245-A285 HydrophobicContact CB-CB 3.69Å
286A76.2Confident86.5Confident28 Ų2866.8 Ų66.823%0.23138%0.382CS..SBendtrans-81.6155.7176.900000112.6P243 K284P243-A286 VanDerWaalsContact O-CB 3.31Å; P243-A286 WeakPolarHBondContact O-CB 3.36Å; P243-A286 PolarHBondContact O-N 2.9Å; K284-A286 WeakPolarHBondContact CE-O 3.38Å; K284-A286 WeakPolarHBondContact CG-O 3.3Å
287N85.4Confident86.7Confident133 Ų13367.3 Ų67.371%0.71139%0.391SS*.PPolyproline II helixtrans-61.6146.5174.6-81.5-33.6000112.4
288V88.7Confident87.1Confident71 Ų7162 Ų6243%0.4336%0.362SS..PPolyproline II helixtrans-85.1124.6173.51730000106.9L250 K284 T292L250-V288 HydrophobicContact CD1-CG2 4.17Å; L250-V288 HydrophobicContact CD2-CG2 4.14Å; K284-V288 HydrophobicContact CD-CG2 3.94Å; V288-T292 HydrophobicContact CG1-CG2 4.25Å; V288-T292 HydrophobicContact CG2-CG2 4.42Å
289T92.8Very high87.5Confident71 Ų7161.8 Ų61.844%0.43636%0.361SS..  trans-119.1178.3176.568.70000109.5L291 T292T289-L291 PolarHBondContact O-N 3.13Å; T289-L291 PolarHBondContact OG1-N 3.26Å; T289-T292 PolarHBondContact N-OG1 2.9Å; T289-T292 WeakPolarHBondContact O-CB 3.49Å; T289-T292 PolarHBondContact O-N 3.36Å; T289-T292 PolarHBondContact O-OG1 2.68Å; T289-T292 PolarHBondContact OG1-N 3.18Å; T289-T292 PolarHBondContact OG1-OG1 3.32Å
290L94.7Very high88Confident153 Ų15362.8 Ų62.880%0.80137%0.366SS*.THydrogen-bonded Turntrans-61.1-34.8171-62179.5000111.8T292 S293L290-T292 VanDerWaalsContact C-N 3.31Å; L290-T292 PolarHBondContact O-N 2.83Å; L290-S293 VanDerWaalsContact O-CB 3.3Å; L290-S293 WeakPolarHBondContact O-CB 3.44Å; L290-S293 PolarHBondContact O-N 2.59Å; L290-S293 PolarHBondContact O-OG 2.96Å
291L95.3Very high88.6Confident55 Ų5562.3 Ų62.329%0.28835%0.35SS..G310 helixtrans-62-38.6176.4-62.7173.5000111.4T289 S293 L294 H386 F388T289-L291 PolarHBondContact O-N 3.13Å; T289-L291 PolarHBondContact OG1-N 3.26Å; L291-S293 PolarHBondContact O-N 3.18Å; L291-L294 HydrophobicContact CD2-CD1 4.11Å; L291-L294 WeakPolarHBondContact O-CB 3.32Å; L291-L294 PolarHBondContact O-N 3.24Å; L291-H386 PolarHBondContact O-CD2 3.35Å; L291-H386 PolarHBondContact O-NE2 3.4Å; L291-F388 HydrophobicContact CD2-CD1 4.09Å; L291-F388 HydrophobicContact CD2-CG 4.47Å
292T94.6Very high89.7Confident13 Ų1361.3 Ų61.38%0.0833%0.326CS..G310 helixtrans-54.7-25.3174.7-45.70000112.7R239 L246 V254 V288 T289 L290 L294R239-T292 PolarHBondContact NH2-O 3.24Å; L246-T292 HydrophobicContact CD2-CG2 4.34Å; V254-T292 WeakPolarHBondContact CG2-O 3.49Å; V288-T292 HydrophobicContact CG1-CG2 4.25Å; V288-T292 HydrophobicContact CG2-CG2 4.42Å; T289-T292 PolarHBondContact N-OG1 2.9Å; T289-T292 WeakPolarHBondContact O-CB 3.49Å; T289-T292 PolarHBondContact O-N 3.36Å; T289-T292 PolarHBondContact O-OG1 2.68Å; T289-T292 PolarHBondContact OG1-N 3.18Å; T289-T292 PolarHBondContact OG1-OG1 3.32Å; L290-T292 VanDerWaalsContact C-N 3.31Å; L290-T292 PolarHBondContact O-N 2.83Å; T292-L294 VanDerWaalsContact C-N 3.35Å
293S93.9Very high90.5Very high41 Ų4157.4 Ų57.429%0.28731%0.312SS..G310 helixtrans-72.9-26.8178.481.30000113.5R219 L290 L291R219-S293 VanDerWaalsContact CZ-O 3.26Å; R219-S293 PolarHBondContact NE-O 3.16Å; R219-S293 PolarHBondContact NH2-O 2.91Å; L290-S293 VanDerWaalsContact O-CB 3.3Å; L290-S293 WeakPolarHBondContact O-CB 3.44Å; L290-S293 PolarHBondContact O-N 2.59Å; L290-S293 PolarHBondContact O-OG 2.96Å; L291-S293 PolarHBondContact O-N 3.18Å
294L96.1Very high91.7Very high8 Ų854.2 Ų54.24%0.04230%0.3CS..SBendtrans-75.4149.8-177.7-55.9178.2000111L220 R239 L291 T292 E298 A299 L302 H386L220-L294 HydrophobicContact CD1-CD2 4.32Å; R239-L294 PolarHBondContact NH1-O 3.34Å; L291-L294 HydrophobicContact CD2-CD1 4.11Å; L291-L294 WeakPolarHBondContact O-CB 3.32Å; L291-L294 PolarHBondContact O-N 3.24Å; T292-L294 VanDerWaalsContact C-N 3.35Å; L294-E298 WeakPolarHBondContact CA-OE2 3.04Å; L294-E298 HydrophobicContact CB-CB 4.3Å; L294-E298 HydrophobicContact CD2-CB 4.21Å; L294-A299 HydrophobicContact CB-CB 4.4Å; L294-A299 HydrophobicContact CD1-CB 4.18Å; L294-L302 HydrophobicContact CD1-CD2 4.08Å; L294-H386 PolarHBondContact O-CD2 3.07Å
295V96.7Very high92.8Very high0 Ų054.7 Ų54.70%031%0.307CS..  trans-90.9159.9159-60.40000110V216 Y229 V231 E235 V254 G297 E298 A299V216-V295 HydrophobicContact CG2-CG1 4.1Å; V216-V295 HydrophobicContact CG2-CG2 3.96Å; Y229-V295 HydrophobicContact CG-CG2 4.27Å; V231-V295 HydrophobicContact CG2-CB 4.08Å; V231-V295 HydrophobicContact CG2-CG1 3.67Å; V231-V295 HydrophobicContact CG2-CG2 4.38Å; E235-V295 VanDerWaalsContact OE1-CA 3.28Å; E235-V295 WeakPolarHBondContact OE1-CA 3.44Å; E235-V295 WeakPolarHBondContact OE1-CB 3.41Å; V254-V295 HydrophobicContact CG1-CG1 3.83Å; V295-G297 VanDerWaalsContact C-N 3.27Å; V295-G297 PolarHBondContact O-N 3.3Å; V295-E298 HydrophobicContact CG2-CB 4.41Å; V295-E298 HydrophobicContact CG2-CG 3.87Å; V295-E298 WeakPolarHBondContact CG2-OE2 3.36Å; V295-E298 PolarHBondContact N-OE2 3.05Å; V295-E298 WeakPolarHBondContact O-CB 3.15Å; V295-E298 PolarHBondContact O-N 3.16Å; V295-A299 PolarHBondContact O-N 3.33Å; V295-A299 VanDerWaalsContact O-N 3.08Å
296E95.8Very high94Very high15 Ų1555.5 Ų55.57%0.0730%0.298CS..Hα-helixtrans-55.2-40.5-174-76.9174.3-139.600113.3E235 R238 E298 A299 V300 G362 H386E235-E296 WeakPolarHBondContact CB-OE1 3.41Å; E235-E296 HydrophobicContact CG-CG 4.23Å; E235-E296 WeakPolarHBondContact CG-OE1 3.34Å; E235-E296 PolarHBondContact OE1-N 2.93Å; E235-E296 VanDerWaalsContact OE1-N 3.1Å; E235-E296 PolarHBondContact OE2-N 2.92Å; R238-E296 IonicContact CZ-OE1 3.24Å; R238-E296 VanDerWaalsContact CZ-OE1 3.27Å; R238-E296 IonicContact NE-OE1 3.65Å; R238-E296 PolarHBondContact NE-OE1 3.37Å; R238-E296 IonicContact NH2-OE1 3.63Å; R238-E296 PolarHBondContact NH2-OE1 3.22Å; E296-E298 VanDerWaalsContact C-N 3.28Å; E296-E298 PolarHBondContact O-N 3.07Å; E296-A299 PolarHBondContact O-N 3.46Å; E296-V300 WeakPolarHBondContact O-CG2 3.36Å; E296-V300 PolarHBondContact O-N 3.16Å; E296-G362 WeakPolarHBondContact OE2-CA 3.33Å; E296-G362 PolarHBondContact OE2-N 3.24Å; E296-H386 HydrophobicContact CG-CB 3.93Å
297G94.9Very high95.1Very high25 Ų2555.1 Ų55.126%0.25830%0.297SS..Hα-helixtrans-60.4-34.9176.200000113.8Y229 V295 H301Y229-G297 VanDerWaalsContact CD1-C 3.43Å; Y229-G297 VanDerWaalsContact CE1-C 3.47Å; Y229-G297 WeakPolarHBondContact CE1-O 3.29Å; V295-G297 VanDerWaalsContact C-N 3.27Å; V295-G297 PolarHBondContact O-N 3.3Å; G297-H301 WeakPolarHBondContact O-CB 3.44Å; G297-H301 PolarHBondContact O-CD2 2.89Å; G297-H301 PolarHBondContact O-N 3.46Å; G297-H301 VanDerWaalsContact O-N 3.15Å
298E95.9Very high95.7Very high6 Ų655.7 Ų55.73%0.02829%0.29CS..Hα-helixtrans-73.2-42174.9-68.8175.5123.300111.9G218 R219 Y229 R256 L294 V295 E296 V300 H301 L302G218-E298 WeakPolarHBondContact CA-OE1 3.38Å; R219-E298 PolarHBondContact N-OE1 3.47Å; Y229-E298 HydrophobicContact CD1-CG 4.05Å; Y229-E298 HydrophobicContact CD2-CG 3.46Å; Y229-E298 VanDerWaalsContact CD2-CG 3.46Å; Y229-E298 HydrophobicContact CE1-CG 4.04Å; Y229-E298 HydrophobicContact CE2-CG 3.47Å; Y229-E298 VanDerWaalsContact CE2-CG 3.47Å; Y229-E298 HydrophobicContact CG-CG 3.76Å; R256-E298 IonicContact CZ-OE1 3.66Å; R256-E298 IonicContact CZ-OE2 4Å; R256-E298 IonicContact NH1-OE1 3.74Å; R256-E298 IonicContact NH2-OE1 2.76Å; R256-E298 PolarHBondContact NH2-OE1 2.89Å; R256-E298 IonicContact NH2-OE2 2.72Å; R256-E298 PolarHBondContact NH2-OE2 3.35Å; L294-E298 WeakPolarHBondContact CA-OE2 3.04Å; L294-E298 HydrophobicContact CB-CB 4.3Å; L294-E298 HydrophobicContact CD2-CB 4.21Å; V295-E298 HydrophobicContact CG2-CB 4.41Å; V295-E298 HydrophobicContact CG2-CG 3.87Å; V295-E298 WeakPolarHBondContact CG2-OE2 3.36Å; V295-E298 PolarHBondContact N-OE2 3.05Å; V295-E298 WeakPolarHBondContact O-CB 3.15Å; V295-E298 PolarHBondContact O-N 3.16Å; E296-E298 VanDerWaalsContact C-N 3.28Å; E296-E298 PolarHBondContact O-N 3.07Å; E298-V300 VanDerWaalsContact C-N 3.34Å; E298-V300 PolarHBondContact O-N 3.13Å; E298-H301 PolarHBondContact O-N 2.92Å; E298-L302 VanDerWaalsContact O-CB 3.27Å; E298-L302 WeakPolarHBondContact O-CB 3.47Å; E298-L302 PolarHBondContact O-N 2.97Å
299A96.8Very high96.2Very high0 Ų055.9 Ų55.90%029%0.292CS..Hα-helixtrans-63.7-40.9-179.300000111.5L294 V295 E296 A303 H386 F388L294-A299 HydrophobicContact CB-CB 4.4Å; L294-A299 HydrophobicContact CD1-CB 4.18Å; V295-A299 PolarHBondContact O-N 3.33Å; V295-A299 VanDerWaalsContact O-N 3.08Å; E296-A299 PolarHBondContact O-N 3.46Å; A299-A303 WeakPolarHBondContact O-CB 3.41Å; A299-A303 PolarHBondContact O-N 3.33Å; A299-H386 HydrophobicContact CB-CB 3.87Å; A299-H386 VanDerWaalsContact CB-O 3.32Å; A299-H386 WeakPolarHBondContact CB-O 3.3Å; A299-F388 HydrophobicContact CB-CB 4.07Å
300V94.4Very high96.4Very high69 Ų6953.4 Ų53.442%0.41828%0.277SS..Hα-helixtrans-68.7-40.4174.8172.80000112E296 E298 A303 R304E296-V300 WeakPolarHBondContact O-CG2 3.36Å; E296-V300 PolarHBondContact O-N 3.16Å; E298-V300 VanDerWaalsContact C-N 3.34Å; E298-V300 PolarHBondContact O-N 3.13Å; V300-A303 PolarHBondContact O-N 2.94Å; V300-R304 PolarHBondContact O-N 2.99Å; V300-R304 VanDerWaalsContact O-N 3.13Å
301H95.4Very high96.5Very high72 Ų7253.2 Ų53.233%0.33327%0.272SS..Hα-helixtrans-64.8-46174.4-80.6-158.7000111.8Y229 G297 E298 A303 R304 D305Y229-H301 HydrophobicContact CE1-CB 4.4Å; Y229-H301 AromaticContact CE1-CE1 3.91Å; Y229-H301 AromaticContact CE1-CG 3.91Å; Y229-H301 AromaticContact CE1-ND1 3.46Å; Y229-H301 WeakPolarHBondContact CE1-ND1 3.5Å; Y229-H301 AromaticContact CZ-ND1 3.81Å; Y229-H301 PolarHBondContact OH-ND1 3.43Å; G297-H301 WeakPolarHBondContact O-CB 3.44Å; G297-H301 PolarHBondContact O-CD2 2.89Å; G297-H301 PolarHBondContact O-N 3.46Å; G297-H301 VanDerWaalsContact O-N 3.15Å; E298-H301 PolarHBondContact O-N 2.92Å; H301-A303 VanDerWaalsContact C-N 3.26Å; H301-A303 PolarHBondContact O-N 3.35Å; H301-R304 WeakPolarHBondContact O-CB 3.45Å; H301-R304 PolarHBondContact O-N 3.04Å; H301-D305 PolarHBondContact O-N 3.49Å
302L97.1Very high96.6Very high57 Ų5753.6 Ų53.630%0.29828%0.276SS..Hα-helixtrans-58.7-38.3176.6179.862.9000112.1L220 L294 E298 F306 F388L220-L302 HydrophobicContact CD1-CD1 4.04Å; L220-L302 HydrophobicContact CD1-CD2 4.07Å; L220-L302 HydrophobicContact CD1-CG 4.5Å; L294-L302 HydrophobicContact CD1-CD2 4.08Å; E298-L302 VanDerWaalsContact O-CB 3.27Å; E298-L302 WeakPolarHBondContact O-CB 3.47Å; E298-L302 PolarHBondContact O-N 2.97Å; L302-F306 VanDerWaalsContact O-CB 3.29Å; L302-F306 WeakPolarHBondContact O-CB 3.44Å; L302-F306 PolarHBondContact O-N 3.35Å; L302-F388 HydrophobicContact CB-CD2 4.26Å; L302-F388 HydrophobicContact CB-CE2 4.49Å; L302-F388 HydrophobicContact CD2-CD2 4.08Å; L302-F388 HydrophobicContact CD2-CE2 4.03Å; L302-F388 HydrophobicContact CG-CD2 4Å; L302-F388 HydrophobicContact CG-CE2 3.8Å
303A97.4Very high96.8Very high6 Ų659.1 Ų59.15%0.0530%0.301CS..Hα-helixtrans-67.5-36.7176.200000112.8A299 V300 H301 G307 F388 P391A299-A303 WeakPolarHBondContact O-CB 3.41Å; A299-A303 PolarHBondContact O-N 3.33Å; V300-A303 PolarHBondContact O-N 2.94Å; H301-A303 VanDerWaalsContact C-N 3.26Å; H301-A303 PolarHBondContact O-N 3.35Å; A303-G307 PolarHBondContact O-N 3.2Å; A303-F388 HydrophobicContact CB-CD2 3.71Å; A303-F388 HydrophobicContact CB-CE2 4.28Å; A303-F388 HydrophobicContact CB-CG 4.5Å; A303-P391 HydrophobicContact CB-CB 4.03Å
304R96.8Very high97Very high159 Ų15961.6 Ų61.660%0.631%0.307SS*.Hα-helixtrans-64.3-48.9174-177-170.5-64.4159.6-0.2111V300 H301 F306 G307 Y308V300-R304 PolarHBondContact O-N 2.99Å; V300-R304 VanDerWaalsContact O-N 3.13Å; H301-R304 WeakPolarHBondContact O-CB 3.45Å; H301-R304 PolarHBondContact O-N 3.04Å; R304-F306 PolarHBondContact O-N 3.11Å; R304-G307 PolarHBondContact O-N 3.35Å; R304-G307 VanDerWaalsContact O-N 3.16Å; R304-Y308 PolarHBondContact O-N 2.88Å
305D97Very high97.1Very high99 Ų9964.7 Ų64.753%0.52933%0.328SS..Hα-helixtrans-65.6-40-178.3-64.3-9.5000111H301 Y308 V309H301-D305 PolarHBondContact O-N 3.49Å; D305-Y308 PolarHBondContact O-N 3.42Å; D305-V309 WeakPolarHBondContact O-CG2 3.34Å; D305-V309 PolarHBondContact O-N 3.28Å
306F98.4Very high97.1Very high84 Ų8465.3 Ų65.337%0.36833%0.333SS..Hα-helixtrans-61.4-43.8171.2-179.7-106.9000112L302 R304 Y308 V309 C310 A392 A395L302-F306 VanDerWaalsContact O-CB 3.29Å; L302-F306 WeakPolarHBondContact O-CB 3.44Å; L302-F306 PolarHBondContact O-N 3.35Å; R304-F306 PolarHBondContact O-N 3.11Å; F306-Y308 PolarHBondContact O-N 3.38Å; F306-V309 PolarHBondContact O-N 3.05Å; F306-C310 VanDerWaalsContact CZ-SG 3.59Å; F306-C310 WeakPolarHBondContact O-CB 3.28Å; F306-C310 PolarHBondContact O-N 3.01Å; F306-C310 PolarHBondContact O-SG 3.49Å; F306-A392 HydrophobicContact CD1-CB 4Å; F306-A392 HydrophobicContact CE1-CB 4.2Å; F306-A395 HydrophobicContact CD1-CB 4.03Å; F306-A395 HydrophobicContact CE1-CB 4.1Å
307G98.3Very high97.2Very high20 Ų2070.2 Ų70.221%0.20635%0.354CS..Hα-helixtrans-58.5-44174.700000113.2A303 R304 C310 E311A303-G307 PolarHBondContact O-N 3.2Å; R304-G307 PolarHBondContact O-N 3.35Å; R304-G307 VanDerWaalsContact O-N 3.16Å; G307-C310 WeakPolarHBondContact O-CB 3.27Å; G307-C310 PolarHBondContact O-N 2.77Å; G307-E311 PolarHBondContact O-N 2.77Å
308Y98.4Very high97.3Very high145 Ų14572 Ų7257%0.56937%0.366SS*.Hα-helixtrans-60.2-50175.5178.2-92.6000111.6R304 D305 F306 C310 E311 T312R304-Y308 PolarHBondContact O-N 2.88Å; D305-Y308 PolarHBondContact O-N 3.42Å; F306-Y308 PolarHBondContact O-N 3.38Å; Y308-C310 VanDerWaalsContact C-N 3.3Å; Y308-C310 PolarHBondContact O-N 3.49Å; Y308-E311 PolarHBondContact O-N 3.22Å; Y308-T312 HydrophobicContact CD1-CG2 4.47Å; Y308-T312 HydrophobicContact CD2-CG2 4.15Å; Y308-T312 HydrophobicContact CE1-CG2 4.05Å; Y308-T312 HydrophobicContact CE2-CG2 3.72Å; Y308-T312 PolarHBondContact O-N 2.96Å; Y308-T312 PolarHBondContact O-OG1 3.39Å
309V98.4Very high97.4Very high76 Ų7674.1 Ų74.146%0.46138%0.379SS..Hα-helixtrans-62.2-36.6177.7173.90000111.8D305 F306 E311 E313 F314D305-V309 WeakPolarHBondContact O-CG2 3.34Å; D305-V309 PolarHBondContact O-N 3.28Å; F306-V309 PolarHBondContact O-N 3.05Å; V309-E311 VanDerWaalsContact C-N 3.28Å; V309-E311 PolarHBondContact O-N 3.05Å; V309-E313 HydrophobicContact CG1-CB 4.05Å; V309-E313 HydrophobicContact CG1-CG 4.03Å; V309-E313 WeakPolarHBondContact O-CB 3.4Å; V309-E313 PolarHBondContact O-N 2.89Å; V309-F314 PolarHBondContact O-N 3.25Å
310C98.4Very high97.3Very high18 Ų1874.1 Ų74.112%0.12238%0.379CS..Hα-helixtrans-65.3-26.7172.3-790000113.9F306 G307 Y308 F314 A395 A399F306-C310 VanDerWaalsContact CZ-SG 3.59Å; F306-C310 WeakPolarHBondContact O-CB 3.28Å; F306-C310 PolarHBondContact O-N 3.01Å; F306-C310 PolarHBondContact O-SG 3.49Å; G307-C310 WeakPolarHBondContact O-CB 3.27Å; G307-C310 PolarHBondContact O-N 2.77Å; Y308-C310 VanDerWaalsContact C-N 3.3Å; Y308-C310 PolarHBondContact O-N 3.49Å; C310-F314 VanDerWaalsContact O-CB 3.32Å; C310-F314 WeakPolarHBondContact O-CB 3.16Å; C310-A395 HydrophobicContact CB-CB 4.3Å; C310-A399 HydrophobicContact CB-CB 4.28Å
311E96.3Very high97.3Very high150 Ų15074.7 Ų74.770%0.70138%0.377SS*.Hα-helixtrans-87.5-41178-173.2170-169.300112.5G307 Y308 V309G307-E311 PolarHBondContact O-N 2.77Å; Y308-E311 PolarHBondContact O-N 3.22Å; V309-E311 VanDerWaalsContact C-N 3.28Å; V309-E311 PolarHBondContact O-N 3.05Å
312T97.7Very high97.2Very high63 Ų6377.2 Ų77.239%0.38739%0.387SS..Hα-helixtrans-94.4-40.1-173.466.90000114.3Y308Y308-T312 HydrophobicContact CD1-CG2 4.47Å; Y308-T312 HydrophobicContact CD2-CG2 4.15Å; Y308-T312 HydrophobicContact CE1-CG2 4.05Å; Y308-T312 HydrophobicContact CE2-CG2 3.72Å; Y308-T312 PolarHBondContact O-N 2.96Å; Y308-T312 PolarHBondContact O-OG1 3.39Å
313E97.9Very high97.1Very high129 Ų12977 Ų7760%0.60339%0.386SS*.THydrogen-bonded Turntrans-100.3-20.7-170.6-50-49.3123.200113.6V309 P315V309-E313 HydrophobicContact CG1-CB 4.05Å; V309-E313 HydrophobicContact CG1-CG 4.03Å; V309-E313 WeakPolarHBondContact O-CB 3.4Å; V309-E313 PolarHBondContact O-N 2.89Å; E313-P315 WeakPolarHBondContact O-CD 3.46Å
314F98.1Very high96.7Very high92 Ų9276.9 Ų76.940%0.40439%0.385SS..  trans-67.1122.6-177-175.3-101.6000111.1V309 C310 A316 A399V309-F314 PolarHBondContact O-N 3.25Å; C310-F314 VanDerWaalsContact O-CB 3.32Å; C310-F314 WeakPolarHBondContact O-CB 3.16Å; F314-A316 HydrophobicContact CD1-CB 4Å; F314-A316 HydrophobicContact CE1-CB 4.25Å; F314-A316 PolarHBondContact O-N 3.01Å; F314-A399 HydrophobicContact CB-CB 4.38Å; F314-A399 HydrophobicContact CD1-CB 3.78Å; F314-A399 HydrophobicContact CE1-CB 4.19Å; F314-A399 HydrophobicContact CG-CB 3.97Å
315P98.1Very high96.3Very high73 Ų7377.7 Ų77.747%0.47439%0.388SS..  trans-8147.4-167.733.7-38.1000113.6E313 K317 A318 V319E313-P315 WeakPolarHBondContact O-CD 3.46Å; P315-K317 VanDerWaalsContact C-N 3.27Å; P315-K317 PolarHBondContact O-N 3.06Å; P315-K317 VanDerWaalsContact O-N 3.12Å; P315-A318 HydrophobicContact CB-CB 4.36Å; P315-A318 PolarHBondContact O-N 3.43Å; P315-V319 HydrophobicContact CG-CG2 4.13Å; P315-V319 WeakPolarHBondContact O-CG2 3.41Å; P315-V319 PolarHBondContact O-N 2.89Å
316A98Very high95.8Very high13 Ų1379 Ų7911%0.10739%0.391CS..Hα-helixtrans-45.5-47.1-17500000113.6F314 A320 N402F314-A316 HydrophobicContact CD1-CB 4Å; F314-A316 HydrophobicContact CE1-CB 4.25Å; F314-A316 PolarHBondContact O-N 3.01Å; A316-A320 VanDerWaalsContact O-CB 3.27Å; A316-A320 WeakPolarHBondContact O-CB 3.34Å; A316-A320 PolarHBondContact O-N 3.33Å; A316-N402 HydrophobicContact CB-CB 4.09Å
317K97Very high95.2Very high119 Ų11976.9 Ų76.952%0.51738%0.382SS..Hα-helixtrans-66.5-46.3179.6-176.7-179.2169-172.90112.9P315 V319 A320 E321 E406P315-K317 VanDerWaalsContact C-N 3.27Å; P315-K317 PolarHBondContact O-N 3.06Å; P315-K317 VanDerWaalsContact O-N 3.12Å; K317-V319 VanDerWaalsContact C-N 3.35Å; K317-V319 PolarHBondContact O-N 3.29Å; K317-A320 WeakPolarHBondContact O-CB 3.29Å; K317-A320 PolarHBondContact O-N 2.88Å; K317-E321 WeakPolarHBondContact CE-OE1 3.28Å; K317-E321 HydrophobicContact CG-CG 4.5Å; K317-E321 IonicContact NZ-OE1 2.64Å; K317-E321 WeakPolarHBondContact O-CG 3.39Å; K317-E321 PolarHBondContact O-N 2.84Å; K317-E406 HydrophobicContact CB-CB 4.41Å; K317-E406 HydrophobicContact CB-CG 4.02Å
318A97.2Very high94.3Very high61 Ų6179.9 Ų79.950%0.50440%0.4SS..Hα-helixtrans-67-38.6-178.600000111.5P315 E321 F322P315-A318 HydrophobicContact CB-CB 4.36Å; P315-A318 PolarHBondContact O-N 3.43Å; A318-E321 PolarHBondContact O-N 3.3Å; A318-F322 WeakPolarHBondContact O-CB 3.23Å; A318-F322 PolarHBondContact O-N 2.9Å
319V97.3Very high93.7Very high51 Ų5176 Ų7631%0.30939%0.389SS..Hα-helixtrans-64.7-42.8174.1177.30000111.1P315 K317 F322 L323 Y403P315-V319 HydrophobicContact CG-CG2 4.13Å; P315-V319 WeakPolarHBondContact O-CG2 3.41Å; P315-V319 PolarHBondContact O-N 2.89Å; K317-V319 VanDerWaalsContact C-N 3.35Å; K317-V319 PolarHBondContact O-N 3.29Å; V319-F322 PolarHBondContact O-N 3.49Å; V319-L323 HydrophobicContact CG1-CD1 3.92Å; V319-L323 HydrophobicContact CG1-CG 4.5Å; V319-L323 WeakPolarHBondContact O-CG 3.23Å; V319-L323 PolarHBondContact O-N 2.61Å; V319-Y403 HydrophobicContact CB-CD2 4.18Å; V319-Y403 HydrophobicContact CG1-CD2 3.79Å; V319-Y403 HydrophobicContact CG1-CE2 3.89Å
320A96.4Very high93Very high0 Ų076.5 Ų76.50%039%0.394CS..Hα-helixtrans-60.9-48.8174.600000112.9A316 K317 F322 N324 Y403 E406 A407A316-A320 VanDerWaalsContact O-CB 3.27Å; A316-A320 WeakPolarHBondContact O-CB 3.34Å; A316-A320 PolarHBondContact O-N 3.33Å; K317-A320 WeakPolarHBondContact O-CB 3.29Å; K317-A320 PolarHBondContact O-N 2.88Å; A320-F322 VanDerWaalsContact C-N 3.3Å; A320-F322 PolarHBondContact O-N 3.4Å; A320-N324 VanDerWaalsContact O-CB 3.31Å; A320-N324 WeakPolarHBondContact O-CB 3.42Å; A320-N324 PolarHBondContact O-N 2.93Å; A320-Y403 HydrophobicContact CB-CD2 3.95Å; A320-Y403 HydrophobicContact CB-CE2 4.15Å; A320-E406 HydrophobicContact CB-CB 3.69Å; A320-A407 HydrophobicContact CB-CB 4Å
321E93.8Very high92.4Very high81 Ų8182 Ų8238%0.37942%0.422SS..Hα-helixtrans-64.8-31.9177.4-74-178.5-17900112.8K317 A318 R325K317-E321 WeakPolarHBondContact CE-OE1 3.28Å; K317-E321 HydrophobicContact CG-CG 4.5Å; K317-E321 IonicContact NZ-OE1 2.64Å; K317-E321 WeakPolarHBondContact O-CG 3.39Å; K317-E321 PolarHBondContact O-N 2.84Å; A318-E321 PolarHBondContact O-N 3.3Å; E321-R325 WeakPolarHBondContact O-CD 3.45Å; E321-R325 VanDerWaalsContact O-CG 3.31Å; E321-R325 WeakPolarHBondContact O-CG 3.34Å; E321-R325 PolarHBondContact O-NE 2.75Å
322F94.1Very high92Very high125 Ų12580.1 Ų80.155%0.54841%0.413SS..Hα-helixtrans-71.5-52175.8178.9-97.6000111.8A318 V319 A320 R325A318-F322 WeakPolarHBondContact O-CB 3.23Å; A318-F322 PolarHBondContact O-N 2.9Å; V319-F322 PolarHBondContact O-N 3.49Å; A320-F322 VanDerWaalsContact C-N 3.3Å; A320-F322 PolarHBondContact O-N 3.4Å; F322-R325 WeakPolarHBondContact O-CB 3.32Å; F322-R325 PolarHBondContact O-N 3.31Å
323L93.3Very high91.6Very high52 Ų5278 Ų7827%0.27240%0.399SS..Hα-helixtrans-69.3-34.7-176.1-69.8175.6000112.7V319 R325 Q326 Y403V319-L323 HydrophobicContact CG1-CD1 3.92Å; V319-L323 HydrophobicContact CG1-CG 4.5Å; V319-L323 WeakPolarHBondContact O-CG 3.23Å; V319-L323 PolarHBondContact O-N 2.61Å; L323-R325 PolarHBondContact O-N 3.34Å; L323-Q326 WeakPolarHBondContact O-CB 3.37Å; L323-Q326 PolarHBondContact O-N 3.12Å; L323-Q326 VanDerWaalsContact O-N 3.13Å; L323-Y403 HydrophobicContact CD1-CE2 3.88Å; L323-Y403 WeakPolarHBondContact CD1-OH 3.43Å
324N90.8Very high91.2Very high4 Ų476.5 Ų76.52%0.02140%0.398CS..Hα-helixtrans-65.3-23.6178-82.3-1.7000113.9A320 Q326 H327 A407 A410 M414A320-N324 VanDerWaalsContact O-CB 3.31Å; A320-N324 WeakPolarHBondContact O-CB 3.42Å; A320-N324 PolarHBondContact O-N 2.93Å; N324-Q326 PolarHBondContact O-N 3.2Å; N324-H327 PolarHBondContact O-N 3.13Å; N324-A407 PolarHBondContact ND2-O 3.07Å; N324-A410 WeakPolarHBondContact ND2-CB 3.43Å; N324-M414 HydrophobicContact CB-CE 4.03Å
325R88.2Confident91Very high176 Ų17676.2 Ų76.266%0.66440%0.404SS*.THydrogen-bonded Turntrans-62.3-22.9174.5-66.8164.3-162.7-162.81112.8E321 F322 L323 H327E321-R325 WeakPolarHBondContact O-CD 3.45Å; E321-R325 VanDerWaalsContact O-CG 3.31Å; E321-R325 WeakPolarHBondContact O-CG 3.34Å; E321-R325 PolarHBondContact O-NE 2.75Å; F322-R325 WeakPolarHBondContact O-CB 3.32Å; F322-R325 PolarHBondContact O-N 3.31Å; L323-R325 PolarHBondContact O-N 3.34Å; R325-H327 VanDerWaalsContact C-N 3.27Å
326Q86.7Confident90.8Very high126 Ų12675 Ų7559%0.58939%0.39SS*.THydrogen-bonded Turntrans-80.1-9.3177-56.6-178.4-11.300112.7L323 N324L323-Q326 WeakPolarHBondContact O-CB 3.37Å; L323-Q326 PolarHBondContact O-N 3.12Å; L323-Q326 VanDerWaalsContact O-N 3.13Å; N324-Q326 PolarHBondContact O-N 3.2Å
327H84.1Confident90.6Very high41 Ų4177.9 Ų77.919%0.1940%0.4CS..  trans-119.855.5-176.9-60.8-63.6000111.1N324 R325 R336N324-H327 PolarHBondContact O-N 3.13Å; R325-H327 VanDerWaalsContact C-N 3.27Å; H327-R336 HydrophobicContact CB-CG 4.27Å; H327-R336 PolarHBondContact CD2-NE 2.95Å; H327-R336 PolarHBondContact NE2-NE 3.05Å; H327-R336 PolarHBondContact NE2-NH2 2.9Å; H327-R336 VanDerWaalsContact NE2-NH2 3.16Å
328S80.4Confident90.5Very high82 Ų8276.7 Ų76.757%0.57340%0.4SS*.  trans-83.9-20.1-177.953.50000114.5P330S328-P330 VanDerWaalsContact O-CD 3.29Å; S328-P330 WeakPolarHBondContact O-CD 3.3Å
329D85.6Confident90.5Very high65 Ų6578.2 Ų78.235%0.34840%0.398SS..  trans-62.4116.2-179-172.5-19.5000111.3N331 E332 Q333D329-N331 PolarHBondContact O-N 3.16Å; D329-N331 WeakPolarHBondContact OD1-CB 3.45Å; D329-N331 PolarHBondContact OD1-N 3.19Å; D329-N331 PolarHBondContact OD1-ND2 3.38Å; D329-E332 HydrophobicContact CB-CB 4.43Å; D329-E332 HydrophobicContact CB-CG 4.27Å; D329-E332 PolarHBondContact O-N 3.26Å; D329-E332 VanDerWaalsContact O-N 3.11Å; D329-Q333 WeakPolarHBondContact O-CG 3.41Å; D329-Q333 PolarHBondContact O-N 3.43Å
330P83.8Confident90.5Very high85 Ų8576.1 Ų76.155%0.55238%0.384SS*.Hα-helixtrans-55-31.6177.7-25.835.9000114.3S328 E332 Q333S328-P330 VanDerWaalsContact O-CD 3.29Å; S328-P330 WeakPolarHBondContact O-CD 3.3Å; P330-E332 VanDerWaalsContact C-N 3.31Å; P330-E332 PolarHBondContact O-N 2.87Å; P330-Q333 PolarHBondContact O-N 2.94Å
331N86Confident90.6Very high135 Ų13580.1 Ų80.172%0.72241%0.405SS*.Hα-helixtrans-68.9-31.6-179-57.6-60.9000112D329D329-N331 PolarHBondContact O-N 3.16Å; D329-N331 WeakPolarHBondContact OD1-CB 3.45Å; D329-N331 PolarHBondContact OD1-N 3.19Å; D329-N331 PolarHBondContact OD1-ND2 3.38Å
332E88.4Confident90.8Very high109 Ų10978.8 Ų78.851%0.50941%0.408SS..Hα-helixtrans-89.3-16-179.8-61.2-163.9155.300113.3D329 P330 V334 T335 R336D329-E332 HydrophobicContact CB-CB 4.43Å; D329-E332 HydrophobicContact CB-CG 4.27Å; D329-E332 PolarHBondContact O-N 3.26Å; D329-E332 VanDerWaalsContact O-N 3.11Å; P330-E332 VanDerWaalsContact C-N 3.31Å; P330-E332 PolarHBondContact O-N 2.87Å; E332-V334 VanDerWaalsContact C-N 3.32Å; E332-V334 PolarHBondContact O-N 3.33Å; E332-T335 PolarHBondContact O-N 2.95Å; E332-R336 WeakPolarHBondContact O-CB 3.25Å; E332-R336 PolarHBondContact O-N 2.83Å
333Q87.5Confident91Very high18 Ų1875.8 Ų75.88%0.08440%0.4CS..Hα-helixtrans-57.4-40.3-174.4-73.4-172.818.400113.3D329 P330 R336 K337 M411D329-Q333 WeakPolarHBondContact O-CG 3.41Å; D329-Q333 PolarHBondContact O-N 3.43Å; P330-Q333 PolarHBondContact O-N 2.94Å; Q333-R336 PolarHBondContact O-N 3.15Å; Q333-K337 VanDerWaalsContact O-CB 3.31Å; Q333-K337 WeakPolarHBondContact O-CB 3.14Å; Q333-K337 PolarHBondContact O-N 3.37Å; Q333-M411 HydrophobicContact CB-CE 4.12Å; Q333-M411 HydrophobicContact CG-CE 4.41Å; Q333-M411 WeakPolarHBondContact O-CE 3.18Å
334V91Very high91.2Very high98 Ų9876.4 Ų76.459%0.59440%0.401SS*.Hα-helixtrans-64.8-49178.8179.50000110.4E332 R336 K337 N338E332-V334 VanDerWaalsContact C-N 3.32Å; E332-V334 PolarHBondContact O-N 3.33Å; V334-R336 VanDerWaalsContact C-N 3.33Å; V334-R336 PolarHBondContact O-N 3.3Å; V334-K337 PolarHBondContact O-N 3.18Å; V334-N338 VanDerWaalsContact O-CG 3.28Å; V334-N338 PolarHBondContact O-N 2.95Å; V334-N338 PolarHBondContact O-ND2 3.05Å
335T93.1Very high91.6Very high87 Ų8780.7 Ų80.753%0.53442%0.421SS..Hα-helixtrans-59.3-44.1176.5-52.70000111.1E332 N338 M339E332-T335 PolarHBondContact O-N 2.95Å; T335-N338 PolarHBondContact O-N 3.22Å; T335-M339 HydrophobicContact CG2-CE 4.34Å; T335-M339 WeakPolarHBondContact O-CG 3.43Å; T335-M339 PolarHBondContact O-N 2.95Å
336R93.7Very high92.1Very high47 Ų4777.6 Ų77.618%0.17742%0.416CS..Hα-helixtrans-64.7-42.7178.2-178.158.7176.5-173-4.9112.5H327 E332 Q333 V334 N338 M339 L340 M411H327-R336 HydrophobicContact CB-CG 4.27Å; H327-R336 PolarHBondContact CD2-NE 2.95Å; H327-R336 PolarHBondContact NE2-NE 3.05Å; H327-R336 PolarHBondContact NE2-NH2 2.9Å; H327-R336 VanDerWaalsContact NE2-NH2 3.16Å; E332-R336 WeakPolarHBondContact O-CB 3.25Å; E332-R336 PolarHBondContact O-N 2.83Å; Q333-R336 PolarHBondContact O-N 3.15Å; V334-R336 VanDerWaalsContact C-N 3.33Å; V334-R336 PolarHBondContact O-N 3.3Å; R336-N338 VanDerWaalsContact C-N 3.35Å; R336-M339 HydrophobicContact CB-CE 4.4Å; R336-M339 PolarHBondContact O-N 2.96Å; R336-L340 WeakPolarHBondContact O-CG 3.34Å; R336-L340 PolarHBondContact O-N 3.44Å; R336-M411 HydrophobicContact CB-CE 3.96Å; R336-M411 HydrophobicContact CG-CE 3.96Å; R336-M411 HydrophobicContact CG-SD 3.96Å
337K93.8Very high92.6Very high73 Ų7372.3 Ų72.332%0.31739%0.393SS..Hα-helixtrans-62-42.9175.4-175.9167.4-179.8168.40111.2Q333 V334 L340 L341 L408 M411 D412Q333-K337 VanDerWaalsContact O-CB 3.31Å; Q333-K337 WeakPolarHBondContact O-CB 3.14Å; Q333-K337 PolarHBondContact O-N 3.37Å; V334-K337 PolarHBondContact O-N 3.18Å; K337-L340 PolarHBondContact O-N 3.23Å; K337-L341 HydrophobicContact CG-CD1 4.27Å; K337-L341 WeakPolarHBondContact O-CG 3.41Å; K337-L341 PolarHBondContact O-N 3.48Å; K337-L408 HydrophobicContact CG-CD2 3.89Å; K337-M411 HydrophobicContact CB-CE 3.98Å; K337-M411 HydrophobicContact CB-SD 4.33Å; K337-D412 IonicContact NZ-OD1 3.42Å; K337-D412 PolarHBondContact NZ-OD1 2.96Å; K337-D412 IonicContact NZ-OD2 3.03Å
338N96Very high93.3Very high95 Ų9575 Ų7551%0.50840%0.404SS..Hα-helixtrans-63.8-41.8176.2-69.9-14.5000112.1V334 T335 R336 L341 A342V334-N338 VanDerWaalsContact O-CG 3.28Å; V334-N338 PolarHBondContact O-N 2.95Å; V334-N338 PolarHBondContact O-ND2 3.05Å; T335-N338 PolarHBondContact O-N 3.22Å; R336-N338 VanDerWaalsContact C-N 3.35Å; N338-L341 PolarHBondContact O-N 2.65Å; N338-A342 WeakPolarHBondContact O-CB 3.27Å; N338-A342 PolarHBondContact O-N 3.25Å
339M96.6Very high94.1Very high93 Ų9376.1 Ų76.146%0.45840%0.4SS..Hα-helixtrans-59.7-46.3173.6-73.1-171.1-70.400112T335 R336 L341 A342 T343T335-M339 HydrophobicContact CG2-CE 4.34Å; T335-M339 WeakPolarHBondContact O-CG 3.43Å; T335-M339 PolarHBondContact O-N 2.95Å; R336-M339 HydrophobicContact CB-CE 4.4Å; R336-M339 PolarHBondContact O-N 2.96Å; M339-L341 PolarHBondContact O-N 3.03Å; M339-A342 PolarHBondContact O-N 3.13Å; M339-T343 PolarHBondContact O-N 2.84Å; M339-T343 PolarHBondContact O-OG1 2.73Å
340L96.8Very high94.7Very high6 Ų677.5 Ų77.53%0.03140%0.403CS..Hα-helixtrans-61.8-41.4177.8-69.6174.6000112.5R336 K337 K344 L404 A407 L408 M411R336-L340 WeakPolarHBondContact O-CG 3.34Å; R336-L340 PolarHBondContact O-N 3.44Å; K337-L340 PolarHBondContact O-N 3.23Å; L340-K344 VanDerWaalsContact O-CB 3.31Å; L340-K344 WeakPolarHBondContact O-CB 3.28Å; L340-K344 PolarHBondContact O-N 3.08Å; L340-L404 HydrophobicContact CD2-CD2 3.6Å; L340-A407 HydrophobicContact CD1-CB 3.9Å; L340-A407 HydrophobicContact CD2-CB 4.25Å; L340-L408 HydrophobicContact CB-CD2 3.81Å; L340-L408 HydrophobicContact CB-CG 4.12Å; L340-L408 HydrophobicContact CD1-CD2 4.13Å; L340-L408 HydrophobicContact CD1-CG 4.33Å; L340-M411 HydrophobicContact CD1-SD 3.52Å; L340-M411 VanDerWaalsContact CD1-SD 3.52Å
341L97.9Very high95.3Very high84 Ų8474.4 Ų74.444%0.4438%0.383SS..Hα-helixtrans-64.2-46.2176.1-72.6169.4000111.7K337 N338 M339 K344 Q345 L408K337-L341 HydrophobicContact CG-CD1 4.27Å; K337-L341 WeakPolarHBondContact O-CG 3.41Å; K337-L341 PolarHBondContact O-N 3.48Å; N338-L341 PolarHBondContact O-N 2.65Å; M339-L341 PolarHBondContact O-N 3.03Å; L341-K344 PolarHBondContact O-N 3.07Å; L341-Q345 PolarHBondContact O-N 2.86Å; L341-L408 HydrophobicContact CD2-CD1 3.74Å; L341-L408 HydrophobicContact CD2-CD2 4.17Å; L341-L408 HydrophobicContact CG-CD1 4.35Å; L341-L408 HydrophobicContact CG-CD2 4.02Å
342A98.4Very high95.9Very high53 Ų5371.4 Ų71.444%0.43837%0.367SS..Hα-helixtrans-62.1-46.4177.200000111.9N338 M339 K344 Q345 I346N338-A342 WeakPolarHBondContact O-CB 3.27Å; N338-A342 PolarHBondContact O-N 3.25Å; M339-A342 PolarHBondContact O-N 3.13Å; A342-K344 VanDerWaalsContact C-N 3.33Å; A342-K344 PolarHBondContact O-N 3.4Å; A342-Q345 PolarHBondContact O-N 3.27Å; A342-I346 WeakPolarHBondContact O-CG1 3.46Å; A342-I346 PolarHBondContact O-N 3.02Å
343T98.5Very high96.3Very high63 Ų6369.3 Ų69.339%0.38736%0.359SS..Hα-helixtrans-58.9-44.8175-52.80000111.2M339 Q345 I346 C347 L404M339-T343 PolarHBondContact O-N 2.84Å; M339-T343 PolarHBondContact O-OG1 2.73Å; T343-Q345 VanDerWaalsContact C-N 3.32Å; T343-Q345 PolarHBondContact O-N 3.36Å; T343-I346 PolarHBondContact O-N 2.95Å; T343-C347 PolarHBondContact O-N 3.04Å; T343-C347 PolarHBondContact O-SG 3.44Å; T343-L404 HydrophobicContact CG2-CD1 3.85Å; T343-L404 HydrophobicContact CG2-CD2 4.28Å
344K98Very high96.7Very high65 Ų6569.1 Ų69.128%0.28336%0.358SS..Hα-helixtrans-62.1-39.4179.4-178.7173172.6173.60112.2L340 L341 A342 K348 L404 T405 L408L340-K344 VanDerWaalsContact O-CB 3.31Å; L340-K344 WeakPolarHBondContact O-CB 3.28Å; L340-K344 PolarHBondContact O-N 3.08Å; L341-K344 PolarHBondContact O-N 3.07Å; A342-K344 VanDerWaalsContact C-N 3.33Å; A342-K344 PolarHBondContact O-N 3.4Å; K344-K348 PolarHBondContact O-N 2.95Å; K344-K348 VanDerWaalsContact O-N 3.07Å; K344-L404 HydrophobicContact CB-CB 4.29Å; K344-L404 HydrophobicContact CB-CD1 3.97Å; K344-T405 PolarHBondContact NZ-OG1 3.17Å; K344-L408 HydrophobicContact CD-CD1 4.36Å
345Q98.4Very high96.9Very high94 Ų9467.1 Ų67.144%0.43935%0.352SS..Hα-helixtrans-65.7-45.9176.8179.756.528.200111.7L341 A342 T343 C347 K348 E349L341-Q345 PolarHBondContact O-N 2.86Å; A342-Q345 PolarHBondContact O-N 3.27Å; T343-Q345 VanDerWaalsContact C-N 3.32Å; T343-Q345 PolarHBondContact O-N 3.36Å; Q345-C347 PolarHBondContact O-N 3.04Å; Q345-K348 WeakPolarHBondContact O-CB 3.31Å; Q345-K348 PolarHBondContact O-N 3.3Å; Q345-K348 VanDerWaalsContact O-N 3.11Å; Q345-E349 WeakPolarHBondContact CG-OE1 3.33Å; Q345-E349 PolarHBondContact NE2-OE1 3.08Å; Q345-E349 PolarHBondContact O-N 3.45Å
346I98.5Very high97.1Very high111 Ų11166.9 Ų66.957%0.56935%0.345SS*.Hα-helixtrans-61.1-43175.9-65.7165.1000111.3A342 T343 K348 E349 F350A342-I346 WeakPolarHBondContact O-CG1 3.46Å; A342-I346 PolarHBondContact O-N 3.02Å; T343-I346 PolarHBondContact O-N 2.95Å; I346-K348 VanDerWaalsContact C-N 3.27Å; I346-K348 PolarHBondContact O-N 3.4Å; I346-E349 PolarHBondContact O-N 2.98Å; I346-F350 WeakPolarHBondContact O-CB 3.31Å; I346-F350 PolarHBondContact O-N 3.31Å
347C98.5Very high97.1Very high14 Ų1465.6 Ų65.610%0.09534%0.341CS..Hα-helixtrans-58.6-40.3174.8-70.10000112.1T343 Q345 T351 V397 Q401T343-C347 PolarHBondContact O-N 3.04Å; T343-C347 PolarHBondContact O-SG 3.44Å; Q345-C347 PolarHBondContact O-N 3.04Å; C347-T351 PolarHBondContact O-N 2.9Å; C347-T351 VanDerWaalsContact O-N 3.1Å; C347-T351 PolarHBondContact O-OG1 3.42Å; C347-V397 HydrophobicContact CB-CG1 3.76Å; C347-Q401 HydrophobicContact CB-CG 3.65Å
348K97.4Very high97.2Very high97 Ų9766 Ų6642%0.42234%0.341SS..Hα-helixtrans-66.2-50.2178.2-171.7-165.8170.7-152.70111.5K344 Q345 I346 F350 T351 D352K344-K348 PolarHBondContact O-N 2.95Å; K344-K348 VanDerWaalsContact O-N 3.07Å; Q345-K348 WeakPolarHBondContact O-CB 3.31Å; Q345-K348 PolarHBondContact O-N 3.3Å; Q345-K348 VanDerWaalsContact O-N 3.11Å; I346-K348 VanDerWaalsContact C-N 3.27Å; I346-K348 PolarHBondContact O-N 3.4Å; K348-F350 PolarHBondContact O-N 3.3Å; K348-T351 WeakPolarHBondContact CA-OG1 3.35Å; K348-T351 PolarHBondContact O-N 3.33Å; K348-T351 PolarHBondContact O-OG1 2.82Å; K348-D352 VanDerWaalsContact CE-OD2 3.23Å; K348-D352 WeakPolarHBondContact CE-OD2 3.31Å; K348-D352 IonicContact NZ-OD2 3.74Å; K348-D352 WeakPolarHBondContact O-CB 3.49Å; K348-D352 PolarHBondContact O-N 2.85Å
349E98.1Very high97.1Very high107 Ų10761.9 Ų61.950%0.532%0.32SS..Hα-helixtrans-55.3-41.7177.9-73167.2-163.400111.8Q345 I346 D352 L353Q345-E349 WeakPolarHBondContact CG-OE1 3.33Å; Q345-E349 PolarHBondContact NE2-OE1 3.08Å; Q345-E349 PolarHBondContact O-N 3.45Å; I346-E349 PolarHBondContact O-N 2.98Å; E349-D352 PolarHBondContact O-N 3.5Å; E349-L353 PolarHBondContact O-N 2.94Å
350F98.1Very high96.8Very high94 Ų9459.6 Ų59.641%0.41231%0.312SS..Hα-helixtrans-64.3-43.1175-178.6-115.8000112.8I346 K348 L353 L354 V393 V397I346-F350 WeakPolarHBondContact O-CB 3.31Å; I346-F350 PolarHBondContact O-N 3.31Å; K348-F350 PolarHBondContact O-N 3.3Å; F350-L353 PolarHBondContact O-N 3.32Å; F350-L354 HydrophobicContact CD1-CD1 4.34Å; F350-L354 HydrophobicContact CE1-CD1 3.84Å; F350-L354 HydrophobicContact CE2-CD1 4.48Å; F350-L354 HydrophobicContact CZ-CD1 3.92Å; F350-L354 HydrophobicContact CZ-CG 4.47Å; F350-L354 WeakPolarHBondContact O-CG 3.27Å; F350-L354 PolarHBondContact O-N 3.23Å; F350-V393 HydrophobicContact CE1-CG1 3.67Å; F350-V393 HydrophobicContact CZ-CG1 4.09Å; F350-V397 HydrophobicContact CD1-CG2 4.15Å; F350-V397 HydrophobicContact CE1-CG2 4.19Å
351T97.6Very high96.4Very high19 Ų1961 Ų6112%0.11732%0.319CS..Hα-helixtrans-68.6-34.6174.7480000113.2C347 K348 L353 L354 A355 V397C347-T351 PolarHBondContact O-N 2.9Å; C347-T351 VanDerWaalsContact O-N 3.1Å; C347-T351 PolarHBondContact O-OG1 3.42Å; K348-T351 WeakPolarHBondContact CA-OG1 3.35Å; K348-T351 PolarHBondContact O-N 3.33Å; K348-T351 PolarHBondContact O-OG1 2.82Å; T351-L353 VanDerWaalsContact C-N 3.32Å; T351-L353 PolarHBondContact O-N 2.87Å; T351-L354 PolarHBondContact O-N 2.78Å; T351-A355 PolarHBondContact O-N 3.07Å; T351-V397 HydrophobicContact CG2-CB 3.91Å; T351-V397 HydrophobicContact CG2-CG1 3.63Å
352D97.1Very high95.7Very high73 Ų7357.9 Ų57.939%0.3931%0.307SS..Hα-helixtrans-68.1-32.3177.5-71.9-13000111K348 E349 Q356K348-D352 VanDerWaalsContact CE-OD2 3.23Å; K348-D352 WeakPolarHBondContact CE-OD2 3.31Å; K348-D352 IonicContact NZ-OD2 3.74Å; K348-D352 WeakPolarHBondContact O-CB 3.49Å; K348-D352 PolarHBondContact O-N 2.85Å; E349-D352 PolarHBondContact O-N 3.5Å; D352-Q356 WeakPolarHBondContact O-CG 3.37Å; D352-Q356 PolarHBondContact O-N 3.1Å; D352-Q356 PolarHBondContact O-NE2 3.49Å
353L97.4Very high94.7Very high64 Ų6459 Ų5934%0.33531%0.306SS..Hα-helixtrans-65-48168.7-178.674.6000111.6E349 F350 T351 A355 Q356 L370E349-L353 PolarHBondContact O-N 2.94Å; F350-L353 PolarHBondContact O-N 3.32Å; T351-L353 VanDerWaalsContact C-N 3.32Å; T351-L353 PolarHBondContact O-N 2.87Å; L353-A355 VanDerWaalsContact C-N 3.28Å; L353-A355 PolarHBondContact O-N 3.42Å; L353-Q356 WeakPolarHBondContact O-CB 3.41Å; L353-Q356 PolarHBondContact O-N 3.42Å; L353-L370 HydrophobicContact CD1-CD1 4.46Å; L353-L370 HydrophobicContact CD1-CD2 3.81Å
354L96.8Very high93.9Very high15 Ų1558.9 Ų58.98%0.07931%0.308CS..Hα-helixtrans-64.6-31.3179.6-66.7178000112.5F350 T351 Q356 D357 L378 V393F350-L354 HydrophobicContact CD1-CD1 4.34Å; F350-L354 HydrophobicContact CE1-CD1 3.84Å; F350-L354 HydrophobicContact CE2-CD1 4.48Å; F350-L354 HydrophobicContact CZ-CD1 3.92Å; F350-L354 HydrophobicContact CZ-CG 4.47Å; F350-L354 WeakPolarHBondContact O-CG 3.27Å; F350-L354 PolarHBondContact O-N 3.23Å; T351-L354 PolarHBondContact O-N 2.78Å; L354-Q356 PolarHBondContact O-N 2.87Å; L354-D357 WeakPolarHBondContact O-CB 3.5Å; L354-D357 PolarHBondContact O-N 3.33Å; L354-L378 HydrophobicContact CD2-CD2 3.64Å; L354-V393 HydrophobicContact CD1-CB 4.3Å; L354-V393 HydrophobicContact CD1-CG1 3.73Å
355A95.1Very high93.4Very high55 Ų5562 Ų6246%0.45532%0.317SS..Hα-helixtrans-69-19.3173.800000113.8T351 L353 D357 R358T351-A355 PolarHBondContact O-N 3.07Å; L353-A355 VanDerWaalsContact C-N 3.28Å; L353-A355 PolarHBondContact O-N 3.42Å; A355-D357 VanDerWaalsContact C-N 3.35Å; A355-R358 PolarHBondContact O-NH1 2.89Å
356Q95.5Very high93.1Very high82 Ų8259.8 Ų59.838%0.38331%0.311SS..THydrogen-bonded Turntrans-85.8-5.6175.3-71.9169.876.400113.5D352 L353 L354 R358 I369 L370D352-Q356 WeakPolarHBondContact O-CG 3.37Å; D352-Q356 PolarHBondContact O-N 3.1Å; D352-Q356 PolarHBondContact O-NE2 3.49Å; L353-Q356 WeakPolarHBondContact O-CB 3.41Å; L353-Q356 PolarHBondContact O-N 3.42Å; L354-Q356 PolarHBondContact O-N 2.87Å; Q356-R358 VanDerWaalsContact C-NH1 3.28Å; Q356-R358 WeakPolarHBondContact O-CG 3.43Å; Q356-R358 PolarHBondContact O-N 3.08Å; Q356-R358 PolarHBondContact O-NH1 3.36Å; Q356-I369 HydrophobicContact CB-CD1 4Å; Q356-I369 HydrophobicContact CB-CG1 4.42Å; Q356-I369 HydrophobicContact CG-CD1 4.23Å; Q356-I369 WeakPolarHBondContact O-CD1 3.27Å; Q356-I369 WeakPolarHBondContact O-CG1 3.4Å; Q356-L370 HydrophobicContact CB-CD1 4.23Å; Q356-L370 HydrophobicContact CB-CD2 3.77Å; Q356-L370 HydrophobicContact CB-CG 4.06Å
357D95.3Very high92.8Very high20 Ų2061.2 Ų61.211%0.10732%0.32CS..  trans-57.5129.7177.6-171.5-7.2000112L354 A355 S359 Q375 L378 N382L354-D357 WeakPolarHBondContact O-CB 3.5Å; L354-D357 PolarHBondContact O-N 3.33Å; A355-D357 VanDerWaalsContact C-N 3.35Å; D357-S359 VanDerWaalsContact CG-OG 3.31Å; D357-S359 WeakPolarHBondContact OD1-CB 3.12Å; D357-S359 PolarHBondContact OD1-N 3.25Å; D357-S359 PolarHBondContact OD1-OG 2.75Å; D357-S359 PolarHBondContact OD2-OG 3.06Å; D357-Q375 PolarHBondContact OD1-NE2 2.99Å; D357-L378 HydrophobicContact CB-CD1 4.17Å; D357-N382 PolarHBondContact OD2-ND2 3.2Å
358R95.2Very high92.6Very high81 Ų8164.8 Ų64.831%0.30634%0.343SS..  trans-118.338.4177.3-60.8-57.8173.8-103.90.7111.8A355 Q356 P366 N367 I369A355-R358 PolarHBondContact O-NH1 2.89Å; Q356-R358 VanDerWaalsContact C-NH1 3.28Å; Q356-R358 WeakPolarHBondContact O-CG 3.43Å; Q356-R358 PolarHBondContact O-N 3.08Å; Q356-R358 PolarHBondContact O-NH1 3.36Å; R358-P366 HydrophobicContact CB-CB 4.08Å; R358-P366 HydrophobicContact CB-CG 3.78Å; R358-P366 HydrophobicContact CG-CB 4.34Å; R358-P366 HydrophobicContact CG-CG 4.45Å; R358-P366 WeakPolarHBondContact O-CG 3.5Å; R358-N367 WeakPolarHBondContact CG-O 3.28Å; R358-I369 HydrophobicContact CG-CD1 4.34Å; R358-I369 HydrophobicContact CG-CG1 3.95Å; R358-I369 HydrophobicContact CG-CG2 4.49Å
359S94.4Very high92.6Very high10 Ų1064.8 Ų64.87%0.0735%0.347CS..  trans-57128.5173.3-68.80000112.2D357 L361 T379 N382D357-S359 VanDerWaalsContact CG-OG 3.31Å; D357-S359 WeakPolarHBondContact OD1-CB 3.12Å; D357-S359 PolarHBondContact OD1-N 3.25Å; D357-S359 PolarHBondContact OD1-OG 2.75Å; D357-S359 PolarHBondContact OD2-OG 3.06Å; S359-L361 VanDerWaalsContact C-N 3.33Å; S359-L361 PolarHBondContact O-N 3.48Å; S359-T379 VanDerWaalsContact OG-CA 3.28Å; S359-T379 WeakPolarHBondContact OG-CA 3.4Å; S359-T379 PolarHBondContact OG-N 3.02Å; S359-N382 VanDerWaalsContact CB-ND2 3.27Å; S359-N382 WeakPolarHBondContact CB-ND2 3.47Å; S359-N382 PolarHBondContact OG-ND2 3.31Å
360P90.6Very high92.5Very high44 Ų4460.7 Ų60.729%0.28633%0.328SS..  trans-75.280178.630.5-36000112.1S364 T379P360-S364 WeakPolarHBondContact CA-O 3.42Å; P360-T379 HydrophobicContact CG-CG2 4.38Å
361L86.8Confident92.4Very high36 Ų3663 Ų6319%0.18834%0.34CS..  trans-99.4147.6175.1-74.6171.2000112S359 N363 S364 N382 G387S359-L361 VanDerWaalsContact C-N 3.33Å; S359-L361 PolarHBondContact O-N 3.48Å; L361-N363 PolarHBondContact O-N 2.85Å; L361-S364 PolarHBondContact O-N 3.15Å; L361-S364 PolarHBondContact O-OG 3.04Å; L361-N382 HydrophobicContact CD1-CB 3.86Å; L361-N382 HydrophobicContact CD2-CB 4.45Å; L361-N382 HydrophobicContact CG-CB 4.28Å; L361-G387 VanDerWaalsContact CD1-CA 3.42Å
362G84Confident92.4Very high18 Ų1866.9 Ų66.919%0.18637%0.366CS..THydrogen-bonded Turntrans49.3-120.5-174.500000111.4A234 E296 R365A234-G362 WeakPolarHBondContact CB-O 3.33Å; E296-G362 WeakPolarHBondContact OE2-CA 3.33Å; E296-G362 PolarHBondContact OE2-N 3.24Å; G362-R365 PolarHBondContact O-NH1 3.15Å; G362-R365 PolarHBondContact O-NH2 3.27Å
363N78Confident92.4Very high77 Ų7765.8 Ų65.841%0.41237%0.372SS..THydrogen-bonded Turntrans-95.3-5.9-177.7-65.9-1.5000113.3N210 T232 L361N210-N363 WeakPolarHBondContact OD1-CB 3.29Å; N210-N363 PolarHBondContact OD1-ND2 3.24Å; N210-N363 VanDerWaalsContact OD1-ND2 3.16Å; T232-N363 PolarHBondContact OG1-OD1 2.74Å; L361-N363 PolarHBondContact O-N 2.85Å
364S81.3Confident92.4Very high61 Ų6166.6 Ų66.643%0.42738%0.375SS..  trans-82.1134.7-17974.70000111.2P360 L361 P366P360-S364 WeakPolarHBondContact CA-O 3.42Å; L361-S364 PolarHBondContact O-N 3.15Å; L361-S364 PolarHBondContact O-OG 3.04Å; S364-P366 VanDerWaalsContact C-CD 3.4Å
365R86.7Confident92.4Very high130 Ų13066.3 Ų66.349%0.49137%0.374SS..  trans-130.461.5173.4-61.9-64.2178.9-87-2.1109.7G362G362-R365 PolarHBondContact O-NH1 3.15Å; G362-R365 PolarHBondContact O-NH2 3.27Å
366P92.2Very high92.5Very high48 Ų4867.4 Ų67.431%0.31238%0.378SS..PPolyproline II helixtrans-67.9152.1179.429.8-35.1000111.4R358 S364R358-P366 HydrophobicContact CB-CB 4.08Å; R358-P366 HydrophobicContact CB-CG 3.78Å; R358-P366 HydrophobicContact CG-CB 4.34Å; R358-P366 HydrophobicContact CG-CG 4.45Å; R358-P366 WeakPolarHBondContact O-CG 3.5Å; S364-P366 VanDerWaalsContact C-CD 3.4Å
367N93Very high92.6Very high140 Ų14067.7 Ų67.775%0.74939%0.388SS*.PPolyproline II helixtrans-68.2132.4170.8-68.8-20.5000109.9R358 I369R358-N367 WeakPolarHBondContact CG-O 3.28Å; N367-I369 PolarHBondContact O-N 3.09Å
368P93.9Very high92.7Very high90 Ų9067.8 Ų67.858%0.58439%0.389SS*.PPolyproline II helixtrans-51.5135.4168.4-31.439.1000112.8Q375P368-Q375 HydrophobicContact CB-CG 4.12Å; P368-Q375 HydrophobicContact CG-CG 4.41Å
369I96.4Very high92.8Very high97 Ų9765.1 Ų65.150%0.49738%0.381SS..  trans-119.8-15.7172.666176.3000113.1Q356 R358 N367Q356-I369 HydrophobicContact CB-CD1 4Å; Q356-I369 HydrophobicContact CB-CG1 4.42Å; Q356-I369 HydrophobicContact CG-CD1 4.23Å; Q356-I369 WeakPolarHBondContact O-CD1 3.27Å; Q356-I369 WeakPolarHBondContact O-CG1 3.4Å; R358-I369 HydrophobicContact CG-CD1 4.34Å; R358-I369 HydrophobicContact CG-CG1 3.95Å; R358-I369 HydrophobicContact CG-CG2 4.49Å; N367-I369 PolarHBondContact O-N 3.09Å
370L96.9Very high92.8Very high20 Ų2069.3 Ų69.311%0.10540%0.4CS..SBendtrans-89.6156.3175.9-66.9175.8000110.6L353 Q356 I374 Q375 L378L353-L370 HydrophobicContact CD1-CD1 4.46Å; L353-L370 HydrophobicContact CD1-CD2 3.81Å; Q356-L370 HydrophobicContact CB-CD1 4.23Å; Q356-L370 HydrophobicContact CB-CD2 3.77Å; Q356-L370 HydrophobicContact CB-CG 4.06Å; L370-I374 HydrophobicContact CD1-CG2 4.32Å; L370-Q375 HydrophobicContact CB-CB 4.19Å; L370-L378 HydrophobicContact CD1-CD1 3.63Å
371E97Very high93.1Very high144 Ų14471 Ų7167%0.67340%0.402SS*.  trans-46.8134.7172.3-82.1-61.2146.800111.9G373 I374 Q375E371-G373 PolarHBondContact O-N 3.26Å; E371-I374 HydrophobicContact CB-CG1 4.27Å; E371-I374 PolarHBondContact O-N 2.97Å; E371-Q375 PolarHBondContact O-N 3.41Å
372P96.4Very high93.6Very high100 Ų10069.5 Ų69.565%0.64940%0.395SS*.Hα-helixtrans-55.1-35.5-170.1-29.336.1000114.6S376P372-S376 WeakPolarHBondContact O-CB 3.44Å; P372-S376 PolarHBondContact O-N 3.16Å
373G97.7Very high94.1Very high50 Ų5069.7 Ų69.752%0.51539%0.392SS..Hα-helixtrans-64.2-44.6175.500000112.8E371 C377E371-G373 PolarHBondContact O-N 3.26Å; G373-C377 PolarHBondContact O-N 2.97Å; G373-C377 PolarHBondContact O-SG 3.38Å; G373-C377 VanDerWaalsContact O-SG 3.34Å
374I97.4Very high94.9Very high80 Ų8068.9 Ų68.941%0.4139%0.387SS..Hα-helixtrans-69.9-47.6178.8-57.4-59000110.4L370 E371 S376 C377 L378L370-I374 HydrophobicContact CD1-CG2 4.32Å; E371-I374 HydrophobicContact CB-CG1 4.27Å; E371-I374 PolarHBondContact O-N 2.97Å; I374-S376 VanDerWaalsContact C-N 3.28Å; I374-S376 PolarHBondContact O-N 3.45Å; I374-C377 PolarHBondContact O-N 3.48Å; I374-L378 HydrophobicContact CG2-CD1 3.95Å; I374-L378 HydrophobicContact CG2-CG 4.38Å; I374-L378 WeakPolarHBondContact O-CG 3.37Å; I374-L378 PolarHBondContact O-N 3.48Å
375Q97.3Very high95.7Very high9 Ų966.1 Ų66.14%0.04237%0.367CS..Hα-helixtrans-61.7-37178.2-171.759.469.200111.6D357 P368 L370 E371 T379D357-Q375 PolarHBondContact OD1-NE2 2.99Å; P368-Q375 HydrophobicContact CB-CG 4.12Å; P368-Q375 HydrophobicContact CG-CG 4.41Å; L370-Q375 HydrophobicContact CB-CB 4.19Å; E371-Q375 PolarHBondContact O-N 3.41Å; Q375-T379 PolarHBondContact NE2-OG1 3.24Å; Q375-T379 WeakPolarHBondContact O-CB 3.31Å; Q375-T379 PolarHBondContact O-N 3.18Å; Q375-T379 PolarHBondContact O-OG1 2.92Å
376S96.9Very high96.1Very high78 Ų7860 Ų6055%0.54534%0.344SS..Hα-helixtrans-62.4-46.5175.8-1760000112.1P372 I374 T379 H380P372-S376 WeakPolarHBondContact O-CB 3.44Å; P372-S376 PolarHBondContact O-N 3.16Å; I374-S376 VanDerWaalsContact C-N 3.28Å; I374-S376 PolarHBondContact O-N 3.45Å; S376-T379 PolarHBondContact O-N 3.12Å; S376-H380 PolarHBondContact O-N 2.74Å
377C97.3Very high96.2Very high89 Ų8958 Ų5860%0.60133%0.332SS*.Hα-helixtrans-63.2-46.8177.1-70.50000112.6G373 I374 H380 F381G373-C377 PolarHBondContact O-N 2.97Å; G373-C377 PolarHBondContact O-SG 3.38Å; G373-C377 VanDerWaalsContact O-SG 3.34Å; I374-C377 PolarHBondContact O-N 3.48Å; C377-H380 PolarHBondContact O-N 3.48Å; C377-F381 PolarHBondContact O-N 3.08Å
378L97.2Very high96.4Very high22 Ų2253.4 Ų53.412%0.11531%0.306CS..Hα-helixtrans-63.1-41.9176.3-69.7176.2000111.7L354 D357 L370 I374 H380 F381 N382L354-L378 HydrophobicContact CD2-CD2 3.64Å; D357-L378 HydrophobicContact CB-CD1 4.17Å; L370-L378 HydrophobicContact CD1-CD1 3.63Å; I374-L378 HydrophobicContact CG2-CD1 3.95Å; I374-L378 HydrophobicContact CG2-CG 4.38Å; I374-L378 WeakPolarHBondContact O-CG 3.37Å; I374-L378 PolarHBondContact O-N 3.48Å; L378-H380 PolarHBondContact O-N 3.27Å; L378-F381 PolarHBondContact O-N 3.3Å; L378-N382 WeakPolarHBondContact O-CB 3.5Å; L378-N382 PolarHBondContact O-N 3.23Å
379T96.5Very high96.6Very high25 Ų2549.3 Ų49.315%0.15328%0.28CS..Hα-helixtrans-58.1-50.6173.4-58.50000110.6S359 P360 Q375 S376 F381 N382 L383S359-T379 VanDerWaalsContact OG-CA 3.28Å; S359-T379 WeakPolarHBondContact OG-CA 3.4Å; S359-T379 PolarHBondContact OG-N 3.02Å; P360-T379 HydrophobicContact CG-CG2 4.38Å; Q375-T379 PolarHBondContact NE2-OG1 3.24Å; Q375-T379 WeakPolarHBondContact O-CB 3.31Å; Q375-T379 PolarHBondContact O-N 3.18Å; Q375-T379 PolarHBondContact O-OG1 2.92Å; S376-T379 PolarHBondContact O-N 3.12Å; T379-F381 VanDerWaalsContact C-N 3.34Å; T379-F381 PolarHBondContact O-N 3.44Å; T379-N382 PolarHBondContact O-N 2.93Å; T379-L383 HydrophobicContact CG2-CD1 3.67Å; T379-L383 HydrophobicContact CG2-CG 3.99Å; T379-L383 WeakPolarHBondContact O-CB 3.41Å; T379-L383 WeakPolarHBondContact O-CG 3.23Å; T379-L383 PolarHBondContact O-N 3.36Å
380H96.2Very high96.6Very high98 Ų9845 Ų4545%0.45426%0.258SS..Hα-helixtrans-55.2-49.6177.3-173.2101.6000111.8S376 C377 L378 N382 L383 I384S376-H380 PolarHBondContact O-N 2.74Å; C377-H380 PolarHBondContact O-N 3.48Å; L378-H380 PolarHBondContact O-N 3.27Å; H380-N382 PolarHBondContact O-N 2.81Å; H380-L383 PolarHBondContact O-N 2.72Å; H380-I384 WeakPolarHBondContact O-CG1 3.47Å; H380-I384 PolarHBondContact O-N 2.92Å
381F96.9Very high96.6Very high78 Ų7847 Ų4734%0.34227%0.273SS..Hα-helixtrans-58.9-43.8179.3174.5-119.3000112.9C377 L378 T379 I384 S385 G389 V393C377-F381 PolarHBondContact O-N 3.08Å; L378-F381 PolarHBondContact O-N 3.3Å; T379-F381 VanDerWaalsContact C-N 3.34Å; T379-F381 PolarHBondContact O-N 3.44Å; F381-I384 VanDerWaalsContact O-CG1 3.27Å; F381-I384 WeakPolarHBondContact O-CG1 3.38Å; F381-S385 WeakPolarHBondContact O-CB 3.43Å; F381-S385 PolarHBondContact O-N 3.25Å; F381-S385 VanDerWaalsContact O-N 3.08Å; F381-S385 PolarHBondContact O-OG 2.76Å; F381-G389 VanDerWaalsContact CZ-CA 3.47Å; F381-V393 HydrophobicContact CE1-CG2 4.47Å; F381-V393 HydrophobicContact CZ-CG2 4.18Å
382N95.8Very high96.6Very high6 Ų640.7 Ų40.73%0.03225%0.245CC..Hα-helixtrans-69.2-39.5176.8-89.2-23.7000113D357 S359 L361 L378 T379 H380 S385 H386 G387 S390D357-N382 PolarHBondContact OD2-ND2 3.2Å; S359-N382 VanDerWaalsContact CB-ND2 3.27Å; S359-N382 WeakPolarHBondContact CB-ND2 3.47Å; S359-N382 PolarHBondContact OG-ND2 3.31Å; L361-N382 HydrophobicContact CD1-CB 3.86Å; L361-N382 HydrophobicContact CD2-CB 4.45Å; L361-N382 HydrophobicContact CG-CB 4.28Å; L378-N382 WeakPolarHBondContact O-CB 3.5Å; L378-N382 PolarHBondContact O-N 3.23Å; T379-N382 PolarHBondContact O-N 2.93Å; H380-N382 PolarHBondContact O-N 2.81Å; N382-S385 PolarHBondContact O-N 2.83Å; N382-S385 PolarHBondContact O-OG 2.68Å; N382-H386 WeakPolarHBondContact O-CA 3.45Å; N382-H386 PolarHBondContact O-N 2.92Å; N382-G387 PolarHBondContact O-N 2.78Å; N382-G387 VanDerWaalsContact O-N 3.13Å; N382-S390 PolarHBondContact OD1-OG 3.19Å
383L95.4Very high96.7Very high22 Ų2238.4 Ų38.412%0.11523%0.229CC..Hα-helixtrans-63-44.1177-66.4175.3000111R238 P243 T379 H380 H386R238-L383 VanDerWaalsContact CD-CD2 3.42Å; R238-L383 HydrophobicContact CG-CD2 3.71Å; R238-L383 PolarHBondContact NH1-O 3.49Å; R238-L383 VanDerWaalsContact NH1-O 3.09Å; P243-L383 HydrophobicContact CG-CB 3.88Å; P243-L383 HydrophobicContact CG-CD1 4.46Å; T379-L383 HydrophobicContact CG2-CD1 3.67Å; T379-L383 HydrophobicContact CG2-CG 3.99Å; T379-L383 WeakPolarHBondContact O-CB 3.41Å; T379-L383 WeakPolarHBondContact O-CG 3.23Å; T379-L383 PolarHBondContact O-N 3.36Å; H380-L383 PolarHBondContact O-N 2.72Å; L383-H386 PolarHBondContact O-CE1 2.68Å; L383-H386 PolarHBondContact O-ND1 3Å
384I95.3Very high96.7Very high60 Ų6037 Ų3731%0.30821%0.211SC..Hα-helixtrans-73.9-24.8178.667.1172.8000114P243 H380 F381 H386P243-I384 HydrophobicContact CB-CG2 4.03Å; P243-I384 HydrophobicContact CG-CG2 3.53Å; H380-I384 WeakPolarHBondContact O-CG1 3.47Å; H380-I384 PolarHBondContact O-N 2.92Å; F381-I384 VanDerWaalsContact O-CG1 3.27Å; F381-I384 WeakPolarHBondContact O-CG1 3.38Å; I384-H386 PolarHBondContact O-CE1 2.74Å
385S96.4Very high96.8Very high2 Ų233.8 Ų33.81%0.01420%0.197CC..Hα-helixtrans-96.9-2.4177.164.30000113.8F381 N382 G387 F388 G389F381-S385 WeakPolarHBondContact O-CB 3.43Å; F381-S385 PolarHBondContact O-N 3.25Å; F381-S385 VanDerWaalsContact O-N 3.08Å; F381-S385 PolarHBondContact O-OG 2.76Å; N382-S385 PolarHBondContact O-N 2.83Å; N382-S385 PolarHBondContact O-OG 2.68Å; S385-G387 PolarHBondContact O-N 2.8Å; S385-F388 WeakPolarHBondContact O-CB 3.49Å; S385-F388 PolarHBondContact O-N 2.79Å; S385-G389 WeakPolarHBondContact OG-CA 3.16Å; S385-G389 PolarHBondContact OG-N 3.23Å; S385-G389 VanDerWaalsContact OG-N 3.08Å
386H95.9Very high96.8Very high1 Ų135.7 Ų35.71%0.00521%0.213CC..THydrogen-bonded Turntrans57.233.4178.6-44.7-27.7000113R238 R239 E244 L291 L294 E296 A299 N382 L383 I384R238-H386 PolarHBondContact NH2-ND1 3.35Å; R239-H386 PolarHBondContact NH2-CE1 2.87Å; R239-H386 PolarHBondContact NH2-NE2 2.93Å; E244-H386 VanDerWaalsContact CD-CE1 3.46Å; E244-H386 IonicContact OE1-CE1 3.27Å; E244-H386 PolarHBondContact OE1-CE1 2.93Å; E244-H386 IonicContact OE1-NE2 2.65Å; E244-H386 IonicContact OE2-CE1 3.48Å; E244-H386 PolarHBondContact OE2-CE1 3.4Å; E244-H386 IonicContact OE2-ND1 3.75Å; L291-H386 PolarHBondContact O-CD2 3.35Å; L291-H386 PolarHBondContact O-NE2 3.4Å; L294-H386 PolarHBondContact O-CD2 3.07Å; E296-H386 HydrophobicContact CG-CB 3.93Å; A299-H386 HydrophobicContact CB-CB 3.87Å; A299-H386 VanDerWaalsContact CB-O 3.32Å; A299-H386 WeakPolarHBondContact CB-O 3.3Å; N382-H386 WeakPolarHBondContact O-CA 3.45Å; N382-H386 PolarHBondContact O-N 2.92Å; L383-H386 PolarHBondContact O-CE1 2.68Å; L383-H386 PolarHBondContact O-ND1 3Å; I384-H386 PolarHBondContact O-CE1 2.74Å
387G95Very high96.9Very high6 Ų633 Ų336%0.06219%0.194CC..THydrogen-bonded Turntrans85.60.5-177.600000116L361 N382 S385 P391L361-G387 VanDerWaalsContact CD1-CA 3.42Å; N382-G387 PolarHBondContact O-N 2.78Å; N382-G387 VanDerWaalsContact O-N 3.13Å; S385-G387 PolarHBondContact O-N 2.8Å; G387-P391 WeakPolarHBondContact O-CD 3.48Å; G387-P391 WeakPolarHBondContact O-CG 3.15Å
388F97.5Very high96.9Very high44 Ų4431.8 Ų31.819%0.19318%0.184CC..SBendtrans-71.8-38.5171.6172.5-97.8000112.7L291 A299 L302 A303 S385 A392L291-F388 HydrophobicContact CD2-CD1 4.09Å; L291-F388 HydrophobicContact CD2-CG 4.47Å; A299-F388 HydrophobicContact CB-CB 4.07Å; L302-F388 HydrophobicContact CB-CD2 4.26Å; L302-F388 HydrophobicContact CB-CE2 4.49Å; L302-F388 HydrophobicContact CD2-CD2 4.08Å; L302-F388 HydrophobicContact CD2-CE2 4.03Å; L302-F388 HydrophobicContact CG-CD2 4Å; L302-F388 HydrophobicContact CG-CE2 3.8Å; A303-F388 HydrophobicContact CB-CD2 3.71Å; A303-F388 HydrophobicContact CB-CE2 4.28Å; A303-F388 HydrophobicContact CB-CG 4.5Å; S385-F388 WeakPolarHBondContact O-CB 3.49Å; S385-F388 PolarHBondContact O-N 2.79Å; F388-A392 HydrophobicContact CD1-CB 4.13Å; F388-A392 HydrophobicContact CD2-CB 4.34Å; F388-A392 HydrophobicContact CE1-CB 3.64Å; F388-A392 HydrophobicContact CE2-CB 3.86Å; F388-A392 HydrophobicContact CG-CB 4.46Å; F388-A392 HydrophobicContact CZ-CB 3.48Å; F388-A392 VanDerWaalsContact CZ-CB 3.48Å; F388-A392 VanDerWaalsContact O-CB 3.25Å; F388-A392 WeakPolarHBondContact O-CB 3.33Å; F388-A392 PolarHBondContact O-N 3.45Å
389G96.4Very high97Very high4 Ų431 Ų314%0.04118%0.18CC..Hα-helixtrans-59.3-66.7-163.300000114.9F381 S385 A392 V393F381-G389 VanDerWaalsContact CZ-CA 3.47Å; S385-G389 WeakPolarHBondContact OG-CA 3.16Å; S385-G389 PolarHBondContact OG-N 3.23Å; S385-G389 VanDerWaalsContact OG-N 3.08Å; G389-A392 PolarHBondContact O-N 3.43Å; G389-V393 WeakPolarHBondContact O-CG2 3.49Å; G389-V393 PolarHBondContact O-N 2.99Å
390S96.2Very high97.1Very high7 Ų733.2 Ų33.25%0.04919%0.191CC..Hα-helixtrans-60.5-43-175.2-660000113N382 A392 V393 C394N382-S390 PolarHBondContact OD1-OG 3.19Å; S390-A392 PolarHBondContact O-N 3.42Å; S390-V393 PolarHBondContact O-N 3.06Å; S390-C394 PolarHBondContact O-N 2.97Å; S390-C394 PolarHBondContact O-SG 2.86Å
391P96.9Very high97.2Very high63 Ų6329.9 Ų29.941%0.40918%0.176SC..Hα-helixtrans-62.3-39.7174.1-25.636.4000114A303 G387 C394 A395A303-P391 HydrophobicContact CB-CB 4.03Å; G387-P391 WeakPolarHBondContact O-CD 3.48Å; G387-P391 WeakPolarHBondContact O-CG 3.15Å; P391-C394 PolarHBondContact O-N 3.4Å; P391-A395 WeakPolarHBondContact O-CB 3.21Å; P391-A395 PolarHBondContact O-N 3.38Å
392A98.2Very high97.2Very high11 Ų1129.1 Ų29.19%0.09118%0.175CC..Hα-helixtrans-66.5-38.6177.200000112.4F306 F388 G389 S390 A395 A396F306-A392 HydrophobicContact CD1-CB 4Å; F306-A392 HydrophobicContact CE1-CB 4.2Å; F388-A392 HydrophobicContact CD1-CB 4.13Å; F388-A392 HydrophobicContact CD2-CB 4.34Å; F388-A392 HydrophobicContact CE1-CB 3.64Å; F388-A392 HydrophobicContact CE2-CB 3.86Å; F388-A392 HydrophobicContact CG-CB 4.46Å; F388-A392 HydrophobicContact CZ-CB 3.48Å; F388-A392 VanDerWaalsContact CZ-CB 3.48Å; F388-A392 VanDerWaalsContact O-CB 3.25Å; F388-A392 WeakPolarHBondContact O-CB 3.33Å; F388-A392 PolarHBondContact O-N 3.45Å; G389-A392 PolarHBondContact O-N 3.43Å; S390-A392 PolarHBondContact O-N 3.42Å; A392-A395 PolarHBondContact O-N 2.78Å; A392-A396 PolarHBondContact O-N 3.24Å
393V98.3Very high97.3Very high51 Ų5130 Ų3031%0.30918%0.178SC..Hα-helixtrans-62.7-45.1171.9173.60000110.5F350 L354 F381 G389 S390 A395 A396 V397F350-V393 HydrophobicContact CE1-CG1 3.67Å; F350-V393 HydrophobicContact CZ-CG1 4.09Å; L354-V393 HydrophobicContact CD1-CB 4.3Å; L354-V393 HydrophobicContact CD1-CG1 3.73Å; F381-V393 HydrophobicContact CE1-CG2 4.47Å; F381-V393 HydrophobicContact CZ-CG2 4.18Å; G389-V393 WeakPolarHBondContact O-CG2 3.49Å; G389-V393 PolarHBondContact O-N 2.99Å; S390-V393 PolarHBondContact O-N 3.06Å; V393-A395 VanDerWaalsContact C-N 3.34Å; V393-A395 PolarHBondContact O-N 3.27Å; V393-A396 PolarHBondContact O-N 3.4Å; V393-V397 HydrophobicContact CG1-CG2 4.4Å; V393-V397 WeakPolarHBondContact O-CG2 2.77Å; V393-V397 PolarHBondContact O-N 3.27Å
394C98.1Very high97.5Very high22 Ų2229.2 Ų29.215%0.14917%0.174CC..Hα-helixtrans-61-40.2176.5-67.80000112.5S390 P391 T398S390-C394 PolarHBondContact O-N 2.97Å; S390-C394 PolarHBondContact O-SG 2.86Å; P391-C394 PolarHBondContact O-N 3.4Å; C394-T398 VanDerWaalsContact O-CB 3.29Å; C394-T398 WeakPolarHBondContact O-CB 3.37Å; C394-T398 PolarHBondContact O-N 3.27Å; C394-T398 PolarHBondContact O-OG1 3.1Å
395A98.4Very high97.6Very high12 Ų1228 Ų2810%0.09917%0.169CC..Hα-helixtrans-61.2-49.4175.200000112.2F306 C310 P391 A392 V393 V397 T398 A399F306-A395 HydrophobicContact CD1-CB 4.03Å; F306-A395 HydrophobicContact CE1-CB 4.1Å; C310-A395 HydrophobicContact CB-CB 4.3Å; P391-A395 WeakPolarHBondContact O-CB 3.21Å; P391-A395 PolarHBondContact O-N 3.38Å; A392-A395 PolarHBondContact O-N 2.78Å; V393-A395 VanDerWaalsContact C-N 3.34Å; V393-A395 PolarHBondContact O-N 3.27Å; A395-V397 PolarHBondContact O-N 3.09Å; A395-T398 WeakPolarHBondContact O-CB 3.49Å; A395-T398 PolarHBondContact O-N 2.98Å; A395-T398 VanDerWaalsContact O-N 3.15Å; A395-A399 PolarHBondContact O-N 2.93Å
396A98.5Very high97.7Very high48 Ų4830.1 Ų30.140%0.39718%0.179SC..Hα-helixtrans-62-41.7178.400000112.5A392 V393 T398 A399 L400A392-A396 PolarHBondContact O-N 3.24Å; V393-A396 PolarHBondContact O-N 3.4Å; A396-T398 VanDerWaalsContact C-N 3.32Å; A396-A399 PolarHBondContact O-N 2.94Å; A396-L400 PolarHBondContact O-N 3.23Å; A396-L400 VanDerWaalsContact O-N 3.08Å
397V98.4Very high97.7Very high21 Ų2130.1 Ų30.113%0.12718%0.179CC..Hα-helixtrans-70.2-29.71761790000111.6C347 F350 T351 V393 A395 L400 Q401C347-V397 HydrophobicContact CB-CG1 3.76Å; F350-V397 HydrophobicContact CD1-CG2 4.15Å; F350-V397 HydrophobicContact CE1-CG2 4.19Å; T351-V397 HydrophobicContact CG2-CB 3.91Å; T351-V397 HydrophobicContact CG2-CG1 3.63Å; V393-V397 HydrophobicContact CG1-CG2 4.4Å; V393-V397 WeakPolarHBondContact O-CG2 2.77Å; V393-V397 PolarHBondContact O-N 3.27Å; A395-V397 PolarHBondContact O-N 3.09Å; V397-L400 PolarHBondContact O-N 3.22Å; V397-Q401 WeakPolarHBondContact O-CG 3.47Å; V397-Q401 PolarHBondContact O-N 3.08Å
398T97.8Very high97.7Very high65 Ų6530.6 Ų30.640%0.39918%0.18SC..Hα-helixtrans-68.9-42.5173-59.40000111.4C394 A395 A396 L400 Q401 N402C394-T398 VanDerWaalsContact O-CB 3.29Å; C394-T398 WeakPolarHBondContact O-CB 3.37Å; C394-T398 PolarHBondContact O-N 3.27Å; C394-T398 PolarHBondContact O-OG1 3.1Å; A395-T398 WeakPolarHBondContact O-CB 3.49Å; A395-T398 PolarHBondContact O-N 2.98Å; A395-T398 VanDerWaalsContact O-N 3.15Å; A396-T398 VanDerWaalsContact C-N 3.32Å; T398-L400 VanDerWaalsContact C-N 3.29Å; T398-L400 PolarHBondContact O-N 3.25Å; T398-Q401 PolarHBondContact O-N 3.21Å; T398-Q401 VanDerWaalsContact O-N 3.15Å; T398-N402 PolarHBondContact O-N 3.41Å
399A98.5Very high97.6Very high4 Ų434 Ų343%0.03320%0.195CC..Hα-helixtrans-59.2-40.3172.400000112C310 F314 A395 A396 N402 Y403C310-A399 HydrophobicContact CB-CB 4.28Å; F314-A399 HydrophobicContact CB-CB 4.38Å; F314-A399 HydrophobicContact CD1-CB 3.78Å; F314-A399 HydrophobicContact CE1-CB 4.19Å; F314-A399 HydrophobicContact CG-CB 3.97Å; A395-A399 PolarHBondContact O-N 2.93Å; A396-A399 PolarHBondContact O-N 2.94Å; A399-N402 PolarHBondContact O-N 2.9Å; A399-Y403 PolarHBondContact O-N 3.07Å
400L98.5Very high97.3Very high72 Ų7234.9 Ų34.938%0.37720%0.202SC..Hα-helixtrans-63.3-44.9171.8-179.166.2000112.2A396 V397 T398 N402 Y403 L404A396-L400 PolarHBondContact O-N 3.23Å; A396-L400 VanDerWaalsContact O-N 3.08Å; V397-L400 PolarHBondContact O-N 3.22Å; T398-L400 VanDerWaalsContact C-N 3.29Å; T398-L400 PolarHBondContact O-N 3.25Å; L400-N402 VanDerWaalsContact C-N 3.29Å; L400-N402 PolarHBondContact O-N 3.26Å; L400-Y403 HydrophobicContact CD1-CD1 3.91Å; L400-Y403 HydrophobicContact CD1-CE1 4.44Å; L400-Y403 WeakPolarHBondContact O-CB 3.23Å; L400-Y403 PolarHBondContact O-N 3.05Å; L400-L404 HydrophobicContact CG-CD1 4.28Å; L400-L404 WeakPolarHBondContact O-CG 3.36Å; L400-L404 PolarHBondContact O-N 2.92Å
401Q98.1Very high96.9Very high29 Ų2934.9 Ų34.914%0.13620%0.201CC..Hα-helixtrans-62.9-33.5175.9-76-176.678.100112.8C347 V397 T398 L404 T405C347-Q401 HydrophobicContact CB-CG 3.65Å; V397-Q401 WeakPolarHBondContact O-CG 3.47Å; V397-Q401 PolarHBondContact O-N 3.08Å; T398-Q401 PolarHBondContact O-N 3.21Å; T398-Q401 VanDerWaalsContact O-N 3.15Å; Q401-L404 PolarHBondContact O-N 3.39Å; Q401-T405 WeakPolarHBondContact O-CB 3.3Å; Q401-T405 PolarHBondContact O-N 2.95Å; Q401-T405 PolarHBondContact O-OG1 2.68Å
402N98.1Very high96.4Very high62 Ų6235 Ų3533%0.33220%0.198SC..Hα-helixtrans-65.5-47.5172.4-72-16.3000110.7A316 T398 A399 L400 L404 T405 E406A316-N402 HydrophobicContact CB-CB 4.09Å; T398-N402 PolarHBondContact O-N 3.41Å; A399-N402 PolarHBondContact O-N 2.9Å; L400-N402 VanDerWaalsContact C-N 3.29Å; L400-N402 PolarHBondContact O-N 3.26Å; N402-L404 PolarHBondContact O-N 3.32Å; N402-T405 WeakPolarHBondContact O-CB 3.44Å; N402-T405 PolarHBondContact O-N 2.94Å; N402-T405 VanDerWaalsContact O-N 3.14Å; N402-E406 PolarHBondContact O-N 2.91Å
403Y98.3Very high95.8Very high25 Ų2542.1 Ų42.110%0.09823%0.227CC..Hα-helixtrans-55.4-48.9172152.5-97.3000112.2V319 A320 L323 A399 L400 T405 E406 A407V319-Y403 HydrophobicContact CB-CD2 4.18Å; V319-Y403 HydrophobicContact CG1-CD2 3.79Å; V319-Y403 HydrophobicContact CG1-CE2 3.89Å; A320-Y403 HydrophobicContact CB-CD2 3.95Å; A320-Y403 HydrophobicContact CB-CE2 4.15Å; L323-Y403 HydrophobicContact CD1-CE2 3.88Å; L323-Y403 WeakPolarHBondContact CD1-OH 3.43Å; A399-Y403 PolarHBondContact O-N 3.07Å; L400-Y403 HydrophobicContact CD1-CD1 3.91Å; L400-Y403 HydrophobicContact CD1-CE1 4.44Å; L400-Y403 WeakPolarHBondContact O-CB 3.23Å; L400-Y403 PolarHBondContact O-N 3.05Å; Y403-T405 PolarHBondContact O-N 3.25Å; Y403-E406 PolarHBondContact O-N 3.37Å; Y403-A407 HydrophobicContact CE2-CB 4.4Å; Y403-A407 WeakPolarHBondContact O-CB 3.31Å; Y403-A407 PolarHBondContact O-N 3.43Å
404L98.1Very high94.7Very high5 Ų542.1 Ų42.13%0.02622%0.224CC..Hα-helixtrans-60.5-34.2178.8-67.9169.1000111.7L340 T343 K344 L400 Q401 N402 L408L340-L404 HydrophobicContact CD2-CD2 3.6Å; T343-L404 HydrophobicContact CG2-CD1 3.85Å; T343-L404 HydrophobicContact CG2-CD2 4.28Å; K344-L404 HydrophobicContact CB-CB 4.29Å; K344-L404 HydrophobicContact CB-CD1 3.97Å; L400-L404 HydrophobicContact CG-CD1 4.28Å; L400-L404 WeakPolarHBondContact O-CG 3.36Å; L400-L404 PolarHBondContact O-N 2.92Å; Q401-L404 PolarHBondContact O-N 3.39Å; N402-L404 PolarHBondContact O-N 3.32Å; L404-L408 WeakPolarHBondContact O-CD1 3.28Å; L404-L408 VanDerWaalsContact O-CG 3.29Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.21Å; L404-L408 VanDerWaalsContact O-N 3.09Å
405T98Very high93.4Very high35 Ų3548.7 Ų48.722%0.21525%0.247CC..Hα-helixtrans-70.5-42.8176.6-57.70000112.1K344 Q401 N402 Y403 L408 K409K344-T405 PolarHBondContact NZ-OG1 3.17Å; Q401-T405 WeakPolarHBondContact O-CB 3.3Å; Q401-T405 PolarHBondContact O-N 2.95Å; Q401-T405 PolarHBondContact O-OG1 2.68Å; N402-T405 WeakPolarHBondContact O-CB 3.44Å; N402-T405 PolarHBondContact O-N 2.94Å; N402-T405 VanDerWaalsContact O-N 3.14Å; Y403-T405 PolarHBondContact O-N 3.25Å; T405-L408 PolarHBondContact O-N 3.22Å; T405-K409 WeakPolarHBondContact O-CG 3.27Å; T405-K409 PolarHBondContact O-N 2.96Å; T405-K409 VanDerWaalsContact O-N 3.15Å
406E97.6Very high92.2Very high46 Ų4654 Ų5422%0.21527%0.273CS..Hα-helixtrans-67.9-35.5173.9-63.6-52124.700112.1K317 A320 N402 Y403 L408 K409 A410K317-E406 HydrophobicContact CB-CB 4.41Å; K317-E406 HydrophobicContact CB-CG 4.02Å; A320-E406 HydrophobicContact CB-CB 3.69Å; N402-E406 PolarHBondContact O-N 2.91Å; Y403-E406 PolarHBondContact O-N 3.37Å; E406-L408 PolarHBondContact O-N 2.84Å; E406-K409 PolarHBondContact O-N 3.45Å; E406-K409 IonicContact OE1-NZ 2.63Å; E406-K409 PolarHBondContact OE1-NZ 3.27Å; E406-K409 IonicContact OE2-NZ 3.87Å; E406-A410 WeakPolarHBondContact O-CB 3.4Å; E406-A410 PolarHBondContact O-N 3.49Å
407A96.6Very high90.6Very high0 Ų056.2 Ų56.20%029%0.286CS..Hα-helixtrans-62.4-43175.400000111.5A320 N324 L340 Y403 A410 M411A320-A407 HydrophobicContact CB-CB 4Å; N324-A407 PolarHBondContact ND2-O 3.07Å; L340-A407 HydrophobicContact CD1-CB 3.9Å; L340-A407 HydrophobicContact CD2-CB 4.25Å; Y403-A407 HydrophobicContact CE2-CB 4.4Å; Y403-A407 WeakPolarHBondContact O-CB 3.31Å; Y403-A407 PolarHBondContact O-N 3.43Å; A407-A410 PolarHBondContact O-N 2.92Å; A407-M411 WeakPolarHBondContact O-CG 3.5Å; A407-M411 PolarHBondContact O-N 3.02Å
408L95.8Very high88.9Confident17 Ų1760.2 Ų60.29%0.08931%0.306CS..Hα-helixtrans-62.3-46.7174.2-71.9165.1000112K337 L340 L341 K344 L404 T405 E406 A410 M411 D412K337-L408 HydrophobicContact CG-CD2 3.89Å; L340-L408 HydrophobicContact CB-CD2 3.81Å; L340-L408 HydrophobicContact CB-CG 4.12Å; L340-L408 HydrophobicContact CD1-CD2 4.13Å; L340-L408 HydrophobicContact CD1-CG 4.33Å; L341-L408 HydrophobicContact CD2-CD1 3.74Å; L341-L408 HydrophobicContact CD2-CD2 4.17Å; L341-L408 HydrophobicContact CG-CD1 4.35Å; L341-L408 HydrophobicContact CG-CD2 4.02Å; K344-L408 HydrophobicContact CD-CD1 4.36Å; L404-L408 WeakPolarHBondContact O-CD1 3.28Å; L404-L408 VanDerWaalsContact O-CG 3.29Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.21Å; L404-L408 VanDerWaalsContact O-N 3.09Å; T405-L408 PolarHBondContact O-N 3.22Å; E406-L408 PolarHBondContact O-N 2.84Å; L408-A410 VanDerWaalsContact C-N 3.32Å; L408-A410 PolarHBondContact O-N 3.02Å; L408-M411 PolarHBondContact O-N 3.27Å; L408-D412 PolarHBondContact O-N 3.04Å
409K95Very high86.7Confident116 Ų11661.3 Ų61.350%0.50431%0.31SS..Hα-helixtrans-58-42.5175.9-70.2170.6-178.3173.30112.5T405 E406 D412 K413T405-K409 WeakPolarHBondContact O-CG 3.27Å; T405-K409 PolarHBondContact O-N 2.96Å; T405-K409 VanDerWaalsContact O-N 3.15Å; E406-K409 PolarHBondContact O-N 3.45Å; E406-K409 IonicContact OE1-NZ 2.63Å; E406-K409 PolarHBondContact OE1-NZ 3.27Å; E406-K409 IonicContact OE2-NZ 3.87Å; K409-D412 PolarHBondContact O-N 3.21Å; K409-K413 PolarHBondContact O-N 2.98Å; K409-K413 VanDerWaalsContact O-N 3.1Å
410A90.7Very high84.5Confident22 Ų2266.7 Ų66.718%0.18235%0.345CS..Hα-helixtrans-68.7-35.4179.300000112.1N324 E406 A407 L408 K413 M414N324-A410 WeakPolarHBondContact ND2-CB 3.43Å; E406-A410 WeakPolarHBondContact O-CB 3.4Å; E406-A410 PolarHBondContact O-N 3.49Å; A407-A410 PolarHBondContact O-N 2.92Å; L408-A410 VanDerWaalsContact C-N 3.32Å; L408-A410 PolarHBondContact O-N 3.02Å; A410-K413 PolarHBondContact O-N 3.39Å; A410-M414 WeakPolarHBondContact O-CG 3.28Å; A410-M414 PolarHBondContact O-N 3.13Å; A410-M414 VanDerWaalsContact O-N 3.12Å
411M87.5Confident82.1Confident6 Ų670 Ų703%0.0336%0.363CS..Hα-helixtrans-64.2-45.2171.7-72.2-172.472.500112.4Q333 R336 K337 L340 A407 L408 K413 M414 Y415Q333-M411 HydrophobicContact CB-CE 4.12Å; Q333-M411 HydrophobicContact CG-CE 4.41Å; Q333-M411 WeakPolarHBondContact O-CE 3.18Å; R336-M411 HydrophobicContact CB-CE 3.96Å; R336-M411 HydrophobicContact CG-CE 3.96Å; R336-M411 HydrophobicContact CG-SD 3.96Å; K337-M411 HydrophobicContact CB-CE 3.98Å; K337-M411 HydrophobicContact CB-SD 4.33Å; L340-M411 HydrophobicContact CD1-SD 3.52Å; L340-M411 VanDerWaalsContact CD1-SD 3.52Å; A407-M411 WeakPolarHBondContact O-CG 3.5Å; A407-M411 PolarHBondContact O-N 3.02Å; L408-M411 PolarHBondContact O-N 3.27Å; M411-K413 VanDerWaalsContact C-N 3.27Å; M411-K413 PolarHBondContact O-N 2.95Å; M411-M414 HydrophobicContact CG-CE 4.13Å; M411-M414 PolarHBondContact O-N 3.02Å; M411-M414 VanDerWaalsContact O-N 3.09Å; M411-Y415 PolarHBondContact O-N 3.3Å
412D86.6Confident79.6Confident65 Ų6572.6 Ų72.635%0.34838%0.384SS..Hα-helixtrans-60-39.9177.5-68.9-26.5000111.1K337 L408 K409 M414 Y415 L416K337-D412 IonicContact NZ-OD1 3.42Å; K337-D412 PolarHBondContact NZ-OD1 2.96Å; K337-D412 IonicContact NZ-OD2 3.03Å; L408-D412 PolarHBondContact O-N 3.04Å; K409-D412 PolarHBondContact O-N 3.21Å; D412-M414 PolarHBondContact O-N 3.46Å; D412-Y415 PolarHBondContact O-N 3.25Å; D412-L416 WeakPolarHBondContact O-CD1 3.44Å; D412-L416 PolarHBondContact O-N 3.4Å; D412-L416 VanDerWaalsContact O-N 3.1Å
413K84.4Confident77.2Confident162 Ų16278.3 Ų78.370%0.70441%0.408SS*.Hα-helixtrans-62.1-40.2173.8-171.1-179.1177.8-1740113K409 A410 M411 Y415 L416 S417K409-K413 PolarHBondContact O-N 2.98Å; K409-K413 VanDerWaalsContact O-N 3.1Å; A410-K413 PolarHBondContact O-N 3.39Å; M411-K413 VanDerWaalsContact C-N 3.27Å; M411-K413 PolarHBondContact O-N 2.95Å; K413-Y415 VanDerWaalsContact C-N 3.34Å; K413-L416 PolarHBondContact O-N 3.38Å; K413-S417 WeakPolarHBondContact O-CB 3.43Å; K413-S417 PolarHBondContact O-N 3.4Å
414M76.3Confident74.9Confident50 Ų5082.5 Ų82.525%0.24644%0.437CS..Hα-helixtrans-65-38.9175.8-69.1-171.3-60.700111.6N324 A410 M411 D412 S417 N418N324-M414 HydrophobicContact CB-CE 4.03Å; A410-M414 WeakPolarHBondContact O-CG 3.28Å; A410-M414 PolarHBondContact O-N 3.13Å; A410-M414 VanDerWaalsContact O-N 3.12Å; M411-M414 HydrophobicContact CG-CE 4.13Å; M411-M414 PolarHBondContact O-N 3.02Å; M411-M414 VanDerWaalsContact O-N 3.09Å; D412-M414 PolarHBondContact O-N 3.46Å; M414-S417 PolarHBondContact O-N 3.12Å; M414-N418 WeakPolarHBondContact O-CB 3.49Å; M414-N418 PolarHBondContact O-N 3.16Å
415Y70.7Confident72.3Confident160 Ų16089.3 Ų89.363%0.62747%0.473SS*.Hα-helixtrans-63.6-43.7177.2-168.2-94.8000112.4M411 D412 K413 S417M411-Y415 PolarHBondContact O-N 3.3Å; D412-Y415 PolarHBondContact O-N 3.25Å; K413-Y415 VanDerWaalsContact C-N 3.34Å; Y415-S417 VanDerWaalsContact C-N 3.35Å
416L72Confident69.7Low123 Ų12395.9 Ų95.964%0.64451%0.507SS*.Hα-helixtrans-64.6-38.3173.5-84.981.7000112.2D412 K413D412-L416 WeakPolarHBondContact O-CD1 3.44Å; D412-L416 PolarHBondContact O-N 3.4Å; D412-L416 VanDerWaalsContact O-N 3.1Å; K413-L416 PolarHBondContact O-N 3.38Å
417S66.2Low66.9Low96 Ų96101.7 Ų101.767%0.67154%0.539SS*.Hα-helixtrans-73.5-24.9-178.6-166.90000114.2K413 M414 Y415 N419K413-S417 WeakPolarHBondContact O-CB 3.43Å; K413-S417 PolarHBondContact O-N 3.4Å; M414-S417 PolarHBondContact O-N 3.12Å; Y415-S417 VanDerWaalsContact C-N 3.35Å; S417-N419 VanDerWaalsContact C-N 3.35Å
418N61.3Low64.3Low104 Ų104106.2 Ų106.256%0.55658%0.577SS**THydrogen-bonded Turntrans-87.8-0.5178.7-829.8000113.4M414 P420M414-N418 WeakPolarHBondContact O-CB 3.49Å; M414-N418 PolarHBondContact O-N 3.16Å; N418-P420 VanDerWaalsContact O-CD 3.31Å; N418-P420 WeakPolarHBondContact O-CD 3.44Å
419N52.5Low61.9Low88 Ų88115.5 Ų115.547%0.47162%0.616SS.*  trans-95105.1176.9-168.91.5000110.5S417 N421 S422S417-N419 VanDerWaalsContact C-N 3.35Å; N419-N421 PolarHBondContact O-N 3.35Å; N419-S422 PolarHBondContact O-OG 3.01Å
420P52.3Low59.2Low118 Ų118116 Ų11677%0.76664%0.635SS**G310 helixtrans-67.5-10.1-173.127.8-35.6000114.2N418 S422N418-P420 VanDerWaalsContact O-CD 3.31Å; N418-P420 WeakPolarHBondContact O-CD 3.44Å; P420-S422 VanDerWaalsContact C-N 3.29Å; P420-S422 PolarHBondContact O-N 3.15Å
421N48.4Very low56.8Low142 Ų142120 Ų12076%0.75966%0.661SS**G310 helixtrans-82.212.9-177.1-103.433.6000115.4N419N419-N421 PolarHBondContact O-N 3.35Å
422S45.7Very low54.8Low82 Ų82126.8 Ų126.857%0.57370%0.698SS**G310 helixtrans-104.61.9-178.161.60000115.5N419 P420N419-S422 PolarHBondContact O-OG 3.01Å; P420-S422 VanDerWaalsContact C-N 3.29Å; P420-S422 PolarHBondContact O-N 3.15Å
423H47.2Very low52.7Low182 Ų182132.7 Ų132.784%0.84372%0.72SS**  trans-122.160.1176.9-91-52.4000113.2
424T49.2Very low50.6Low114 Ų114132.1 Ų132.170%0.69972%0.72SS**  trans-128.4148.915443.20000108.8
425D44.9Very low49.2Very low148 Ų148139.1 Ų139.179%0.79175%0.752SS**SBendtrans68.381.3-179.7-54.8-27.4000117.2
426N43.8Very low48Very low172 Ų172139.7 Ų139.792%0.9276%0.758SS**SBendtrans-168.116.6137.7-103.4-29.9000117
427N38.2Very low46.7Very low168 Ų168143 Ų14390%0.89877%0.77SS**SBendtrans-128.432.1-178.5-152.319.7000115.6
428A41.6Very low45.8Very low96 Ų96150 Ų15079%0.79378%0.782SS**SBendtrans-127.652.7179.500000112.5
429K45Very low45.1Very low211 Ų211158.4 Ų158.492%0.91781%0.813SS**SBendtrans-170.765.7165.7-110.9163.3-171.31750113.6
430S38.1Very low44.8Very low128 Ų128162 Ų16290%0.89583%0.83SS**  trans-158.347.3160.1-169.80000112.5
431S41.4Very low44.4Very low104 Ų104164.3 Ų164.373%0.72783%0.834SS**SBendtrans-113.4147.6156.2-1690000107.3
432D44.8Very low44.1Very low150 Ų150165.5 Ų165.580%0.80284%0.838SS**  trans61.889.3-177.2-57.1-30.2000116.1
433K42.6Very low44Very low189 Ų189170.4 Ų170.482%0.82285%0.853SS**  -155.6122.8122.6-111.6174.1-173.6-171.90114.5
434E40.1Very low43.8Very low150 Ų150169.7 Ų169.770%0.70185%0.854SS**  trans64.182.7148-69.217499.900118.8K436E434-K436 VanDerWaalsContact C-N 3.26Å; E434-K436 PolarHBondContact O-N 2.94Å
435E46.7Very low43.5Very low197 Ų197173.4 Ų173.492%0.92186%0.864SS**  -35.490.4125.1-176.4-172170.900112.6
436K46.3Very low43.4Very low172 Ų172175.2 Ų175.275%0.74887%0.869SS**  trans-167.8100.7154.9-118.8172.3-178.5171.70111.1E434E434-K436 VanDerWaalsContact C-N 3.26Å; E434-K436 PolarHBondContact O-N 2.94Å
437H43.8Very low43.4Very low193 Ų193175.5 Ų175.589%0.89487%0.866SS**  -165.7118.8121-115.4-128.1000111
438R48.8Very low43.8Very low243 Ų243176.1 Ų176.192%0.91786%0.863SS**  trans-103.6118174.7175.4-172-174.4-175.14.3107.8
439K46.3Very low44Very low280 Ų280183.4 Ų183.4100%1.21787%0.869SS**  trans-162.20148.5-118177.2-179.1-177.70110.9

Retrieved 439 of 439 residues in 55.3 ms (Link to these results)