A0A2K5YJM3_MANLE Loading...

TATA-box binding protein like 2

AlphaFold DB , UniProt , Accession A0A2K5YJM3, Species MANLE (Mandrillus leucophaeus, Drill), Gene TBPL2, Length 376 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.4Very low36.9Very low240 Ų240157.6 Ų157.6100%1.18286%0.861SS**  090.80-69144.8157.500106.7
2A37.8Very low36.9Very low92 Ų92165.6 Ų165.676%0.7687%0.869SS**  68.876.780.700000110.4
3S34.6Very low37Very low119 Ų119164.7 Ų164.783%0.83286%0.864SS**  71.310664.382.50000114
4A38.5Very low36.8Very low100 Ų100165.3 Ų165.383%0.82687%0.867SS**  trans-112.4146.9169.100000110.5
5P46.1Very low36.9Very low126 Ų126161.7 Ų161.782%0.81887%0.871SS**  trans-98163.5-162.30.821.2000114.5
6R38.5Very low37.1Very low239 Ų239155.7 Ų155.790%0.90286%0.858SS**  trans-77.3142.7168.3-60.2177.1-177.2172.5-0.2110.6E8R6-E8 PolarHBondContact O-N 3.23Å
7P39.3Very low37.5Very low133 Ų133154.5 Ų154.586%0.86486%0.861SS**  trans-83.592173.833.1-33.1000111.5
8E31.9Very low37.5Very low163 Ų163154.6 Ų154.676%0.76286%0.859SS**  trans-116.3142.9160.1-101.1-162.4-147.800110.4R6R6-E8 PolarHBondContact O-N 3.23Å
9R34.7Very low38Very low226 Ų226151.9 Ų151.985%0.85385%0.849SS**  trans63.375.2169-54176.2-178.2-164.9-0.8118.5
10V34.4Very low38.9Very low144 Ų144150.6 Ų150.687%0.87385%0.847SS**  -143.396128.4-174.40000110.1
11L31.7Very low38.8Very low152 Ų152153.4 Ų153.480%0.79685%0.846SS**  trans-172.535.1144.6-108.5169.2000114.2L13L11-L13 VanDerWaalsContact C-N 3.3Å; L11-L13 PolarHBondContact O-N 3.03Å; L11-L13 VanDerWaalsContact O-N 3.08Å
12R36.8Very low39.5Very low253 Ų253147 Ų14796%0.95582%0.822SS**  trans-75.585.1157.5-89.9-168.9172.7-169.7-1.4108.5
13L38.3Very low40.1Very low154 Ų154148 Ų14881%0.80682%0.821SS**  trans-165.633.2161.2-113167.1000115.8L11L11-L13 VanDerWaalsContact C-N 3.3Å; L11-L13 PolarHBondContact O-N 3.03Å; L11-L13 VanDerWaalsContact O-N 3.08Å
14L34.9Very low40.6Very low173 Ų173147.7 Ų147.791%0.90682%0.816SS**  trans-132.864.7161.4-74.4-179.8000110.1
15A37.6Very low40.8Very low112 Ų112148.4 Ų148.493%0.92681%0.812SS**  trans-111.379.4175.900000109.7
16G40Very low40.3Very low65 Ų65147.9 Ų147.967%0.6781%0.809SS**  trans-166.3136.2177.400000111.3
17C43.7Very low40.3Very low135 Ų135143.3 Ų143.391%0.91281%0.808SS**  trans58.763.3174.9-57.30000116.6
18L38.2Very low40.1Very low156 Ų156143.5 Ų143.582%0.81781%0.807SS**  trans-119.3139.5143.9-75.9174.3000108.5
19P46.6Very low40.2Very low104 Ų104138 Ų13868%0.67579%0.794SS**PPolyproline II helixtrans-67.3158.2175.830-35.1000110.7Y21P19-Y21 PolarHBondContact O-N 2.97Å
20P55.2Low40.1Very low125 Ų125135.9 Ų135.981%0.81280%0.798SS**PPolyproline II helixtrans-59.2130.9172.226.4-33.8000109.8
21Y38.3Very low39.9Very low211 Ų211134.8 Ų134.883%0.82779%0.787SS**PPolyproline II helixtrans-58140.9167.4-93.7-104.6000109.2P19P19-Y21 PolarHBondContact O-N 2.97Å
22P51.8Low40.3Very low104 Ų104130 Ų13068%0.67577%0.766SS**PPolyproline II helixtrans-59.6148.6168.628-34.3000109.4
23P51.1Low40.3Very low113 Ų113124.2 Ų124.273%0.73475%0.751SS**PPolyproline II helixtrans-58.2150.217426.8-34.6000110.1
24P45.2Very low40.4Very low113 Ų113123.1 Ų123.173%0.73474%0.742SS**PPolyproline II helixtrans-57.1146.717326.6-34.5000109.8
25P42.3Very low40.6Very low115 Ų115120.3 Ų120.375%0.74773%0.725SS**PPolyproline II helixtrans-57.1141.9175.526.2-34.5000109.3T27P25-T27 PolarHBondContact O-N 2.75Å
26P36.8Very low40.8Very low116 Ų116120.5 Ų120.575%0.75371%0.706SS**PPolyproline II helixtrans-58.9131.9-178.824.8-33.8000109.7V28P26-V28 PolarHBondContact O-N 2.8Å; P26-V28 VanDerWaalsContact O-N 3.11Å
27T37.1Very low40.9Very low142 Ų142123.3 Ų123.387%0.87170%0.702SS**PPolyproline II helixtrans-52.8119.8171.7-540000108.7P25 G29P25-T27 PolarHBondContact O-N 2.75Å; T27-G29 PolarHBondContact O-N 3.03Å
28V36.6Very low40.8Very low138 Ų138120.6 Ų120.684%0.83668%0.681SS**  trans-73.483178.9-175.10000108.9P26P26-V28 PolarHBondContact O-N 2.8Å; P26-V28 VanDerWaalsContact O-N 3.11Å
29G32.6Very low40.8Very low48 Ų48121.5 Ų121.550%0.49568%0.675SS.*PPolyproline II helixtrans-63.5160.3154.300000109.8T27 L31T27-G29 PolarHBondContact O-N 3.03Å; G29-L31 PolarHBondContact O-N 3.27Å
30L32.8Very low40.4Very low181 Ų181121.9 Ų121.995%0.94867%0.671SS**PPolyproline II helixtrans-61.2127.6174.1-7677.3000108.9
31L31.2Very low39.7Very low120 Ų120122.4 Ų122.463%0.62866%0.662SS**PPolyproline II helixtrans-65.3143.1172-62.2169000109.1G29G29-L31 PolarHBondContact O-N 3.27Å
32S40.4Very low39.8Very low51 Ų51117.8 Ų117.836%0.35765%0.652SS.*PPolyproline II helixtrans-64.7149.2173.4-172.40000110.3E34 Q35S32-E34 WeakPolarHBondContact CB-OE2 3.47Å; S32-E34 PolarHBondContact O-N 2.96Å; S32-E34 PolarHBondContact OG-OE2 2.87Å; S32-Q35 WeakPolarHBondContact O-CB 3.42Å; S32-Q35 PolarHBondContact O-N 2.99Å
33M35.9Very low39.3Very low132 Ų132120.1 Ų120.165%0.6565%0.648SS**Hα-helixtrans-51.2-40.7174.5-69.8-68.7-6400111.5Q35 Q36 E37M33-Q35 PolarHBondContact O-N 3.32Å; M33-Q36 WeakPolarHBondContact O-CA 3.44Å; M33-Q36 WeakPolarHBondContact O-CB 3.42Å; M33-Q36 PolarHBondContact O-N 3.03Å; M33-E37 PolarHBondContact O-N 3.17Å; M33-E37 VanDerWaalsContact O-N 3.16Å
34E40.5Very low38.6Very low132 Ų132120.2 Ų120.262%0.61764%0.641SS**Hα-helixtrans-54.8-36.7178.9-58.7154.4130.700112.2S32 Q36 E37 T38S32-E34 WeakPolarHBondContact CB-OE2 3.47Å; S32-E34 PolarHBondContact O-N 2.96Å; S32-E34 PolarHBondContact OG-OE2 2.87Å; E34-Q36 VanDerWaalsContact C-N 3.33Å; E34-Q36 PolarHBondContact O-N 3.01Å; E34-E37 PolarHBondContact O-N 3.24Å; E34-T38 PolarHBondContact O-N 3.2Å; E34-T38 VanDerWaalsContact O-N 3.1Å; E34-T38 PolarHBondContact O-OG1 3.49Å
35Q39.1Very low38.3Very low114 Ų114120.6 Ų120.653%0.53364%0.637SS.*Hα-helixtrans-76.6-20179.9-65.4-177.6-37.400112.9S32 M33S32-Q35 WeakPolarHBondContact O-CB 3.42Å; S32-Q35 PolarHBondContact O-N 2.99Å; M33-Q35 PolarHBondContact O-N 3.32Å
36Q41.4Very low38Very low115 Ų115122 Ų12254%0.53763%0.634SS.*Hα-helixtrans-79.1-35.8170.6-59.1-167.7-53.900111M33 E34 Y39 L40M33-Q36 WeakPolarHBondContact O-CA 3.44Å; M33-Q36 WeakPolarHBondContact O-CB 3.42Å; M33-Q36 PolarHBondContact O-N 3.03Å; E34-Q36 VanDerWaalsContact C-N 3.33Å; E34-Q36 PolarHBondContact O-N 3.01Å; Q36-Y39 PolarHBondContact O-N 3Å; Q36-L40 PolarHBondContact O-N 3.34Å; Q36-L40 VanDerWaalsContact O-N 3.08Å
37E41.6Very low38Very low124 Ų124119.9 Ų119.958%0.57962%0.621SS**Hα-helixtrans-64.6-46.8175-67.1177.7145.500111.3M33 E34 Y39 L40 E41M33-E37 PolarHBondContact O-N 3.17Å; M33-E37 VanDerWaalsContact O-N 3.16Å; E34-E37 PolarHBondContact O-N 3.24Å; E37-Y39 VanDerWaalsContact C-N 3.25Å; E37-Y39 PolarHBondContact O-N 2.96Å; E37-L40 WeakPolarHBondContact O-CA 3.49Å; E37-L40 WeakPolarHBondContact O-CB 3.47Å; E37-L40 PolarHBondContact O-N 3.23Å; E37-E41 PolarHBondContact O-N 2.82Å
38T41.5Very low38.1Very low78 Ų78116.5 Ų116.548%0.47961%0.608SS.*Hα-helixtrans-59.4-35.7175.9-390000112.6E34 L40 L42E34-T38 PolarHBondContact O-N 3.2Å; E34-T38 VanDerWaalsContact O-N 3.1Å; E34-T38 PolarHBondContact O-OG1 3.49Å; T38-L40 VanDerWaalsContact C-N 3.32Å; T38-L42 HydrophobicContact CG2-CD1 4.48Å; T38-L42 WeakPolarHBondContact O-CB 3.44Å; T38-L42 WeakPolarHBondContact O-CG 3.39Å; T38-L42 PolarHBondContact O-N 2.83Å; T38-L42 VanDerWaalsContact O-N 3.14Å
39Y39.9Very low38.1Very low176 Ų176114 Ų11469%0.6960%0.602SS**Hα-helixtrans-71.9-28.3177-162.2-91.6000112.2Q36 E37 Y43Q36-Y39 PolarHBondContact O-N 3Å; E37-Y39 VanDerWaalsContact C-N 3.25Å; E37-Y39 PolarHBondContact O-N 2.96Å; Y39-Y43 WeakPolarHBondContact O-CB 3.3Å; Y39-Y43 PolarHBondContact O-N 3.17Å
40L36.6Very low38.5Very low111 Ų111119.5 Ų119.558%0.58162%0.615SS**Hα-helixtrans-77.4-40175.9-136.274.9000112Q36 E37 T38 Y43 L44Q36-L40 PolarHBondContact O-N 3.34Å; Q36-L40 VanDerWaalsContact O-N 3.08Å; E37-L40 WeakPolarHBondContact O-CA 3.49Å; E37-L40 WeakPolarHBondContact O-CB 3.47Å; E37-L40 PolarHBondContact O-N 3.23Å; T38-L40 VanDerWaalsContact C-N 3.32Å; L40-Y43 WeakPolarHBondContact O-CB 3.38Å; L40-Y43 PolarHBondContact O-N 3.15Å; L40-L44 WeakPolarHBondContact O-CG 3.38Å; L40-L44 PolarHBondContact O-N 3.31Å
41E42.2Very low38.6Very low136 Ų136118.7 Ų118.764%0.63661%0.611SS**Hα-helixtrans-59.6-49.9172-73.8-165.7130.200111.3E37 Y43 L44 D45E37-E41 PolarHBondContact O-N 2.82Å; E41-Y43 PolarHBondContact O-N 3.19Å; E41-L44 PolarHBondContact O-N 2.86Å; E41-D45 WeakPolarHBondContact O-CB 3.44Å; E41-D45 PolarHBondContact O-N 3.39Å
42L39.4Very low39Very low115 Ų115120 Ų12060%0.60262%0.618SS**Hα-helixtrans-57.5-31.2176.3-77.8167.3000113.1T38 Q46T38-L42 HydrophobicContact CG2-CD1 4.48Å; T38-L42 WeakPolarHBondContact O-CB 3.44Å; T38-L42 WeakPolarHBondContact O-CG 3.39Å; T38-L42 PolarHBondContact O-N 2.83Å; T38-L42 VanDerWaalsContact O-N 3.14Å; L42-Q46 VanDerWaalsContact O-CB 3.31Å; L42-Q46 WeakPolarHBondContact O-CB 3.39Å; L42-Q46 PolarHBondContact O-N 3.21Å
43Y40.3Very low38.8Very low153 Ų153125.7 Ų125.760%0.664%0.644SS**Hα-helixtrans-75.1-37.1176.1-170.2-99.9000112.6Y39 L40 E41 C47Y39-Y43 WeakPolarHBondContact O-CB 3.3Å; Y39-Y43 PolarHBondContact O-N 3.17Å; L40-Y43 WeakPolarHBondContact O-CB 3.38Å; L40-Y43 PolarHBondContact O-N 3.15Å; E41-Y43 PolarHBondContact O-N 3.19Å; Y43-C47 PolarHBondContact O-N 3.3Å
44L38Very low38.6Very low114 Ų114123.9 Ų123.960%0.59765%0.65SS**Hα-helixtrans-73.1-43.1178-70.1168000112L40 E41 Q46 C47 A48L40-L44 WeakPolarHBondContact O-CG 3.38Å; L40-L44 PolarHBondContact O-N 3.31Å; E41-L44 PolarHBondContact O-N 2.86Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 2.99Å; L44-C47 WeakPolarHBondContact O-CB 3.36Å; L44-C47 PolarHBondContact O-N 2.89Å; L44-A48 PolarHBondContact O-N 2.98Å; L44-A48 VanDerWaalsContact O-N 3.12Å
45D38.1Very low38.5Very low121 Ų121123.2 Ų123.265%0.64766%0.657SS**Hα-helixtrans-64.9-37.7179.8-158.945.6000111.3E41 C47 A48 A49E41-D45 WeakPolarHBondContact O-CB 3.44Å; E41-D45 PolarHBondContact O-N 3.39Å; D45-C47 VanDerWaalsContact C-N 3.25Å; D45-C47 PolarHBondContact O-N 2.89Å; D45-A48 PolarHBondContact O-N 3.4Å; D45-A48 VanDerWaalsContact O-N 3.17Å; D45-A49 PolarHBondContact O-N 3.02Å
46Q36.4Very low38.3Very low145 Ų145124 Ų12468%0.67867%0.672SS**Hα-helixtrans-68.6-19173.4-173.6154.390.300113.9L42 L44L42-Q46 VanDerWaalsContact O-CB 3.31Å; L42-Q46 WeakPolarHBondContact O-CB 3.39Å; L42-Q46 PolarHBondContact O-N 3.21Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 2.99Å
47C37.3Very low37.7Very low71 Ų71130.3 Ų130.348%0.4869%0.691SS.*Hα-helixtrans-81.5-36.7168.3-73.20000112.5Y43 L44 D45 A49 Q50Y43-C47 PolarHBondContact O-N 3.3Å; L44-C47 WeakPolarHBondContact O-CB 3.36Å; L44-C47 PolarHBondContact O-N 2.89Å; D45-C47 VanDerWaalsContact C-N 3.25Å; D45-C47 PolarHBondContact O-N 2.89Å; C47-A49 VanDerWaalsContact C-N 3.26Å; C47-A49 PolarHBondContact O-N 3.3Å; C47-Q50 PolarHBondContact O-N 3.34Å
48A37.3Very low37.5Very low72 Ų72129.6 Ų129.660%0.59570%0.7SS**Hα-helixtrans-62.2-34.7176.900000112.2L44 D45 Q50L44-A48 PolarHBondContact O-N 2.98Å; L44-A48 VanDerWaalsContact O-N 3.12Å; D45-A48 PolarHBondContact O-N 3.4Å; D45-A48 VanDerWaalsContact O-N 3.17Å; A48-Q50 PolarHBondContact O-N 3.14Å; A48-Q50 VanDerWaalsContact O-N 3.12Å
49A38.2Very low37.3Very low86 Ų86131.8 Ų131.871%0.71172%0.716SS**THydrogen-bonded Turntrans-73.27.7-179.500000115.9D45 C47D45-A49 PolarHBondContact O-N 3.02Å; C47-A49 VanDerWaalsContact C-N 3.26Å; C47-A49 PolarHBondContact O-N 3.3Å
50Q39.5Very low37Very low163 Ų163131 Ų13176%0.76272%0.722SS**THydrogen-bonded Turntrans-114.6-8.3-178-68.4-160.7-28.200116.1C47 A48C47-Q50 PolarHBondContact O-N 3.34Å; A48-Q50 PolarHBondContact O-N 3.14Å; A48-Q50 VanDerWaalsContact O-N 3.12Å
51D34.9Very low36.6Very low163 Ų163131.1 Ų131.187%0.87273%0.731SS**SBendtrans-94.1-1-176.4-94.1-23.2000115
52D40.3Very low35.9Very low147 Ų147132.1 Ų132.179%0.78674%0.741SS**  trans-119.992.6-179.8-169.110.4000112.9
53L37.1Very low35.8Very low172 Ų172132 Ų13290%0.90175%0.747SS**  trans-172.683.5160-111.1172.4000113.9
54A31Very low35.3Very low93 Ų93131.1 Ų131.177%0.76976%0.758SS**  trans-158.6125.6160.500000113.3
55P38.8Very low34.8Very low118 Ų118131.9 Ų131.977%0.76677%0.766SS**PPolyproline II helixtrans-89.8158.6-175.835.3-36000114.4
56P34.9Very low35.1Very low131 Ų131130.6 Ų130.685%0.85177%0.765SS**PPolyproline II helixtrans-74.1148.4179.330.9-35.9000113.2
57R29.1Very low34.7Very low247 Ų247134.9 Ų134.993%0.93278%0.777SS**PPolyproline II helixtrans-101.4140.8166.6-78.5-176170.1177-2.8111
58S36.1Very low34.3Very low109 Ų109135.4 Ų135.476%0.76279%0.793SS**PPolyproline II helixtrans-83.1151.1174.648.20000112.7
59P37.7Very low34Very low125 Ų125139 Ų13981%0.81280%0.8SS**PPolyproline II helixtrans-94.1147.5165.235.4-31000111.8
60L34.3Very low33.7Very low158 Ų158144.6 Ų144.683%0.82780%0.804SS**  trans-135.8138.3170.5-97.6169.6000110.5
61C26.8Very low33.3Very low115 Ų115143.8 Ų143.878%0.77780%0.803SS**  trans58.3118161.6-60.70000120.4
62N28Very low33Very low156 Ų156143.2 Ų143.283%0.83480%0.799SS**  trans-61.6169.2147.7-65.1-26.3000110.2
63P38.3Very low32.4Very low114 Ų114142.5 Ų142.574%0.7480%0.796SS**  -153.3169.592.742.8-25.9000117.3
64V28.4Very low31.9Very low134 Ų134138.8 Ų138.881%0.81279%0.79SS**  trans75.5123.7161.4-166.50000119.5
65V29.1Very low31.8Very low129 Ų129139.5 Ų139.578%0.78279%0.789SS**  trans-112.4165.1160.9-149.50000107.4
66P43Very low31.2Very low95 Ų95141 Ų14162%0.61779%0.791SS**  -156.9171.397.637.6-16.9000118.4
67Y28.6Very low31.8Very low235 Ų235139.1 Ų139.192%0.92278%0.779SS**  trans78.2128.6165-65.9-70.9000120.6
68G29.8Very low31.7Very low81 Ų81134.2 Ų134.284%0.83577%0.771SS**  trans160.265.2-179.600000112.7
69M29.8Very low31.3Very low148 Ų148135.7 Ų135.773%0.72978%0.775SS**  trans-78133-169.8-178.5-175.5-174.600113.8
70Y32.5Very low30.8Very low204 Ų204133.3 Ų133.380%0.877%0.767SS**  172.4169122.4-97.4-70.3000112.5
71I31.4Very low30.4Very low145 Ų145135.2 Ų135.274%0.74477%0.768SS**  trans-131.4143.9-162.6-73.4170.7000111.4
72L27.3Very low30.4Very low151 Ų151137.5 Ų137.579%0.79177%0.773SS**  trans-162.6138.4133.6-132.377.3000114.3
73N27.3Very low30.3Very low132 Ų132134.9 Ų134.971%0.70677%0.767SS**  trans11.3141.1152.6-57.31.7000120.6
74A28Very low29.6Very low94 Ų94137 Ų13778%0.77777%0.772SS**  66.213950.600000113.2
75S27.8Very low29.7Very low109 Ų109135.9 Ų135.976%0.76277%0.767SS**  cis-161.4154.211.752.20000113.9
76N26.7Very low29.4Very low149 Ų149137.9 Ų137.980%0.79777%0.768SS**  trans7.3165.2134.4-76.934.4000122.2
77P47.3Very low28.6Very low92 Ų92139.9 Ų139.960%0.59778%0.778SS**  cis-146.9-165.8-25.141.8-21.5000115.6
78D26.5Very low28.5Very low143 Ų143136.8 Ų136.877%0.76577%0.77SS**  trans53129.2147.4-57-32.2000123.6
79T28.1Very low28.3Very low140 Ų140141.9 Ų141.986%0.85977%0.772SS**  -179.2139.799.3-68.70000114.2
80A28Very low28.2Very low76 Ų76141 Ų14163%0.62878%0.775SS**  trans-22.6141.7173.200000123.8
81F25.1Very low28.2Very low197 Ų197136.7 Ų136.786%0.86477%0.774SS**  trans46.9125.2134.4-76.1-94.3000122.7
82N26.8Very low28Very low163 Ų163132.7 Ų132.787%0.87277%0.769SS**  -154.2164.9118.3-121.1-40.7000112.3
83S25.6Very low28.1Very low101 Ų101132.8 Ų132.871%0.70677%0.771SS**  trans-117.3136.1-161.357.90000116
84N25Very low28.6Very low160 Ų160132.8 Ų132.886%0.85677%0.765SS**  trans-161.7146.6138.7-135.914.5000111.1
85P29.1Very low28.9Very low109 Ų109133 Ų13371%0.70876%0.76SS**  trans-92.2111.4179.333.4-29.1000112.2V87P85-V87 PolarHBondContact O-N 3.19Å
86E23.6Very low29.3Very low172 Ų172133.3 Ų133.380%0.80476%0.762SS**  trans-82.7109.7169.6-166.2-176143.700109.7K88E86-K88 PolarHBondContact O-N 2.58Å
87V26Very low29.6Very low136 Ų136131.7 Ų131.782%0.82476%0.758SS**  trans-74.792.4179.8-179.50000109.5P85 E89P85-V87 PolarHBondContact O-N 3.19Å; V87-E89 PolarHBondContact O-N 3.39Å
88K26.6Very low29Very low171 Ų171133.2 Ų133.274%0.74376%0.761SS**  trans-86.5106179.9-162.7162.2-167.6156.10110.5E86 T90E86-K88 PolarHBondContact O-N 2.58Å; K88-T90 PolarHBondContact O-N 3.16Å
89E25.9Very low29.6Very low187 Ų187130 Ų13087%0.87474%0.743SS**  trans-59.9108.1176-67.8-167.9129.800111.1V87 S91V87-E89 PolarHBondContact O-N 3.39Å; E89-S91 PolarHBondContact O-N 2.79Å
90T27.3Very low29.9Very low131 Ų131126.9 Ų126.980%0.80473%0.727SS**  trans-84.9104.417154.20000109.4K88 G92K88-T90 PolarHBondContact O-N 3.16Å; T90-G92 PolarHBondContact O-N 2.83Å
91S31.9Very low30.2Very low112 Ų112132.6 Ų132.678%0.78374%0.739SS**  trans-61.796.1167.3550000109.8E89 D93E89-S91 PolarHBondContact O-N 2.79Å; S91-D93 PolarHBondContact O-N 2.99Å
92G28.9Very low30.5Very low62 Ų62127 Ų12764%0.63972%0.717SS**  trans-69.692.9-177.500000112.2T90 F94T90-G92 PolarHBondContact O-N 2.83Å; G92-F94 PolarHBondContact O-N 3.43Å
93D27.6Very low30.8Very low153 Ų153124.4 Ų124.482%0.81871%0.709SS**  trans-59.6124.7176.1-104.3-36.7000111.3S91 S95S91-D93 PolarHBondContact O-N 2.99Å; D93-S95 PolarHBondContact O-N 3.32Å
94F39.5Very low31.3Very low131 Ų131125.9 Ų125.958%0.57571%0.709SS**  trans-75.789.9177.5-83.1-109.4000110.7G92 K347G92-F94 PolarHBondContact O-N 3.43Å; F94-K347 HydrophobicContact CE1-CD 4.28Å; F94-K347 HydrophobicContact CZ-CD 4.32Å
95S32.8Very low31.7Very low99 Ų99127 Ų12769%0.69271%0.709SS**  trans-106.4131.9165.365.10000111.9D93D93-S95 PolarHBondContact O-N 3.32Å
96S36Very low31.8Very low115 Ų115127.5 Ų127.580%0.80471%0.71SS**  trans50.380.2171.854.20000116.5
97V33.9Very low32.2Very low116 Ų116125.2 Ų125.270%0.70371%0.708SS**  trans-78.9127.3131.3-176.80000105.6L99V97-L99 HydrophobicContact CG1-CD2 4.21Å
98D34.9Very low32.4Very low124 Ų124126.4 Ų126.466%0.66370%0.704SS**  trans-76.6134.9172.7-17019.6000110S100D98-S100 VanDerWaalsContact CG-OG 3.22Å; D98-S100 PolarHBondContact OD1-N 3.35Å; D98-S100 PolarHBondContact OD1-OG 2.88Å; D98-S100 WeakPolarHBondContact OD2-CB 3.46Å; D98-S100 PolarHBondContact OD2-OG 2.96Å
99L39Very low32.5Very low75 Ų75127 Ų12739%0.39371%0.71SS.*  trans-122.424.7-177.5-64177.5000111.2V97 F101 L102V97-L99 HydrophobicContact CG1-CD2 4.21Å; L99-F101 PolarHBondContact O-N 3.22Å; L99-F101 VanDerWaalsContact O-N 3.12Å; L99-L102 PolarHBondContact O-N 3.04Å
100S34.5Very low32.8Very low75 Ų75124.5 Ų124.552%0.52470%0.703SS.*THydrogen-bonded Turntrans-58.4-14.5175.352.10000115D98D98-S100 VanDerWaalsContact CG-OG 3.22Å; D98-S100 PolarHBondContact OD1-N 3.35Å; D98-S100 PolarHBondContact OD1-OG 2.88Å; D98-S100 WeakPolarHBondContact OD2-CB 3.46Å; D98-S100 PolarHBondContact OD2-OG 2.96Å
101F34.5Very low32.9Very low196 Ų196127.4 Ų127.486%0.8670%0.704SS**THydrogen-bonded Turntrans-93.25.9-176.9-82-93.9000115.7L99 P103L99-F101 PolarHBondContact O-N 3.22Å; L99-F101 VanDerWaalsContact O-N 3.12Å; F101-P103 WeakPolarHBondContact O-CD 3.41Å
102L31.3Very low32.8Very low80 Ų80129.6 Ų129.642%0.41971%0.707SS.*SBendtrans-87.3120.1172.2-67.4179.2000110.7L99L99-L102 PolarHBondContact O-N 3.04Å
103P33.5Very low32.8Very low108 Ų108135.5 Ų135.570%0.70172%0.718SS**  trans-73.4128179.428.4-33.8000112.2F101 E105F101-P103 WeakPolarHBondContact O-CD 3.41Å; P103-E105 VanDerWaalsContact C-N 3.3Å; P103-E105 PolarHBondContact O-N 2.97Å
104D35.7Very low33Very low132 Ų132133.8 Ų133.871%0.70672%0.715SS**  trans-75.973.6171.8-90-31.3000110.9V106D104-V106 VanDerWaalsContact C-N 3.32Å; D104-V106 PolarHBondContact O-N 2.97Å
105E33.5Very low32.4Very low182 Ų182134.2 Ų134.285%0.8573%0.729SS**  trans-69.886169.6-76.9-157.5135.800111.4P103 T107P103-E105 VanDerWaalsContact C-N 3.3Å; P103-E105 PolarHBondContact O-N 2.97Å; E105-T107 PolarHBondContact O-N 2.87Å
106V31.5Very low32.2Very low121 Ų121136.7 Ų136.773%0.73373%0.732SS**  trans-72.2110.1172178.30000109.6D104 Q108D104-V106 VanDerWaalsContact C-N 3.32Å; D104-V106 PolarHBondContact O-N 2.97Å; V106-Q108 PolarHBondContact O-N 3.14Å
107T32.3Very low31.6Very low124 Ų124136.4 Ų136.476%0.76173%0.73SS**  trans-58.2119.5178-41.50000111.6E105 E109E105-T107 PolarHBondContact O-N 2.87Å; T107-E109 HydrophobicContact CG2-CG 4.4Å
108Q30Very low31.3Very low160 Ų160136 Ų13675%0.74873%0.733SS**  trans-108.192.8173-179.5178-3600109.6V106 N110V106-Q108 PolarHBondContact O-N 3.14Å; Q108-N110 PolarHBondContact NE2-OD1 2.9Å
109E28.8Very low31.1Very low183 Ų183140.2 Ų140.286%0.85574%0.74SS**  trans-84.3125.7164.2-72.9-171108.800109.7T107T107-E109 HydrophobicContact CG2-CG 4.4Å
110N30.7Very low30.6Very low136 Ų136146 Ų14673%0.72776%0.764SS**  trans-81.1143-179.1-69.6-38.1000111Q108Q108-N110 PolarHBondContact NE2-OD1 2.9Å
111K30.8Very low30.2Very low192 Ų192150 Ų15084%0.83578%0.775SS**  trans-105.6113.2155.6176.7-171.6176.9-176.30107.3
112D30.3Very low29.9Very low158 Ų158147.4 Ų147.485%0.84578%0.775SS**  trans-168136.5143.6-94.6-27.8000109.8
113Q28.4Very low29.7Very low185 Ų185152.4 Ų152.486%0.86480%0.796SS**  trans-145.2113.8178.3-159.4176.640.700107.5
114P30.8Very low29.6Very low117 Ų117156.9 Ų156.976%0.7681%0.807SS**  trans-78137.9-173.930.1-33.8000111.4
115V27.5Very low29.2Very low141 Ų141156.8 Ų156.886%0.85581%0.807SS**  trans-74.1124.5171176.20000109.2
116I28.7Very low29Very low150 Ų150153.7 Ų153.777%0.76981%0.806SS**  trans-119.7123.6161.4-63.5-178.7000107.7
117S23Very low28.8Very low109 Ų109155.9 Ų155.976%0.76281%0.808SS**  trans-105.1123.6172.4176.60000108.8
118S27.8Very low28.7Very low109 Ų109154.4 Ų154.476%0.76280%0.802SS**  trans-129.1120.4168.355.30000108.7
119R29.6Very low28.6Very low212 Ų212155.2 Ų155.280%0.881%0.806SS**  trans-69.2151.3-179.4-62.3171.6177.1157.5-3.9111
120H28.8Very low28.6Very low197 Ų197151.4 Ų151.491%0.91280%0.8SS**  trans-137.7142.8144-114-91.3000108.6
121E26Very low29.1Very low159 Ų159149.9 Ų149.974%0.74380%0.797SS**  trans-106.6142.6-174-63.316315600109.7
122T28.5Very low28.9Very low141 Ų141149.4 Ų149.487%0.86580%0.798SS**  trans-154.5147.7150.2-62.10000107.4
123E28Very low28.7Very low184 Ų184146.6 Ų146.686%0.8679%0.791SS**  trans-78.4148.4-165.5-57.7148.3121.100113.5
124E30.3Very low28.5Very low202 Ų202149 Ų14994%0.94479%0.792SS**  trans-140139.7141.6-166.2167.7-152.600108.1
125N27.7Very low28.4Very low130 Ų130150.9 Ų150.970%0.69580%0.795SS**  trans-132.4116.5-167.2173.538.2000111.6
126S28.9Very low28.8Very low118 Ų118149.9 Ų149.983%0.82579%0.791SS**  trans-155.3121.1156-71.50000111.8
127E28.2Very low28.6Very low167 Ų167147.6 Ų147.678%0.7879%0.789SS**  trans-42.7159159.1-76.6172.110800114.7
128S29Very low29.2Very low92 Ų92147.6 Ų147.664%0.64379%0.786SS**  cis-166.7164.75.738.30000112.8
129Q29.7Very low29.1Very low178 Ų178147.2 Ų147.283%0.83278%0.783SS**  trans40147.9138.3-64.6177.932.700122.1
130S28.3Very low29.1Very low103 Ų103144.3 Ų144.372%0.7278%0.779SS**  cis-166.5-164.9-16.372.70000108.3
131P39.8Very low29Very low104 Ų104142.4 Ų142.468%0.67577%0.771SS**  trans-126.6-163.4-133.734.6-10.1000116.2
132Q27.2Very low29Very low181 Ų181141.4 Ų141.485%0.84677%0.77SS**  trans79.3149.4164-66179.416.600116.8
133S25.8Very low29.1Very low100 Ų100142.1 Ų142.170%0.69977%0.767SS**  cis-163166.5-10.453.70000114.2
134R25.4Very low29.1Very low236 Ų236137 Ų13789%0.89176%0.763SS**  trans52.4114.9139-170.4177.1-66.2-117.63121.1
135L27.9Very low29.1Very low155 Ų155136.1 Ų136.181%0.81276%0.764SS**  trans-50.2150.1159.6-92.4157.8000114.5
136P35.1Very low29Very low120 Ų120133 Ų13378%0.77976%0.763SS**  -147.4174.877.540.3-22.2000117.8
137S26Very low29.1Very low102 Ų102135 Ų13571%0.71376%0.764SS**  trans-82.6165.3173.355.20000113.9
138P35.2Very low29.2Very low109 Ų109134.3 Ų134.371%0.70877%0.765SS**  -153.2173.8101.239.3-22000117.1
139S26.1Very low29.2Very low101 Ų101135.2 Ų135.271%0.70677%0.771SS**  trans61.6153.8150.353.40000121.2
140E28.4Very low29.4Very low151 Ų151131.6 Ų131.671%0.70677%0.766SS**  cis-169.4151-23-108.3-165.610300109.3
141Q28.6Very low29.7Very low158 Ų158132.1 Ų132.174%0.73877%0.77SS**  trans62.3165159.4-57.916429.900116.1
142D25.9Very low29.4Very low137 Ų137135 Ų13573%0.73378%0.778SS**  cis-147.3-171.4-10.6-151.7-9.2000111.8
143I30.6Very low29.6Very low156 Ų156130.4 Ų130.480%0.877%0.766SS**  trans-59.4146179.2-62.3151.7000115.2
144G27.1Very low30Very low76 Ų76132.8 Ų132.878%0.78477%0.771SS**  trans-164.1146.9170.400000116.2
145L29.7Very low30.3Very low185 Ų185125.5 Ų125.597%0.96976%0.756SS**  trans-115.3164.2-170.9-67.2162.7000113.7
146G26.3Very low30.5Very low65 Ų65126.3 Ų126.367%0.6776%0.756SS**  trans121.4124.516600000112.9
147L31.8Very low30.5Very low159 Ų159124.3 Ų124.383%0.83275%0.745SS**  cis61.7109.441-54.3178.4000112
148N30.3Very low30.8Very low152 Ų152127.7 Ų127.781%0.81375%0.749SS**  cis75.879.844.7-55.333.4000113.4
149S28.3Very low30.6Very low111 Ų111129 Ų12978%0.77675%0.749SS**  trans-99128.515942.60000108.9
150S34.2Very low30.9Very low103 Ų103132.2 Ų132.272%0.7275%0.753SS**  cis90.7110.638.577.10000114.3
151S33.4Very low32.1Very low113 Ų113131.1 Ų131.179%0.7976%0.759SS**  trans163.7150134.9410000110.1
152L33.2Very low32.1Very low164 Ų164127 Ų12786%0.85976%0.76SS**  cis-164.6162.8-13-95.7167.9000105.1
153S33.1Very low32.4Very low85 Ų85128 Ų12859%0.59477%0.765SS**  cis-174.7155.2-5.353.30000111
154N33.3Very low32.5Very low151 Ų151127.5 Ų127.581%0.80777%0.769SS**  trans47148.6135.6-70.17.9000122.6
155S31.6Very low32.7Very low82 Ų82130.9 Ų130.957%0.57377%0.769SS**  cis-167.7156.92.9-108.60000112.3
156H33.1Very low32.8Very low172 Ų172127.2 Ų127.280%0.79676%0.759SS**  trans44.4151.8144.1-77.7-110.6000122.6
157S33.5Very low33.1Very low79 Ų79130.8 Ų130.855%0.55277%0.768SS**  cis-177.6139.7-1649.50000113
158Q32.9Very low33.2Very low172 Ų172130.8 Ų130.880%0.80476%0.763SS**  trans68.1167.8152.3-69.7171.7-62.700118.5
159L31.7Very low33.7Very low136 Ų136129.2 Ų129.271%0.71276%0.761SS**  cis-144.5-120.91.7-136.4169.8000114.9
160H32.5Very low33.6Very low170 Ų170128.3 Ų128.379%0.78776%0.755SS**  trans-160-179.4-169.9-90.4-76.3000109.6
161P53.6Low34Very low127 Ų127128.5 Ų128.583%0.82575%0.754SS**  cis-132.8-168.7-19.834.1-12.9000114.1
162G28.1Very low33.6Very low73 Ų73132.1 Ų132.175%0.75376%0.758SS**  trans148.4136.4152.100000118.3
163D31.7Very low33.6Very low158 Ų158133.7 Ų133.785%0.84576%0.758SS**  trans-106.4159.8179.3-48.2-91.7000113.7
164T33.1Very low33.9Very low144 Ų144134.8 Ų134.888%0.88376%0.763SS**  170.5163.7129.4310000114.8
165D30.9Very low33.8Very low147 Ų147134.8 Ų134.879%0.78676%0.763SS**  trans-70.3160.3-174.8-63.3-82.1000117.5
166S32.1Very low33.8Very low108 Ų108136.4 Ų136.476%0.75578%0.775SS**  175.2130.1115.8-81.90000117.7
167V33.1Very low33.7Very low141 Ų141136 Ų13686%0.85578%0.778SS**  trans77.2135.7131.7174.80000122.3
168Q32.5Very low33.6Very low158 Ų158137.9 Ų137.974%0.73879%0.791SS**  trans-84.3170.2172.4-111.4-175.3-70.100112.2
169P41.2Very low33.9Very low120 Ų120138.5 Ų138.578%0.77980%0.799SS**  cis-151.8-17146.642.3-19.2000118.4
170S26.1Very low33.9Very low91 Ų91137.6 Ų137.664%0.63681%0.805SS**  trans-64.1176.6169.6-51.20000113.2
171P43.1Very low34.4Very low108 Ų108138 Ų13870%0.70181%0.811SS**  cis-153.9-179.634.145.2-22.5000122.1
172E26Very low33.8Very low188 Ų188136 Ų13688%0.87981%0.805SS**  trans90.5167.8143.6-89.8164.9-175.500124
173K32.9Very low34.3Very low198 Ų198138.2 Ų138.286%0.86181%0.807SS**  trans-117.7-175.8-158.2-85.5-174.9177.9-178.40109.8
174P40.1Very low35.1Very low108 Ų108138.7 Ų138.770%0.70181%0.808SS**  cis-147.4178.718.744.9-24000119.7
175N29.3Very low35.6Very low150 Ų150137 Ų13780%0.80280%0.797SS**  trans37.8129.7146.8-572.7000123.1
176S31.9Very low36.2Very low117 Ų117135.7 Ų135.782%0.81880%0.797SS**  -172.5160.5108.257.20000112.7
177D31.6Very low36.9Very low163 Ų163138.9 Ų138.987%0.87280%0.802SS**  trans-79.4153.3-170.7-50.6-96.1000115.6
178S31.1Very low37.7Very low118 Ų118138.1 Ų138.183%0.82580%0.797SS**  trans-151.9137.5151.159.10000111.3
179L39.8Very low38.5Very low185 Ų185135.8 Ų135.897%0.96980%0.796SS**  trans-83136.4179.3-66.5166.2000110.2
180S31.8Very low38.5Very low118 Ų118139 Ų13983%0.82580%0.803SS**  trans-129.6128.1172.3-173.20000110.5
181L43Very low39.7Very low177 Ų177140.5 Ų140.593%0.92781%0.809SS**  trans-96.8105.7-174.4-154.878.7000109.6
182A40.5Very low39.7Very low85 Ų85141 Ų14170%0.70281%0.812SS**  trans-87.6143.7178.400000111.8
183P39.4Very low40.7Very low120 Ų120138 Ų13878%0.77981%0.806SS**  trans-68.5139.4-179.9-1932.3000113T185P183-T185 PolarHBondContact O-N 3.39Å; P183-T185 VanDerWaalsContact O-N 3.11Å
184I46.8Very low41.5Very low169 Ų169132.3 Ų132.387%0.86779%0.791SS**  trans-72.9103.1173.9-49.3173000108.5
185T44.4Very low41.9Very low107 Ų107133.9 Ų133.966%0.65679%0.789SS**  trans-75.3134.9166.843.10000109.3P183 M187P183-T185 PolarHBondContact O-N 3.39Å; P183-T185 VanDerWaalsContact O-N 3.11Å; T185-M187 PolarHBondContact O-N 2.75Å; T185-M187 VanDerWaalsContact O-N 3.16Å
186P43.7Very low43Very low120 Ų120132.1 Ų132.178%0.77979%0.787SS**  trans-68.6115.817727.4-32.7000109.1T188P186-T188 PolarHBondContact O-N 3.04Å
187M46.5Very low44.3Very low175 Ų175128.6 Ų128.686%0.86276%0.762SS**  trans-63.3105176.5-68.8-75.4-82.500109.4T185T185-M187 PolarHBondContact O-N 2.75Å; T185-M187 VanDerWaalsContact O-N 3.16Å
188T50.2Low46.7Very low125 Ų125124.5 Ų124.577%0.76776%0.759SS**  trans-55.2126.3169.3-44.80000108.1P186 M190P186-T188 PolarHBondContact O-N 3.04Å; T188-M190 PolarHBondContact O-N 2.8Å; T188-M190 VanDerWaalsContact O-N 3.11Å
189P48.6Very low49.6Very low110 Ų110120.6 Ų120.671%0.71473%0.728SS**  trans-61.5121.6178.824.9-33.1000108.6T191P189-T191 PolarHBondContact O-N 3.08Å
190M42.2Very low52.1Low187 Ų187115.7 Ų115.792%0.92171%0.706SS**  trans-63.5102.8168.9-73.6-177.417000107.5T188T188-M190 PolarHBondContact O-N 2.8Å; T188-M190 VanDerWaalsContact O-N 3.11Å
191T50Low55.2Low123 Ų123110.2 Ų110.276%0.75567%0.667SS**PPolyproline II helixtrans-53.6128163.924.50000107.5P189 V193P189-T191 PolarHBondContact O-N 3.08Å; T191-V193 PolarHBondContact O-N 2.9Å
192P44.6Very low57.7Low119 Ų119106.9 Ų106.977%0.77365%0.647SS**PPolyproline II helixtrans-60.2120.3176.425-32.6000107.6S194P192-S194 PolarHBondContact O-N 2.98Å; P192-S194 VanDerWaalsContact O-N 3.12Å
193V45.8Very low60.4Low123 Ų123103.8 Ų103.875%0.74562%0.618SS**PPolyproline II helixtrans-53.9121.3168.8176.90000106.3T191 E195T191-V193 PolarHBondContact O-N 2.9Å; V193-E195 PolarHBondContact O-N 3.21Å; V193-E195 VanDerWaalsContact O-N 3.1Å
194S50.4Low63.2Low79 Ų79100.9 Ų100.955%0.55259%0.594SS**  trans-43.5119.9-176.8-66.30000109.9P192 C196P192-S194 PolarHBondContact O-N 2.98Å; P192-S194 VanDerWaalsContact O-N 3.12Å; S194-C196 PolarHBondContact O-N 3.36Å; S194-C196 PolarHBondContact O-SG 2.87Å; S194-C196 VanDerWaalsContact O-SG 3.37Å
195E48.2Very low65.6Low141 Ų14194.7 Ų94.766%0.65956%0.563SS**  trans-45.2104.5-173.4-64.4174.5132.100110.2V193 C197 K371V193-E195 PolarHBondContact O-N 3.21Å; V193-E195 VanDerWaalsContact O-N 3.1Å; E195-C197 VanDerWaalsContact C-N 3.3Å; E195-C197 PolarHBondContact O-N 2.88Å; E195-K371 IonicContact OE2-NZ 2.85Å; E195-K371 PolarHBondContact OE2-NZ 2.92Å
196C51.6Low68.1Low113 Ų11389.6 Ų89.676%0.76453%0.532SS*.  trans-68.289.7-167.7-60.40000109.8S194 G198S194-C196 PolarHBondContact O-N 3.36Å; S194-C196 PolarHBondContact O-SG 2.87Å; S194-C196 VanDerWaalsContact O-SG 3.37Å; C196-G198 PolarHBondContact O-N 2.8Å
197C60.6Low70.7Confident44 Ų4484.8 Ų84.830%0.29750%0.5SS..  trans-62.7124.6175.7-168.30000108E195 I199 Y367E195-C197 VanDerWaalsContact C-N 3.3Å; E195-C197 PolarHBondContact O-N 2.88Å; C197-I199 PolarHBondContact O-N 3.35Å; C197-I199 WeakPolarHBondContact SG-CD1 3.12Å; C197-I199 VanDerWaalsContact SG-CG1 3.56Å; C197-Y367 HydrophobicContact CB-CD1 4.14Å; C197-Y367 HydrophobicContact CB-CE1 3.51Å; C197-Y367 HydrophobicContact CB-CE2 4.06Å; C197-Y367 VanDerWaalsContact CB-CZ 3.48Å; C197-Y367 PolarHBondContact SG-OH 3.21Å; C197-Y367 VanDerWaalsContact SG-OH 3.32Å
198G81.6Confident73.2Confident77 Ų7776.5 Ų76.579%0.79446%0.459SS*.SBendtrans-66.317.9-177.800000115.3C196 V200C196-G198 PolarHBondContact O-N 2.8Å; G198-V200 PolarHBondContact O-N 2.86Å
199I91.5Very high75.5Confident35 Ų3572.3 Ų72.318%0.17943%0.434CS..  trans-89.794.9178.4-61.8175.3000107.3C197 C300 D301 R303 F363C197-I199 PolarHBondContact O-N 3.35Å; C197-I199 WeakPolarHBondContact SG-CD1 3.12Å; C197-I199 VanDerWaalsContact SG-CG1 3.56Å; I199-C300 HydrophobicContact CG2-CB 4.06Å; I199-D301 WeakPolarHBondContact CG2-O 3.17Å; I199-R303 HydrophobicContact CD1-CG 4.13Å; I199-F363 HydrophobicContact CB-CE1 4.45Å; I199-F363 HydrophobicContact CB-CZ 4.32Å; I199-F363 HydrophobicContact CG2-CE1 4.38Å; I199-F363 HydrophobicContact CG2-CZ 3.94Å; I199-F363 WeakPolarHBondContact O-CE1 3.31Å
200V93.7Very high77.8Confident82 Ų8267.3 Ų67.350%0.49740%0.401SS..  trans-91.7123.7179.1-179.10000109.9G198 Q202 Y360G198-V200 PolarHBondContact O-N 2.86Å; V200-Q202 PolarHBondContact O-N 2.91Å; V200-Q202 PolarHBondContact O-NE2 3.46Å; V200-Y360 HydrophobicContact CG1-CD1 4.5Å; V200-Y360 HydrophobicContact CG1-CE1 3.65Å
201P95.6Very high80.5Confident3 Ų360.6 Ų60.62%0.01937%0.369CS..  trans-53.7134.7171.5-27.933.5000113.9C300 I359 Y360 F363P201-C300 HydrophobicContact CG-CB 4.39Å; P201-I359 HydrophobicContact CB-CG2 3.8Å; P201-I359 HydrophobicContact CG-CG2 4.48Å; P201-Y360 HydrophobicContact CB-CD1 4.19Å; P201-Y360 HydrophobicContact CB-CE1 3.94Å; P201-Y360 HydrophobicContact CG-CD1 4.02Å; P201-Y360 HydrophobicContact CG-CE1 4.18Å; P201-Y360 WeakPolarHBondContact O-CE1 3.12Å; P201-Y360 PolarHBondContact O-OH 3.35Å; P201-F363 HydrophobicContact CG-CB 3.55Å; P201-F363 HydrophobicContact CG-CD1 3.74Å; P201-F363 HydrophobicContact CG-CD2 4.16Å; P201-F363 HydrophobicContact CG-CG 3.52Å
202Q96.6Very high82.8Confident107 Ų10754.8 Ų54.850%0.533%0.333SS..EExtended strand (participates in β ladder)trans-108135.1-178.2-58.8-56-47.500110.5V200 G298 S299V200-Q202 PolarHBondContact O-N 2.91Å; V200-Q202 PolarHBondContact O-NE2 3.46Å; Q202-G298 CarbonylContact O-C 3.57Å; Q202-G298 VanDerWaalsContact O-CA 3.32Å; Q202-G298 WeakPolarHBondContact O-CA 3.47Å; Q202-S299 PolarHBondContact N-O 3Å; Q202-S299 PolarHBondContact O-N 2.87Å
203L96.9Very high85.3Confident20 Ų2051.4 Ų51.411%0.10532%0.316CS..EExtended strand (participates in β ladder)trans-74.1128.3177.5-64.4176.6000110.7I206 K263 M296 R356 I359L203-I206 HydrophobicContact CD1-CD1 4.28Å; L203-K263 WeakPolarHBondContact CB-O 3.49Å; L203-M296 HydrophobicContact CD1-CE 3.64Å; L203-M296 HydrophobicContact CD2-CE 3.85Å; L203-M296 HydrophobicContact CG-CE 4.42Å; L203-R356 HydrophobicContact CD1-CG 4.13Å; L203-I359 HydrophobicContact CD2-CD1 3.57Å
204Q96.8Very high87.7Confident59 Ų5946.5 Ų46.528%0.27629%0.286SS..EExtended strand (participates in β ladder)trans-110.2-34-177.9-58-57.2-14.600113.3V297 S299Q204-V297 PolarHBondContact N-O 3.42Å; Q204-S299 VanDerWaalsContact CG-OG 3.28Å; Q204-S299 WeakPolarHBondContact CG-OG 3.22Å; Q204-S299 PolarHBondContact NE2-OG 2.79Å
205N97.4Very high89.9Confident39 Ų3950.7 Ų50.721%0.20930%0.295CS..EExtended strand (participates in β ladder)trans-152.4145.5178.6-179.733.3000110.8G261 A262 V297N205-G261 VanDerWaalsContact OD1-CA 3.31Å; N205-G261 WeakPolarHBondContact OD1-CA 3.44Å; N205-G261 PolarHBondContact OD1-N 2.88Å; N205-A262 CarbonylContact C-O 3.51Å; N205-A262 WeakPolarHBondContact CA-O 3.31Å; N205-V297 HydrophobicContact CB-CB 4.21Å; N205-V297 HydrophobicContact CB-CG2 4.34Å; N205-V297 PolarHBondContact N-O 2.88Å; N205-V297 PolarHBondContact O-N 3.28Å
206I97.8Very high92.2Very high0 Ų044.4 Ų44.40%027%0.266CS..EExtended strand (participates in β ladder)trans-133.5125.5174.7-63.7169.1000108.7L203 A262 S264 E265 I293 M296L203-I206 HydrophobicContact CD1-CD1 4.28Å; I206-A262 PolarHBondContact N-O 3.26Å; I206-S264 VanDerWaalsContact CD1-CA 3.46Å; I206-E265 HydrophobicContact CD1-CG 4.22Å; I206-I293 HydrophobicContact CG2-CD1 3.87Å; I206-I293 HydrophobicContact CG2-CG2 3.96Å; I206-M296 HydrophobicContact CD1-CE 3.9Å; I206-M296 HydrophobicContact CG1-CE 4.13Å; I206-M296 HydrophobicContact CG1-CG 4.27Å; I206-M296 HydrophobicContact CG2-CG 4.43Å
207V98Very high94.4Very high19 Ų1942.8 Ų42.812%0.11525%0.249CC..EExtended strand (participates in β ladder)trans-98.5121.8173.9-178.40000108.5V258 C259 T260 Q294 N295V207-V258 HydrophobicContact CG1-CG1 3.95Å; V207-C259 WeakPolarHBondContact CA-O 3.48Å; V207-T260 HydrophobicContact CB-CG2 4.45Å; V207-T260 HydrophobicContact CG1-CG2 4.12Å; V207-T260 HydrophobicContact CG2-CG2 4.03Å; V207-Q294 HydrophobicContact CG1-CB 4.45Å; V207-Q294 PolarHBondContact O-N 3.29Å; V207-N295 HydrophobicContact CB-CB 4.17Å; V207-N295 HydrophobicContact CG2-CB 4.33Å; V207-N295 PolarHBondContact N-O 2.96Å; V207-N295 PolarHBondContact O-N 2.9Å
208S98.5Very high96.1Very high1 Ų141 Ų411%0.00724%0.237CC..EExtended strand (participates in β ladder)trans-125.3155173.964.40000112.1V258 C259 S268 F291 K292S208-V258 CarbonylContact O-C 3.58Å; S208-V258 WeakPolarHBondContact O-CA 3.22Å; S208-C259 PolarHBondContact N-O 2.84Å; S208-C259 PolarHBondContact O-N 2.92Å; S208-S268 WeakPolarHBondContact CB-OG 3.32Å; S208-S268 PolarHBondContact OG-OG 3.05Å; S208-F291 WeakPolarHBondContact OG-CE2 3.49Å; S208-K292 CarbonylContact C-O 3.56Å; S208-K292 VanDerWaalsContact CA-O 3.27Å; S208-K292 WeakPolarHBondContact CA-O 3.49Å; S208-K292 WeakPolarHBondContact CB-O 3.2Å
209T98.3Very high96.8Very high37 Ų3744.3 Ų44.323%0.22723%0.229CC..EExtended strand (participates in β ladder)trans-116.3151.7170.7510000110.6M257 V258 F291 K292 Q294T209-M257 CarbonylContact C-O 3.52Å; T209-M257 WeakPolarHBondContact CA-O 3.33Å; T209-V258 HydrophobicContact CG2-CG2 4.13Å; T209-F291 WeakPolarHBondContact O-CA 3.29Å; T209-K292 PolarHBondContact N-O 3.37Å; T209-K292 PolarHBondContact O-N 2.82Å; T209-Q294 HydrophobicContact CG2-CG 3.7Å; T209-Q294 PolarHBondContact OG1-NE2 2.97Å
210V98.6Very high97Very high6 Ų647 Ų474%0.03624%0.24CC..EExtended strand (participates in β ladder)trans-146.5152.2171.467.90000110.1M257 A272 F288 L289 F291V210-M257 HydrophobicContact CG1-CB 3.92Å; V210-M257 HydrophobicContact CG1-CE 3.28Å; V210-M257 HydrophobicContact CG1-CG 4.35Å; V210-M257 PolarHBondContact N-O 3.13Å; V210-M257 PolarHBondContact O-N 3.1Å; V210-A272 HydrophobicContact CG1-CB 4.27Å; V210-F288 HydrophobicContact CB-CE2 4.46Å; V210-F288 HydrophobicContact CG2-CD1 4.49Å; V210-F288 HydrophobicContact CG2-CD2 3.69Å; V210-F288 HydrophobicContact CG2-CE1 4.48Å; V210-F288 HydrophobicContact CG2-CE2 3.67Å; V210-F288 HydrophobicContact CG2-CG 4.11Å; V210-F288 HydrophobicContact CG2-CZ 4.08Å; V210-L289 WeakPolarHBondContact CG2-O 3.07Å; V210-F291 HydrophobicContact CB-CD2 4.31Å; V210-F291 HydrophobicContact CG2-CB 4.23Å
211N98.4Very high97.1Very high46 Ų4643 Ų4325%0.24622%0.216CC..EExtended strand (participates in β ladder)trans-104.9120.7176.9-176.96.5000110.3A213 L289 D290N211-A213 VanDerWaalsContact C-N 3.31Å; N211-A213 WeakPolarHBondContact OD1-CA 3.45Å; N211-A213 PolarHBondContact OD1-N 2.96Å; N211-L289 HydrophobicContact CB-CB 4.28Å; N211-L289 PolarHBondContact N-O 3.11Å; N211-L289 PolarHBondContact O-N 3.21Å; N211-D290 HydrophobicContact CB-CB 3.89Å; N211-D290 WeakPolarHBondContact CB-OD2 3.41Å; N211-D290 PolarHBondContact ND2-OD2 3.3Å
212L97.9Very high97.1Very high0 Ų044.2 Ų44.20%023%0.226CC..  trans-84.2-6.6176.9-57.9176.2000112.8C214 L216 I251 G255 M257 A276 V279 A286 R287L212-C214 PolarHBondContact O-N 3.48Å; L212-C214 VanDerWaalsContact O-N 3.14Å; L212-L216 HydrophobicContact CD1-CD1 3.8Å; L212-I251 HydrophobicContact CD1-CG2 4.41Å; L212-G255 VanDerWaalsContact CB-O 3.24Å; L212-G255 WeakPolarHBondContact CB-O 3.44Å; L212-G255 WeakPolarHBondContact CG-O 3.39Å; L212-G255 PolarHBondContact N-O 3.22Å; L212-M257 HydrophobicContact CD1-CB 4.25Å; L212-M257 HydrophobicContact CD1-SD 4.38Å; L212-M257 HydrophobicContact CD2-CE 4.05Å; L212-M257 HydrophobicContact CG-CB 4.43Å; L212-A276 HydrophobicContact CD2-CB 3.64Å; L212-V279 HydrophobicContact CD1-CG1 4.49Å; L212-V279 HydrophobicContact CD1-CG2 4.3Å; L212-A286 HydrophobicContact CB-CB 4.16Å; L212-A286 HydrophobicContact CD2-CB 4.45Å; L212-A286 WeakPolarHBondContact O-CA 3.48Å; L212-R287 WeakPolarHBondContact CA-O 3.5Å; L212-R287 WeakPolarHBondContact CD2-O 3.41Å; L212-R287 PolarHBondContact O-N 3.18Å
213A96.6Very high97Very high49 Ų4945.9 Ų45.941%0.40524%0.237SC..  trans58.222.417200000116.3N211 R287 L289N211-A213 VanDerWaalsContact C-N 3.31Å; N211-A213 WeakPolarHBondContact OD1-CA 3.45Å; N211-A213 PolarHBondContact OD1-N 2.96Å; A213-R287 HydrophobicContact CB-CB 4.13Å; A213-R287 HydrophobicContact CB-CG 4.44Å; A213-L289 HydrophobicContact CB-CD1 3.8Å; A213-L289 HydrophobicContact CB-CG 4.45Å
214C96.4Very high96.8Very high19 Ų1950.2 Ų50.213%0.12826%0.257CS..SBendtrans-146.8150.6174.8610000111.1L212 L216 G255 P285L212-C214 PolarHBondContact O-N 3.48Å; L212-C214 VanDerWaalsContact O-N 3.14Å; C214-L216 VanDerWaalsContact SG-CD2 3.59Å; C214-G255 VanDerWaalsContact O-CA 3.22Å; C214-G255 WeakPolarHBondContact O-CA 3.09Å; C214-P285 HydrophobicContact CB-CG 4.02Å
215K97.1Very high96.6Very high168 Ų16848 Ų4873%0.7325%0.249SC*.  trans-68.5141.2168.6-67.3-67-170.5173.90109.9S253K215-S253 WeakPolarHBondContact CA-O 3.43Å; K215-S253 WeakPolarHBondContact CD-O 3.41Å
216L96.7Very high96.1Very high9 Ų955 Ų555%0.04728%0.277CS..  trans-124.1129.4-174.2-64.5178.5000111.3L212 C214 L218 I221 I251 S253 V279 F284L212-L216 HydrophobicContact CD1-CD1 3.8Å; C214-L216 VanDerWaalsContact SG-CD2 3.59Å; L216-L218 HydrophobicContact CB-CD2 4.26Å; L216-L218 PolarHBondContact O-N 3.07Å; L216-I221 HydrophobicContact CB-CD1 3.92Å; L216-I221 HydrophobicContact CD1-CD1 4.04Å; L216-I221 HydrophobicContact CD2-CD1 4.3Å; L216-I221 HydrophobicContact CG-CD1 4.31Å; L216-I251 HydrophobicContact CD1-CG2 3.52Å; L216-S253 PolarHBondContact N-O 2.84Å; L216-S253 VanDerWaalsContact N-O 3.07Å; L216-V279 HydrophobicContact CD1-CG1 4.21Å; L216-V279 HydrophobicContact CD2-CG1 3.73Å; L216-F284 HydrophobicContact CD2-CB 3.76Å; L216-F284 HydrophobicContact CD2-CD1 3.6Å; L216-F284 HydrophobicContact CD2-CD2 4.27Å; L216-F284 HydrophobicContact CD2-CE1 4.23Å; L216-F284 HydrophobicContact CD2-CG 3.62Å
217D97.1Very high95.8Very high78 Ų7860.2 Ų60.242%0.41731%0.305SS..  trans-80.1103.6165.8175.320000109.6K219 K220 I221 F284D217-K219 VanDerWaalsContact C-N 3.25Å; D217-K219 PolarHBondContact O-N 3.07Å; D217-K219 WeakPolarHBondContact OD1-CB 3.49Å; D217-K219 PolarHBondContact OD1-N 3.22Å; D217-K220 HydrophobicContact CB-CB 4.12Å; D217-K220 PolarHBondContact O-N 3.08Å; D217-K220 WeakPolarHBondContact OD2-CB 3.45Å; D217-K220 PolarHBondContact OD2-N 2.83Å; D217-K220 VanDerWaalsContact OD2-N 3.14Å; D217-I221 WeakPolarHBondContact O-CG1 3.3Å; D217-I221 PolarHBondContact O-N 2.75Å; D217-F284 HydrophobicContact CB-CE1 4.39Å; D217-F284 HydrophobicContact CB-CZ 4.34Å
218L96.6Very high95.7Very high6 Ų660.4 Ų60.43%0.03131%0.308CS..Hα-helixtrans-62.7-29.6179.3-60-166.2000112.8L216 I221 A222 Y230 V238 I251L216-L218 HydrophobicContact CB-CD2 4.26Å; L216-L218 PolarHBondContact O-N 3.07Å; L218-I221 HydrophobicContact CD2-CD1 4.47Å; L218-A222 WeakPolarHBondContact O-CB 3.49Å; L218-A222 PolarHBondContact O-N 2.97Å; L218-Y230 HydrophobicContact CB-CD1 4.32Å; L218-Y230 HydrophobicContact CB-CD2 4.31Å; L218-Y230 HydrophobicContact CB-CE1 3.8Å; L218-Y230 HydrophobicContact CB-CE2 3.8Å; L218-Y230 HydrophobicContact CD1-CD2 4.47Å; L218-Y230 HydrophobicContact CD1-CE2 3.66Å; L218-Y230 HydrophobicContact CG-CE2 4.4Å; L218-V238 HydrophobicContact CB-CG2 3.65Å; L218-V238 HydrophobicContact CD1-CG2 4.4Å; L218-V238 HydrophobicContact CD2-CG2 3.86Å; L218-V238 HydrophobicContact CG-CG2 4.14Å; L218-V238 WeakPolarHBondContact O-CG2 3.47Å; L218-I251 HydrophobicContact CD2-CG2 4.44Å; L218-I251 WeakPolarHBondContact CD2-O 3.24Å
219K96Very high95.5Very high148 Ų14864.7 Ų64.764%0.64333%0.328SS*.Hα-helixtrans-68.6-49.9176.1-63.9179.6179.5179.30110.5D217 I221 A222 L223 Y230D217-K219 VanDerWaalsContact C-N 3.25Å; D217-K219 PolarHBondContact O-N 3.07Å; D217-K219 WeakPolarHBondContact OD1-CB 3.49Å; D217-K219 PolarHBondContact OD1-N 3.22Å; K219-I221 VanDerWaalsContact C-N 3.3Å; K219-I221 PolarHBondContact O-N 3.46Å; K219-A222 PolarHBondContact O-N 3.45Å; K219-L223 WeakPolarHBondContact O-CB 3.38Å; K219-L223 PolarHBondContact O-N 3.03Å; K219-Y230 HydrophobicContact CG-CE1 3.91Å
220K95.7Very high95.5Very high90 Ų9066.2 Ų66.239%0.39133%0.331SS..Hα-helixtrans-60.3-38.3175.1-179.4177.7178.8-1730112.1D217 H224 F284D217-K220 HydrophobicContact CB-CB 4.12Å; D217-K220 PolarHBondContact O-N 3.08Å; D217-K220 WeakPolarHBondContact OD2-CB 3.45Å; D217-K220 PolarHBondContact OD2-N 2.83Å; D217-K220 VanDerWaalsContact OD2-N 3.14Å; K220-H224 PolarHBondContact O-N 2.97Å; K220-H224 PolarHBondContact O-ND1 2.99Å; K220-F284 HydrophobicContact CB-CZ 4.26Å; K220-F284 HydrophobicContact CD-CE2 4.42Å; K220-F284 HydrophobicContact CD-CZ 3.95Å; K220-F284 HydrophobicContact CG-CZ 4.21Å
221I95.9Very high95.3Very high0 Ų070.1 Ų70.10%035%0.351CS..Hα-helixtrans-62.1-53.9174.4-68173.3000110.5L216 D217 L218 K219 L223 H224 A225 V238 M240 I251 L282 F284L216-I221 HydrophobicContact CB-CD1 3.92Å; L216-I221 HydrophobicContact CD1-CD1 4.04Å; L216-I221 HydrophobicContact CD2-CD1 4.3Å; L216-I221 HydrophobicContact CG-CD1 4.31Å; D217-I221 WeakPolarHBondContact O-CG1 3.3Å; D217-I221 PolarHBondContact O-N 2.75Å; L218-I221 HydrophobicContact CD2-CD1 4.47Å; K219-I221 VanDerWaalsContact C-N 3.3Å; K219-I221 PolarHBondContact O-N 3.46Å; I221-L223 VanDerWaalsContact C-N 3.29Å; I221-L223 PolarHBondContact O-N 2.9Å; I221-H224 PolarHBondContact O-N 3.35Å; I221-A225 HydrophobicContact CG2-CB 4.28Å; I221-A225 WeakPolarHBondContact O-CB 3.46Å; I221-A225 PolarHBondContact O-N 3.14Å; I221-V238 HydrophobicContact CB-CG2 4.48Å; I221-V238 HydrophobicContact CG2-CG1 4.18Å; I221-V238 HydrophobicContact CG2-CG2 4.37Å; I221-M240 HydrophobicContact CG2-CE 3.72Å; I221-I251 HydrophobicContact CD1-CG2 4.43Å; I221-L282 HydrophobicContact CB-CD1 4.43Å; I221-L282 HydrophobicContact CG1-CD1 4.28Å; I221-L282 HydrophobicContact CG2-CD1 4.18Å; I221-F284 HydrophobicContact CD1-CE2 4.1Å; I221-F284 HydrophobicContact CD1-CZ 4.41Å; I221-F284 HydrophobicContact CG1-CD2 4.24Å; I221-F284 HydrophobicContact CG1-CE2 3.47Å; I221-F284 VanDerWaalsContact CG1-CE2 3.47Å; I221-F284 HydrophobicContact CG1-CZ 3.91Å
222A95Very high95.1Very high27 Ų2771.6 Ų71.622%0.22336%0.363CS..Hα-helixtrans-60.9-34.9-177.400000113.4L218 K219 Y230L218-A222 WeakPolarHBondContact O-CB 3.49Å; L218-A222 PolarHBondContact O-N 2.97Å; K219-A222 PolarHBondContact O-N 3.45Å; A222-Y230 HydrophobicContact CB-CD1 4.34Å; A222-Y230 HydrophobicContact CB-CG 4.34Å
223L94.8Very high95Very high143 Ų14381.5 Ų81.575%0.74941%0.406SS*.Hα-helixtrans-70.2-28.4179.2-176.561.8000113.9K219 I221K219-L223 WeakPolarHBondContact O-CB 3.38Å; K219-L223 PolarHBondContact O-N 3.03Å; I221-L223 VanDerWaalsContact C-N 3.29Å; I221-L223 PolarHBondContact O-N 2.9Å
224H93.6Very high94.9Very high111 Ų11188.2 Ų88.251%0.51442%0.421SS..Hα-helixtrans-113-18.9-172.9-61.484.2000114.1K220 I221 L282K220-H224 PolarHBondContact O-N 2.97Å; K220-H224 PolarHBondContact O-ND1 2.99Å; I221-H224 PolarHBondContact O-N 3.35Å; H224-L282 HydrophobicContact CB-CD2 3.62Å
225A91.3Very high94.9Very high13 Ų1391.2 Ų91.211%0.10743%0.432CS..SBendtrans-83.7131178.800000111.5I221 A228 M240 L282I221-A225 HydrophobicContact CG2-CB 4.28Å; I221-A225 WeakPolarHBondContact O-CB 3.46Å; I221-A225 PolarHBondContact O-N 3.14Å; A225-A228 HydrophobicContact CB-CB 3.66Å; A225-M240 HydrophobicContact CB-CE 3.62Å; A225-L282 HydrophobicContact CB-CD1 4.15Å
226K87.7Confident94.8Very high185 Ų18586.5 Ų86.580%0.80442%0.424SS*.THydrogen-bonded Turntrans-72.1138.7170.1-59.9-173.9179.7-172.60109.4
227N91.3Very high94.8Very high110 Ų11086.1 Ų86.159%0.58842%0.423SS*.THydrogen-bonded Turntrans57.345.9-178.5-42.7-37.1000113.1M240 R241N227-M240 WeakPolarHBondContact O-CA 3.21Å; N227-R241 PolarHBondContact O-N 3.4Å
228A95.4Very high94.9Very high22 Ų2282.4 Ų82.418%0.18240%0.403CS..EExtended strand (participates in β ladder)trans-118.4132172.700000110.6A225 V238 I239 M240A225-A228 HydrophobicContact CB-CB 3.66Å; A228-V238 HydrophobicContact CB-CG1 3.92Å; A228-I239 CarbonylContact C-O 3.59Å; A228-I239 VanDerWaalsContact CA-O 3.3Å; A228-I239 WeakPolarHBondContact CA-O 3.43Å; A228-M240 HydrophobicContact CB-CE 4.39Å; A228-M240 HydrophobicContact CB-CG 4.41Å
229E96.2Very high94.9Very high91 Ų9183.3 Ų83.343%0.42541%0.407SS..EExtended strand (participates in β ladder)trans-115.2133.4179.1-56.3155.3-130.300108.2I239 R241E229-I239 HydrophobicContact CB-CB 4.26Å; E229-I239 PolarHBondContact N-O 2.86Å; E229-I239 PolarHBondContact O-N 3.29Å; E229-R241 IonicContact OE1-CZ 3.54Å; E229-R241 IonicContact OE1-NE 2.75Å; E229-R241 PolarHBondContact OE1-NE 2.92Å; E229-R241 IonicContact OE1-NH2 2.57Å; E229-R241 PolarHBondContact OE1-NH2 3.42Å; E229-R241 VanDerWaalsContact OE1-NH2 3.08Å; E229-R241 IonicContact OE2-NH2 3.08Å; E229-R241 PolarHBondContact OE2-NH2 3.1Å
230Y97.4Very high95Very high70 Ų7076.4 Ų76.428%0.27538%0.377SS..  trans-147.1117.5176.6-178.3-127.7000111.6L218 K219 A222 P232 A237 V238L218-Y230 HydrophobicContact CB-CD1 4.32Å; L218-Y230 HydrophobicContact CB-CD2 4.31Å; L218-Y230 HydrophobicContact CB-CE1 3.8Å; L218-Y230 HydrophobicContact CB-CE2 3.8Å; L218-Y230 HydrophobicContact CD1-CD2 4.47Å; L218-Y230 HydrophobicContact CD1-CE2 3.66Å; L218-Y230 HydrophobicContact CG-CE2 4.4Å; K219-Y230 HydrophobicContact CG-CE1 3.91Å; A222-Y230 HydrophobicContact CB-CD1 4.34Å; A222-Y230 HydrophobicContact CB-CG 4.34Å; Y230-P232 HydrophobicContact CE1-CB 4.44Å; Y230-P232 HydrophobicContact CE1-CG 4.16Å; Y230-P232 HydrophobicContact CE2-CB 4.22Å; Y230-A237 WeakPolarHBondContact CD2-O 3.49Å; Y230-V238 HydrophobicContact CD2-CG2 3.94Å; Y230-V238 HydrophobicContact CG-CG2 4.03Å
231N95.3Very high95.1Very high87 Ų8777 Ų7747%0.46538%0.377SS..  trans-134.597172.5178.7-4.3000108.9K233 R234 F235N231-K233 PolarHBondContact O-N 3.48Å; N231-K233 VanDerWaalsContact O-N 3.13Å; N231-K233 WeakPolarHBondContact OD1-CB 3.24Å; N231-K233 PolarHBondContact OD1-N 2.86Å; N231-K233 VanDerWaalsContact OD1-N 3.1Å; N231-R234 HydrophobicContact CB-CB 4.18Å; N231-R234 PolarHBondContact O-N 2.86Å; N231-F235 PolarHBondContact O-N 2.84Å
232P93.4Very high95.1Very high77 Ų7778.8 Ų78.850%0.539%0.386SS..THydrogen-bonded Turntrans-66.1-13.6-176.525.3-33.6000114.4Y230Y230-P232 HydrophobicContact CE1-CB 4.44Å; Y230-P232 HydrophobicContact CE1-CG 4.16Å; Y230-P232 HydrophobicContact CE2-CB 4.22Å
233K95.7Very high95.1Very high208 Ų20888.4 Ų88.490%0.90442%0.417SS*.THydrogen-bonded Turntrans-76.8-24.8170.1-64.8-172.8175.2-173.20112.6N231N231-K233 PolarHBondContact O-N 3.48Å; N231-K233 VanDerWaalsContact O-N 3.13Å; N231-K233 WeakPolarHBondContact OD1-CB 3.24Å; N231-K233 PolarHBondContact OD1-N 2.86Å; N231-K233 VanDerWaalsContact OD1-N 3.1Å
234R95.4Very high95Very high191 Ų19188.1 Ų88.172%0.72141%0.412SS*.THydrogen-bonded Turntrans-96.5-42.9178.5-174.2-175.7-179-77.9-2.3112.1N231N231-R234 HydrophobicContact CB-CB 4.18Å; N231-R234 PolarHBondContact O-N 2.86Å
235F95.3Very high95.1Very high81 Ų8183.6 Ų83.636%0.35539%0.392SS..  trans-158139.2-176.5-163.4-124000112.5N231 A237 L250 F252N231-F235 PolarHBondContact O-N 2.84Å; F235-A237 HydrophobicContact CD1-CB 3.79Å; F235-A237 HydrophobicContact CE1-CB 3.65Å; F235-A237 PolarHBondContact O-N 2.98Å; F235-A237 VanDerWaalsContact O-N 3.1Å; F235-L250 HydrophobicContact CE1-CD1 4.28Å; F235-L250 HydrophobicContact CE1-CD2 4.48Å; F235-F252 HydrophobicContact CE1-CZ 4.44Å; F235-F252 HydrophobicContact CZ-CE1 4.31Å; F235-F252 HydrophobicContact CZ-CZ 4.23Å
236A94.8Very high95.4Very high69 Ų6993.3 Ų93.357%0.5743%0.426SS*.SBendtrans-83.827.6-17300000114.8
237A97.2Very high95.8Very high1 Ų184.8 Ų84.81%0.00839%0.39CS..EExtended strand (participates in β ladder)trans-142.5153.7179.900000111.5Y230 F235 I251 F252Y230-A237 WeakPolarHBondContact CD2-O 3.49Å; F235-A237 HydrophobicContact CD1-CB 3.79Å; F235-A237 HydrophobicContact CE1-CB 3.65Å; F235-A237 PolarHBondContact O-N 2.98Å; F235-A237 VanDerWaalsContact O-N 3.1Å; A237-I251 CarbonylContact C-O 3.55Å; A237-I251 VanDerWaalsContact CA-O 3.32Å; A237-I251 WeakPolarHBondContact CA-O 3.5Å; A237-I251 WeakPolarHBondContact CB-O 3.47Å; A237-F252 HydrophobicContact CB-CD1 3.82Å; A237-F252 HydrophobicContact CB-CD2 4.43Å; A237-F252 HydrophobicContact CB-CE1 3.84Å; A237-F252 HydrophobicContact CB-CE2 4.43Å; A237-F252 HydrophobicContact CB-CG 4.13Å; A237-F252 HydrophobicContact CB-CZ 4.16Å
238V98Very high96.2Very high0 Ų080.9 Ų80.90%037%0.37CS..EExtended strand (participates in β ladder)trans-80.7127.9169.2178.90000108.6L218 I221 A228 Y230 L250 I251L218-V238 HydrophobicContact CB-CG2 3.65Å; L218-V238 HydrophobicContact CD1-CG2 4.4Å; L218-V238 HydrophobicContact CD2-CG2 3.86Å; L218-V238 HydrophobicContact CG-CG2 4.14Å; L218-V238 WeakPolarHBondContact O-CG2 3.47Å; I221-V238 HydrophobicContact CB-CG2 4.48Å; I221-V238 HydrophobicContact CG2-CG1 4.18Å; I221-V238 HydrophobicContact CG2-CG2 4.37Å; A228-V238 HydrophobicContact CB-CG1 3.92Å; Y230-V238 HydrophobicContact CD2-CG2 3.94Å; Y230-V238 HydrophobicContact CG-CG2 4.03Å; V238-L250 WeakPolarHBondContact O-CA 3.16Å; V238-I251 HydrophobicContact CB-CB 4.39Å; V238-I251 PolarHBondContact N-O 2.85Å; V238-I251 PolarHBondContact O-N 2.93Å
239I97.9Very high96.3Very high25 Ų2579.8 Ų79.813%0.12836%0.361CS..EExtended strand (participates in β ladder)trans-89.7120169.6-56.9164.6000106.8A228 E229 R241 T248 A249 L250A228-I239 CarbonylContact C-O 3.59Å; A228-I239 VanDerWaalsContact CA-O 3.3Å; A228-I239 WeakPolarHBondContact CA-O 3.43Å; E229-I239 HydrophobicContact CB-CB 4.26Å; E229-I239 PolarHBondContact N-O 2.86Å; E229-I239 PolarHBondContact O-N 3.29Å; I239-R241 HydrophobicContact CG2-CG 4.49Å; I239-T248 HydrophobicContact CG2-CG2 3.59Å; I239-A249 WeakPolarHBondContact CA-O 3.42Å; I239-L250 HydrophobicContact CB-CD2 4.4Å; I239-L250 HydrophobicContact CG1-CD2 3.79Å; I239-L250 HydrophobicContact CG2-CD2 4.38Å
240M97.7Very high96.4Very high3 Ų377 Ų772%0.01535%0.348CS..EExtended strand (participates in β ladder)trans-123140.2178.3-167.8-178-64.300110.1I221 A225 N227 A228 T248 A249 I251 Y275 V278I221-M240 HydrophobicContact CG2-CE 3.72Å; A225-M240 HydrophobicContact CB-CE 3.62Å; N227-M240 WeakPolarHBondContact O-CA 3.21Å; A228-M240 HydrophobicContact CB-CE 4.39Å; A228-M240 HydrophobicContact CB-CG 4.41Å; M240-T248 CarbonylContact O-C 3.52Å; M240-T248 WeakPolarHBondContact O-CA 3.38Å; M240-A249 PolarHBondContact N-O 2.86Å; M240-A249 PolarHBondContact O-N 2.87Å; M240-I251 HydrophobicContact CB-CD1 4.39Å; M240-I251 HydrophobicContact CE-CD1 3.83Å; M240-I251 HydrophobicContact SD-CD1 4.43Å; M240-Y275 HydrophobicContact CB-CD1 4.26Å; M240-Y275 HydrophobicContact CB-CE1 4Å; M240-Y275 HydrophobicContact CG-CD1 4.12Å; M240-Y275 HydrophobicContact CG-CE1 3.93Å; M240-Y275 PolarHBondContact O-OH 2.57Å; M240-Y275 HydrophobicContact SD-CD1 3.82Å; M240-Y275 HydrophobicContact SD-CE1 4.23Å; M240-V278 HydrophobicContact CE-CG1 4.24Å; M240-V278 HydrophobicContact SD-CB 4.39Å; M240-V278 HydrophobicContact SD-CG1 3.91Å
241R97.6Very high96.4Very high103 Ų10373.6 Ų73.639%0.38934%0.335SS..EExtended strand (participates in β ladder)trans-129.4135-174.7-51-173.9-162.2-100.310.2112.6N227 E229 I239 T248N227-R241 PolarHBondContact O-N 3.4Å; E229-R241 IonicContact OE1-CZ 3.54Å; E229-R241 IonicContact OE1-NE 2.75Å; E229-R241 PolarHBondContact OE1-NE 2.92Å; E229-R241 IonicContact OE1-NH2 2.57Å; E229-R241 PolarHBondContact OE1-NH2 3.42Å; E229-R241 VanDerWaalsContact OE1-NH2 3.08Å; E229-R241 IonicContact OE2-NH2 3.08Å; E229-R241 PolarHBondContact OE2-NH2 3.1Å; I239-R241 HydrophobicContact CG2-CG 4.49Å; R241-T248 HydrophobicContact CG-CG2 4.14Å; R241-T248 PolarHBondContact NH1-OG1 3.36Å; R241-T248 VanDerWaalsContact NH1-OG1 3.14Å
242I96.4Very high96.5Very high37 Ų3772.2 Ų72.219%0.1933%0.325CS..EExtended strand (participates in β ladder)trans-122.1148.5172.271.1-175.1000111R246 T247 K274 Y275I242-R246 WeakPolarHBondContact O-CA 3.44Å; I242-T247 VanDerWaalsContact CG1-OG1 3.31Å; I242-T247 WeakPolarHBondContact CG1-OG1 3.49Å; I242-T247 PolarHBondContact N-O 3.28Å; I242-T247 PolarHBondContact O-N 2.82Å; I242-T247 VanDerWaalsContact O-N 3.15Å; I242-K274 HydrophobicContact CD1-CB 3.89Å; I242-K274 HydrophobicContact CD1-CD 3.98Å; I242-Y275 HydrophobicContact CD1-CE2 3.99Å; I242-Y275 HydrophobicContact CG1-CE1 4.47Å; I242-Y275 HydrophobicContact CG1-CE2 4.25Å; I242-Y275 HydrophobicContact CG2-CD1 4.39Å; I242-Y275 HydrophobicContact CG2-CE1 3.76Å; I242-Y275 PolarHBondContact N-OH 3.04Å
243R94.9Very high96.7Very high229 Ų22971.7 Ų71.786%0.86432%0.323SS*.EExtended strand (participates in β ladder)trans-78.2-25.3-178.4-67.6-175.7179179.3-1.3113.7P245 R246R243-P245 CarbonylContact O-C 3.59Å; R243-R246 WeakPolarHBondContact O-CA 3.5Å; R243-R246 PolarHBondContact O-N 2.8Å; R243-R246 VanDerWaalsContact O-N 3.17Å
244E93.4Very high96.8Very high137 Ų13764.2 Ų64.264%0.6430%0.297SS*.THydrogen-bonded Turntrans-140.5114.5-172.1-171.5-158.9-121.500112.2K274E244-K274 WeakPolarHBondContact O-CD 3.39Å; E244-K274 PolarHBondContact O-NZ 2.97Å; E244-K274 IonicContact OE2-NZ 2.97Å; E244-K274 PolarHBondContact OE2-NZ 2.89Å
245P94.9Very high96.9Very high17 Ų1755.1 Ų55.111%0.1126%0.263CS..THydrogen-bonded Turncis-60.4148.7-18.630.7-36000109.8R243 T247 Q267 A271R243-P245 CarbonylContact O-C 3.59Å; P245-T247 HydrophobicContact CB-CG2 4.31Å; P245-T247 HydrophobicContact CG-CG2 4.03Å; P245-T247 PolarHBondContact O-N 2.93Å; P245-T247 PolarHBondContact O-OG1 2.83Å; P245-Q267 HydrophobicContact CB-CB 4.22Å; P245-Q267 HydrophobicContact CB-CG 4.38Å; P245-Q267 HydrophobicContact CG-CB 4.22Å; P245-A271 HydrophobicContact CG-CB 3.84Å
246R96.7Very high97Very high217 Ų21758 Ų5882%0.81928%0.276SS*.EExtended strand (participates in β ladder)trans-6499.4-176.7-178.4179.8175.2177-2.3109.7I242 R243I242-R246 WeakPolarHBondContact O-CA 3.44Å; R243-R246 WeakPolarHBondContact O-CA 3.5Å; R243-R246 PolarHBondContact O-N 2.8Å; R243-R246 VanDerWaalsContact O-N 3.17Å
247T97.9Very high97.1Very high5 Ų554.8 Ų54.83%0.03125%0.249CC..EExtended strand (participates in β ladder)trans-141.7164.4-169.749.70000110.9I242 P245 T260 A262 A271 Y275I242-T247 VanDerWaalsContact CG1-OG1 3.31Å; I242-T247 WeakPolarHBondContact CG1-OG1 3.49Å; I242-T247 PolarHBondContact N-O 3.28Å; I242-T247 PolarHBondContact O-N 2.82Å; I242-T247 VanDerWaalsContact O-N 3.15Å; P245-T247 HydrophobicContact CB-CG2 4.31Å; P245-T247 HydrophobicContact CG-CG2 4.03Å; P245-T247 PolarHBondContact O-N 2.93Å; P245-T247 PolarHBondContact O-OG1 2.83Å; T247-T260 VanDerWaalsContact CA-O 3.24Å; T247-T260 WeakPolarHBondContact CA-O 3.16Å; T247-T260 WeakPolarHBondContact CB-O 3.32Å; T247-T260 WeakPolarHBondContact CG2-O 3.43Å; T247-A262 HydrophobicContact CG2-CB 4.02Å; T247-A271 HydrophobicContact CG2-CB 3.86Å; T247-Y275 VanDerWaalsContact C-OH 3.23Å; T247-Y275 PolarHBondContact O-OH 2.9Å; T247-Y275 PolarHBondContact OG1-OH 2.96Å
248T97.9Very high97.2Very high28 Ų2856.1 Ų56.117%0.17226%0.256CS..EExtended strand (participates in β ladder)trans-125.4142.4168.8-62.20000108.9I239 M240 R241 C259 T260 Y275I239-T248 HydrophobicContact CG2-CG2 3.59Å; M240-T248 CarbonylContact O-C 3.52Å; M240-T248 WeakPolarHBondContact O-CA 3.38Å; R241-T248 HydrophobicContact CG-CG2 4.14Å; R241-T248 PolarHBondContact NH1-OG1 3.36Å; R241-T248 VanDerWaalsContact NH1-OG1 3.14Å; T248-C259 WeakPolarHBondContact O-CA 3.19Å; T248-T260 PolarHBondContact N-O 2.73Å; T248-T260 PolarHBondContact O-N 2.99Å; T248-Y275 WeakPolarHBondContact CA-OH 3.44Å
249A98Very high97.2Very high0 Ų056.1 Ų56.10%026%0.257CS..EExtended strand (participates in β ladder)trans-117.5144169.800000111.6I239 M240 M257 V258 Y275I239-A249 WeakPolarHBondContact CA-O 3.42Å; M240-A249 PolarHBondContact N-O 2.86Å; M240-A249 PolarHBondContact O-N 2.87Å; A249-M257 HydrophobicContact CB-CG 4.12Å; A249-M257 HydrophobicContact CB-SD 3.94Å; A249-V258 CarbonylContact C-O 3.57Å; A249-V258 WeakPolarHBondContact CA-O 3.44Å; A249-V258 WeakPolarHBondContact CB-O 3.47Å; A249-Y275 HydrophobicContact CB-CD1 3.69Å; A249-Y275 HydrophobicContact CB-CD2 3.64Å; A249-Y275 HydrophobicContact CB-CE1 3.67Å; A249-Y275 HydrophobicContact CB-CE2 3.65Å; A249-Y275 HydrophobicContact CB-CG 3.69Å
250L98.1Very high97.2Very high31 Ų3156.8 Ų56.816%0.16226%0.262CS..EExtended strand (participates in β ladder)trans-109.9113.1171.9-51.7178.4000107.8F235 V238 I239 F252 M257 V258F235-L250 HydrophobicContact CE1-CD1 4.28Å; F235-L250 HydrophobicContact CE1-CD2 4.48Å; V238-L250 WeakPolarHBondContact O-CA 3.16Å; I239-L250 HydrophobicContact CB-CD2 4.4Å; I239-L250 HydrophobicContact CG1-CD2 3.79Å; I239-L250 HydrophobicContact CG2-CD2 4.38Å; L250-F252 HydrophobicContact CB-CE2 4.11Å; L250-M257 VanDerWaalsContact O-CA 3.27Å; L250-M257 WeakPolarHBondContact O-CA 3.41Å; L250-V258 HydrophobicContact CB-CB 4.25Å; L250-V258 PolarHBondContact N-O 2.76Å; L250-V258 PolarHBondContact O-N 2.91Å
251I98.1Very high97.1Very high0 Ų058.4 Ų58.40%028%0.279CS..EExtended strand (participates in β ladder)trans-108.2115.2-174.1-56.3175000109.6L212 L216 L218 I221 A237 V238 M240 M257 V279L212-I251 HydrophobicContact CD1-CG2 4.41Å; L216-I251 HydrophobicContact CD1-CG2 3.52Å; L218-I251 HydrophobicContact CD2-CG2 4.44Å; L218-I251 WeakPolarHBondContact CD2-O 3.24Å; I221-I251 HydrophobicContact CD1-CG2 4.43Å; A237-I251 CarbonylContact C-O 3.55Å; A237-I251 VanDerWaalsContact CA-O 3.32Å; A237-I251 WeakPolarHBondContact CA-O 3.5Å; A237-I251 WeakPolarHBondContact CB-O 3.47Å; V238-I251 HydrophobicContact CB-CB 4.39Å; V238-I251 PolarHBondContact N-O 2.85Å; V238-I251 PolarHBondContact O-N 2.93Å; M240-I251 HydrophobicContact CB-CD1 4.39Å; M240-I251 HydrophobicContact CE-CD1 3.83Å; M240-I251 HydrophobicContact SD-CD1 4.43Å; I251-M257 HydrophobicContact CD1-SD 4.09Å; I251-M257 HydrophobicContact CG1-CG 3.95Å; I251-M257 HydrophobicContact CG1-SD 3.72Å; I251-V279 HydrophobicContact CD1-CG2 4.04Å
252F98.1Very high97.1Very high58 Ų5853.5 Ų53.525%0.25426%0.26SS..EExtended strand (participates in β ladder)trans-92.9151.6-179-63.1-93.7000111.4F235 A237 L250 S254 G255 K256 V258F235-F252 HydrophobicContact CE1-CZ 4.44Å; F235-F252 HydrophobicContact CZ-CE1 4.31Å; F235-F252 HydrophobicContact CZ-CZ 4.23Å; A237-F252 HydrophobicContact CB-CD1 3.82Å; A237-F252 HydrophobicContact CB-CD2 4.43Å; A237-F252 HydrophobicContact CB-CE1 3.84Å; A237-F252 HydrophobicContact CB-CE2 4.43Å; A237-F252 HydrophobicContact CB-CG 4.13Å; A237-F252 HydrophobicContact CB-CZ 4.16Å; L250-F252 HydrophobicContact CB-CE2 4.11Å; F252-S254 WeakPolarHBondContact CB-OG 3.33Å; F252-S254 PolarHBondContact O-N 3.38Å; F252-G255 PolarHBondContact O-N 2.7Å; F252-K256 HydrophobicContact CD2-CB 4.47Å; F252-K256 WeakPolarHBondContact CD2-O 3.5Å; F252-K256 PolarHBondContact N-O 3.32Å; F252-V258 HydrophobicContact CE2-CG2 4.08Å
253S97.5Very high97Very high65 Ų6556.7 Ų56.746%0.45527%0.273SS..THydrogen-bonded Turntrans-61.4-18.3178.560.10000113.7K215 L216 G255K215-S253 WeakPolarHBondContact CA-O 3.43Å; K215-S253 WeakPolarHBondContact CD-O 3.41Å; L216-S253 PolarHBondContact N-O 2.84Å; L216-S253 VanDerWaalsContact N-O 3.07Å; S253-G255 VanDerWaalsContact C-N 3.28Å; S253-G255 PolarHBondContact O-N 3.5Å
254S97.4Very high97.1Very high52 Ų5247 Ų4736%0.36424%0.24SC..THydrogen-bonded Turntrans-70.6-16.4172.859.50000114.5F252 K256F252-S254 WeakPolarHBondContact CB-OG 3.33Å; F252-S254 PolarHBondContact O-N 3.38Å; S254-K256 PolarHBondContact OG-N 2.92Å
255G96.1Very high97.3Very high0 Ų042.6 Ų42.60%022%0.22CC..SBendtrans88.4-5-169.400000114.1L212 C214 F252 S253L212-G255 VanDerWaalsContact CB-O 3.24Å; L212-G255 WeakPolarHBondContact CB-O 3.44Å; L212-G255 WeakPolarHBondContact CG-O 3.39Å; L212-G255 PolarHBondContact N-O 3.22Å; C214-G255 VanDerWaalsContact O-CA 3.22Å; C214-G255 WeakPolarHBondContact O-CA 3.09Å; F252-G255 PolarHBondContact O-N 2.7Å; S253-G255 VanDerWaalsContact C-N 3.28Å; S253-G255 PolarHBondContact O-N 3.5Å
256K98Very high97.4Very high142 Ų14247.8 Ų47.862%0.61724%0.242SC*.EExtended strand (participates in β ladder)trans-67.4141.6166.1-68.9-171.9176.5-175.80109.6F252 S254F252-K256 HydrophobicContact CD2-CB 4.47Å; F252-K256 WeakPolarHBondContact CD2-O 3.5Å; F252-K256 PolarHBondContact N-O 3.32Å; S254-K256 PolarHBondContact OG-N 2.92Å
257M98.3Very high97.4Very high1 Ų141.2 Ų41.21%0.00522%0.221CC..EExtended strand (participates in β ladder)trans-134.8133.7173.3178.3170.86700110.5T209 V210 L212 A249 L250 I251 A272 Y275T209-M257 CarbonylContact C-O 3.52Å; T209-M257 WeakPolarHBondContact CA-O 3.33Å; V210-M257 HydrophobicContact CG1-CB 3.92Å; V210-M257 HydrophobicContact CG1-CE 3.28Å; V210-M257 HydrophobicContact CG1-CG 4.35Å; V210-M257 PolarHBondContact N-O 3.13Å; V210-M257 PolarHBondContact O-N 3.1Å; L212-M257 HydrophobicContact CD1-CB 4.25Å; L212-M257 HydrophobicContact CD1-SD 4.38Å; L212-M257 HydrophobicContact CD2-CE 4.05Å; L212-M257 HydrophobicContact CG-CB 4.43Å; A249-M257 HydrophobicContact CB-CG 4.12Å; A249-M257 HydrophobicContact CB-SD 3.94Å; L250-M257 VanDerWaalsContact O-CA 3.27Å; L250-M257 WeakPolarHBondContact O-CA 3.41Å; I251-M257 HydrophobicContact CD1-SD 4.09Å; I251-M257 HydrophobicContact CG1-CG 3.95Å; I251-M257 HydrophobicContact CG1-SD 3.72Å; M257-A272 HydrophobicContact CE-CB 4.5Å; M257-Y275 VanDerWaalsContact SD-CB 3.58Å; M257-Y275 HydrophobicContact SD-CG 4.25Å
258V98.5Very high97.5Very high28 Ų2841 Ų4117%0.1722%0.22CC..EExtended strand (participates in β ladder)trans-100.6145.5168.5-176.60000108.2V207 S208 T209 A249 L250 F252 T260V207-V258 HydrophobicContact CG1-CG1 3.95Å; S208-V258 CarbonylContact O-C 3.58Å; S208-V258 WeakPolarHBondContact O-CA 3.22Å; T209-V258 HydrophobicContact CG2-CG2 4.13Å; A249-V258 CarbonylContact C-O 3.57Å; A249-V258 WeakPolarHBondContact CA-O 3.44Å; A249-V258 WeakPolarHBondContact CB-O 3.47Å; L250-V258 HydrophobicContact CB-CB 4.25Å; L250-V258 PolarHBondContact N-O 2.76Å; L250-V258 PolarHBondContact O-N 2.91Å; F252-V258 HydrophobicContact CE2-CG2 4.08Å; V258-T260 HydrophobicContact CG1-CG2 4.07Å
259C98.3Very high97.5Very high1 Ų145.8 Ų45.81%0.00724%0.235CC..EExtended strand (participates in β ladder)trans-133.3130.2177-175.60000110.2V207 S208 T248 A272V207-C259 WeakPolarHBondContact CA-O 3.48Å; S208-C259 PolarHBondContact N-O 2.84Å; S208-C259 PolarHBondContact O-N 2.92Å; T248-C259 WeakPolarHBondContact O-CA 3.19Å; C259-A272 HydrophobicContact CB-CB 4.47Å
260T97.8Very high97.5Very high39 Ų3950 Ų5024%0.23926%0.256CS..EExtended strand (participates in β ladder)trans-136.3163-17466.40000112.4V207 T247 T248 V258V207-T260 HydrophobicContact CB-CG2 4.45Å; V207-T260 HydrophobicContact CG1-CG2 4.12Å; V207-T260 HydrophobicContact CG2-CG2 4.03Å; T247-T260 VanDerWaalsContact CA-O 3.24Å; T247-T260 WeakPolarHBondContact CA-O 3.16Å; T247-T260 WeakPolarHBondContact CB-O 3.32Å; T247-T260 WeakPolarHBondContact CG2-O 3.43Å; T248-T260 PolarHBondContact N-O 2.73Å; T248-T260 PolarHBondContact O-N 2.99Å; V258-T260 HydrophobicContact CG1-CG2 4.07Å
261G95.3Very high97.5Very high36 Ų3648.5 Ų48.537%0.37125%0.249SC..EExtended strand (participates in β ladder)trans91.31.3176.400000115.5N205N205-G261 VanDerWaalsContact OD1-CA 3.31Å; N205-G261 WeakPolarHBondContact OD1-CA 3.44Å; N205-G261 PolarHBondContact OD1-N 2.88Å
262A97.3Very high97.5Very high0 Ų048.5 Ų48.50%025%0.249CC..EExtended strand (participates in β ladder)trans-79.2144.5176.900000111.3N205 I206 T247 Q267N205-A262 CarbonylContact C-O 3.51Å; N205-A262 WeakPolarHBondContact CA-O 3.31Å; I206-A262 PolarHBondContact N-O 3.26Å; T247-A262 HydrophobicContact CG2-CB 4.02Å; A262-Q267 HydrophobicContact CB-CB 4.04Å
263K95.3Very high97.5Very high104 Ų10453.3 Ų53.345%0.45227%0.265SS..SBendtrans-97.5-8177.6-65.2-154.7174.8-156.30114.7L203 Q267L203-K263 WeakPolarHBondContact CB-O 3.49Å; K263-Q267 VanDerWaalsContact N-OE1 3.16Å
264S96.8Very high97.5Very high25 Ų2553.5 Ų53.518%0.17526%0.258CS..SBendtrans-140.9160.6169.989.30000112.5I206 E266 Q267 S268I206-S264 VanDerWaalsContact CD1-CA 3.46Å; S264-E266 VanDerWaalsContact C-N 3.28Å; S264-E266 WeakPolarHBondContact CB-OE2 3.35Å; S264-E266 PolarHBondContact O-N 2.9Å; S264-E266 PolarHBondContact OG-OE2 3.12Å; S264-Q267 WeakPolarHBondContact O-CB 3.27Å; S264-Q267 PolarHBondContact O-N 3.09Å; S264-Q267 VanDerWaalsContact O-N 3.16Å; S264-Q267 WeakPolarHBondContact OG-CG 3.49Å; S264-Q267 PolarHBondContact OG-N 3.37Å; S264-S268 PolarHBondContact O-N 3.36Å
265E96.6Very high97.5Very high45 Ų4551 Ų5121%0.2124%0.241CC..Hα-helixtrans-61-38.9-178.5-61.989.612800110.8I206 S268 R269 M296I206-E265 HydrophobicContact CD1-CG 4.22Å; E265-S268 PolarHBondContact O-N 2.93Å; E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 PolarHBondContact O-N 3.16Å; E265-M296 HydrophobicContact CG-CE 3.94Å; E265-M296 WeakPolarHBondContact OE1-CE 3.4Å
266E97.4Very high97.6Very high126 Ų12651.2 Ų51.259%0.58924%0.242SC*.Hα-helixtrans-69.1-41.5174.6-48.670.9-151.400111.1S264 S268 R269 L270S264-E266 VanDerWaalsContact C-N 3.28Å; S264-E266 WeakPolarHBondContact CB-OE2 3.35Å; S264-E266 PolarHBondContact O-N 2.9Å; S264-E266 PolarHBondContact OG-OE2 3.12Å; E266-S268 VanDerWaalsContact C-N 3.34Å; E266-R269 PolarHBondContact O-N 2.82Å; E266-L270 WeakPolarHBondContact O-CB 3.5Å; E266-L270 PolarHBondContact O-N 2.88Å
267Q97.6Very high97.6Very high80 Ų8051.5 Ų51.537%0.37424%0.239SC..Hα-helixtrans-62.2-42.5174.4-72.2-178.19.200111.1P245 A262 K263 S264 L270 A271P245-Q267 HydrophobicContact CB-CB 4.22Å; P245-Q267 HydrophobicContact CB-CG 4.38Å; P245-Q267 HydrophobicContact CG-CB 4.22Å; A262-Q267 HydrophobicContact CB-CB 4.04Å; K263-Q267 VanDerWaalsContact N-OE1 3.16Å; S264-Q267 WeakPolarHBondContact O-CB 3.27Å; S264-Q267 PolarHBondContact O-N 3.09Å; S264-Q267 VanDerWaalsContact O-N 3.16Å; S264-Q267 WeakPolarHBondContact OG-CG 3.49Å; S264-Q267 PolarHBondContact OG-N 3.37Å; Q267-L270 PolarHBondContact O-N 3.18Å; Q267-A271 VanDerWaalsContact O-CB 3.29Å; Q267-A271 WeakPolarHBondContact O-CB 3.27Å; Q267-A271 PolarHBondContact O-N 2.76Å
268S98.3Very high97.5Very high0 Ų053.8 Ų53.80%025%0.253CS..Hα-helixtrans-63.7-44.4177.9-159.20000110.9S208 S264 E265 E266 A271 A272S208-S268 WeakPolarHBondContact CB-OG 3.32Å; S208-S268 PolarHBondContact OG-OG 3.05Å; S264-S268 PolarHBondContact O-N 3.36Å; E265-S268 PolarHBondContact O-N 2.93Å; E266-S268 VanDerWaalsContact C-N 3.34Å; S268-A271 PolarHBondContact O-N 2.86Å; S268-A272 WeakPolarHBondContact O-CB 3.4Å; S268-A272 PolarHBondContact O-N 2.71Å
269R98.1Very high97.4Very high129 Ų12952.4 Ų52.449%0.48725%0.245SC..Hα-helixtrans-64.3-41174.8-166.1-177.1-65.7-1033.6112.4E265 E266 R273 F288 F291E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 PolarHBondContact O-N 3.16Å; E266-R269 PolarHBondContact O-N 2.82Å; R269-R273 VanDerWaalsContact O-CG 3.3Å; R269-R273 WeakPolarHBondContact O-CG 3.24Å; R269-R273 PolarHBondContact O-N 3.27Å; R269-F288 HydrophobicContact CG-CZ 4.22Å; R269-F291 HydrophobicContact CB-CE1 3.88Å; R269-F291 HydrophobicContact CB-CE2 4.12Å; R269-F291 HydrophobicContact CB-CZ 3.64Å; R269-F291 HydrophobicContact CG-CD1 4.15Å; R269-F291 HydrophobicContact CG-CE1 3.98Å; R269-F291 HydrophobicContact CG-CE2 4.36Å; R269-F291 HydrophobicContact CG-CG 4.42Å; R269-F291 HydrophobicContact CG-CZ 4.09Å; R269-F291 VanDerWaalsContact CZ-CD1 3.5Å
270L98.3Very high97.3Very high87 Ų8755.8 Ų55.846%0.45526%0.261SS..Hα-helixtrans-66.3-43.3177178.360.9000111.5E266 Q267 R273 K274E266-L270 WeakPolarHBondContact O-CB 3.5Å; E266-L270 PolarHBondContact O-N 2.88Å; Q267-L270 PolarHBondContact O-N 3.18Å; L270-R273 PolarHBondContact O-N 3.29Å; L270-K274 WeakPolarHBondContact O-CG 3.28Å; L270-K274 PolarHBondContact O-N 2.91Å
271A98.3Very high97.3Very high0 Ų062 Ų620%028%0.284CS..Hα-helixtrans-58.8-54.217500000110.8P245 T247 Q267 S268 R273 K274 Y275P245-A271 HydrophobicContact CG-CB 3.84Å; T247-A271 HydrophobicContact CG2-CB 3.86Å; Q267-A271 VanDerWaalsContact O-CB 3.29Å; Q267-A271 WeakPolarHBondContact O-CB 3.27Å; Q267-A271 PolarHBondContact O-N 2.76Å; S268-A271 PolarHBondContact O-N 2.86Å; A271-R273 PolarHBondContact O-N 2.95Å; A271-K274 CarbonylContact O-C 3.33Å; A271-K274 WeakPolarHBondContact O-CA 3.45Å; A271-K274 WeakPolarHBondContact O-CB 3.36Å; A271-K274 PolarHBondContact O-N 2.88Å; A271-Y275 HydrophobicContact CB-CD2 4.46Å; A271-Y275 HydrophobicContact CB-CE2 4.2Å; A271-Y275 WeakPolarHBondContact O-CD2 3.24Å; A271-Y275 PolarHBondContact O-N 3.46Å
272A98.3Very high97.3Very high0 Ų061.9 Ų61.90%028%0.275CS..Hα-helixtrans-56.2-37.817800000112.3V210 M257 C259 S268 A276 F288 F291V210-A272 HydrophobicContact CG1-CB 4.27Å; M257-A272 HydrophobicContact CE-CB 4.5Å; C259-A272 HydrophobicContact CB-CB 4.47Å; S268-A272 WeakPolarHBondContact O-CB 3.4Å; S268-A272 PolarHBondContact O-N 2.71Å; A272-A276 WeakPolarHBondContact O-CB 3.46Å; A272-A276 PolarHBondContact O-N 2.62Å; A272-F288 HydrophobicContact CB-CE2 3.75Å; A272-F288 HydrophobicContact CB-CZ 4.28Å; A272-F291 HydrophobicContact CB-CD2 4.13Å; A272-F291 HydrophobicContact CB-CE2 3.97Å
273R98.1Very high97.2Very high159 Ų15964.9 Ų64.960%0.631%0.306SS*.Hα-helixtrans-68.1-40.2172.4-72.5177.973.8-175.24112.9R269 L270 A271 R277 F288R269-R273 VanDerWaalsContact O-CG 3.3Å; R269-R273 WeakPolarHBondContact O-CG 3.24Å; R269-R273 PolarHBondContact O-N 3.27Å; L270-R273 PolarHBondContact O-N 3.29Å; A271-R273 PolarHBondContact O-N 2.95Å; R273-R277 WeakPolarHBondContact O-CB 3.32Å; R273-R277 PolarHBondContact O-N 3.25Å; R273-F288 HydrophobicContact CB-CE2 4.27Å; R273-F288 HydrophobicContact CG-CD1 4.33Å; R273-F288 HydrophobicContact CG-CD2 3.77Å; R273-F288 HydrophobicContact CG-CE1 4.05Å; R273-F288 HydrophobicContact CG-CE2 3.43Å; R273-F288 VanDerWaalsContact CG-CE2 3.43Å; R273-F288 HydrophobicContact CG-CG 4.22Å; R273-F288 HydrophobicContact CG-CZ 3.59Å
274K97.7Very high97.3Very high69 Ų6961.1 Ų61.130%0.329%0.29SS..Hα-helixtrans-60.8-45.7173.6-74.5-174.2-178.3-171.80110.4I242 E244 L270 A271 R277 V278I242-K274 HydrophobicContact CD1-CB 3.89Å; I242-K274 HydrophobicContact CD1-CD 3.98Å; E244-K274 WeakPolarHBondContact O-CD 3.39Å; E244-K274 PolarHBondContact O-NZ 2.97Å; E244-K274 IonicContact OE2-NZ 2.97Å; E244-K274 PolarHBondContact OE2-NZ 2.89Å; L270-K274 WeakPolarHBondContact O-CG 3.28Å; L270-K274 PolarHBondContact O-N 2.91Å; A271-K274 CarbonylContact O-C 3.33Å; A271-K274 WeakPolarHBondContact O-CA 3.45Å; A271-K274 WeakPolarHBondContact O-CB 3.36Å; A271-K274 PolarHBondContact O-N 2.88Å; K274-R277 PolarHBondContact O-N 3.12Å; K274-V278 PolarHBondContact O-N 3.32Å
275Y97.8Very high97.3Very high0 Ų064.7 Ų64.70%031%0.312CS..Hα-helixtrans-62-49.3175.8-71.2-68000112.8M240 I242 T247 T248 A249 M257 A271 R277 V278 V279M240-Y275 HydrophobicContact CB-CD1 4.26Å; M240-Y275 HydrophobicContact CB-CE1 4Å; M240-Y275 HydrophobicContact CG-CD1 4.12Å; M240-Y275 HydrophobicContact CG-CE1 3.93Å; M240-Y275 PolarHBondContact O-OH 2.57Å; M240-Y275 HydrophobicContact SD-CD1 3.82Å; M240-Y275 HydrophobicContact SD-CE1 4.23Å; I242-Y275 HydrophobicContact CD1-CE2 3.99Å; I242-Y275 HydrophobicContact CG1-CE1 4.47Å; I242-Y275 HydrophobicContact CG1-CE2 4.25Å; I242-Y275 HydrophobicContact CG2-CD1 4.39Å; I242-Y275 HydrophobicContact CG2-CE1 3.76Å; I242-Y275 PolarHBondContact N-OH 3.04Å; T247-Y275 VanDerWaalsContact C-OH 3.23Å; T247-Y275 PolarHBondContact O-OH 2.9Å; T247-Y275 PolarHBondContact OG1-OH 2.96Å; T248-Y275 WeakPolarHBondContact CA-OH 3.44Å; A249-Y275 HydrophobicContact CB-CD1 3.69Å; A249-Y275 HydrophobicContact CB-CD2 3.64Å; A249-Y275 HydrophobicContact CB-CE1 3.67Å; A249-Y275 HydrophobicContact CB-CE2 3.65Å; A249-Y275 HydrophobicContact CB-CG 3.69Å; M257-Y275 VanDerWaalsContact SD-CB 3.58Å; M257-Y275 HydrophobicContact SD-CG 4.25Å; A271-Y275 HydrophobicContact CB-CD2 4.46Å; A271-Y275 HydrophobicContact CB-CE2 4.2Å; A271-Y275 WeakPolarHBondContact O-CD2 3.24Å; A271-Y275 PolarHBondContact O-N 3.46Å; Y275-R277 PolarHBondContact O-N 2.99Å; Y275-V278 WeakPolarHBondContact O-CB 3.44Å; Y275-V278 PolarHBondContact O-N 3.39Å; Y275-V279 PolarHBondContact O-N 3.01Å
276A97.7Very high97.3Very high4 Ų462.7 Ų62.73%0.03330%0.304CS..Hα-helixtrans-56.6-38.2175.600000111.9L212 A272 V279 Q280 F288L212-A276 HydrophobicContact CD2-CB 3.64Å; A272-A276 WeakPolarHBondContact O-CB 3.46Å; A272-A276 PolarHBondContact O-N 2.62Å; A276-V279 PolarHBondContact O-N 3.49Å; A276-Q280 WeakPolarHBondContact O-CG 3.09Å; A276-Q280 PolarHBondContact O-N 2.89Å; A276-F288 HydrophobicContact CB-CD2 4.18Å
277R97.1Very high97.3Very high149 Ų14964.7 Ų64.756%0.56231%0.306SS*.Hα-helixtrans-70.6-28.3176.3-169.855.1170.7167.41.3113.6R273 K274 Y275 K281R273-R277 WeakPolarHBondContact O-CB 3.32Å; R273-R277 PolarHBondContact O-N 3.25Å; K274-R277 PolarHBondContact O-N 3.12Å; Y275-R277 PolarHBondContact O-N 2.99Å; R277-K281 WeakPolarHBondContact O-CG 3.43Å; R277-K281 PolarHBondContact O-N 3.1Å; R277-K281 VanDerWaalsContact O-N 3.17Å
278V96.2Very high97.3Very high48 Ų4864 Ų6429%0.29130%0.302SS..Hα-helixtrans-66.9-48.5168.8173.10000109.9M240 K274 Y275 Q280 K281 L282M240-V278 HydrophobicContact CE-CG1 4.24Å; M240-V278 HydrophobicContact SD-CB 4.39Å; M240-V278 HydrophobicContact SD-CG1 3.91Å; K274-V278 PolarHBondContact O-N 3.32Å; Y275-V278 WeakPolarHBondContact O-CB 3.44Å; Y275-V278 PolarHBondContact O-N 3.39Å; V278-Q280 VanDerWaalsContact C-N 3.31Å; V278-Q280 PolarHBondContact O-N 3.28Å; V278-K281 WeakPolarHBondContact O-CB 3.25Å; V278-K281 PolarHBondContact O-N 3.13Å; V278-L282 HydrophobicContact CG1-CD1 4.48Å; V278-L282 WeakPolarHBondContact O-CG 3.3Å; V278-L282 PolarHBondContact O-N 2.94Å
279V96.9Very high97.3Very high0 Ų067.7 Ų67.70%032%0.321CS..Hα-helixtrans-59.9-40179179.10000111.7L212 L216 I251 Y275 A276 K281 L282 F284 A286L212-V279 HydrophobicContact CD1-CG1 4.49Å; L212-V279 HydrophobicContact CD1-CG2 4.3Å; L216-V279 HydrophobicContact CD1-CG1 4.21Å; L216-V279 HydrophobicContact CD2-CG1 3.73Å; I251-V279 HydrophobicContact CD1-CG2 4.04Å; Y275-V279 PolarHBondContact O-N 3.01Å; A276-V279 PolarHBondContact O-N 3.49Å; V279-K281 PolarHBondContact O-N 2.98Å; V279-L282 PolarHBondContact O-N 3.25Å; V279-F284 HydrophobicContact CG1-CB 3.88Å; V279-F284 HydrophobicContact CG1-CD2 4.1Å; V279-F284 HydrophobicContact CG1-CG 4.26Å; V279-A286 HydrophobicContact CB-CB 4.24Å; V279-A286 HydrophobicContact CG1-CB 3.77Å
280Q96.9Very high97.2Very high72 Ų7266.7 Ų66.734%0.33633%0.325SS..Hα-helixtrans-58.7-44.4170.6-74176.9-5.400113.1A276 V278 L282 G283 A286A276-Q280 WeakPolarHBondContact O-CG 3.09Å; A276-Q280 PolarHBondContact O-N 2.89Å; V278-Q280 VanDerWaalsContact C-N 3.31Å; V278-Q280 PolarHBondContact O-N 3.28Å; Q280-L282 PolarHBondContact O-N 3.17Å; Q280-G283 PolarHBondContact O-N 3.44Å; Q280-A286 HydrophobicContact CG-CB 4.16Å; Q280-A286 WeakPolarHBondContact CG-O 3.33Å; Q280-A286 PolarHBondContact NE2-O 3.06Å
281K96.6Very high97.2Very high168 Ų16864.1 Ų64.173%0.7331%0.31SS*.Hα-helixtrans-65.5-17.9178.8-79-176.4173.5-169.60113.7R277 V278 V279 G283R277-K281 WeakPolarHBondContact O-CG 3.43Å; R277-K281 PolarHBondContact O-N 3.1Å; R277-K281 VanDerWaalsContact O-N 3.17Å; V278-K281 WeakPolarHBondContact O-CB 3.25Å; V278-K281 PolarHBondContact O-N 3.13Å; V279-K281 PolarHBondContact O-N 2.98Å; K281-G283 VanDerWaalsContact C-N 3.27Å
282L95.7Very high97.2Very high35 Ų3569.7 Ų69.718%0.18334%0.335CS..THydrogen-bonded Turntrans-86.15.3173.6-60.6178000113.4I221 H224 A225 V278 V279 Q280 F284I221-L282 HydrophobicContact CB-CD1 4.43Å; I221-L282 HydrophobicContact CG1-CD1 4.28Å; I221-L282 HydrophobicContact CG2-CD1 4.18Å; H224-L282 HydrophobicContact CB-CD2 3.62Å; A225-L282 HydrophobicContact CB-CD1 4.15Å; V278-L282 HydrophobicContact CG1-CD1 4.48Å; V278-L282 WeakPolarHBondContact O-CG 3.3Å; V278-L282 PolarHBondContact O-N 2.94Å; V279-L282 PolarHBondContact O-N 3.25Å; Q280-L282 PolarHBondContact O-N 3.17Å; L282-F284 HydrophobicContact CB-CD2 3.92Å; L282-F284 HydrophobicContact CB-CE2 4.03Å
283G95.9Very high97.2Very high63 Ų6371 Ų7165%0.64934%0.341SS*.THydrogen-bonded Turntrans86.514.4176.100000114.9Q280 K281Q280-G283 PolarHBondContact O-N 3.44Å; K281-G283 VanDerWaalsContact C-N 3.27Å
284F96.6Very high97.1Very high25 Ų2566.9 Ų66.911%0.1133%0.329CS..  trans-90.4141.9172.6-62.1-83.9000110.8L216 D217 K220 I221 V279 L282 A286L216-F284 HydrophobicContact CD2-CB 3.76Å; L216-F284 HydrophobicContact CD2-CD1 3.6Å; L216-F284 HydrophobicContact CD2-CD2 4.27Å; L216-F284 HydrophobicContact CD2-CE1 4.23Å; L216-F284 HydrophobicContact CD2-CG 3.62Å; D217-F284 HydrophobicContact CB-CE1 4.39Å; D217-F284 HydrophobicContact CB-CZ 4.34Å; K220-F284 HydrophobicContact CB-CZ 4.26Å; K220-F284 HydrophobicContact CD-CE2 4.42Å; K220-F284 HydrophobicContact CD-CZ 3.95Å; K220-F284 HydrophobicContact CG-CZ 4.21Å; I221-F284 HydrophobicContact CD1-CE2 4.1Å; I221-F284 HydrophobicContact CD1-CZ 4.41Å; I221-F284 HydrophobicContact CG1-CD2 4.24Å; I221-F284 HydrophobicContact CG1-CE2 3.47Å; I221-F284 VanDerWaalsContact CG1-CE2 3.47Å; I221-F284 HydrophobicContact CG1-CZ 3.91Å; V279-F284 HydrophobicContact CG1-CB 3.88Å; V279-F284 HydrophobicContact CG1-CD2 4.1Å; V279-F284 HydrophobicContact CG1-CG 4.26Å; L282-F284 HydrophobicContact CB-CD2 3.92Å; L282-F284 HydrophobicContact CB-CE2 4.03Å; F284-A286 PolarHBondContact O-N 3.12Å
285P96.8Very high97.1Very high100 Ų10065.1 Ų65.165%0.64932%0.323SS*.  trans-77.843.6-178.434.4-37.3000112.9C214C214-P285 HydrophobicContact CB-CG 4.02Å
286A97.1Very high97.1Very high3 Ų365.2 Ų65.23%0.02532%0.323CS..  trans-68.1131.5-172.900000112.5L212 V279 Q280 F284L212-A286 HydrophobicContact CB-CB 4.16Å; L212-A286 HydrophobicContact CD2-CB 4.45Å; L212-A286 WeakPolarHBondContact O-CA 3.48Å; V279-A286 HydrophobicContact CB-CB 4.24Å; V279-A286 HydrophobicContact CG1-CB 3.77Å; Q280-A286 HydrophobicContact CG-CB 4.16Å; Q280-A286 WeakPolarHBondContact CG-O 3.33Å; Q280-A286 PolarHBondContact NE2-O 3.06Å; F284-A286 PolarHBondContact O-N 3.12Å
287R96.6Very high97.2Very high168 Ų16865.2 Ų65.263%0.63432%0.323SS*.  trans-101.5-177.9174.1-59.4-175.3177.6-170.8-2.4110.1L212 A213 L289L212-R287 WeakPolarHBondContact CA-O 3.5Å; L212-R287 WeakPolarHBondContact CD2-O 3.41Å; L212-R287 PolarHBondContact O-N 3.18Å; A213-R287 HydrophobicContact CB-CB 4.13Å; A213-R287 HydrophobicContact CB-CG 4.44Å; R287-L289 HydrophobicContact CB-CG 4.13Å
288F97.9Very high97.2Very high66 Ų6658.1 Ų58.129%0.28930%0.296SS..  trans-129.184.7174.3-174.1-89.7000107.8V210 R269 A272 R273 A276 F291V210-F288 HydrophobicContact CB-CE2 4.46Å; V210-F288 HydrophobicContact CG2-CD1 4.49Å; V210-F288 HydrophobicContact CG2-CD2 3.69Å; V210-F288 HydrophobicContact CG2-CE1 4.48Å; V210-F288 HydrophobicContact CG2-CE2 3.67Å; V210-F288 HydrophobicContact CG2-CG 4.11Å; V210-F288 HydrophobicContact CG2-CZ 4.08Å; R269-F288 HydrophobicContact CG-CZ 4.22Å; A272-F288 HydrophobicContact CB-CE2 3.75Å; A272-F288 HydrophobicContact CB-CZ 4.28Å; R273-F288 HydrophobicContact CB-CE2 4.27Å; R273-F288 HydrophobicContact CG-CD1 4.33Å; R273-F288 HydrophobicContact CG-CD2 3.77Å; R273-F288 HydrophobicContact CG-CE1 4.05Å; R273-F288 HydrophobicContact CG-CE2 3.43Å; R273-F288 VanDerWaalsContact CG-CE2 3.43Å; R273-F288 HydrophobicContact CG-CG 4.22Å; R273-F288 HydrophobicContact CG-CZ 3.59Å; A276-F288 HydrophobicContact CB-CD2 4.18Å; F288-F291 HydrophobicContact CE1-CB 3.73Å; F288-F291 HydrophobicContact CE1-CD2 4.41Å; F288-F291 HydrophobicContact CE1-CG 4.18Å; F288-F291 HydrophobicContact CE2-CD2 4.36Å; F288-F291 HydrophobicContact CZ-CB 3.8Å; F288-F291 AromaticContact CZ-CD2 3.64Å; F288-F291 HydrophobicContact CZ-CD2 3.64Å; F288-F291 AromaticContact CZ-CG 3.85Å; F288-F291 HydrophobicContact CZ-CG 3.85Å
289L97.9Very high97.2Very high76 Ų7656.9 Ų56.940%0.39829%0.289SS..EExtended strand (participates in β ladder)trans-114.4162.9-178.5-54.1-175.7000110.2V210 N211 A213 R287 F291V210-L289 WeakPolarHBondContact CG2-O 3.07Å; N211-L289 HydrophobicContact CB-CB 4.28Å; N211-L289 PolarHBondContact N-O 3.11Å; N211-L289 PolarHBondContact O-N 3.21Å; A213-L289 HydrophobicContact CB-CD1 3.8Å; A213-L289 HydrophobicContact CB-CG 4.45Å; R287-L289 HydrophobicContact CB-CG 4.13Å; L289-F291 PolarHBondContact O-N 3.16Å; L289-F291 VanDerWaalsContact O-N 3.08Å
290D96.9Very high97.2Very high109 Ų10957.5 Ų57.558%0.58329%0.294SS*.EExtended strand (participates in β ladder)trans54.733.4167.6-40.5-33.3000114.9N211 K292N211-D290 HydrophobicContact CB-CB 3.89Å; N211-D290 WeakPolarHBondContact CB-OD2 3.41Å; N211-D290 PolarHBondContact ND2-OD2 3.3Å; D290-K292 PolarHBondContact O-N 3.11Å
291F98.3Very high97.3Very high32 Ų3255.4 Ų55.414%0.1429%0.285CS..EExtended strand (participates in β ladder)trans-66.5117175.7178.4-90.5000110.5S208 T209 V210 R269 A272 F288 L289 I293S208-F291 WeakPolarHBondContact OG-CE2 3.49Å; T209-F291 WeakPolarHBondContact O-CA 3.29Å; V210-F291 HydrophobicContact CB-CD2 4.31Å; V210-F291 HydrophobicContact CG2-CB 4.23Å; R269-F291 HydrophobicContact CB-CE1 3.88Å; R269-F291 HydrophobicContact CB-CE2 4.12Å; R269-F291 HydrophobicContact CB-CZ 3.64Å; R269-F291 HydrophobicContact CG-CD1 4.15Å; R269-F291 HydrophobicContact CG-CE1 3.98Å; R269-F291 HydrophobicContact CG-CE2 4.36Å; R269-F291 HydrophobicContact CG-CG 4.42Å; R269-F291 HydrophobicContact CG-CZ 4.09Å; R269-F291 VanDerWaalsContact CZ-CD1 3.5Å; A272-F291 HydrophobicContact CB-CD2 4.13Å; A272-F291 HydrophobicContact CB-CE2 3.97Å; F288-F291 HydrophobicContact CE1-CB 3.73Å; F288-F291 HydrophobicContact CE1-CD2 4.41Å; F288-F291 HydrophobicContact CE1-CG 4.18Å; F288-F291 HydrophobicContact CE2-CD2 4.36Å; F288-F291 HydrophobicContact CZ-CB 3.8Å; F288-F291 AromaticContact CZ-CD2 3.64Å; F288-F291 HydrophobicContact CZ-CD2 3.64Å; F288-F291 AromaticContact CZ-CG 3.85Å; F288-F291 HydrophobicContact CZ-CG 3.85Å; L289-F291 PolarHBondContact O-N 3.16Å; L289-F291 VanDerWaalsContact O-N 3.08Å; F291-I293 HydrophobicContact CE1-CD1 3.91Å; F291-I293 HydrophobicContact CZ-CD1 3.8Å
292K97.8Very high97.2Very high118 Ų11847.5 Ų47.551%0.51325%0.251SS..EExtended strand (participates in β ladder)trans-141.5138.9-176.9176.6165.8179.8174.70111.1S208 T209 D290S208-K292 CarbonylContact C-O 3.56Å; S208-K292 VanDerWaalsContact CA-O 3.27Å; S208-K292 WeakPolarHBondContact CA-O 3.49Å; S208-K292 WeakPolarHBondContact CB-O 3.2Å; T209-K292 PolarHBondContact N-O 3.37Å; T209-K292 PolarHBondContact O-N 2.82Å; D290-K292 PolarHBondContact O-N 3.11Å
293I98.1Very high97.2Very high26 Ų2655.1 Ų55.113%0.13328%0.277CS..EExtended strand (participates in β ladder)trans-76.1133.3167.2-52.7-51.2000108.5I206 F291 M296I206-I293 HydrophobicContact CG2-CD1 3.87Å; I206-I293 HydrophobicContact CG2-CG2 3.96Å; F291-I293 HydrophobicContact CE1-CD1 3.91Å; F291-I293 HydrophobicContact CZ-CD1 3.8Å; I293-M296 HydrophobicContact CG2-CG 3.57Å; I293-M296 HydrophobicContact CG2-SD 4.13Å
294Q97.6Very high97.3Very high73 Ų7353.2 Ų53.234%0.34125%0.251SS..EExtended strand (participates in β ladder)trans-110.1-37-179.3-60.9-65.51.900112.4V207 T209 K354V207-Q294 HydrophobicContact CG1-CB 4.45Å; V207-Q294 PolarHBondContact O-N 3.29Å; T209-Q294 HydrophobicContact CG2-CG 3.7Å; T209-Q294 PolarHBondContact OG1-NE2 2.97Å; Q294-K354 WeakPolarHBondContact O-CG 3.3Å
295N97.5Very high97.3Very high33 Ų3355 Ų5518%0.17627%0.265CS..EExtended strand (participates in β ladder)trans-147.8145.1174-17117.6000110.9V207 T351 G352 A353V207-N295 HydrophobicContact CB-CB 4.17Å; V207-N295 HydrophobicContact CG2-CB 4.33Å; V207-N295 PolarHBondContact N-O 2.96Å; V207-N295 PolarHBondContact O-N 2.9Å; N295-T351 PolarHBondContact ND2-OG1 2.96Å; N295-T351 VanDerWaalsContact ND2-OG1 3.12Å; N295-G352 VanDerWaalsContact OD1-CA 3.3Å; N295-G352 WeakPolarHBondContact OD1-CA 3.03Å; N295-G352 PolarHBondContact OD1-N 2.96Å; N295-A353 CarbonylContact C-O 3.51Å; N295-A353 VanDerWaalsContact CA-O 3.25Å; N295-A353 WeakPolarHBondContact CA-O 3.38Å
296M98.1Very high97.4Very high1 Ų150.2 Ų50.21%0.00523%0.234CC..EExtended strand (participates in β ladder)trans-126.5130.9171.8-57.8-175.968.500108.6L203 I206 E265 I293 A353 R356 I359L203-M296 HydrophobicContact CD1-CE 3.64Å; L203-M296 HydrophobicContact CD2-CE 3.85Å; L203-M296 HydrophobicContact CG-CE 4.42Å; I206-M296 HydrophobicContact CD1-CE 3.9Å; I206-M296 HydrophobicContact CG1-CE 4.13Å; I206-M296 HydrophobicContact CG1-CG 4.27Å; I206-M296 HydrophobicContact CG2-CG 4.43Å; E265-M296 HydrophobicContact CG-CE 3.94Å; E265-M296 WeakPolarHBondContact OE1-CE 3.4Å; I293-M296 HydrophobicContact CG2-CG 3.57Å; I293-M296 HydrophobicContact CG2-SD 4.13Å; M296-A353 HydrophobicContact CB-CB 4.21Å; M296-A353 PolarHBondContact N-O 2.94Å; M296-R356 HydrophobicContact CE-CB 3.99Å; M296-I359 HydrophobicContact CB-CD1 3.87Å
297V97.8Very high97.4Very high5 Ų555.8 Ų55.83%0.0325%0.254CS..EExtended strand (participates in β ladder)trans-111.1116.3178.8-173.30000109.1Q204 N205 V349 L350Q204-V297 PolarHBondContact N-O 3.42Å; N205-V297 HydrophobicContact CB-CB 4.21Å; N205-V297 HydrophobicContact CB-CG2 4.34Å; N205-V297 PolarHBondContact N-O 2.88Å; N205-V297 PolarHBondContact O-N 3.28Å; V297-V349 HydrophobicContact CG1-CG1 3.73Å; V297-L350 CarbonylContact C-O 3.6Å; V297-L350 WeakPolarHBondContact CA-O 3.43Å
298G97.7Very high97.4Very high0 Ų047.8 Ų47.80%022%0.224CC..EExtended strand (participates in β ladder)trans-102.5158.9172.800000111.9Q202 V349 L350Q202-G298 CarbonylContact O-C 3.57Å; Q202-G298 VanDerWaalsContact O-CA 3.32Å; Q202-G298 WeakPolarHBondContact O-CA 3.47Å; G298-V349 WeakPolarHBondContact O-CA 3.35Å; G298-L350 PolarHBondContact N-O 2.86Å; G298-L350 PolarHBondContact O-N 2.83Å
299S97.3Very high97.3Very high21 Ų2148.7 Ų48.715%0.14723%0.229CC..EExtended strand (participates in β ladder)trans-143.6155.8164.370.50000112.7Q202 Q204 V348Q202-S299 PolarHBondContact N-O 3Å; Q202-S299 PolarHBondContact O-N 2.87Å; Q204-S299 VanDerWaalsContact CG-OG 3.28Å; Q204-S299 WeakPolarHBondContact CG-OG 3.22Å; Q204-S299 PolarHBondContact NE2-OG 2.79Å; S299-V348 CarbonylContact C-O 3.46Å; S299-V348 VanDerWaalsContact CA-O 3.24Å; S299-V348 WeakPolarHBondContact CA-O 3.3Å; S299-V348 WeakPolarHBondContact CB-O 3.43Å
300C97.2Very high97.2Very high14 Ų1445.9 Ų45.910%0.09522%0.219CC..EExtended strand (participates in β ladder)trans-147.1174.2173.450.50000110.3I199 P201 V348 F363I199-C300 HydrophobicContact CG2-CB 4.06Å; P201-C300 HydrophobicContact CG-CB 4.39Å; C300-V348 PolarHBondContact N-O 3.49Å; C300-V348 PolarHBondContact O-N 3.04Å; C300-F363 HydrophobicContact CB-CE2 4.29Å; C300-F363 WeakPolarHBondContact SG-CD2 3.42Å; C300-F363 WeakPolarHBondContact SG-CE2 3.27Å
301D97.2Very high97.2Very high28 Ų2840.7 Ų40.715%0.1519%0.191CC..EExtended strand (participates in β ladder)trans-138.5113.8176.5175.2-6.4000106.5I199 R303 G346 K347I199-D301 WeakPolarHBondContact CG2-O 3.17Å; D301-R303 PolarHBondContact O-N 2.92Å; D301-R303 WeakPolarHBondContact OD1-CA 3.43Å; D301-R303 PolarHBondContact OD1-N 3.36Å; D301-R303 IonicContact OD2-CZ 3.29Å; D301-R303 IonicContact OD2-NE 3.36Å; D301-R303 IonicContact OD2-NH1 3.78Å; D301-R303 PolarHBondContact OD2-NH1 3.21Å; D301-G346 WeakPolarHBondContact CA-O 3.49Å; D301-K347 HydrophobicContact CB-CG 4.39Å
302V96.1Very high97.1Very high2 Ų240.7 Ų40.71%0.01219%0.194CC..  trans-74.5-2.6-176.6-52.50000113.2F304 I306 G346 V348 F363 Y367 L370V302-F304 VanDerWaalsContact C-N 3.25Å; V302-F304 HydrophobicContact CB-CD1 4.3Å; V302-F304 HydrophobicContact CB-CE1 3.8Å; V302-F304 HydrophobicContact CB-CE2 4.45Å; V302-F304 HydrophobicContact CB-CZ 3.88Å; V302-F304 HydrophobicContact CG2-CD1 3.97Å; V302-F304 HydrophobicContact CG2-CD2 3.85Å; V302-F304 HydrophobicContact CG2-CE1 3.72Å; V302-F304 HydrophobicContact CG2-CE2 3.58Å; V302-F304 HydrophobicContact CG2-CG 4.03Å; V302-F304 HydrophobicContact CG2-CZ 3.51Å; V302-F304 WeakPolarHBondContact O-CD1 3.12Å; V302-F304 VanDerWaalsContact O-CE1 3.3Å; V302-F304 WeakPolarHBondContact O-CE1 3.34Å; V302-F304 PolarHBondContact O-N 3.03Å; V302-I306 HydrophobicContact CG2-CD1 4Å; V302-I306 HydrophobicContact CG2-CG1 4.37Å; V302-G346 WeakPolarHBondContact CG2-O 3.47Å; V302-G346 PolarHBondContact N-O 3.05Å; V302-V348 HydrophobicContact CG1-CG2 4.45Å; V302-F363 HydrophobicContact CG1-CE2 4.05Å; V302-F363 HydrophobicContact CG1-CZ 4.28Å; V302-Y367 HydrophobicContact CB-CE2 4.24Å; V302-Y367 HydrophobicContact CG1-CD2 4.09Å; V302-Y367 HydrophobicContact CG1-CE2 4.31Å; V302-L370 HydrophobicContact CG1-CD1 4.37Å
303R95.6Very high97Very high195 Ų19541.7 Ų41.774%0.73620%0.204SC*.SBendtrans63.320.4177.5-51.4-57.4-173176.710.4115.5I199 D301I199-R303 HydrophobicContact CD1-CG 4.13Å; D301-R303 PolarHBondContact O-N 2.92Å; D301-R303 WeakPolarHBondContact OD1-CA 3.43Å; D301-R303 PolarHBondContact OD1-N 3.36Å; D301-R303 IonicContact OD2-CZ 3.29Å; D301-R303 IonicContact OD2-NE 3.36Å; D301-R303 IonicContact OD2-NH1 3.78Å; D301-R303 PolarHBondContact OD2-NH1 3.21Å
304F96.3Very high96.9Very high22 Ų2244.8 Ų44.810%0.09622%0.224CC..SBendtrans-147.4148.3170.456-99.5000112.1V302 I306 G346 Y367 L370 K371 K374V302-F304 VanDerWaalsContact C-N 3.25Å; V302-F304 HydrophobicContact CB-CD1 4.3Å; V302-F304 HydrophobicContact CB-CE1 3.8Å; V302-F304 HydrophobicContact CB-CE2 4.45Å; V302-F304 HydrophobicContact CB-CZ 3.88Å; V302-F304 HydrophobicContact CG2-CD1 3.97Å; V302-F304 HydrophobicContact CG2-CD2 3.85Å; V302-F304 HydrophobicContact CG2-CE1 3.72Å; V302-F304 HydrophobicContact CG2-CE2 3.58Å; V302-F304 HydrophobicContact CG2-CG 4.03Å; V302-F304 HydrophobicContact CG2-CZ 3.51Å; V302-F304 WeakPolarHBondContact O-CD1 3.12Å; V302-F304 VanDerWaalsContact O-CE1 3.3Å; V302-F304 WeakPolarHBondContact O-CE1 3.34Å; V302-F304 PolarHBondContact O-N 3.03Å; F304-I306 HydrophobicContact CD2-CG1 4.28Å; F304-I306 HydrophobicContact CE2-CG1 4.19Å; F304-G346 VanDerWaalsContact O-CA 3.23Å; F304-G346 WeakPolarHBondContact O-CA 3.14Å; F304-Y367 HydrophobicContact CE1-CE2 4.07Å; F304-Y367 HydrophobicContact CZ-CE2 4.27Å; F304-L370 WeakPolarHBondContact CE2-O 3.31Å; F304-K371 HydrophobicContact CZ-CB 4.17Å; F304-K374 HydrophobicContact CB-CD 3.9Å; F304-K374 HydrophobicContact CB-CG 4.1Å; F304-K374 HydrophobicContact CD2-CB 3.75Å; F304-K374 HydrophobicContact CD2-CD 4.09Å; F304-K374 HydrophobicContact CD2-CG 3.78Å; F304-K374 HydrophobicContact CE2-CB 4.04Å; F304-K374 HydrophobicContact CG-CB 4.46Å; F304-K374 HydrophobicContact CG-CD 3.93Å; F304-K374 HydrophobicContact CG-CG 4.09Å
305P97.6Very high96.8Very high63 Ų6343.1 Ų43.141%0.40922%0.216SC..  trans-69.6146.1176.928.1-34.6000112.3V344 K374 K375P305-V344 CarbonylContact C-O 3.55Å; P305-V344 WeakPolarHBondContact CA-O 3.42Å; P305-V344 WeakPolarHBondContact CB-O 3.21Å; P305-K374 WeakPolarHBondContact O-CA 3.23Å; P305-K375 HydrophobicContact CB-CB 4.28Å; P305-K375 HydrophobicContact CG-CB 4.12Å; P305-K375 PolarHBondContact O-N 3.32Å
306I97.9Very high96.8Very high0 Ų048.7 Ų48.70%024%0.241CC..BIsolated β-bridgetrans-118.7138.9-171.8-52.2173.6000111V302 F304 L308 I342 V344 L370 F373 K375V302-I306 HydrophobicContact CG2-CD1 4Å; V302-I306 HydrophobicContact CG2-CG1 4.37Å; F304-I306 HydrophobicContact CD2-CG1 4.28Å; F304-I306 HydrophobicContact CE2-CG1 4.19Å; I306-L308 HydrophobicContact CB-CD2 4.24Å; I306-L308 HydrophobicContact CG2-CD2 3.93Å; I306-L308 PolarHBondContact O-N 3.35Å; I306-I342 HydrophobicContact CD1-CG2 3.85Å; I306-V344 PolarHBondContact N-O 3.37Å; I306-L370 HydrophobicContact CD1-CB 4.2Å; I306-L370 HydrophobicContact CD1-CD1 4.07Å; I306-L370 HydrophobicContact CD1-CD2 4.32Å; I306-L370 HydrophobicContact CD1-CG 4.4Å; I306-L370 HydrophobicContact CG2-CD2 4.47Å; I306-F373 HydrophobicContact CG2-CB 4.11Å; I306-K375 VanDerWaalsContact O-CE 3.23Å; I306-K375 WeakPolarHBondContact O-CE 3.46Å
307R97.4Very high96.7Very high119 Ų11957.2 Ų57.245%0.44928%0.281SS..  trans-85.873.9175.2-160-173.1-46.4-146.64.5111.5E309 G310 L311 F373 K375R307-E309 WeakPolarHBondContact CA-OE2 3.48Å; R307-E309 WeakPolarHBondContact CG-OE2 3.46Å; R307-E309 PolarHBondContact O-N 2.87Å; R307-E309 VanDerWaalsContact O-N 3.14Å; R307-G310 PolarHBondContact O-N 2.84Å; R307-L311 PolarHBondContact O-N 3.28Å; R307-L311 VanDerWaalsContact O-N 3.08Å; R307-F373 WeakPolarHBondContact CB-O 3.37Å; R307-F373 PolarHBondContact N-O 3.07Å; R307-K375 VanDerWaalsContact CA-CE 3.46Å; R307-K375 HydrophobicContact CB-CG 3.93Å; R307-K375 HydrophobicContact CG-CG 4.49Å
308L96.9Very high96.6Very high0 Ų060.5 Ų60.50%030%0.295CS..Hα-helixtrans-54.7-30.7-179.7-58.1-173.8000112.7I306 G310 L311 V312 Y321 L329 I342 V344I306-L308 HydrophobicContact CB-CD2 4.24Å; I306-L308 HydrophobicContact CG2-CD2 3.93Å; I306-L308 PolarHBondContact O-N 3.35Å; L308-G310 VanDerWaalsContact C-N 3.35Å; L308-G310 PolarHBondContact O-N 2.84Å; L308-L311 HydrophobicContact CD2-CD2 4.43Å; L308-L311 PolarHBondContact O-N 2.93Å; L308-V312 WeakPolarHBondContact O-CG1 3.5Å; L308-V312 PolarHBondContact O-N 3.17Å; L308-Y321 HydrophobicContact CB-CD1 4.17Å; L308-Y321 HydrophobicContact CB-CE1 3.94Å; L308-Y321 HydrophobicContact CB-CE2 4.32Å; L308-Y321 HydrophobicContact CB-CG 4.45Å; L308-Y321 HydrophobicContact CD1-CD2 4.1Å; L308-Y321 HydrophobicContact CD1-CE2 3.58Å; L308-L329 HydrophobicContact CB-CB 4.4Å; L308-L329 HydrophobicContact CB-CD1 4.23Å; L308-L329 HydrophobicContact CD1-CB 4.04Å; L308-L329 HydrophobicContact CD2-CB 3.97Å; L308-L329 HydrophobicContact CD2-CD1 4.43Å; L308-L329 HydrophobicContact CG-CB 4.36Å; L308-I342 WeakPolarHBondContact CD1-O 3.49Å; L308-I342 HydrophobicContact CD2-CB 4.38Å; L308-I342 HydrophobicContact CD2-CG2 3.88Å; L308-V344 HydrophobicContact CD1-CG1 3.53Å; L308-V344 HydrophobicContact CG-CG1 3.92Å
309E95.7Very high96.6Very high86 Ų8660.8 Ų60.840%0.40230%0.297SS..Hα-helixtrans-65-38179.6-43.182.3175.300111.4R307 K375R307-E309 WeakPolarHBondContact CA-OE2 3.48Å; R307-E309 WeakPolarHBondContact CG-OE2 3.46Å; R307-E309 PolarHBondContact O-N 2.87Å; R307-E309 VanDerWaalsContact O-N 3.14Å; E309-K375 IonicContact OE1-NZ 2.7Å; E309-K375 PolarHBondContact OE1-NZ 3.22Å; E309-K375 IonicContact OE2-NZ 3.46Å
310G95.6Very high96.6Very high17 Ų1762.5 Ų62.518%0.17531%0.309CS..Hα-helixtrans-80.2-31.8173.200000112.9R307 L308 T314 F373R307-G310 PolarHBondContact O-N 2.84Å; L308-G310 VanDerWaalsContact C-N 3.35Å; L308-G310 PolarHBondContact O-N 2.84Å; G310-T314 WeakPolarHBondContact O-CB 3.46Å; G310-T314 PolarHBondContact O-N 2.85Å; G310-T314 VanDerWaalsContact O-N 3.11Å; G310-T314 PolarHBondContact O-OG1 2.86Å; G310-F373 WeakPolarHBondContact O-CE1 3.3Å
311L96.6Very high96.6Very high0 Ų063.6 Ų63.60%031%0.311CS..Hα-helixtrans-66.9-47.1177.5179.859000111.4R307 L308 L313 T314 H315 L329 I342 I369 L370 F373R307-L311 PolarHBondContact O-N 3.28Å; R307-L311 VanDerWaalsContact O-N 3.08Å; L308-L311 HydrophobicContact CD2-CD2 4.43Å; L308-L311 PolarHBondContact O-N 2.93Å; L311-L313 PolarHBondContact O-N 3Å; L311-T314 PolarHBondContact O-N 3.12Å; L311-H315 HydrophobicContact CD1-CB 4.35Å; L311-H315 WeakPolarHBondContact O-CB 3.35Å; L311-H315 PolarHBondContact O-N 3.17Å; L311-L329 HydrophobicContact CB-CD1 4.15Å; L311-L329 HydrophobicContact CD2-CD1 4Å; L311-L329 HydrophobicContact CD2-CD2 4.16Å; L311-L329 HydrophobicContact CG-CD1 3.97Å; L311-I342 HydrophobicContact CD2-CD1 4.41Å; L311-I369 HydrophobicContact CD1-CG2 3.76Å; L311-L370 HydrophobicContact CD2-CD2 3.69Å; L311-F373 HydrophobicContact CB-CD1 4.43Å; L311-F373 HydrophobicContact CB-CD2 4.17Å; L311-F373 HydrophobicContact CB-CE2 4.48Å; L311-F373 HydrophobicContact CB-CG 4.15Å; L311-F373 HydrophobicContact CD1-CD2 3.68Å; L311-F373 HydrophobicContact CD1-CE2 3.73Å; L311-F373 HydrophobicContact CD1-CG 4.49Å; L311-F373 HydrophobicContact CG-CD2 4.47Å
312V96.6Very high96.5Very high32 Ų3268.3 Ų68.319%0.19433%0.332CS..Hα-helixtrans-65.4-37.6177.770.40000112.1L308 T314 Q316 Y321 L329L308-V312 WeakPolarHBondContact O-CG1 3.5Å; L308-V312 PolarHBondContact O-N 3.17Å; V312-T314 VanDerWaalsContact C-N 3.3Å; V312-T314 PolarHBondContact O-N 3.19Å; V312-Q316 WeakPolarHBondContact O-CA 3.49Å; V312-Q316 VanDerWaalsContact O-CB 3.3Å; V312-Q316 WeakPolarHBondContact O-CB 3.45Å; V312-Q316 PolarHBondContact O-N 3.37Å; V312-Y321 HydrophobicContact CG1-CD1 4.45Å; V312-L329 HydrophobicContact CB-CD1 3.87Å
313L95.9Very high96.4Very high138 Ų13871.1 Ų71.172%0.72335%0.351SS*.Hα-helixtrans-63.2-37.6175.6-175.466.6000112L311L311-L313 PolarHBondContact O-N 3Å
314T96.5Very high96.4Very high91 Ų9170.6 Ų70.656%0.55836%0.357SS*.Hα-helixtrans-87.4-35.2-175.2-49.30000112.6G310 L311 V312 F373G310-T314 WeakPolarHBondContact O-CB 3.46Å; G310-T314 PolarHBondContact O-N 2.85Å; G310-T314 VanDerWaalsContact O-N 3.11Å; G310-T314 PolarHBondContact O-OG1 2.86Å; L311-T314 PolarHBondContact O-N 3.12Å; V312-T314 VanDerWaalsContact C-N 3.3Å; V312-T314 PolarHBondContact O-N 3.19Å; T314-F373 HydrophobicContact CG2-CZ 4.03Å; T314-F373 WeakPolarHBondContact OG1-CZ 3.12Å
315H96.3Very high96.3Very high39 Ų3976.9 Ų76.918%0.18139%0.39CS..SBendtrans-111.633.7-177.6-70.9-115.1000111.9L311 Q317 F318 S319 Y331L311-H315 HydrophobicContact CD1-CB 4.35Å; L311-H315 WeakPolarHBondContact O-CB 3.35Å; L311-H315 PolarHBondContact O-N 3.17Å; H315-Q317 PolarHBondContact O-N 3.05Å; H315-Q317 VanDerWaalsContact O-N 3.12Å; H315-F318 CarbonylContact O-C 3.57Å; H315-F318 PolarHBondContact O-N 3.12Å; H315-S319 WeakPolarHBondContact CB-OG 3.43Å; H315-S319 VanDerWaalsContact O-CB 3.27Å; H315-S319 WeakPolarHBondContact O-CB 3.42Å; H315-S319 PolarHBondContact O-N 3.34Å; H315-S319 PolarHBondContact O-OG 2.89Å; H315-Y331 HydrophobicContact CB-CE2 3.81Å; H315-Y331 AromaticContact CG-CE2 4Å; H315-Y331 AromaticContact ND1-CE2 3.72Å; H315-Y331 AromaticContact ND1-CZ 3.84Å; H315-Y331 PolarHBondContact ND1-OH 3.31Å
316Q95.8Very high96.3Very high149 Ų14977.4 Ų77.470%0.69639%0.386SS*.THydrogen-bonded Turntrans-54.8-34.4-171.2-162.3-177.722.500113.9V312 F318 S319V312-Q316 WeakPolarHBondContact O-CA 3.49Å; V312-Q316 VanDerWaalsContact O-CB 3.3Å; V312-Q316 WeakPolarHBondContact O-CB 3.45Å; V312-Q316 PolarHBondContact O-N 3.37Å; Q316-F318 PolarHBondContact O-N 3.44Å; Q316-S319 PolarHBondContact O-N 3.45Å
317Q96.2Very high96.1Very high180 Ų18081.6 Ų81.684%0.84141%0.414SS*.THydrogen-bonded Turntrans-64.9-20.2177.1-66.9-177.4-18.100114.1H315H315-Q317 PolarHBondContact O-N 3.05Å; H315-Q317 VanDerWaalsContact O-N 3.12Å
318F96.3Very high96.1Very high74 Ų7476 Ų7633%0.32539%0.393SS..THydrogen-bonded Turntrans-117.9-8.6-177.9-51.5-64.6000113H315 Q316 Y331 R332 V334H315-F318 CarbonylContact O-C 3.57Å; H315-F318 PolarHBondContact O-N 3.12Å; Q316-F318 PolarHBondContact O-N 3.44Å; F318-Y331 HydrophobicContact CB-CE1 4.09Å; F318-Y331 HydrophobicContact CB-CE2 4.09Å; F318-Y331 CarbonylContact O-C 3.6Å; F318-Y331 WeakPolarHBondContact O-CA 3.49Å; F318-R332 PolarHBondContact O-N 3.39Å; F318-V334 HydrophobicContact CD1-CG2 4.12Å; F318-V334 HydrophobicContact CE1-CG2 3.78Å
319S97.3Very high96.2Very high7 Ų776 Ų765%0.04939%0.393CS..EExtended strand (participates in β ladder)trans-120.8137.1-166.9-53.60000111.8H315 Q316 I330 Y331H315-S319 WeakPolarHBondContact CB-OG 3.43Å; H315-S319 VanDerWaalsContact O-CB 3.27Å; H315-S319 WeakPolarHBondContact O-CB 3.42Å; H315-S319 PolarHBondContact O-N 3.34Å; H315-S319 PolarHBondContact O-OG 2.89Å; Q316-S319 PolarHBondContact O-N 3.45Å; S319-I330 CarbonylContact C-O 3.58Å; S319-I330 WeakPolarHBondContact CA-O 3.44Å; S319-Y331 WeakPolarHBondContact OG-CD2 3.23Å
320S97.3Very high96.3Very high56 Ų5674.1 Ų74.139%0.39239%0.385SS..EExtended strand (participates in β ladder)trans-130.2128.3170.1-480000108.7I330S320-I330 PolarHBondContact N-O 2.86Å; S320-I330 PolarHBondContact O-N 3.23Å
321Y97.7Very high96.4Very high37 Ų3774 Ų7415%0.14538%0.379CS..  trans-148.696.8-177.2177.8-120.1000110.2L308 V312 P323 L329L308-Y321 HydrophobicContact CB-CD1 4.17Å; L308-Y321 HydrophobicContact CB-CE1 3.94Å; L308-Y321 HydrophobicContact CB-CE2 4.32Å; L308-Y321 HydrophobicContact CB-CG 4.45Å; L308-Y321 HydrophobicContact CD1-CD2 4.1Å; L308-Y321 HydrophobicContact CD1-CE2 3.58Å; V312-Y321 HydrophobicContact CG1-CD1 4.45Å; Y321-P323 HydrophobicContact CE1-CG 4.44Å; Y321-P323 HydrophobicContact CE2-CB 4.25Å; Y321-L329 HydrophobicContact CD2-CB 3.99Å; Y321-L329 HydrophobicContact CG-CB 4.21Å
322E95.3Very high96.5Very high128 Ų12880.9 Ų80.960%0.59841%0.405SS*.  trans-11792.2176.4-61-56.9153.900107.3E324 L325 F326E322-E324 PolarHBondContact O-N 3.04Å; E322-L325 HydrophobicContact CB-CB 4.16Å; E322-L325 HydrophobicContact CB-CD1 3.97Å; E322-L325 HydrophobicContact CB-CG 4.14Å; E322-L325 HydrophobicContact CG-CD1 4.37Å; E322-L325 PolarHBondContact O-N 3.03Å; E322-F326 PolarHBondContact O-N 3.27Å
323P93.4Very high96.5Very high61 Ų6180.3 Ų80.340%0.39640%0.401SS..THydrogen-bonded Turntrans-63.5-26.1-167.123.3-33.7000113.9Y321 L325Y321-P323 HydrophobicContact CE1-CG 4.44Å; Y321-P323 HydrophobicContact CE2-CB 4.25Å; P323-L325 VanDerWaalsContact C-N 3.3Å
324E95.7Very high96.5Very high184 Ų18479 Ų7986%0.8640%0.398SS*.THydrogen-bonded Turntrans-69.2-26.1174.3-52.2-54.9135.800112.7E322E322-E324 PolarHBondContact O-N 3.04Å
325L95.6Very high96.3Very high154 Ų15482 Ų8281%0.80640%0.404SS*.THydrogen-bonded Turntrans-96.1-38.9178.1-60.1179.8000112E322 P323E322-L325 HydrophobicContact CB-CB 4.16Å; E322-L325 HydrophobicContact CB-CD1 3.97Å; E322-L325 HydrophobicContact CB-CG 4.14Å; E322-L325 HydrophobicContact CG-CD1 4.37Å; E322-L325 PolarHBondContact O-N 3.03Å; P323-L325 VanDerWaalsContact C-N 3.3Å
326F95.7Very high96.3Very high73 Ų7380.7 Ų80.732%0.3240%0.398SS..  trans-154.4126.8-179.8-177.8-112.5000112.1E322 G328 I330 L341 F343E322-F326 PolarHBondContact O-N 3.27Å; F326-G328 WeakPolarHBondContact CD1-O 3.37Å; F326-G328 PolarHBondContact O-N 3.17Å; F326-I330 HydrophobicContact CD1-CD1 4.5Å; F326-I330 HydrophobicContact CD1-CG1 4.22Å; F326-I330 HydrophobicContact CE1-CG1 4.45Å; F326-L341 HydrophobicContact CE1-CD2 3.64Å; F326-L341 HydrophobicContact CZ-CD2 3.9Å; F326-F343 HydrophobicContact CZ-CE1 4.01Å; F326-F343 AromaticContact CZ-CZ 3.93Å; F326-F343 HydrophobicContact CZ-CZ 3.93Å
327P95.6Very high96.3Very high89 Ų8984 Ų8458%0.57840%0.404SS*.SBendtrans-75.917.2-172.231.7-38.7000115.5
328G96.7Very high96.4Very high1 Ų175.4 Ų75.41%0.0136%0.364CS..EExtended strand (participates in β ladder)trans-135.5152.4177.500000111.6F326 I342F326-G328 WeakPolarHBondContact CD1-O 3.37Å; F326-G328 PolarHBondContact O-N 3.17Å; G328-I342 CarbonylContact C-O 3.55Å; G328-I342 WeakPolarHBondContact CA-O 3.31Å
329L98.2Very high96.5Very high0 Ų074 Ų740%036%0.362CS..EExtended strand (participates in β ladder)trans-80.5128.3173.1-179.4151.7000109.5L308 L311 V312 Y321 Y331 I342L308-L329 HydrophobicContact CB-CB 4.4Å; L308-L329 HydrophobicContact CB-CD1 4.23Å; L308-L329 HydrophobicContact CD1-CB 4.04Å; L308-L329 HydrophobicContact CD2-CB 3.97Å; L308-L329 HydrophobicContact CD2-CD1 4.43Å; L308-L329 HydrophobicContact CG-CB 4.36Å; L311-L329 HydrophobicContact CB-CD1 4.15Å; L311-L329 HydrophobicContact CD2-CD1 4Å; L311-L329 HydrophobicContact CD2-CD2 4.16Å; L311-L329 HydrophobicContact CG-CD1 3.97Å; V312-L329 HydrophobicContact CB-CD1 3.87Å; Y321-L329 HydrophobicContact CD2-CB 3.99Å; Y321-L329 HydrophobicContact CG-CB 4.21Å; L329-Y331 HydrophobicContact CD2-CD2 4.21Å; L329-I342 HydrophobicContact CB-CB 4.43Å; L329-I342 HydrophobicContact CD2-CD1 4.26Å; L329-I342 PolarHBondContact N-O 3.19Å; L329-I342 PolarHBondContact O-N 3.05Å
330I98.3Very high96.5Very high46 Ų4673.7 Ų73.724%0.23636%0.36CS..EExtended strand (participates in β ladder)trans-88.9113.2173.5-56.2175.3000107.6S319 S320 F326 R332 V339 L340 L341S319-I330 CarbonylContact C-O 3.58Å; S319-I330 WeakPolarHBondContact CA-O 3.44Å; S320-I330 PolarHBondContact N-O 2.86Å; S320-I330 PolarHBondContact O-N 3.23Å; F326-I330 HydrophobicContact CD1-CD1 4.5Å; F326-I330 HydrophobicContact CD1-CG1 4.22Å; F326-I330 HydrophobicContact CE1-CG1 4.45Å; I330-R332 HydrophobicContact CG2-CG 4.41Å; I330-V339 HydrophobicContact CG2-CG1 3.89Å; I330-L340 WeakPolarHBondContact CA-O 3.49Å; I330-L341 HydrophobicContact CG1-CD2 4.08Å
331Y98.3Very high96.6Very high15 Ų1572.3 Ų72.36%0.05935%0.348CS..EExtended strand (participates in β ladder)trans-107.2124.1175.9-164.3-80.2000110.2H315 F318 S319 L329 M333 V339 L340 I342 I366H315-Y331 HydrophobicContact CB-CE2 3.81Å; H315-Y331 AromaticContact CG-CE2 4Å; H315-Y331 AromaticContact ND1-CE2 3.72Å; H315-Y331 AromaticContact ND1-CZ 3.84Å; H315-Y331 PolarHBondContact ND1-OH 3.31Å; F318-Y331 HydrophobicContact CB-CE1 4.09Å; F318-Y331 HydrophobicContact CB-CE2 4.09Å; F318-Y331 CarbonylContact O-C 3.6Å; F318-Y331 WeakPolarHBondContact O-CA 3.49Å; S319-Y331 WeakPolarHBondContact OG-CD2 3.23Å; L329-Y331 HydrophobicContact CD2-CD2 4.21Å; Y331-M333 HydrophobicContact CD1-CB 4.37Å; Y331-M333 HydrophobicContact CE1-CB 4.35Å; Y331-M333 HydrophobicContact CE1-CE 4.4Å; Y331-V339 WeakPolarHBondContact O-CA 3.46Å; Y331-L340 HydrophobicContact CD1-CD1 4.17Å; Y331-L340 PolarHBondContact N-O 2.92Å; Y331-L340 PolarHBondContact O-N 2.94Å; Y331-I342 HydrophobicContact CG-CD1 4.48Å; Y331-I366 HydrophobicContact CD1-CD1 3.96Å; Y331-I366 HydrophobicContact CD2-CD1 4.1Å; Y331-I366 HydrophobicContact CE1-CD1 3.77Å; Y331-I366 HydrophobicContact CE2-CD1 3.89Å; Y331-I366 HydrophobicContact CG-CD1 4.13Å
332R97.9Very high96.6Very high145 Ų14570.6 Ų70.655%0.54734%0.341SS..EExtended strand (participates in β ladder)trans-103.992.5-177.8-60.1-179.4-173.4-94.14109.2F318 I330F318-R332 PolarHBondContact O-N 3.39Å; I330-R332 HydrophobicContact CG2-CG 4.41Å
333M97.1Very high96.7Very high20 Ų2067 Ų6710%0.09932%0.323CS..  trans-75.2133.8177.9-169.9170.5-73.100110.5Y331 K335 P336 R337 I338 L340 A362 N365 I366Y331-M333 HydrophobicContact CD1-CB 4.37Å; Y331-M333 HydrophobicContact CE1-CB 4.35Å; Y331-M333 HydrophobicContact CE1-CE 4.4Å; M333-K335 WeakPolarHBondContact CG-O 3.46Å; M333-P336 CarbonylContact C-O 3.53Å; M333-P336 WeakPolarHBondContact CG-O 3.13Å; M333-R337 WeakPolarHBondContact O-CA 3.5Å; M333-I338 WeakPolarHBondContact CB-O 3.41Å; M333-I338 PolarHBondContact N-O 3.24Å; M333-I338 PolarHBondContact O-N 2.99Å; M333-L340 HydrophobicContact CB-CD1 3.93Å; M333-L340 HydrophobicContact CE-CD1 4.31Å; M333-A362 WeakPolarHBondContact CE-O 3.44Å; M333-A362 HydrophobicContact SD-CB 3.82Å; M333-N365 HydrophobicContact CE-CB 3.87Å; M333-N365 HydrophobicContact SD-CB 4.19Å; M333-I366 HydrophobicContact CE-CB 4.04Å; M333-I366 HydrophobicContact CE-CD1 4.31Å
334V95.4Very high96.9Very high109 Ų10967 Ų6766%0.66132%0.322SS*.SBendtrans-83.4-39.1-178.2-179.30000111.7F318 P336F318-V334 HydrophobicContact CD1-CG2 4.12Å; F318-V334 HydrophobicContact CE1-CG2 3.78Å; V334-P336 CarbonylContact C-O 3.59Å
335K93.3Very high97Very high156 Ų15661.4 Ų61.468%0.67830%0.303SS*.SBendtrans-137.3120.4177.4-172.3-171.7172.4-168.30110.8M333M333-K335 WeakPolarHBondContact CG-O 3.46Å
336P95.3Very high97.1Very high10 Ų1054.1 Ų54.17%0.06527%0.265CS..SBendcis-59.8162.3-1828.7-34.2000110.4M333 V334 I338 E358 E361 A362M333-P336 CarbonylContact C-O 3.53Å; M333-P336 WeakPolarHBondContact CG-O 3.13Å; V334-P336 CarbonylContact C-O 3.59Å; P336-I338 VanDerWaalsContact C-N 3.28Å; P336-I338 HydrophobicContact CB-CG1 4.06Å; P336-I338 HydrophobicContact CG-CG1 3.84Å; P336-I338 PolarHBondContact O-N 2.81Å; P336-E358 HydrophobicContact CB-CB 3.97Å; P336-E358 HydrophobicContact CB-CG 4.15Å; P336-E358 HydrophobicContact CG-CB 4.15Å; P336-E358 VanDerWaalsContact CG-O 3.31Å; P336-E358 WeakPolarHBondContact CG-O 3.38Å; P336-E361 HydrophobicContact CG-CB 4.19Å; P336-E361 HydrophobicContact CG-CG 4.34Å; P336-A362 HydrophobicContact CG-CB 4Å
337R96.5Very high97.2Very high218 Ų21854.8 Ų54.882%0.82327%0.268SS*.  trans-78.676-173.6-172.3-179.9168171-3.8111.3M333M333-R337 WeakPolarHBondContact O-CA 3.5Å
338I97.5Very high97.3Very high1 Ų150.6 Ų50.61%0.00524%0.241CC..  trans-118.4142.5-171.2-61.2-57.4000110.9M333 P336 L340 L350 A353 E358 A362M333-I338 WeakPolarHBondContact CB-O 3.41Å; M333-I338 PolarHBondContact N-O 3.24Å; M333-I338 PolarHBondContact O-N 2.99Å; P336-I338 VanDerWaalsContact C-N 3.28Å; P336-I338 HydrophobicContact CB-CG1 4.06Å; P336-I338 HydrophobicContact CG-CG1 3.84Å; P336-I338 PolarHBondContact O-N 2.81Å; I338-L340 HydrophobicContact CB-CD1 4.46Å; I338-L340 HydrophobicContact CG2-CD1 3.96Å; I338-L340 HydrophobicContact CG2-CG 4.17Å; I338-L350 HydrophobicContact CG2-CB 4.18Å; I338-L350 HydrophobicContact CG2-CD2 4.45Å; I338-A353 VanDerWaalsContact CD1-CA 3.5Å; I338-A353 HydrophobicContact CD1-CB 3.59Å; I338-E358 HydrophobicContact CD1-CB 4.14Å; I338-E358 HydrophobicContact CG1-CB 4.48Å; I338-A362 HydrophobicContact CB-CB 4.09Å; I338-A362 HydrophobicContact CG1-CB 4Å; I338-A362 HydrophobicContact CG2-CB 4.05Å
339V98.1Very high97.3Very high45 Ų4552.1 Ų52.127%0.27325%0.25SC..EExtended strand (participates in β ladder)trans-101129167.7-177.70000108.6I330 Y331 T351I330-V339 HydrophobicContact CG2-CG1 3.89Å; Y331-V339 WeakPolarHBondContact O-CA 3.46Å; V339-T351 HydrophobicContact CB-CG2 4.11Å; V339-T351 PolarHBondContact N-O 2.85Å; V339-T351 PolarHBondContact O-N 3.14Å
340L98.3Very high97.3Very high0 Ų052.1 Ų52.10%025%0.25CC..EExtended strand (participates in β ladder)trans-113.3141.5175.9-54.186.8000109.9I330 Y331 M333 I338 I342 V348 V349 L350 I366I330-L340 WeakPolarHBondContact CA-O 3.49Å; Y331-L340 HydrophobicContact CD1-CD1 4.17Å; Y331-L340 PolarHBondContact N-O 2.92Å; Y331-L340 PolarHBondContact O-N 2.94Å; M333-L340 HydrophobicContact CB-CD1 3.93Å; M333-L340 HydrophobicContact CE-CD1 4.31Å; I338-L340 HydrophobicContact CB-CD1 4.46Å; I338-L340 HydrophobicContact CG2-CD1 3.96Å; I338-L340 HydrophobicContact CG2-CG 4.17Å; L340-I342 HydrophobicContact CB-CD1 4.37Å; L340-I342 HydrophobicContact CB-CG1 4.16Å; L340-V348 HydrophobicContact CB-CG1 4.39Å; L340-V348 HydrophobicContact CD2-CG1 4.23Å; L340-V349 CarbonylContact C-O 3.44Å; L340-V349 VanDerWaalsContact CA-O 3.27Å; L340-V349 WeakPolarHBondContact CA-O 3.38Å; L340-L350 HydrophobicContact CD2-CD2 3.62Å; L340-L350 HydrophobicContact CD2-CG 3.91Å; L340-L350 HydrophobicContact CG-CD2 4.05Å; L340-L350 HydrophobicContact CG-CG 4.04Å; L340-I366 HydrophobicContact CD2-CB 4.13Å; L340-I366 HydrophobicContact CD2-CG1 4.25Å; L340-I366 HydrophobicContact CD2-CG2 3.74Å
341L98.2Very high97.3Very high27 Ų2750.5 Ų50.514%0.14124%0.242CC..EExtended strand (participates in β ladder)trans-114.5110.1176.1-61.3154.5000106.8F326 I330 F343 V348 V349F326-L341 HydrophobicContact CE1-CD2 3.64Å; F326-L341 HydrophobicContact CZ-CD2 3.9Å; I330-L341 HydrophobicContact CG1-CD2 4.08Å; L341-F343 HydrophobicContact CB-CE2 4.22Å; L341-V348 WeakPolarHBondContact O-CA 3.3Å; L341-V349 HydrophobicContact CB-CB 4.25Å; L341-V349 HydrophobicContact CD1-CB 4.26Å; L341-V349 HydrophobicContact CD1-CG1 4.34Å; L341-V349 PolarHBondContact N-O 3.2Å; L341-V349 PolarHBondContact O-N 2.78Å
342I98.3Very high97.1Very high0 Ų051.6 Ų51.60%026%0.258CS..EExtended strand (participates in β ladder)trans-114.5114.8-165.8-49.6-173.3000109I306 L308 L311 G328 L329 Y331 L340 V348 I366 L370I306-I342 HydrophobicContact CD1-CG2 3.85Å; L308-I342 WeakPolarHBondContact CD1-O 3.49Å; L308-I342 HydrophobicContact CD2-CB 4.38Å; L308-I342 HydrophobicContact CD2-CG2 3.88Å; L311-I342 HydrophobicContact CD2-CD1 4.41Å; G328-I342 CarbonylContact C-O 3.55Å; G328-I342 WeakPolarHBondContact CA-O 3.31Å; L329-I342 HydrophobicContact CB-CB 4.43Å; L329-I342 HydrophobicContact CD2-CD1 4.26Å; L329-I342 PolarHBondContact N-O 3.19Å; L329-I342 PolarHBondContact O-N 3.05Å; Y331-I342 HydrophobicContact CG-CD1 4.48Å; L340-I342 HydrophobicContact CB-CD1 4.37Å; L340-I342 HydrophobicContact CB-CG1 4.16Å; I342-V348 HydrophobicContact CG1-CG1 4.33Å; I342-V348 HydrophobicContact CG2-CG2 4.21Å; I342-I366 HydrophobicContact CD1-CG1 4.23Å; I342-L370 HydrophobicContact CD1-CD1 4.46Å; I342-L370 HydrophobicContact CD1-CD2 4Å; I342-L370 HydrophobicContact CG2-CD1 4.3Å; I342-L370 HydrophobicContact CG2-CD2 4.11Å
343F98.2Very high97.1Very high52 Ų5244.7 Ų44.723%0.22823%0.232CC..EExtended strand (participates in β ladder)trans-98.3150.1-175.6-62.3-84.6000111.8F326 L341 S345 G346 K347 V349F326-F343 HydrophobicContact CZ-CE1 4.01Å; F326-F343 AromaticContact CZ-CZ 3.93Å; F326-F343 HydrophobicContact CZ-CZ 3.93Å; L341-F343 HydrophobicContact CB-CE2 4.22Å; F343-S345 PolarHBondContact O-N 2.84Å; F343-G346 PolarHBondContact O-N 2.83Å; F343-K347 HydrophobicContact CB-CB 4.47Å; F343-K347 HydrophobicContact CD2-CB 4.32Å; F343-K347 WeakPolarHBondContact CD2-O 3.49Å; F343-K347 PolarHBondContact N-O 2.89Å; F343-V349 HydrophobicContact CE2-CG2 4.44Å
344V97.3Very high97Very high63 Ų6349.2 Ų49.238%0.38225%0.251SS..THydrogen-bonded Turntrans-54.4-22.8178.9-65.60000114.1P305 I306 L308 G346P305-V344 CarbonylContact C-O 3.55Å; P305-V344 WeakPolarHBondContact CA-O 3.42Å; P305-V344 WeakPolarHBondContact CB-O 3.21Å; I306-V344 PolarHBondContact N-O 3.37Å; L308-V344 HydrophobicContact CD1-CG1 3.53Å; L308-V344 HydrophobicContact CG-CG1 3.92Å; V344-G346 VanDerWaalsContact C-N 3.35Å
345S97.3Very high97.1Very high66 Ų6650 Ų5046%0.46225%0.247SC..THydrogen-bonded Turntrans-79.4-8.2179.254.90000115F343F343-S345 PolarHBondContact O-N 2.84Å
346G96.6Very high97.2Very high0 Ų048 Ų480%024%0.236CC..SBendtrans91.7-4.6-173.700000114.7D301 V302 F304 F343 V344D301-G346 WeakPolarHBondContact CA-O 3.49Å; V302-G346 WeakPolarHBondContact CG2-O 3.47Å; V302-G346 PolarHBondContact N-O 3.05Å; F304-G346 VanDerWaalsContact O-CA 3.23Å; F304-G346 WeakPolarHBondContact O-CA 3.14Å; F343-G346 PolarHBondContact O-N 2.83Å; V344-G346 VanDerWaalsContact C-N 3.35Å
347K97.8Very high97.3Very high88 Ų8850.6 Ų50.638%0.38325%0.254SS..EExtended strand (participates in β ladder)trans-70.2138.5170.3-63.8-173.9-178-175.90110.3F94 D301 F343F94-K347 HydrophobicContact CE1-CD 4.28Å; F94-K347 HydrophobicContact CZ-CD 4.32Å; D301-K347 HydrophobicContact CB-CG 4.39Å; F343-K347 HydrophobicContact CB-CB 4.47Å; F343-K347 HydrophobicContact CD2-CB 4.32Å; F343-K347 WeakPolarHBondContact CD2-O 3.49Å; F343-K347 PolarHBondContact N-O 2.89Å
348V98.1Very high97.3Very high1 Ų142.6 Ų42.61%0.00623%0.226CC..EExtended strand (participates in β ladder)trans-133.6135.8177.8-177.70000109.6S299 C300 V302 L340 L341 I342 L350 L370S299-V348 CarbonylContact C-O 3.46Å; S299-V348 VanDerWaalsContact CA-O 3.24Å; S299-V348 WeakPolarHBondContact CA-O 3.3Å; S299-V348 WeakPolarHBondContact CB-O 3.43Å; C300-V348 PolarHBondContact N-O 3.49Å; C300-V348 PolarHBondContact O-N 3.04Å; V302-V348 HydrophobicContact CG1-CG2 4.45Å; L340-V348 HydrophobicContact CB-CG1 4.39Å; L340-V348 HydrophobicContact CD2-CG1 4.23Å; L341-V348 WeakPolarHBondContact O-CA 3.3Å; I342-V348 HydrophobicContact CG1-CG1 4.33Å; I342-V348 HydrophobicContact CG2-CG2 4.21Å; V348-L350 HydrophobicContact CG1-CD1 4.06Å; V348-L350 HydrophobicContact CG1-CG 4.35Å; V348-L370 HydrophobicContact CG2-CD1 3.99Å
349V98.3Very high97.3Very high32 Ų3242.6 Ų42.619%0.19423%0.226CC..EExtended strand (participates in β ladder)trans-116138.3169.9-178.90000108.4V297 G298 L340 L341 F343V297-V349 HydrophobicContact CG1-CG1 3.73Å; G298-V349 WeakPolarHBondContact O-CA 3.35Å; L340-V349 CarbonylContact C-O 3.44Å; L340-V349 VanDerWaalsContact CA-O 3.27Å; L340-V349 WeakPolarHBondContact CA-O 3.38Å; L341-V349 HydrophobicContact CB-CB 4.25Å; L341-V349 HydrophobicContact CD1-CB 4.26Å; L341-V349 HydrophobicContact CD1-CG1 4.34Å; L341-V349 PolarHBondContact N-O 3.2Å; L341-V349 PolarHBondContact O-N 2.78Å; F343-V349 HydrophobicContact CE2-CG2 4.44Å
350L98.2Very high97.2Very high0 Ų043 Ų430%022%0.223CC..EExtended strand (participates in β ladder)trans-120.4132.4-179.9-57.292.3000108.9V297 G298 I338 L340 V348 I359 A362 F363V297-L350 CarbonylContact C-O 3.6Å; V297-L350 WeakPolarHBondContact CA-O 3.43Å; G298-L350 PolarHBondContact N-O 2.86Å; G298-L350 PolarHBondContact O-N 2.83Å; I338-L350 HydrophobicContact CG2-CB 4.18Å; I338-L350 HydrophobicContact CG2-CD2 4.45Å; L340-L350 HydrophobicContact CD2-CD2 3.62Å; L340-L350 HydrophobicContact CD2-CG 3.91Å; L340-L350 HydrophobicContact CG-CD2 4.05Å; L340-L350 HydrophobicContact CG-CG 4.04Å; V348-L350 HydrophobicContact CG1-CD1 4.06Å; V348-L350 HydrophobicContact CG1-CG 4.35Å; L350-I359 HydrophobicContact CB-CG2 4.42Å; L350-I359 HydrophobicContact CD2-CG2 4.4Å; L350-A362 HydrophobicContact CD2-CB 3.87Å; L350-F363 HydrophobicContact CD2-CB 4.39Å
351T97.3Very high97.2Very high13 Ų1346.6 Ų46.68%0.0824%0.239CC..EExtended strand (participates in β ladder)trans-145.9158.2-177-171.80000111.6N295 V339N295-T351 PolarHBondContact ND2-OG1 2.96Å; N295-T351 VanDerWaalsContact ND2-OG1 3.12Å; V339-T351 HydrophobicContact CB-CG2 4.11Å; V339-T351 PolarHBondContact N-O 2.85Å; V339-T351 PolarHBondContact O-N 3.14Å
352G94.8Very high97.1Very high38 Ų3845.3 Ų45.339%0.39223%0.233SC..EExtended strand (participates in β ladder)trans100.3-7.1-176.300000114.3N295N295-G352 VanDerWaalsContact OD1-CA 3.3Å; N295-G352 WeakPolarHBondContact OD1-CA 3.03Å; N295-G352 PolarHBondContact OD1-N 2.96Å
353A96.9Very high97.1Very high0 Ų045.8 Ų45.80%024%0.235CC..EExtended strand (participates in β ladder)trans-69.3144.8177.500000111.8N295 M296 I338 E358 I359N295-A353 CarbonylContact C-O 3.51Å; N295-A353 VanDerWaalsContact CA-O 3.25Å; N295-A353 WeakPolarHBondContact CA-O 3.38Å; M296-A353 HydrophobicContact CB-CB 4.21Å; M296-A353 PolarHBondContact N-O 2.94Å; I338-A353 VanDerWaalsContact CD1-CA 3.5Å; I338-A353 HydrophobicContact CD1-CB 3.59Å; A353-E358 WeakPolarHBondContact CA-OE2 3.4Å; A353-E358 HydrophobicContact CB-CB 4.15Å; A353-I359 HydrophobicContact CB-CD1 3.92Å; A353-I359 HydrophobicContact CB-CG1 3.52Å
354K96.1Very high96.9Very high114 Ų11449.9 Ų49.950%0.49626%0.255SS..SBendtrans-108.1-21.4169.3-73.8159.5-174.6159.90111.7Q294 E358Q294-K354 WeakPolarHBondContact O-CG 3.3Å; K354-E358 PolarHBondContact N-OE2 3.37Å
355E96.6Very high96.9Very high126 Ų12650.5 Ų50.559%0.58926%0.256SS*.SBendtrans-125148.1174.2-60.2-171.4177.600111.8S357 E358E355-S357 VanDerWaalsContact CB-OG 3.24Å; E355-S357 WeakPolarHBondContact CB-OG 3.46Å; E355-S357 PolarHBondContact O-N 3.17Å; E355-S357 PolarHBondContact OE2-OG 3.08Å; E355-E358 HydrophobicContact CB-CG 4.4Å; E355-E358 PolarHBondContact N-OE2 3.08Å; E355-E358 PolarHBondContact O-N 2.93Å
356R95.8Very high96.8Very high115 Ų11547.4 Ų47.443%0.43423%0.234SC..Hα-helixtrans-63.3-29.5-179.3-172.2177.8172179.7-8.4113.2L203 M296 E358 I359 Y360L203-R356 HydrophobicContact CD1-CG 4.13Å; M296-R356 HydrophobicContact CE-CB 3.99Å; R356-E358 VanDerWaalsContact C-N 3.35Å; R356-I359 PolarHBondContact O-N 2.98Å; R356-Y360 HydrophobicContact CG-CD2 4.37Å; R356-Y360 HydrophobicContact CG-CE2 3.7Å; R356-Y360 PolarHBondContact NE-OH 3.16Å; R356-Y360 PolarHBondContact NH2-OH 3.25Å; R356-Y360 WeakPolarHBondContact O-CD2 3.49Å
357S96.7Very high96.8Very high63 Ų6348.8 Ų48.844%0.44124%0.24SC..Hα-helixtrans-54.3-45.617237.20000112.4E355 I359 Y360 E361E355-S357 VanDerWaalsContact CB-OG 3.24Å; E355-S357 WeakPolarHBondContact CB-OG 3.46Å; E355-S357 PolarHBondContact O-N 3.17Å; E355-S357 PolarHBondContact OE2-OG 3.08Å; S357-I359 VanDerWaalsContact C-N 3.25Å; S357-I359 PolarHBondContact O-N 3.25Å; S357-Y360 PolarHBondContact O-N 3.49Å; S357-E361 PolarHBondContact O-N 3.5Å
358E97.4Very high96.8Very high51 Ų5147.6 Ų47.624%0.23824%0.241CC..Hα-helixtrans-63.3-31.2-177.3-59.6175.2118.500112.4P336 I338 A353 K354 E355 R356 A362P336-E358 HydrophobicContact CB-CB 3.97Å; P336-E358 HydrophobicContact CB-CG 4.15Å; P336-E358 HydrophobicContact CG-CB 4.15Å; P336-E358 VanDerWaalsContact CG-O 3.31Å; P336-E358 WeakPolarHBondContact CG-O 3.38Å; I338-E358 HydrophobicContact CD1-CB 4.14Å; I338-E358 HydrophobicContact CG1-CB 4.48Å; A353-E358 WeakPolarHBondContact CA-OE2 3.4Å; A353-E358 HydrophobicContact CB-CB 4.15Å; K354-E358 PolarHBondContact N-OE2 3.37Å; E355-E358 HydrophobicContact CB-CG 4.4Å; E355-E358 PolarHBondContact N-OE2 3.08Å; E355-E358 PolarHBondContact O-N 2.93Å; R356-E358 VanDerWaalsContact C-N 3.35Å; E358-A362 WeakPolarHBondContact O-CB 3.34Å; E358-A362 PolarHBondContact O-N 3.11Å
359I97.4Very high96.7Very high1 Ų149.7 Ų49.71%0.00525%0.252CS..Hα-helixtrans-70.6-35.3176.1-64.6173.5000110.9P201 L203 M296 L350 A353 R356 S357 F363P201-I359 HydrophobicContact CB-CG2 3.8Å; P201-I359 HydrophobicContact CG-CG2 4.48Å; L203-I359 HydrophobicContact CD2-CD1 3.57Å; M296-I359 HydrophobicContact CB-CD1 3.87Å; L350-I359 HydrophobicContact CB-CG2 4.42Å; L350-I359 HydrophobicContact CD2-CG2 4.4Å; A353-I359 HydrophobicContact CB-CD1 3.92Å; A353-I359 HydrophobicContact CB-CG1 3.52Å; R356-I359 PolarHBondContact O-N 2.98Å; S357-I359 VanDerWaalsContact C-N 3.25Å; S357-I359 PolarHBondContact O-N 3.25Å; I359-F363 WeakPolarHBondContact O-CB 3.5Å; I359-F363 PolarHBondContact O-N 3.05Å; I359-F363 VanDerWaalsContact O-N 3.16Å
360Y96.5Very high96.6Very high53 Ų5348.2 Ų48.221%0.20824%0.242CC..Hα-helixtrans-75.5-47.3177-63.4-45.5000111.7V200 P201 R356 S357 A362 F363 E364V200-Y360 HydrophobicContact CG1-CD1 4.5Å; V200-Y360 HydrophobicContact CG1-CE1 3.65Å; P201-Y360 HydrophobicContact CB-CD1 4.19Å; P201-Y360 HydrophobicContact CB-CE1 3.94Å; P201-Y360 HydrophobicContact CG-CD1 4.02Å; P201-Y360 HydrophobicContact CG-CE1 4.18Å; P201-Y360 WeakPolarHBondContact O-CE1 3.12Å; P201-Y360 PolarHBondContact O-OH 3.35Å; R356-Y360 HydrophobicContact CG-CD2 4.37Å; R356-Y360 HydrophobicContact CG-CE2 3.7Å; R356-Y360 PolarHBondContact NE-OH 3.16Å; R356-Y360 PolarHBondContact NH2-OH 3.25Å; R356-Y360 WeakPolarHBondContact O-CD2 3.49Å; S357-Y360 PolarHBondContact O-N 3.49Å; Y360-A362 VanDerWaalsContact C-N 3.32Å; Y360-A362 PolarHBondContact O-N 3.14Å; Y360-F363 PolarHBondContact O-N 2.87Å; Y360-F363 VanDerWaalsContact O-N 3.09Å; Y360-E364 WeakPolarHBondContact O-CG 3.43Å; Y360-E364 PolarHBondContact O-N 3.1Å
361E96.9Very high96.5Very high75 Ų7552.7 Ų52.735%0.3526%0.262SS..Hα-helixtrans-57.9-43174.4-172.5-173.3169.600111.3P336 S357 F363 E364 N365P336-E361 HydrophobicContact CG-CB 4.19Å; P336-E361 HydrophobicContact CG-CG 4.34Å; S357-E361 PolarHBondContact O-N 3.5Å; E361-F363 VanDerWaalsContact C-N 3.34Å; E361-F363 PolarHBondContact O-N 2.93Å; E361-E364 PolarHBondContact O-N 3.49Å; E361-N365 WeakPolarHBondContact O-CB 3.19Å; E361-N365 VanDerWaalsContact O-CG 3.24Å; E361-N365 PolarHBondContact O-N 3.26Å; E361-N365 PolarHBondContact O-ND2 2.73Å
362A97.3Very high96.4Very high0 Ų055.2 Ų55.20%029%0.291CS..Hα-helixtrans-64.1-36.417600000113.3M333 P336 I338 L350 E358 Y360 I366M333-A362 WeakPolarHBondContact CE-O 3.44Å; M333-A362 HydrophobicContact SD-CB 3.82Å; P336-A362 HydrophobicContact CG-CB 4Å; I338-A362 HydrophobicContact CB-CB 4.09Å; I338-A362 HydrophobicContact CG1-CB 4Å; I338-A362 HydrophobicContact CG2-CB 4.05Å; L350-A362 HydrophobicContact CD2-CB 3.87Å; E358-A362 WeakPolarHBondContact O-CB 3.34Å; E358-A362 PolarHBondContact O-N 3.11Å; Y360-A362 VanDerWaalsContact C-N 3.32Å; Y360-A362 PolarHBondContact O-N 3.14Å; A362-I366 WeakPolarHBondContact O-CG2 3.37Å; A362-I366 PolarHBondContact O-N 2.85Å; A362-I366 VanDerWaalsContact O-N 3.13Å
363F96.9Very high96.4Very high11 Ų1155.2 Ų55.25%0.04828%0.28CS..Hα-helixtrans-73.2-43.3177.7-176.8-107000112.2I199 P201 C300 V302 L350 I359 Y360 E361 N365 I366 Y367I199-F363 HydrophobicContact CB-CE1 4.45Å; I199-F363 HydrophobicContact CB-CZ 4.32Å; I199-F363 HydrophobicContact CG2-CE1 4.38Å; I199-F363 HydrophobicContact CG2-CZ 3.94Å; I199-F363 WeakPolarHBondContact O-CE1 3.31Å; P201-F363 HydrophobicContact CG-CB 3.55Å; P201-F363 HydrophobicContact CG-CD1 3.74Å; P201-F363 HydrophobicContact CG-CD2 4.16Å; P201-F363 HydrophobicContact CG-CG 3.52Å; C300-F363 HydrophobicContact CB-CE2 4.29Å; C300-F363 WeakPolarHBondContact SG-CD2 3.42Å; C300-F363 WeakPolarHBondContact SG-CE2 3.27Å; V302-F363 HydrophobicContact CG1-CE2 4.05Å; V302-F363 HydrophobicContact CG1-CZ 4.28Å; L350-F363 HydrophobicContact CD2-CB 4.39Å; I359-F363 WeakPolarHBondContact O-CB 3.5Å; I359-F363 PolarHBondContact O-N 3.05Å; I359-F363 VanDerWaalsContact O-N 3.16Å; Y360-F363 PolarHBondContact O-N 2.87Å; Y360-F363 VanDerWaalsContact O-N 3.09Å; E361-F363 VanDerWaalsContact C-N 3.34Å; E361-F363 PolarHBondContact O-N 2.93Å; F363-N365 VanDerWaalsContact C-N 3.28Å; F363-N365 PolarHBondContact O-N 3.48Å; F363-I366 HydrophobicContact CD2-CG2 4.33Å; F363-I366 PolarHBondContact O-N 2.82Å; F363-Y367 HydrophobicContact CE1-CD2 4.32Å; F363-Y367 HydrophobicContact CE1-CG 4.41Å; F363-Y367 HydrophobicContact CE2-CD2 4.29Å; F363-Y367 AromaticContact CZ-CD2 3.7Å; F363-Y367 HydrophobicContact CZ-CD2 3.7Å; F363-Y367 HydrophobicContact CZ-CG 4.17Å; F363-Y367 WeakPolarHBondContact O-CB 3.27Å; F363-Y367 PolarHBondContact O-N 2.99Å
364E95.8Very high96.4Very high137 Ų13760.5 Ų60.564%0.6430%0.303SS*.Hα-helixtrans-61-37.8176.2-72.2176.5-179.700111.9Y360 E361 P368Y360-E364 WeakPolarHBondContact O-CG 3.43Å; Y360-E364 PolarHBondContact O-N 3.1Å; E361-E364 PolarHBondContact O-N 3.49Å; E364-P368 WeakPolarHBondContact O-CD 3.35Å
365N95.8Very high96.1Very high77 Ų7758.4 Ų58.441%0.41229%0.294SS..Hα-helixtrans-69.1-41.3175-75.1-28.5000113.3M333 E361 F363M333-N365 HydrophobicContact CE-CB 3.87Å; M333-N365 HydrophobicContact SD-CB 4.19Å; E361-N365 WeakPolarHBondContact O-CB 3.19Å; E361-N365 VanDerWaalsContact O-CG 3.24Å; E361-N365 PolarHBondContact O-N 3.26Å; E361-N365 PolarHBondContact O-ND2 2.73Å; F363-N365 VanDerWaalsContact C-N 3.28Å; F363-N365 PolarHBondContact O-N 3.48Å
366I96.3Very high95.1Very high0 Ų060 Ų600%033%0.328CS..Hα-helixtrans-83.2-32.9-176.3-155.665000113Y331 M333 L340 I342 A362 F363 I369 L370Y331-I366 HydrophobicContact CD1-CD1 3.96Å; Y331-I366 HydrophobicContact CD2-CD1 4.1Å; Y331-I366 HydrophobicContact CE1-CD1 3.77Å; Y331-I366 HydrophobicContact CE2-CD1 3.89Å; Y331-I366 HydrophobicContact CG-CD1 4.13Å; M333-I366 HydrophobicContact CE-CB 4.04Å; M333-I366 HydrophobicContact CE-CD1 4.31Å; L340-I366 HydrophobicContact CD2-CB 4.13Å; L340-I366 HydrophobicContact CD2-CG1 4.25Å; L340-I366 HydrophobicContact CD2-CG2 3.74Å; I342-I366 HydrophobicContact CD1-CG1 4.23Å; A362-I366 WeakPolarHBondContact O-CG2 3.37Å; A362-I366 PolarHBondContact O-N 2.85Å; A362-I366 VanDerWaalsContact O-N 3.13Å; F363-I366 HydrophobicContact CD2-CG2 4.33Å; F363-I366 PolarHBondContact O-N 2.82Å; I366-I369 HydrophobicContact CD1-CD1 4.15Å; I366-I369 WeakPolarHBondContact O-CB 3.38Å; I366-I369 PolarHBondContact O-N 2.9Å; I366-I369 VanDerWaalsContact O-N 3.07Å; I366-L370 HydrophobicContact CG1-CD1 4.24Å; I366-L370 HydrophobicContact CG1-CD2 4.21Å; I366-L370 HydrophobicContact CG1-CG 4.05Å; I366-L370 HydrophobicContact CG2-CD1 4.18Å; I366-L370 WeakPolarHBondContact O-CG 3.41Å; I366-L370 PolarHBondContact O-N 3Å
367Y96.7Very high95.1Very high30 Ų3057.2 Ų57.212%0.11832%0.323CS..Hα-helixtrans-53.6-47.6-173.3178-98.9000115.1C197 V302 F304 F363 I369 L370 K371C197-Y367 HydrophobicContact CB-CD1 4.14Å; C197-Y367 HydrophobicContact CB-CE1 3.51Å; C197-Y367 HydrophobicContact CB-CE2 4.06Å; C197-Y367 VanDerWaalsContact CB-CZ 3.48Å; C197-Y367 PolarHBondContact SG-OH 3.21Å; C197-Y367 VanDerWaalsContact SG-OH 3.32Å; V302-Y367 HydrophobicContact CB-CE2 4.24Å; V302-Y367 HydrophobicContact CG1-CD2 4.09Å; V302-Y367 HydrophobicContact CG1-CE2 4.31Å; F304-Y367 HydrophobicContact CE1-CE2 4.07Å; F304-Y367 HydrophobicContact CZ-CE2 4.27Å; F363-Y367 HydrophobicContact CE1-CD2 4.32Å; F363-Y367 HydrophobicContact CE1-CG 4.41Å; F363-Y367 HydrophobicContact CE2-CD2 4.29Å; F363-Y367 AromaticContact CZ-CD2 3.7Å; F363-Y367 HydrophobicContact CZ-CD2 3.7Å; F363-Y367 HydrophobicContact CZ-CG 4.17Å; F363-Y367 WeakPolarHBondContact O-CB 3.27Å; F363-Y367 PolarHBondContact O-N 2.99Å; Y367-I369 VanDerWaalsContact C-N 3.27Å; Y367-I369 PolarHBondContact O-N 3.23Å; Y367-L370 PolarHBondContact O-N 3.18Å; Y367-K371 HydrophobicContact CE1-CD 4.24Å; Y367-K371 PolarHBondContact O-N 3.43Å
368P96.2Very high95Very high62 Ų6256.9 Ų56.940%0.40332%0.316SS..Hα-helixtrans-64.2-32.3178.624.9-34000112.7E364 K371 G372E364-P368 WeakPolarHBondContact O-CD 3.35Å; P368-K371 PolarHBondContact O-N 3.05Å; P368-G372 PolarHBondContact O-N 3.12Å
369I96.1Very high94.8Very high46 Ų4657.2 Ų57.224%0.23632%0.321CS..Hα-helixtrans-64.6-49.7174-61161.3000109.3L311 I366 Y367 K371 G372 F373L311-I369 HydrophobicContact CD1-CG2 3.76Å; I366-I369 HydrophobicContact CD1-CD1 4.15Å; I366-I369 WeakPolarHBondContact O-CB 3.38Å; I366-I369 PolarHBondContact O-N 2.9Å; I366-I369 VanDerWaalsContact O-N 3.07Å; Y367-I369 VanDerWaalsContact C-N 3.27Å; Y367-I369 PolarHBondContact O-N 3.23Å; I369-K371 VanDerWaalsContact C-N 3.31Å; I369-K371 PolarHBondContact O-N 2.63Å; I369-G372 WeakPolarHBondContact O-CA 3.5Å; I369-G372 PolarHBondContact O-N 3.28Å; I369-F373 HydrophobicContact CG2-CD2 3.99Å; I369-F373 HydrophobicContact CG2-CE2 3.94Å; I369-F373 VanDerWaalsContact O-CD2 3.3Å; I369-F373 WeakPolarHBondContact O-CD2 3.44Å; I369-F373 PolarHBondContact O-N 2.81Å
370L96.6Very high94.7Very high0 Ų060.5 Ų60.50%034%0.339CS..Hα-helixtrans-62-38.1179-57.3-175.3000112.3V302 F304 I306 L311 I342 V348 I366 Y367 G372 F373 K374V302-L370 HydrophobicContact CG1-CD1 4.37Å; F304-L370 WeakPolarHBondContact CE2-O 3.31Å; I306-L370 HydrophobicContact CD1-CB 4.2Å; I306-L370 HydrophobicContact CD1-CD1 4.07Å; I306-L370 HydrophobicContact CD1-CD2 4.32Å; I306-L370 HydrophobicContact CD1-CG 4.4Å; I306-L370 HydrophobicContact CG2-CD2 4.47Å; L311-L370 HydrophobicContact CD2-CD2 3.69Å; I342-L370 HydrophobicContact CD1-CD1 4.46Å; I342-L370 HydrophobicContact CD1-CD2 4Å; I342-L370 HydrophobicContact CG2-CD1 4.3Å; I342-L370 HydrophobicContact CG2-CD2 4.11Å; V348-L370 HydrophobicContact CG2-CD1 3.99Å; I366-L370 HydrophobicContact CG1-CD1 4.24Å; I366-L370 HydrophobicContact CG1-CD2 4.21Å; I366-L370 HydrophobicContact CG1-CG 4.05Å; I366-L370 HydrophobicContact CG2-CD1 4.18Å; I366-L370 WeakPolarHBondContact O-CG 3.41Å; I366-L370 PolarHBondContact O-N 3Å; Y367-L370 PolarHBondContact O-N 3.18Å; L370-G372 VanDerWaalsContact C-N 3.26Å; L370-G372 PolarHBondContact O-N 3.01Å; L370-F373 CarbonylContact O-C 3.57Å; L370-F373 PolarHBondContact O-N 3.11Å; L370-K374 PolarHBondContact O-N 3.29Å
371K95.7Very high94.6Very high95 Ų9561 Ų6141%0.41335%0.347SS..Hα-helixtrans-59.2-36.7173.9-172.9175.6176.6175.20112E195 F304 Y367 P368 I369 K374E195-K371 IonicContact OE2-NZ 2.85Å; E195-K371 PolarHBondContact OE2-NZ 2.92Å; F304-K371 HydrophobicContact CZ-CB 4.17Å; Y367-K371 HydrophobicContact CE1-CD 4.24Å; Y367-K371 PolarHBondContact O-N 3.43Å; P368-K371 PolarHBondContact O-N 3.05Å; I369-K371 VanDerWaalsContact C-N 3.31Å; I369-K371 PolarHBondContact O-N 2.63Å; K371-K374 WeakPolarHBondContact O-CB 3.44Å
372G95.4Very high94.4Very high66 Ų6660.1 Ų60.168%0.6835%0.347SS*.Hα-helixtrans-67.5-31.3172.600000114.4P368 I369 L370P368-G372 PolarHBondContact O-N 3.12Å; I369-G372 WeakPolarHBondContact O-CA 3.5Å; I369-G372 PolarHBondContact O-N 3.28Å; L370-G372 VanDerWaalsContact C-N 3.26Å; L370-G372 PolarHBondContact O-N 3.01Å
373F96.2Very high94.2Very high38 Ų3864.4 Ų64.417%0.16737%0.372CS..THydrogen-bonded Turntrans-94.215.6177.6-70.2-73.6000114.5I306 R307 G310 L311 T314 I369 L370 K375I306-F373 HydrophobicContact CG2-CB 4.11Å; R307-F373 WeakPolarHBondContact CB-O 3.37Å; R307-F373 PolarHBondContact N-O 3.07Å; G310-F373 WeakPolarHBondContact O-CE1 3.3Å; L311-F373 HydrophobicContact CB-CD1 4.43Å; L311-F373 HydrophobicContact CB-CD2 4.17Å; L311-F373 HydrophobicContact CB-CE2 4.48Å; L311-F373 HydrophobicContact CB-CG 4.15Å; L311-F373 HydrophobicContact CD1-CD2 3.68Å; L311-F373 HydrophobicContact CD1-CE2 3.73Å; L311-F373 HydrophobicContact CD1-CG 4.49Å; L311-F373 HydrophobicContact CG-CD2 4.47Å; T314-F373 HydrophobicContact CG2-CZ 4.03Å; T314-F373 WeakPolarHBondContact OG1-CZ 3.12Å; I369-F373 HydrophobicContact CG2-CD2 3.99Å; I369-F373 HydrophobicContact CG2-CE2 3.94Å; I369-F373 VanDerWaalsContact O-CD2 3.3Å; I369-F373 WeakPolarHBondContact O-CD2 3.44Å; I369-F373 PolarHBondContact O-N 2.81Å; L370-F373 CarbonylContact O-C 3.57Å; L370-F373 PolarHBondContact O-N 3.11Å; F373-K375 PolarHBondContact O-N 3.08Å
374K95.8Very high94Very high111 Ų11168.5 Ų68.548%0.48340%0.397SS..BIsolated β-bridgetrans-53.6133.2172.4176.3172.6174.4-174.40110.9F304 P305 L370 K371F304-K374 HydrophobicContact CB-CD 3.9Å; F304-K374 HydrophobicContact CB-CG 4.1Å; F304-K374 HydrophobicContact CD2-CB 3.75Å; F304-K374 HydrophobicContact CD2-CD 4.09Å; F304-K374 HydrophobicContact CD2-CG 3.78Å; F304-K374 HydrophobicContact CE2-CB 4.04Å; F304-K374 HydrophobicContact CG-CB 4.46Å; F304-K374 HydrophobicContact CG-CD 3.93Å; F304-K374 HydrophobicContact CG-CG 4.09Å; P305-K374 WeakPolarHBondContact O-CA 3.23Å; L370-K374 PolarHBondContact O-N 3.29Å; K371-K374 WeakPolarHBondContact O-CB 3.44Å
375K90.1Very high93.9Very high70 Ų7062.8 Ų62.830%0.30438%0.377SS..  trans-70131.6168.2-70-174.4176.6-179.40108.3P305 I306 R307 E309 F373P305-K375 HydrophobicContact CB-CB 4.28Å; P305-K375 HydrophobicContact CG-CB 4.12Å; P305-K375 PolarHBondContact O-N 3.32Å; I306-K375 VanDerWaalsContact O-CE 3.23Å; I306-K375 WeakPolarHBondContact O-CE 3.46Å; R307-K375 VanDerWaalsContact CA-CE 3.46Å; R307-K375 HydrophobicContact CB-CG 3.93Å; R307-K375 HydrophobicContact CG-CG 4.49Å; E309-K375 IonicContact OE1-NZ 2.7Å; E309-K375 PolarHBondContact OE1-NZ 3.22Å; E309-K375 IonicContact OE2-NZ 3.46Å; F373-K375 PolarHBondContact O-N 3.08Å
376A75.6Confident93.7Very high158 Ų15861.5 Ų61.5100%1.30637%0.374SS*.  trans-75.40-177.300000111

Retrieved 376 of 376 residues in 173.2 ms (Link to these results)