A0A087XF85_POEFO Loading...

Angiomotin

AlphaFold DB , UniProt , Accession A0A087XF85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 612 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
1M34.1Very low35.2Very low232 Ų232148.8 Ų148.8100%1.14381%0.808SS**  0136.60-111.9142.2172.800107.4
2E37.2Very low35.4Very low168 Ų168149 Ų14979%0.78581%0.808SS**  trans14.1150.5154.2-69.2176.9106.800119.3
3M33.1Very low34.8Very low138 Ų138146.5 Ų146.568%0.6881%0.808SS**  cis-177.4139-2-105.1-112.2-9200103.3
4R36.7Very low35Very low225 Ų225146.9 Ų146.985%0.84981%0.809SS**  trans65134.3137.2-145.9178.7-173.6159.80.8121.2
5A34.5Very low34.8Very low98 Ų98146.3 Ų146.381%0.8181%0.811SS**  trans115.1124.713200000117.1
6G32.8Very low35.1Very low60 Ų60145.1 Ų145.162%0.61982%0.815SS**  trans122.4108.814000000116.5
7T31.3Very low35.2Very low137 Ų137140.6 Ų140.684%0.8481%0.809SS**  63.5128.2128.9460000117.6
8E31.6Very low35.9Very low188 Ų188137.7 Ų137.788%0.87982%0.815SS**  -162.5141.952.4-71.3-171.5142.300112.5
9E33.3Very low36.3Very low175 Ų175134.2 Ų134.282%0.81881%0.81SS**  trans-76.1-173153.7-81-91.1129.600109.5
10P54.4Low37.3Very low98 Ų98130.2 Ų130.264%0.63679%0.788SS**  cis-130.3177.7-48.632.3-14.8000111.2
11S28.2Very low39.3Very low118 Ų118128 Ų12883%0.82578%0.776SS**  trans177.3106.4134.7-80.90000114.2
12N37.7Very low41.3Very low151 Ų151122 Ų12281%0.80775%0.752SS**  trans3.5134.7144.1-86.7-17.2000120.7
13S28.1Very low43.2Very low117 Ų117120.8 Ų120.882%0.81875%0.75SS**  -145.4120.4118.252.50000111.3
14N37.1Very low45.5Very low152 Ų152119.7 Ų119.781%0.81374%0.743SS**  trans-62.9130.5166.6-92.4-4.9000110.1
15V31.2Very low47.7Very low138 Ų138116.9 Ų116.984%0.83673%0.733SS**  trans-125.7106.3147.4165.90000108
16S40.7Very low50.2Low126 Ų126116.9 Ų116.988%0.88172%0.719SS**  trans-68.5124.5162.4-175.20000108.2
17G35.8Very low52.7Low69 Ų69119.9 Ų119.971%0.71172%0.72SS**  trans17375.9179.800000115.6
18G48Very low55.2Low89 Ų89118.4 Ų118.492%0.91870%0.703SS**  trans55.187.8139.600000119.1
19G44.1Very low57.7Low70 Ų70114.8 Ų114.872%0.72269%0.686SS**  trans-156.933.9166.900000114.1T21G19-T21 PolarHBondContact O-N 3.28Å
20S55.9Low59.9Low54 Ų54111.6 Ų111.638%0.37867%0.672SS.*  trans-64.6113.1174.5174.80000108.9Q24 R25S20-Q24 WeakPolarHBondContact OG-CB 3.42Å; S20-R25 PolarHBondContact OG-N 2.98Å
21T78.5Confident61.1Low85 Ų85113 Ų11352%0.52167%0.671SS.*  trans-56.8154.8169.463.10000109.7G19 L23 Q24 R25G19-T21 PolarHBondContact O-N 3.28Å; T21-L23 PolarHBondContact O-N 3.07Å; T21-L23 VanDerWaalsContact O-N 3.16Å; T21-Q24 PolarHBondContact O-N 3.47Å; T21-Q24 PolarHBondContact OG1-N 2.98Å; T21-R25 PolarHBondContact O-N 3.39Å
22V78.1Confident63.7Low107 Ų107111.7 Ų111.765%0.64866%0.655SS**Hα-helixtrans-54.1-36178.5175.60000111R25 L26V22-R25 PolarHBondContact O-N 2.78Å; V22-L26 HydrophobicContact CG1-CD1 3.77Å; V22-L26 WeakPolarHBondContact O-CD1 3.4Å; V22-L26 PolarHBondContact O-N 2.83Å
23L76.9Confident65.7Low142 Ų142112.3 Ų112.374%0.74365%0.646SS**Hα-helixtrans-60.9-44.8174-108.4158.6000112.6T21 R25 L26 L27T21-L23 PolarHBondContact O-N 3.07Å; T21-L23 VanDerWaalsContact O-N 3.16Å; L23-R25 VanDerWaalsContact C-N 3.3Å; L23-R25 PolarHBondContact O-N 2.84Å; L23-L26 PolarHBondContact O-N 3.13Å; L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.5Å
24Q79.8Confident68Low115 Ų115111.8 Ų111.854%0.53763%0.634SS.*Hα-helixtrans-69.3-31.6178.2-172.3155.133.800112S20 T21 Q28S20-Q24 WeakPolarHBondContact OG-CB 3.42Å; T21-Q24 PolarHBondContact O-N 3.47Å; T21-Q24 PolarHBondContact OG1-N 2.98Å; Q24-Q28 VanDerWaalsContact O-CB 3.27Å; Q24-Q28 WeakPolarHBondContact O-CB 3.49Å; Q24-Q28 PolarHBondContact O-N 2.84Å
25R83.8Confident70Confident165 Ų165112 Ų11262%0.62362%0.624SS**Hα-helixtrans-69.2-42.9173.5-154.1-179.2-59.9-179.42.5111.8S20 T21 V22 L23 Q28 E29S20-R25 PolarHBondContact OG-N 2.98Å; T21-R25 PolarHBondContact O-N 3.39Å; V22-R25 PolarHBondContact O-N 2.78Å; L23-R25 VanDerWaalsContact C-N 3.3Å; L23-R25 PolarHBondContact O-N 2.84Å; R25-Q28 PolarHBondContact O-N 3.36Å; R25-E29 VanDerWaalsContact O-CB 3.27Å; R25-E29 WeakPolarHBondContact O-CB 3.45Å; R25-E29 PolarHBondContact O-N 3.37Å
26L86.1Confident72Confident99 Ų99109.5 Ų109.552%0.51861%0.61SS.*Hα-helixtrans-65.8-37.8175.4-102.8115.3000112.4V22 L23 E29 Q30V22-L26 HydrophobicContact CG1-CD1 3.77Å; V22-L26 WeakPolarHBondContact O-CD1 3.4Å; V22-L26 PolarHBondContact O-N 2.83Å; L23-L26 PolarHBondContact O-N 3.13Å; L26-E29 PolarHBondContact O-N 2.99Å; L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.33Å; L26-Q30 PolarHBondContact O-N 2.91Å
27L86.5Confident73.6Confident123 Ų123108.7 Ų108.764%0.64460%0.595SS**Hα-helixtrans-69.4-41177.5-166.168.4000111.2L23 E29 Q30 M31L23-L27 WeakPolarHBondContact O-CB 3.34Å; L23-L27 PolarHBondContact O-N 3.5Å; L27-E29 VanDerWaalsContact C-N 3.32Å; L27-E29 PolarHBondContact O-N 3.41Å; L27-Q30 PolarHBondContact O-N 2.92Å; L27-M31 PolarHBondContact O-N 2.95Å
28Q82.5Confident75.4Confident106 Ų106110.6 Ų110.650%0.49559%0.585SS.*Hα-helixtrans-62.8-39.8172.9-17073.664.400111.5Q24 R25 M31 N32Q24-Q28 VanDerWaalsContact O-CB 3.27Å; Q24-Q28 WeakPolarHBondContact O-CB 3.49Å; Q24-Q28 PolarHBondContact O-N 2.84Å; R25-Q28 PolarHBondContact O-N 3.36Å; Q28-M31 PolarHBondContact O-N 3.35Å; Q28-N32 WeakPolarHBondContact O-CB 3.29Å; Q28-N32 PolarHBondContact O-N 3.43Å
29E84.4Confident76.2Confident111 Ų111111.8 Ų111.852%0.51957%0.567SS.*Hα-helixtrans-68.9-37178.5-168.6172.6-169.600112.2R25 L26 L27 N32 R33R25-E29 VanDerWaalsContact O-CB 3.27Å; R25-E29 WeakPolarHBondContact O-CB 3.45Å; R25-E29 PolarHBondContact O-N 3.37Å; L26-E29 PolarHBondContact O-N 2.99Å; L27-E29 VanDerWaalsContact C-N 3.32Å; L27-E29 PolarHBondContact O-N 3.41Å; E29-N32 PolarHBondContact O-N 2.94Å; E29-R33 PolarHBondContact O-N 2.87Å
30Q81.1Confident77.1Confident109 Ų109115 Ų11551%0.50956%0.563SS.*Hα-helixtrans-65.8-43.7172.3-81.5-67.9-12.300112.5L26 L27 R33 N34L26-Q30 WeakPolarHBondContact O-CB 3.31Å; L26-Q30 WeakPolarHBondContact O-CG 3.33Å; L26-Q30 PolarHBondContact O-N 2.91Å; L27-Q30 PolarHBondContact O-N 2.92Å; Q30-R33 PolarHBondContact O-N 3.43Å; Q30-N34 PolarHBondContact O-N 3.39Å
31M78.7Confident77.2Confident128 Ų128120 Ų12063%0.63158%0.581SS**Hα-helixtrans-63.3-42.9174.4-88.4-114.1-68.200112.1L27 Q28 N34 Y35L27-M31 PolarHBondContact O-N 2.95Å; Q28-M31 PolarHBondContact O-N 3.35Å; M31-N34 PolarHBondContact O-N 3.28Å; M31-Y35 WeakPolarHBondContact O-CB 3.36Å; M31-Y35 PolarHBondContact O-N 2.82Å
32N82.5Confident76.1Confident90 Ų90123.5 Ų123.548%0.48159%0.591SS.*Hα-helixtrans-66-38.5177.7-85.5-4.6000112.2Q28 E29 N34 Y35 V36Q28-N32 WeakPolarHBondContact O-CB 3.29Å; Q28-N32 PolarHBondContact O-N 3.43Å; E29-N32 PolarHBondContact O-N 2.94Å; N32-N34 VanDerWaalsContact C-N 3.34Å; N32-Y35 PolarHBondContact O-N 3.46Å; N32-V36 VanDerWaalsContact O-CG2 3.29Å; N32-V36 WeakPolarHBondContact O-CG2 3.4Å; N32-V36 PolarHBondContact O-N 3.49Å
33R79.8Confident74.9Confident164 Ų164123.1 Ų123.162%0.61959%0.593SS**Hα-helixtrans-60.5-44.1171.4-87.2-168-166.7-154.33.7112E29 Q30 Y35 V36 L37E29-R33 PolarHBondContact O-N 2.87Å; Q30-R33 PolarHBondContact O-N 3.43Å; R33-Y35 VanDerWaalsContact C-N 3.34Å; R33-V36 PolarHBondContact O-N 3.31Å; R33-L37 WeakPolarHBondContact O-CG 3.28Å; R33-L37 PolarHBondContact O-N 2.87Å
34N77.6Confident73.3Confident106 Ų106119.7 Ų119.757%0.56759%0.592SS**Hα-helixtrans-63-42.6177.8-111.8-78.1000111.6Q30 M31 N32 V36 L37 Q38Q30-N34 PolarHBondContact O-N 3.39Å; M31-N34 PolarHBondContact O-N 3.28Å; N32-N34 VanDerWaalsContact C-N 3.34Å; N34-V36 PolarHBondContact O-N 3.21Å; N34-L37 PolarHBondContact O-N 2.66Å; N34-Q38 WeakPolarHBondContact O-CB 3.43Å; N34-Q38 PolarHBondContact O-N 3.06Å
35Y78.5Confident71.5Confident155 Ų155117.2 Ų117.261%0.60860%0.597SS**Hα-helixtrans-63.8-40.5177.8-171.1-101.3000112.6M31 N32 R33 Q38 Q39M31-Y35 WeakPolarHBondContact O-CB 3.36Å; M31-Y35 PolarHBondContact O-N 2.82Å; N32-Y35 PolarHBondContact O-N 3.46Å; R33-Y35 VanDerWaalsContact C-N 3.34Å; Y35-Q38 PolarHBondContact O-N 3.02Å; Y35-Q39 WeakPolarHBondContact O-CB 3.41Å; Y35-Q39 PolarHBondContact O-N 2.93Å
36V73.9Confident69.2Low87 Ų87115.6 Ų115.653%0.52761%0.606SS.*Hα-helixtrans-68-40.2177172.50000111.6N32 R33 N34 Q38 Q39 Q40N32-V36 VanDerWaalsContact O-CG2 3.29Å; N32-V36 WeakPolarHBondContact O-CG2 3.4Å; N32-V36 PolarHBondContact O-N 3.49Å; R33-V36 PolarHBondContact O-N 3.31Å; N34-V36 PolarHBondContact O-N 3.21Å; V36-Q38 VanDerWaalsContact C-N 3.34Å; V36-Q39 PolarHBondContact O-N 3.31Å; V36-Q40 PolarHBondContact O-N 3.07Å
37L72.4Confident66.7Low108 Ų108119.2 Ų119.257%0.56563%0.625SS**Hα-helixtrans-65.3-38174.8-71.9171.4000112R33 N34 Q39 Q40 Q41R33-L37 WeakPolarHBondContact O-CG 3.28Å; R33-L37 PolarHBondContact O-N 2.87Å; N34-L37 PolarHBondContact O-N 2.66Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; L37-Q39 PolarHBondContact O-N 3.43Å; L37-Q40 PolarHBondContact O-N 3.36Å; L37-Q41 PolarHBondContact O-N 3.09Å
38Q73.8Confident64.2Low109 Ų109116.8 Ų116.851%0.50963%0.629SS.*Hα-helixtrans-63.5-38.5174-167.586.98700111.6N34 Y35 V36 Q41 Q42N34-Q38 WeakPolarHBondContact O-CB 3.43Å; N34-Q38 PolarHBondContact O-N 3.06Å; Y35-Q38 PolarHBondContact O-N 3.02Å; V36-Q38 VanDerWaalsContact C-N 3.34Å; Q38-Q41 PolarHBondContact O-N 3.38Å; Q38-Q42 PolarHBondContact O-N 2.92Å
39Q65.6Low61.8Low115 Ų115120.8 Ų120.854%0.53765%0.648SS.*Hα-helixtrans-73-35.1179.5-154.6-176.1108.600112.2Y35 V36 L37 Q41 Q42 S43Y35-Q39 WeakPolarHBondContact O-CB 3.41Å; Y35-Q39 PolarHBondContact O-N 2.93Å; V36-Q39 PolarHBondContact O-N 3.31Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; L37-Q39 PolarHBondContact O-N 3.43Å; Q39-Q41 VanDerWaalsContact C-N 3.28Å; Q39-Q41 PolarHBondContact O-N 2.91Å; Q39-Q42 PolarHBondContact O-N 3.06Å; Q39-S43 PolarHBondContact O-N 3.49Å
40Q62.6Low59.3Low137 Ų137122 Ų12264%0.6466%0.663SS**Hα-helixtrans-70.8-24.5176.1-169.8162.982.800112.7V36 L37 Q42V36-Q40 PolarHBondContact O-N 3.07Å; L37-Q40 PolarHBondContact O-N 3.36Å; Q40-Q42 VanDerWaalsContact C-N 3.35Å
41Q58Low56.8Low160 Ų160122 Ų12275%0.74868%0.675SS**Hα-helixtrans-80.1-15.7174.2-162.7156.471.700113.3L37 Q38 Q39L37-Q41 PolarHBondContact O-N 3.09Å; Q38-Q41 PolarHBondContact O-N 3.38Å; Q39-Q41 VanDerWaalsContact C-N 3.28Å; Q39-Q41 PolarHBondContact O-N 2.91Å
42Q56.4Low55.7Low158 Ų158121.5 Ų121.574%0.73868%0.681SS**Hα-helixtrans-94.9-13.8176.5-72.9178.410.800114Q38 Q39 Q40Q38-Q42 PolarHBondContact O-N 2.92Å; Q39-Q42 PolarHBondContact O-N 3.06Å; Q40-Q42 VanDerWaalsContact C-N 3.35Å
43S51.1Low53.2Low98 Ų98123 Ų12369%0.68570%0.698SS**SBendtrans-1021.9178.461.80000115Q39Q39-S43 PolarHBondContact O-N 3.49Å
44G45.3Very low51Low71 Ų71122.7 Ų122.773%0.73271%0.709SS**  trans-110.654.4-178.600000113.7
45G41.2Very low48.8Very low63 Ų63124.5 Ų124.565%0.64972%0.719SS**  trans-124.6114.9169.900000109.8
46V35.8Very low46.7Very low131 Ų131125.3 Ų125.379%0.79473%0.728SS**  trans164.4117.5138.7158.80000109.9
47L34Very low44.8Very low175 Ų175126.3 Ų126.392%0.91674%0.738SS**  trans75.4128.4165.6-54.2161.8000116.5
48G32.4Very low43Very low72 Ų72128.3 Ų128.374%0.74276%0.755SS**  cis179.4149.34.400000107.7
49Q33.3Very low40.9Very low190 Ų190127.1 Ų127.189%0.88876%0.759SS**  trans-55.9150.3173.7-73.3-174.2-900112.3
50V30.9Very low39.3Very low137 Ų137126.6 Ų126.683%0.8377%0.774SS**  174.3136.2118.9152.60000110.3
51S29.6Very low37.8Very low109 Ų109128.2 Ų128.276%0.76278%0.781SS**  trans-88.8170.4172.5-88.10000111.4
52P55.2Low36.7Very low117 Ų117129 Ų12976%0.7679%0.788SS**  trans-93.6160.7-140.237.7-35.6000114.4
53S29.4Very low35.5Very low121 Ų121125.5 Ų125.585%0.84679%0.787SS**  trans-152.3139.2159.1-70.80000110.6
54D34.7Very low34.5Very low157 Ų157131.4 Ų131.484%0.8479%0.794SS**  trans-55.1146.5171.2-57.8-76000112.5
55D30.8Very low33.8Very low145 Ų145135.7 Ų135.778%0.77580%0.795SS**  174.9167.1121.7-132.4-64.2000111.9
56H34.4Very low33.5Very low171 Ų171140.5 Ų140.579%0.79280%0.801SS**  trans-75.5152.7-156.5-61.6-66.5000118.3
57S33.7Very low33.7Very low108 Ų108139.8 Ų139.876%0.75580%0.799SS**  trans48.2113.3135.6-176.70000120.2
58V35.6Very low33.6Very low151 Ų151139.9 Ų139.992%0.91580%0.795SS**  -149.8128.3125.4-102.10000111.1
59S29.4Very low33.7Very low84 Ų84139.7 Ų139.759%0.58779%0.792SS**  trans-69.5144.7-179-168.30000112.6H61S59-H61 PolarHBondContact OG-CD2 3.25Å; S59-H61 PolarHBondContact OG-NE2 3.47Å
60A31.5Very low33.6Very low104 Ų104140.1 Ų140.186%0.8680%0.795SS**  trans-122.295.2153.600000108.2
61H32.1Very low34.1Very low170 Ų170142.3 Ų142.379%0.78780%0.796SS**  trans-77.9121.6168.6-75.6-64.7000110.4S59S59-H61 PolarHBondContact OG-CD2 3.25Å; S59-H61 PolarHBondContact OG-NE2 3.47Å
62I33.1Very low34.3Very low176 Ų176144.6 Ų144.690%0.90380%0.798SS**  trans-136.6135.6141.2-63.5-175.2000107.4
63A32.7Very low33.2Very low86 Ų86147.5 Ų147.571%0.71180%0.802SS**  trans-98.4171.9-151.300000116.2
64R29Very low33.4Very low221 Ų221148.8 Ų148.883%0.83481%0.805SS**  trans83.1132.6147.7-126.5175.5171.4158.9-0.4115.2
65Q30.4Very low33.2Very low162 Ų162147.9 Ų147.976%0.75780%0.8SS**  cis-163.5136.331.9-161.115932.800110.1
66E36.5Very low33.1Very low163 Ų163146.3 Ų146.376%0.76280%0.801SS**  trans-106.5150172.3-159.6-150.3137.200109.2Q68E66-Q68 PolarHBondContact OE1-N 2.99Å
67P39.5Very low32.9Very low117 Ų117141.2 Ų141.276%0.7679%0.794SS**  trans-120.1106.8148.429.3-14000109.9
68Q31Very low32.9Very low177 Ų177143.8 Ų143.883%0.82780%0.799SS**  53109.5104.2-76.8-169.8-30.800116E66E66-Q68 PolarHBondContact OE1-N 2.99Å
69G35.1Very low32.8Very low67 Ų67144 Ų14469%0.69179%0.79SS**  trans-82.5-177169.800000114.2
70Q31.2Very low33.1Very low200 Ų200149 Ų14994%0.93580%0.801SS**  trans-172.5134.2142.5-106.1155.8-200111.7
71E40.5Very low33.2Very low182 Ų182151.2 Ų151.285%0.8580%0.803SS**  trans-72.5153.1170.9-51.9174.8100.500110.6
72L34.3Very low33.3Very low157 Ų157146 Ų14682%0.82280%0.795SS**  trans179.6111.9151.5-94.7145.2000107.4
73Q32.1Very low33.1Very low178 Ų178143.8 Ų143.883%0.83279%0.79SS**  37.611693.2-75.9-172.721.500114.4
74T34.4Very low33.1Very low148 Ų148146.4 Ų146.491%0.90879%0.79SS**  trans-136.9110.1150.241.50000111.1
75D29.5Very low33.4Very low139 Ų139146.8 Ų146.874%0.74379%0.792SS**  trans-80.1152.6161.1-165-16.6000109.3
76S28.4Very low33.6Very low112 Ų112145.2 Ų145.278%0.78379%0.793SS**  trans31.7130.6153.8-63.20000123.5
77G30.3Very low33.3Very low64 Ų64141.1 Ų141.166%0.6680%0.795SS**  114119.7121.200000118.6
78L35.3Very low32.9Very low161 Ų161138.9 Ų138.984%0.84379%0.793SS**  49.4124.9123.2-82.6154.7000116.5
79E33.3Very low33.1Very low156 Ų156139.8 Ų139.873%0.72980%0.797SS**  cis-169.7144.938.3-53.5-164.7151.400111.3
80K34.6Very low33Very low190 Ų190140.1 Ų140.183%0.82680%0.8SS**  49.9105.3125.5-159.7-179.9-174.1-171.90120.4
81V33.4Very low33.1Very low150 Ų150134.8 Ų134.891%0.90980%0.798SS**  -140.5119.6122.4-176.80000108.2
82G33.8Very low32.6Very low60 Ų60130 Ų13062%0.61980%0.798SS**  trans-105.1168.1174.700000112.3
83V29.8Very low33Very low130 Ų130128.9 Ų128.979%0.78880%0.804SS**  trans-157.2119147162.80000109.4
84I32.7Very low32.9Very low141 Ų141124.4 Ų124.472%0.72381%0.805SS**  trans74.9100.1150.5-62.9171.4000118.4
85R35.4Very low32.7Very low228 Ų228121.1 Ų121.186%0.8680%0.8SS**  74.8127.587-109.1-158.4-92.2-156.1-3.2111.5
86V34.7Very low32.8Very low129 Ų129118.5 Ų118.578%0.78281%0.807SS**  cis-154.5126.225.4162.10000105.4
87G30.8Very low32.9Very low78 Ų78116.4 Ų116.480%0.80480%0.802SS**  92.4127.387.300000110.3
88G31.4Very low32.9Very low69 Ų69118.9 Ų118.971%0.71181%0.808SS**  cis-174.2150.7-0.300000110
89H35.3Very low32.8Very low197 Ų197118.3 Ų118.391%0.91281%0.811SS**  trans-0.1143.8152.8-56.3124.1000118.6
90G32.3Very low32.7Very low74 Ų74114.2 Ų114.276%0.76381%0.811SS**  cis118.6128.949.900000105.8
91G32Very low32.6Very low87 Ų87110.7 Ų110.790%0.89781%0.81SS**  101.6129.572.900000108.4
92G30.8Very low32.4Very low82 Ų82109.4 Ų109.485%0.84581%0.806SS**  trans156.5109168.900000116.1
93S42.1Very low32.2Very low134 Ų134109.8 Ų109.894%0.93781%0.811SS**  trans-61.2163.7170.3-67.70000115.7
94G30.9Very low32.1Very low84 Ų84113.1 Ų113.187%0.86682%0.818SS**  trans116.8133162.900000110.5
95G30.3Very low32.1Very low78 Ų78110.7 Ų110.780%0.80482%0.819SS**  cis146.6133.815.400000106.4
96G31.1Very low31.9Very low85 Ų85105.3 Ų105.388%0.87682%0.816SS**  trans76.4146.5155.300000120.6
97G30.1Very low31.9Very low67 Ų67104.9 Ų104.969%0.69182%0.819SS**  trans84.2104.3154.700000115.5
98C31.1Very low31.8Very low116 Ų116105 Ų10578%0.78482%0.819SS**  70.4140.878.483.40000115.3
99V33.6Very low31.8Very low149 Ų149105.8 Ų105.890%0.90383%0.828SS**  trans66.4137.9171.9-51.80000116.4
100G31.1Very low31.5Very low71 Ų7199.9 Ų99.973%0.73282%0.82SS**  cis157.8159.37.500000108
101S31.2Very low31.5Very low115 Ų115102.7 Ų102.780%0.80483%0.828SS**  trans79.8107.1156.9-98.50000122.4
102C29.3Very low31.4Very low123 Ų123101.9 Ų101.983%0.83182%0.82SS**  32.7146.1119.369.20000123.6
103G29.6Very low31.5Very low69 Ų69105.3 Ų105.371%0.71182%0.824SS**  trans129.592.9160.100000110.9
104E29.4Very low31.1Very low200 Ų200102.7 Ų102.794%0.93582%0.818SS**  71.6140.866.3-141.9-178.1-171.300114.5
105A32.1Very low31.2Very low90 Ų90101.4 Ų101.474%0.74481%0.805SS**  trans79.3112.6173.600000116.9
106S31.6Very low31.4Very low114 Ų114106.4 Ų106.480%0.79781%0.811SS**  95137.259.8-93.30000113.5
107S33.8Very low31.4Very low121 Ų121109 Ų10985%0.84681%0.81SS**  trans73.2116.2152.859.50000119.9
108G29.5Very low31.6Very low79 Ų79114.8 Ų114.881%0.81482%0.819SS**  120.5114.296.900000117
109G30.3Very low31.7Very low86 Ų86112.8 Ų112.889%0.88782%0.819SS**  trans74.7138.9152.800000115.5
110G29.8Very low31.5Very low73 Ų73114.7 Ų114.775%0.75382%0.818SS**  cis139.7127.818.100000107.5
111S32.4Very low31.6Very low134 Ų134117 Ų11794%0.93782%0.821SS**  trans74.7114.4164.4-65.60000120
112G29.8Very low32.1Very low70 Ų70117.5 Ų117.572%0.72282%0.822SS**  124.2120.1108.500000117.7
113V33.1Very low32.4Very low154 Ų154116.3 Ų116.393%0.93381%0.807SS**  trans95.9121151.9-178.90000116.7
114G33.3Very low33.2Very low78 Ų78120.6 Ų120.680%0.80481%0.813SS**  trans-73.6157.2-171.800000114.8
115G31.8Very low34.2Very low58 Ų58118.8 Ų118.860%0.59881%0.805SS**  trans-163.796.4172.200000108.7T117G115-T117 PolarHBondContact O-N 3.48Å
116I35.1Very low35.4Very low182 Ų182121.6 Ų121.693%0.93381%0.807SS**  trans4.2106.9150.722.8173.5000115.3
117T32.1Very low36.9Very low139 Ų139122.9 Ų122.985%0.85380%0.804SS**  trans-104.7122.8165.849.60000111.4G115G115-T117 PolarHBondContact O-N 3.48Å
118Q33.7Very low38.6Very low189 Ų189120.1 Ų120.188%0.88378%0.783SS**PPolyproline II helixtrans-46.5131.7166.3-159.716911.200111.3Q120Q118-Q120 PolarHBondContact O-N 3.26Å
119G32.3Very low41.1Very low75 Ų75121 Ų12177%0.77377%0.773SS**PPolyproline II helixtrans-55.7125.9-179.500000112.4
120Q30.7Very low43Very low188 Ų188125.8 Ų125.888%0.87977%0.766SS**PPolyproline II helixtrans-63.1136.6169-103.3139.6200111.1Q118Q118-Q120 PolarHBondContact O-N 3.26Å
121C31.9Very low45.4Very low119 Ų119127.1 Ų127.180%0.80475%0.752SS**PPolyproline II helixtrans-49.4129.7162.7-56.30000110.3N123C121-N123 PolarHBondContact O-N 3.39Å
122P42.5Very low47.7Very low127 Ų127126.5 Ų126.583%0.82574%0.735SS**  trans-72.2113.5163.4-5.721.7000108.5
123N34.8Very low50.2Low97 Ų97124.9 Ų124.952%0.51972%0.715SS.*  trans14.6116.8146.8-166-88.6000117.3C121 E125 D126C121-N123 PolarHBondContact O-N 3.39Å; N123-E125 PolarHBondContact ND2-OE2 2.87Å; N123-E125 PolarHBondContact O-N 3.23Å; N123-E125 WeakPolarHBondContact OD1-CA 3.26Å; N123-E125 VanDerWaalsContact OD1-CB 3.3Å; N123-E125 WeakPolarHBondContact OD1-CB 3.4Å; N123-E125 PolarHBondContact OD1-N 3.2Å; N123-D126 PolarHBondContact OD1-N 3.29Å
124L47Very low52.7Low160 Ų160122.2 Ų122.284%0.83869%0.69SS**THydrogen-bonded Turntrans-81.96.8176.6-151.684.7000113
125E50.7Low55.1Low162 Ų162123 Ų12376%0.75768%0.679SS**THydrogen-bonded Turntrans-108.91.7-169.9-68.9143135.600114N123N123-E125 PolarHBondContact ND2-OE2 2.87Å; N123-E125 PolarHBondContact O-N 3.23Å; N123-E125 WeakPolarHBondContact OD1-CA 3.26Å; N123-E125 VanDerWaalsContact OD1-CB 3.3Å; N123-E125 WeakPolarHBondContact OD1-CB 3.4Å; N123-E125 PolarHBondContact OD1-N 3.2Å
126D57.7Low57.2Low149 Ų149125.5 Ų125.580%0.79768%0.675SS**  trans-11234.4-178.3-129.26.4000113.1N123N123-D126 PolarHBondContact OD1-N 3.29Å
127L62.6Low59.2Low140 Ų140120.8 Ų120.873%0.73366%0.658SS**SBendtrans-92.1129.2168.4-76.5164.1000109.2T129L127-T129 PolarHBondContact O-N 3.41Å
128P70.7Confident61.1Low63 Ų63121 Ų12141%0.40965%0.65SS.*PPolyproline II helixtrans-53.6133.3177.8-21.829.4000110.1Y130 E132 A133P128-Y130 PolarHBondContact O-N 2.84Å; P128-E132 HydrophobicContact CB-CB 4.06Å; P128-A133 HydrophobicContact CB-CB 4.38Å
129T80.4Confident62.8Low98 Ų98119.6 Ų119.660%0.60164%0.637SS**PPolyproline II helixtrans-57.2146.3176.6-62.10000108.5L127 E131 E132 A133L127-T129 PolarHBondContact O-N 3.41Å; T129-E131 CarbonylContact O-C 3.53Å; T129-E131 PolarHBondContact O-N 3.37Å; T129-E132 PolarHBondContact N-OE2 2.97Å; T129-E132 WeakPolarHBondContact O-CA 3.46Å; T129-E132 WeakPolarHBondContact O-CB 3.42Å; T129-E132 PolarHBondContact O-N 3.09Å; T129-A133 PolarHBondContact O-N 3.21Å
130Y70.4Confident64.1Low187 Ų187123.1 Ų123.173%0.73363%0.632SS**Hα-helixtrans-46.6-35-177.7175.4-99.1000113.8P128 K134P128-Y130 PolarHBondContact O-N 2.84Å; Y130-K134 VanDerWaalsContact O-CB 3.29Å; Y130-K134 WeakPolarHBondContact O-CB 3.36Å; Y130-K134 PolarHBondContact O-N 3.25Å; Y130-K134 VanDerWaalsContact O-N 3.08Å
131E80.9Confident65.7Low100 Ų100124.8 Ų124.847%0.46763%0.63SS.*Hα-helixtrans-70.8-39.4173-82.6-64174.300114.1T129 K134 V135T129-E131 CarbonylContact O-C 3.53Å; T129-E131 PolarHBondContact O-N 3.37Å; E131-K134 VanDerWaalsContact CD-NZ 3.26Å; E131-K134 PolarHBondContact O-N 2.9Å; E131-K134 IonicContact OE1-NZ 2.65Å; E131-K134 PolarHBondContact OE1-NZ 3.35Å; E131-K134 IonicContact OE2-NZ 3.3Å; E131-K134 PolarHBondContact OE2-NZ 2.84Å; E131-V135 VanDerWaalsContact O-CG2 3.3Å; E131-V135 WeakPolarHBondContact O-CG2 3.44Å; E131-V135 PolarHBondContact O-N 3.32Å
132E80.3Confident66.4Low122 Ų122122.3 Ų122.357%0.5763%0.625SS**Hα-helixtrans-65.3-42173.4-79.6-176.4137.800112.2P128 T129 K134 V135 Q136P128-E132 HydrophobicContact CB-CB 4.06Å; T129-E132 PolarHBondContact N-OE2 2.97Å; T129-E132 WeakPolarHBondContact O-CA 3.46Å; T129-E132 WeakPolarHBondContact O-CB 3.42Å; T129-E132 PolarHBondContact O-N 3.09Å; E132-K134 VanDerWaalsContact C-N 3.26Å; E132-K134 PolarHBondContact O-N 3Å; E132-V135 PolarHBondContact O-N 3.37Å; E132-Q136 PolarHBondContact O-N 3.32Å
133A82.4Confident66.7Low36 Ų36123 Ų12330%0.29862%0.617SS.*Hα-helixtrans-62.9-35.3175.900000111.8P128 T129 S137P128-A133 HydrophobicContact CB-CB 4.38Å; T129-A133 PolarHBondContact O-N 3.21Å; A133-S137 WeakPolarHBondContact O-CB 3.22Å; A133-S137 PolarHBondContact O-N 2.99Å; A133-S137 PolarHBondContact O-OG 3.43Å
134K86.8Confident66.8Low98 Ų98121.7 Ų121.743%0.42663%0.626SS.*Hα-helixtrans-70.1-40.5175.7-177.5174.2134.3-126.90111.9Y130 E131 E132 S137 Q138Y130-K134 VanDerWaalsContact O-CB 3.29Å; Y130-K134 WeakPolarHBondContact O-CB 3.36Å; Y130-K134 PolarHBondContact O-N 3.25Å; Y130-K134 VanDerWaalsContact O-N 3.08Å; E131-K134 VanDerWaalsContact CD-NZ 3.26Å; E131-K134 PolarHBondContact O-N 2.9Å; E131-K134 IonicContact OE1-NZ 2.65Å; E131-K134 PolarHBondContact OE1-NZ 3.35Å; E131-K134 IonicContact OE2-NZ 3.3Å; E131-K134 PolarHBondContact OE2-NZ 2.84Å; E132-K134 VanDerWaalsContact C-N 3.26Å; E132-K134 PolarHBondContact O-N 3Å; K134-S137 PolarHBondContact O-N 3.35Å; K134-Q138 WeakPolarHBondContact O-CB 3.44Å; K134-Q138 PolarHBondContact O-N 2.91Å
135V83.1Confident66.3Low93 Ų93119.4 Ų119.456%0.56462%0.624SS**Hα-helixtrans-64.2-44.5174.2171.80000110.9E131 E132 S137 Q138 Y139E131-V135 VanDerWaalsContact O-CG2 3.3Å; E131-V135 WeakPolarHBondContact O-CG2 3.44Å; E131-V135 PolarHBondContact O-N 3.32Å; E132-V135 PolarHBondContact O-N 3.37Å; V135-S137 PolarHBondContact O-N 2.88Å; V135-Q138 PolarHBondContact O-N 3.48Å; V135-Y139 PolarHBondContact O-N 3.03Å
136Q74.4Confident65.9Low112 Ų112117.4 Ų117.452%0.52363%0.625SS.*Hα-helixtrans-60-45.4173.4-87.6-176.7-20.200111.8E132 Q138 Y139 F140E132-Q136 PolarHBondContact O-N 3.32Å; Q136-Q138 PolarHBondContact O-N 3.36Å; Q136-Y139 WeakPolarHBondContact O-CB 3.49Å; Q136-Y139 PolarHBondContact O-N 3.09Å; Q136-Y139 VanDerWaalsContact O-N 3.17Å; Q136-F140 VanDerWaalsContact O-CD2 3.3Å; Q136-F140 WeakPolarHBondContact O-CD2 3.47Å; Q136-F140 PolarHBondContact O-N 2.83Å
137S77.9Confident65.2Low82 Ų82116.5 Ų116.557%0.57363%0.627SS**Hα-helixtrans-63.4-30.1177.9-64.20000113A133 K134 V135 R141A133-S137 WeakPolarHBondContact O-CB 3.22Å; A133-S137 PolarHBondContact O-N 2.99Å; A133-S137 PolarHBondContact O-OG 3.43Å; K134-S137 PolarHBondContact O-N 3.35Å; V135-S137 PolarHBondContact O-N 2.88Å; S137-R141 PolarHBondContact O-N 3.16Å
138Q71.6Confident63.9Low144 Ų144119.7 Ų119.767%0.67364%0.638SS**Hα-helixtrans-77.4-33.3176.2-160.3170.853.400112.1K134 V135 Q136 R141K134-Q138 WeakPolarHBondContact O-CB 3.44Å; K134-Q138 PolarHBondContact O-N 2.91Å; V135-Q138 PolarHBondContact O-N 3.48Å; Q136-Q138 PolarHBondContact O-N 3.36Å; Q138-R141 PolarHBondContact O-N 2.83Å
139Y70.1Confident62.2Low159 Ų159120.3 Ų120.362%0.62466%0.656SS**Hα-helixtrans-65.4-41.5175.8-171.4-96.6000112.4V135 Q136 R141V135-Y139 PolarHBondContact O-N 3.03Å; Q136-Y139 WeakPolarHBondContact O-CB 3.49Å; Q136-Y139 PolarHBondContact O-N 3.09Å; Q136-Y139 VanDerWaalsContact O-N 3.17Å; Y139-R141 PolarHBondContact O-N 2.89Å
140F60.2Low59.9Low149 Ų149125.1 Ų125.165%0.65467%0.672SS**Hα-helixtrans-77.1-19.1179.6-77.9-78.3000114.4Q136 G142Q136-F140 VanDerWaalsContact O-CD2 3.3Å; Q136-F140 WeakPolarHBondContact O-CD2 3.47Å; Q136-F140 PolarHBondContact O-N 2.83Å; F140-G142 PolarHBondContact O-N 2.65Å
141R63.4Low58.3Low223 Ų223120.6 Ų120.684%0.84267%0.673SS**THydrogen-bonded Turntrans-68.7-20177-172.1179-73.2-110.91.5113.1S137 Q138 Y139S137-R141 PolarHBondContact O-N 3.16Å; Q138-R141 PolarHBondContact O-N 2.83Å; Y139-R141 PolarHBondContact O-N 2.89Å
142G47.5Very low56Low68 Ų68125.4 Ų125.470%0.70170%0.696SS**THydrogen-bonded Turntrans-86.5-14.1-17900000115.6F140 G144F140-G142 PolarHBondContact O-N 2.65Å; G142-G144 PolarHBondContact O-N 3.18Å
143H47.8Very low53.6Low141 Ų141127.9 Ų127.965%0.65371%0.707SS**  trans-95.471.7179.6-76.7-74.8000111
144G36.8Very low51.9Low70 Ų70131.1 Ų131.172%0.72273%0.725SS**PPolyproline II helixtrans-73.2128.3161.700000110.2G142G142-G144 PolarHBondContact O-N 3.18Å
145S37.8Very low49.2Very low112 Ų112131.1 Ų131.178%0.78374%0.737SS**PPolyproline II helixtrans-54.5146.5173.67.50000112.5
146P41.3Very low46.9Very low119 Ų119134.7 Ų134.777%0.77375%0.753SS**PPolyproline II helixtrans-74146.4171.830.2-31.3000110.7
147P43.3Very low45.9Very low131 Ų131134.9 Ų134.985%0.85176%0.763SS**PPolyproline II helixtrans-76.6130.9173.229.6-29.9000110.7
148Q35.8Very low43.8Very low206 Ų206135.5 Ų135.596%0.96377%0.774SS**PPolyproline II helixtrans-78.6133.9162.2-88.7-178.6-3000109.9
149G33.4Very low41.9Very low77 Ų77133.8 Ų133.879%0.79478%0.777SS**  trans-170.7116.3167.300000111.1
150Q33.2Very low40.2Very low199 Ų199134.5 Ų134.593%0.9379%0.791SS**  trans-74.5146.1-178.8-69.3165.9-34.800112.9
151A35.4Very low38.8Very low92 Ų92130.9 Ų130.976%0.7680%0.796SS**  155.9128.9113.400000115
152Q32.5Very low37.4Very low200 Ų200125 Ų12594%0.93580%0.795SS**  trans61.7131.3145.9-81.1167.35.400124.6
153Q30.1Very low36.6Very low175 Ų175126 Ų12682%0.81880%0.796SS**  trans-70.2-179.6172.4-78.7-100.74.800114.2
154P48.6Very low35.7Very low104 Ų104127.9 Ų127.968%0.67580%0.803SS**  cis-139.31734.627.9-2.9000118.7
155S29.8Very low35.7Very low97 Ų97135.5 Ų135.568%0.67881%0.812SS**  trans84.8118.8139.461.80000125.3
156L33.2Very low35.5Very low168 Ų168136.3 Ų136.388%0.8881%0.811SS**  trans89.9154.8134.8-68.7174.6000122.7
157P55Low35Very low116 Ų116137 Ų13775%0.75381%0.814SS**  trans-121165.3-136.843.3-31.7000116.8
158A33.1Very low34.6Very low95 Ų95133.4 Ų133.479%0.78580%0.8SS**  trans-169.3126.2157.100000108.2
159S30.8Very low34.5Very low108 Ų108131.1 Ų131.176%0.75579%0.794SS**  cis70.8128.448.8-152.40000115.1
160L34.8Very low34.5Very low175 Ų175133.1 Ų133.192%0.91679%0.791SS**  trans80.6136.3170.8-56.9152.9000116.1
161G31.3Very low34.3Very low73 Ų73128.7 Ų128.775%0.75378%0.782SS**  cis-173.71638.100000111.1
162A34Very low34.1Very low99 Ų99130.8 Ų130.882%0.81879%0.785SS**  trans-80.3156.7-175.900000114.3
163A30.3Very low34.6Very low88 Ų88131.2 Ų131.273%0.72778%0.784SS**  trans176.9102139.600000108.5
164F30.2Very low35.2Very low181 Ų181129.4 Ų129.479%0.79479%0.785SS**  40.898.786.1-86.8-86000115.2
165Y35.3Very low34.6Very low230 Ų230134 Ų13490%0.90279%0.789SS**  -143.6116.7129.6-84.9-75.7000109.5
166V33.4Very low35Very low129 Ų129134.4 Ų134.478%0.78279%0.788SS**  trans-96.4127.8159.5155.30000106
167T32.4Very low35.1Very low134 Ų134134 Ų13482%0.82278%0.781SS**  trans-148.6124.4157.4-680000107.3
168G34.2Very low34.1Very low55 Ų55132 Ų13257%0.56778%0.782SS**  trans-98.9-178.2-178.700000113.7
169L32.6Very low34.3Very low158 Ų158137.7 Ų137.783%0.82778%0.783SS**  trans89.9123.1153.4-70.8131.3000120.1
170T34Very low34.8Very low119 Ų119138.7 Ų138.773%0.7379%0.787SS**  trans86.3108.3138.757.20000120.6
171S30.3Very low35.2Very low107 Ų107134.8 Ų134.875%0.74877%0.771SS**  34126.4129.5-54.50000119.7
172T31.3Very low35.6Very low135 Ų135139.4 Ų139.483%0.82878%0.777SS**  166.7144.7105.538.90000110.7
173K42.7Very low35.5Very low209 Ų209143 Ų14391%0.90978%0.777SS**  trans-58.9132.6172.2-75.9178.7169.2-177.80110.3
174V41.8Very low35.8Very low138 Ų138149.2 Ų149.284%0.83678%0.782SS**  trans-128.8116.9155.2-175.10000108.3
175R36.8Very low36Very low199 Ų199147 Ų14775%0.75178%0.783SS**  trans-76.1151165.3175.2-173.9171103.23.3108.1E177R175-E177 IonicContact NH2-OE1 2.87Å
176T37.2Very low36.3Very low107 Ų107141 Ų14166%0.65677%0.774SS**  trans148101135.8-66.80000110
177E35.2Very low36.3Very low158 Ų158137.8 Ų137.874%0.73877%0.768SS**  103134.590.1-75.3-177.8-165.100112.8R175R175-E177 IonicContact NH2-OE1 2.87Å
178G33.3Very low37Very low75 Ų75138.9 Ų138.977%0.77377%0.774SS**  trans174.268.4-177.900000110.1
179R38.9Very low37.2Very low214 Ų214139 Ų13981%0.80878%0.775SS**  trans-71.5152.1170.7-134-171.7-171.4-172.14.1109.2
180P40.3Very low38.1Very low129 Ų129141.5 Ų141.584%0.83878%0.779SS**  -123.3141.7120.329.1-18.6000112.1
181T43.6Very low39Very low94 Ų94142.5 Ų142.558%0.57779%0.785SS**  trans-69.5130-173.5-56.80000112.3
182L39Very low40.3Very low169 Ų169142.3 Ų142.389%0.88577%0.772SS**  trans-145.4104.3138-80.3-174000110.9
183Q33.3Very low41.6Very low174 Ų174145 Ų14581%0.81378%0.775SS**  trans35104.5141.5-137.1159.124.900119.8
184R37.2Very low42.4Very low220 Ų220138.9 Ų138.983%0.8375%0.752SS**  trans-72.7118.1159.1-176.3-166.4-69.4-177-3.4108.6
185V33.7Very low43.8Very low134 Ų134136.1 Ų136.181%0.81273%0.733SS**  trans-96.7116.2147.5157.40000106.5G187V185-G187 PolarHBondContact O-N 3.39Å
186S40.5Very low45.5Very low103 Ų103129 Ų12972%0.7272%0.721SS**  trans-74.1111.5169.2-670000108.3
187G33.3Very low47Very low63 Ų63128.5 Ų128.565%0.64971%0.714SS**  trans-131.9121.8163.100000107.5V185 G189V185-G187 PolarHBondContact O-N 3.39Å; G187-G189 PolarHBondContact O-N 3.02Å
188T47.7Very low48.9Very low156 Ų156125.8 Ų125.896%0.95770%0.7SS**  trans-51.5119.5175.647.30000111.5
189G37.9Very low50.9Low57 Ų57127 Ų12759%0.58869%0.688SS**  trans-174.2109.3173.500000111.9G187 V191G187-G189 PolarHBondContact O-N 3.02Å; G189-V191 PolarHBondContact O-N 3.01Å
190K53.3Low52.9Low211 Ų211122.6 Ų122.692%0.91768%0.68SS**  trans-63.487.1159.7-77.5-173.4175.7179.90107.9H192K190-H192 PolarHBondContact O-N 3.43Å
191V52Low55Low140 Ų140123.3 Ų123.385%0.84867%0.67SS**  trans-79.7113.3168.3-84.30000108.6G189 Q193G189-V191 PolarHBondContact O-N 3.01Å; V191-Q193 PolarHBondContact O-N 2.99Å
192H58Low56.8Low104 Ų104123.5 Ų123.548%0.48167%0.665SS.*  trans-49.4109.7-175-106.955.4000112.6K190 D194 D195K190-H192 PolarHBondContact O-N 3.43Å; H192-D194 PolarHBondContact O-N 3.04Å; H192-D195 HydrophobicContact CB-CB 3.88Å; H192-D195 WeakPolarHBondContact CB-OD2 3.46Å; H192-D195 IonicContact CD2-OD1 3.81Å; H192-D195 PolarHBondContact CD2-OD1 3.43Å; H192-D195 IonicContact CD2-OD2 2.88Å; H192-D195 IonicContact CG-OD1 3.16Å; H192-D195 IonicContact CG-OD2 3.28Å; H192-D195 PolarHBondContact O-N 2.96Å
193Q58.7Low59.2Low190 Ų190116.9 Ų116.989%0.88864%0.637SS**Hα-helixtrans-60.1-21.7157.9-81.8-170.330.900111.7V191 D195V191-Q193 PolarHBondContact O-N 2.99Å; Q193-D195 VanDerWaalsContact C-N 3.32Å
194D59.5Low62Low81 Ų81115.3 Ų115.343%0.43363%0.63SS.*Hα-helixtrans-71.9-25.6179.4-153.2-109.2000112.4H192 L197 K198H192-D194 PolarHBondContact O-N 3.04Å; D194-L197 PolarHBondContact O-N 3.39Å; D194-K198 WeakPolarHBondContact O-CB 3.47Å; D194-K198 WeakPolarHBondContact O-CD 3.41Å; D194-K198 VanDerWaalsContact O-CG 3.26Å; D194-K198 WeakPolarHBondContact O-CG 3.4Å; D194-K198 PolarHBondContact O-N 2.9Å; D194-K198 WeakPolarHBondContact OD1-CE 3.47Å; D194-K198 IonicContact OD1-NZ 3.56Å; D194-K198 PolarHBondContact OD1-NZ 3.5Å
195D70Confident64.6Low81 Ų81109.6 Ų109.643%0.43362%0.619SS.*Hα-helixtrans-71.2-40.1178.9-75.1-20.8000111.6H192 Q193 L197 K198 D199H192-D195 HydrophobicContact CB-CB 3.88Å; H192-D195 WeakPolarHBondContact CB-OD2 3.46Å; H192-D195 IonicContact CD2-OD1 3.81Å; H192-D195 PolarHBondContact CD2-OD1 3.43Å; H192-D195 IonicContact CD2-OD2 2.88Å; H192-D195 IonicContact CG-OD1 3.16Å; H192-D195 IonicContact CG-OD2 3.28Å; H192-D195 PolarHBondContact O-N 2.96Å; Q193-D195 VanDerWaalsContact C-N 3.32Å; D195-L197 VanDerWaalsContact C-N 3.26Å; D195-L197 PolarHBondContact O-N 3.43Å; D195-K198 PolarHBondContact O-N 2.91Å; D195-D199 WeakPolarHBondContact O-CB 3.46Å; D195-D199 PolarHBondContact O-N 3.37Å
196G72.8Confident67.2Low48 Ų48110 Ų11050%0.49561%0.606SS.*Hα-helixtrans-63.9-31.9174.300000113.1L200G196-L200 WeakPolarHBondContact O-CB 3.49Å; G196-L200 PolarHBondContact O-N 2.92Å; G196-L200 VanDerWaalsContact O-N 3.08Å
197L69.9Low69.7Low97 Ų97108.3 Ų108.351%0.50859%0.594SS.*Hα-helixtrans-76.5-37.5176.9-147.782.5000111.8D194 D195 K201D194-L197 PolarHBondContact O-N 3.39Å; D195-L197 VanDerWaalsContact C-N 3.26Å; D195-L197 PolarHBondContact O-N 3.43Å; L197-K201 WeakPolarHBondContact O-CB 3.49Å; L197-K201 WeakPolarHBondContact O-CG 3.43Å; L197-K201 PolarHBondContact O-N 3.39Å
198K73.3Confident72.6Confident102 Ų102109.9 Ų109.944%0.44359%0.587SS.*Hα-helixtrans-65-43.1172.4-76.6165.1168.3155.10111.3D194 D195 L200 K201 Q202D194-K198 WeakPolarHBondContact O-CB 3.47Å; D194-K198 WeakPolarHBondContact O-CD 3.41Å; D194-K198 VanDerWaalsContact O-CG 3.26Å; D194-K198 WeakPolarHBondContact O-CG 3.4Å; D194-K198 PolarHBondContact O-N 2.9Å; D194-K198 WeakPolarHBondContact OD1-CE 3.47Å; D194-K198 IonicContact OD1-NZ 3.56Å; D194-K198 PolarHBondContact OD1-NZ 3.5Å; D195-K198 PolarHBondContact O-N 2.91Å; K198-L200 PolarHBondContact O-N 3.47Å; K198-K201 PolarHBondContact O-N 3.01Å; K198-Q202 WeakPolarHBondContact O-CB 3.42Å; K198-Q202 PolarHBondContact O-N 2.94Å
199D76.3Confident74.8Confident99 Ų99105.7 Ų105.753%0.52956%0.564SS.*Hα-helixtrans-65.3-37.9176.5-80.6-10.1000112.2D195 G203D195-D199 WeakPolarHBondContact O-CB 3.46Å; D195-D199 PolarHBondContact O-N 3.37Å; D199-G203 WeakPolarHBondContact O-CA 3.36Å; D199-G203 PolarHBondContact O-N 3.16Å
200L81.6Confident77.4Confident122 Ų122107.7 Ų107.764%0.63956%0.558SS**Hα-helixtrans-69.5-43.2175.8-174.162.3000111.8G196 K198 G203 H204G196-L200 WeakPolarHBondContact O-CB 3.49Å; G196-L200 PolarHBondContact O-N 2.92Å; G196-L200 VanDerWaalsContact O-N 3.08Å; K198-L200 PolarHBondContact O-N 3.47Å; L200-G203 PolarHBondContact O-N 3.45Å; L200-H204 PolarHBondContact O-N 3.29Å
201K83.6Confident79.3Confident144 Ų144105.5 Ų105.563%0.62654%0.544SS*.Hα-helixtrans-63.7-41.9174-75.7-179.8177.5-175.80111.2L197 K198 G203 H204 V205L197-K201 WeakPolarHBondContact O-CB 3.49Å; L197-K201 WeakPolarHBondContact O-CG 3.43Å; L197-K201 PolarHBondContact O-N 3.39Å; K198-K201 PolarHBondContact O-N 3.01Å; K201-G203 VanDerWaalsContact C-N 3.35Å; K201-H204 PolarHBondContact O-N 2.93Å; K201-V205 WeakPolarHBondContact O-CG2 3.49Å; K201-V205 PolarHBondContact O-N 3.33Å
202Q81.4Confident81.2Confident98 Ų98103.2 Ų103.246%0.45853%0.527SS..Hα-helixtrans-68.6-34.4176.3-166.2169.137.500111.8K198 V205 R206K198-Q202 WeakPolarHBondContact O-CB 3.42Å; K198-Q202 PolarHBondContact O-N 2.94Å; Q202-V205 PolarHBondContact O-N 3.37Å; Q202-R206 VanDerWaalsContact O-CB 3.31Å; Q202-R206 WeakPolarHBondContact O-CB 3.31Å; Q202-R206 WeakPolarHBondContact O-CG 3.42Å; Q202-R206 PolarHBondContact O-N 3.48Å
203G90.1Very high82.9Confident30 Ų30103.6 Ų103.631%0.30953%0.53SS..Hα-helixtrans-63.9-40.4170.800000112.1D199 L200 K201 R206 S207D199-G203 WeakPolarHBondContact O-CA 3.36Å; D199-G203 PolarHBondContact O-N 3.16Å; L200-G203 PolarHBondContact O-N 3.45Å; K201-G203 VanDerWaalsContact C-N 3.35Å; G203-R206 PolarHBondContact O-N 3.4Å; G203-S207 VanDerWaalsContact O-CB 3.23Å; G203-S207 WeakPolarHBondContact O-CB 3.45Å; G203-S207 PolarHBondContact O-N 3.18Å
204H90.8Very high84.5Confident142 Ų14299.6 Ų99.666%0.65751%0.511SS*.Hα-helixtrans-66.6-43.2174.7-13170.8000112L200 K201 S207 L208L200-H204 PolarHBondContact O-N 3.29Å; K201-H204 PolarHBondContact O-N 2.93Å; H204-S207 PolarHBondContact O-N 2.89Å; H204-L208 WeakPolarHBondContact O-CB 3.49Å; H204-L208 PolarHBondContact O-N 3.43Å
205V91.4Very high85.9Confident100 Ų100100.3 Ų100.361%0.60651%0.514SS*.Hα-helixtrans-63.6-44175173.10000111K201 Q202 L208 S209K201-V205 WeakPolarHBondContact O-CG2 3.49Å; K201-V205 PolarHBondContact O-N 3.33Å; Q202-V205 PolarHBondContact O-N 3.37Å; V205-L208 PolarHBondContact O-N 3.36Å; V205-S209 WeakPolarHBondContact O-CB 3.37Å; V205-S209 PolarHBondContact O-N 3.01Å
206R88.8Confident86.8Confident143 Ų14399.5 Ų99.554%0.5452%0.515SS..Hα-helixtrans-63.3-46.3175.7-80.7-166.1-88.5-131.1-1.9112.4Q202 G203 L208 S209 E210Q202-R206 VanDerWaalsContact O-CB 3.31Å; Q202-R206 WeakPolarHBondContact O-CB 3.31Å; Q202-R206 WeakPolarHBondContact O-CG 3.42Å; Q202-R206 PolarHBondContact O-N 3.48Å; G203-R206 PolarHBondContact O-N 3.4Å; R206-L208 VanDerWaalsContact C-N 3.35Å; R206-L208 PolarHBondContact O-N 2.97Å; R206-S209 PolarHBondContact O-N 3.36Å; R206-S209 PolarHBondContact O-OG 2.95Å; R206-S209 VanDerWaalsContact O-OG 3.07Å; R206-E210 WeakPolarHBondContact O-CB 3.42Å; R206-E210 PolarHBondContact O-N 3.49Å
207S94.1Very high87.2Confident66 Ų66103.3 Ų103.346%0.46252%0.523SS..Hα-helixtrans-66.8-37.1178.5-177.10000112.1G203 H204 E210 R211G203-S207 VanDerWaalsContact O-CB 3.23Å; G203-S207 WeakPolarHBondContact O-CB 3.45Å; G203-S207 PolarHBondContact O-N 3.18Å; H204-S207 PolarHBondContact O-N 2.89Å; S207-E210 PolarHBondContact O-N 3.4Å; S207-R211 WeakPolarHBondContact O-CB 3.44Å; S207-R211 PolarHBondContact O-N 3.43Å
208L93.9Very high87.3Confident96 Ų96102.6 Ų102.650%0.50353%0.532SS..Hα-helixtrans-68.1-44.1174.5-178.463.6000111.3H204 V205 R206 E210 R211 L212H204-L208 WeakPolarHBondContact O-CB 3.49Å; H204-L208 PolarHBondContact O-N 3.43Å; V205-L208 PolarHBondContact O-N 3.36Å; R206-L208 VanDerWaalsContact C-N 3.35Å; R206-L208 PolarHBondContact O-N 2.97Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 2.96Å; L208-R211 PolarHBondContact O-N 3.07Å; L208-L212 HydrophobicContact CD1-CD1 4.28Å; L208-L212 HydrophobicContact CD1-CG 4.38Å; L208-L212 HydrophobicContact CG-CD1 4.03Å; L208-L212 WeakPolarHBondContact O-CB 3.37Å; L208-L212 WeakPolarHBondContact O-CG 3.27Å; L208-L212 PolarHBondContact O-N 2.88Å
209S92.4Very high87.1Confident68 Ų68103.1 Ų103.148%0.47654%0.543SS..Hα-helixtrans-63.5-38.6176.483.30000111V205 R206 L212 M213V205-S209 WeakPolarHBondContact O-CB 3.37Å; V205-S209 PolarHBondContact O-N 3.01Å; R206-S209 PolarHBondContact O-N 3.36Å; R206-S209 PolarHBondContact O-OG 2.95Å; R206-S209 VanDerWaalsContact O-OG 3.07Å; S209-L212 PolarHBondContact O-N 3.42Å; S209-M213 VanDerWaalsContact O-CB 3.23Å; S209-M213 WeakPolarHBondContact O-CB 3.36Å; S209-M213 PolarHBondContact O-N 3.15Å
210E93.9Very high86.2Confident100 Ų100102.8 Ų102.847%0.46755%0.549SS..Hα-helixtrans-63.3-47.4175.3-168.1-171.1168.500111.6R206 S207 L208 L212 M213 Q214R206-E210 WeakPolarHBondContact O-CB 3.42Å; R206-E210 PolarHBondContact O-N 3.49Å; S207-E210 PolarHBondContact O-N 3.4Å; L208-E210 VanDerWaalsContact C-N 3.29Å; L208-E210 PolarHBondContact O-N 2.96Å; E210-L212 PolarHBondContact O-N 3.3Å; E210-M213 PolarHBondContact O-N 3.37Å; E210-Q214 WeakPolarHBondContact O-CB 3.29Å; E210-Q214 VanDerWaalsContact O-CG 3.26Å; E210-Q214 WeakPolarHBondContact O-CG 3.4Å; E210-Q214 PolarHBondContact O-N 3.29Å; E210-Q214 PolarHBondContact OE1-NE2 3.33Å
211R92.9Very high84.8Confident164 Ų164100 Ų10062%0.61955%0.55SS*.Hα-helixtrans-62.5-41.9176.2178.6-177.9-71.7-98.6-1112.1S207 L208 Q214 L215S207-R211 WeakPolarHBondContact O-CB 3.44Å; S207-R211 PolarHBondContact O-N 3.43Å; L208-R211 PolarHBondContact O-N 3.07Å; R211-Q214 PolarHBondContact O-N 3.3Å; R211-L215 HydrophobicContact CG-CD1 4.07Å; R211-L215 WeakPolarHBondContact O-CB 3.27Å; R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 3.49Å
212L92.4Very high83.2Confident93 Ų93100 Ų10049%0.48756%0.561SS.*Hα-helixtrans-65.2-43176.4-76.4170.3000110.8L208 S209 E210 Q214 L215 S216L208-L212 HydrophobicContact CD1-CD1 4.28Å; L208-L212 HydrophobicContact CD1-CG 4.38Å; L208-L212 HydrophobicContact CG-CD1 4.03Å; L208-L212 WeakPolarHBondContact O-CB 3.37Å; L208-L212 WeakPolarHBondContact O-CG 3.27Å; L208-L212 PolarHBondContact O-N 2.88Å; S209-L212 PolarHBondContact O-N 3.42Å; E210-L212 PolarHBondContact O-N 3.3Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 3.06Å; L212-L215 PolarHBondContact O-N 3.49Å; L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 2.87Å; L212-S216 PolarHBondContact O-OG 3.46Å
213M92.1Very high81.9Confident112 Ų112104.8 Ų104.855%0.55258%0.581SS**Hα-helixtrans-60.2-43.6173.3-177.6175.569.400111.4S209 E210 S216 L217S209-M213 VanDerWaalsContact O-CB 3.23Å; S209-M213 WeakPolarHBondContact O-CB 3.36Å; S209-M213 PolarHBondContact O-N 3.15Å; E210-M213 PolarHBondContact O-N 3.37Å; M213-S216 PolarHBondContact O-N 2.86Å; M213-L217 HydrophobicContact CG-CD1 4.2Å; M213-L217 WeakPolarHBondContact O-CB 3.33Å; M213-L217 VanDerWaalsContact O-CG 3.26Å; M213-L217 WeakPolarHBondContact O-CG 3.46Å; M213-L217 PolarHBondContact O-N 3.05Å
214Q92.9Very high79.5Confident105 Ų105107.9 Ų107.949%0.49160%0.603SS.*Hα-helixtrans-61.8-43.5174.8-72.1172.721.900112E210 R211 L212 L217 A218E210-Q214 WeakPolarHBondContact O-CB 3.29Å; E210-Q214 VanDerWaalsContact O-CG 3.26Å; E210-Q214 WeakPolarHBondContact O-CG 3.4Å; E210-Q214 PolarHBondContact O-N 3.29Å; E210-Q214 PolarHBondContact OE1-NE2 3.33Å; R211-Q214 PolarHBondContact O-N 3.3Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 3.06Å; Q214-L217 PolarHBondContact O-N 3.24Å; Q214-A218 VanDerWaalsContact O-CB 3.26Å; Q214-A218 WeakPolarHBondContact O-CB 3.44Å; Q214-A218 PolarHBondContact O-N 3.15Å
215L89.8Confident76.8Confident96 Ų96109.7 Ų109.750%0.50361%0.612SS.*Hα-helixtrans-65.4-40175-79.4163.1000111.9R211 L212 A218 T219R211-L215 HydrophobicContact CG-CD1 4.07Å; R211-L215 WeakPolarHBondContact O-CB 3.27Å; R211-L215 WeakPolarHBondContact O-CG 3.48Å; R211-L215 PolarHBondContact O-N 3.49Å; L212-L215 PolarHBondContact O-N 3.49Å; L215-A218 PolarHBondContact O-N 2.95Å; L215-T219 WeakPolarHBondContact O-CB 3.4Å; L215-T219 WeakPolarHBondContact O-CG2 3.41Å; L215-T219 PolarHBondContact O-N 2.66Å; L215-T219 PolarHBondContact O-OG1 3.43Å
216S87.6Confident74.1Confident64 Ų64109 Ų10945%0.44862%0.616SS.*Hα-helixtrans-65.1-41.7175.5-67.90000111L212 M213 T219 S220L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 2.87Å; L212-S216 PolarHBondContact O-OG 3.46Å; M213-S216 PolarHBondContact O-N 2.86Å; S216-T219 PolarHBondContact O-N 3Å; S216-T219 PolarHBondContact O-OG1 3.18Å; S216-S220 WeakPolarHBondContact O-CA 3.42Å; S216-S220 WeakPolarHBondContact O-CB 3.47Å; S216-S220 PolarHBondContact O-N 2.99Å; S216-S220 PolarHBondContact O-OG 2.92Å
217L81.8Confident71.9Confident128 Ų128108.5 Ų108.567%0.6763%0.632SS**Hα-helixtrans-67.9-35.3173.7-68.7171.9000112.3M213 Q214 T219M213-L217 HydrophobicContact CG-CD1 4.2Å; M213-L217 WeakPolarHBondContact O-CB 3.33Å; M213-L217 VanDerWaalsContact O-CG 3.26Å; M213-L217 WeakPolarHBondContact O-CG 3.46Å; M213-L217 PolarHBondContact O-N 3.05Å; Q214-L217 PolarHBondContact O-N 3.24Å; L217-T219 VanDerWaalsContact C-N 3.32Å; L217-T219 PolarHBondContact O-N 3.47Å
218A71.4Confident69.2Low83 Ų83113.6 Ų113.669%0.68665%0.652SS**Hα-helixtrans-72.9-21.8177.900000113.7Q214 L215Q214-A218 VanDerWaalsContact O-CB 3.26Å; Q214-A218 WeakPolarHBondContact O-CB 3.44Å; Q214-A218 PolarHBondContact O-N 3.15Å; L215-A218 PolarHBondContact O-N 2.95Å
219T68.9Low66.2Low112 Ų112114.5 Ų114.569%0.68767%0.667SS**Hα-helixtrans-108.7-20.5179.955.50000113.1L215 S216 L217 G221L215-T219 WeakPolarHBondContact O-CB 3.4Å; L215-T219 WeakPolarHBondContact O-CG2 3.41Å; L215-T219 PolarHBondContact O-N 2.66Å; L215-T219 PolarHBondContact O-OG1 3.43Å; S216-T219 PolarHBondContact O-N 3Å; S216-T219 PolarHBondContact O-OG1 3.18Å; L217-T219 VanDerWaalsContact C-N 3.32Å; L217-T219 PolarHBondContact O-N 3.47Å; T219-G221 PolarHBondContact O-N 3.35Å
220S58.6Low63.3Low92 Ų92116.1 Ų116.164%0.64368%0.678SS**  trans-85.364.4171.3-52.70000109.7S216S216-S220 WeakPolarHBondContact O-CA 3.42Å; S216-S220 WeakPolarHBondContact O-CB 3.47Å; S216-S220 PolarHBondContact O-N 2.99Å; S216-S220 PolarHBondContact O-OG 2.92Å
221G52.8Low60.4Low64 Ų64117.7 Ų117.766%0.6669%0.694SS**  trans-111.786.7168.900000110.3T219 K223T219-G221 PolarHBondContact O-N 3.35Å; G221-K223 PolarHBondContact O-N 2.94Å
222V48.6Very low58.3Low143 Ų143114.9 Ų114.987%0.86770%0.697SS**  trans-62.8114.7152.2165.10000106.6A224V222-A224 PolarHBondContact O-N 2.7Å
223K55.2Low55.4Low199 Ų199118 Ų11887%0.86571%0.713SS**SBendtrans891166.1-164.9170.7-175.5177.40115.5G221G221-K223 PolarHBondContact O-N 2.94Å
224A38.4Very low52.7Low95 Ų95117.9 Ų117.979%0.78572%0.724SS**  trans-127.7130.7161.900000109.5V222V222-A224 PolarHBondContact O-N 2.7Å
225H34.3Very low50.4Low181 Ų181118.3 Ų118.384%0.83874%0.736SS**PPolyproline II helixtrans-49.4145.3-177.1-88.7-106.5000114.2
226A36Very low47.6Very low84 Ų84123.1 Ų123.169%0.69476%0.756SS**PPolyproline II helixtrans-62.8137.216400000110.7I228A226-I228 PolarHBondContact O-N 3.43Å
227P42.2Very low45Very low133 Ų133127.9 Ų127.986%0.86478%0.775SS**PPolyproline II helixtrans-74.2124172.727.2-29.2000110.9
228I37Very low43.6Very low173 Ų173127 Ų12789%0.88778%0.777SS**PPolyproline II helixtrans-80.8134.5172.742.1163.7000111.5A226A226-I228 PolarHBondContact O-N 3.43Å
229S30.3Very low42.5Very low116 Ų116128.6 Ų128.681%0.81178%0.78SS**  trans-168.4120.8152.3-172.30000105.8
230S31.5Very low40.6Very low102 Ų102128 Ų12871%0.71378%0.781SS**  cis-160.1130.75.246.80000109
231T34.5Very low38.9Very low132 Ų132128.9 Ų128.981%0.8179%0.786SS**  trans-0.7169.8151.337.20000123.3
232P48.1Very low38Very low105 Ų105134.5 Ų134.568%0.68280%0.795SS**  cis-142.2166.4-25.734.8-15.1000115.7
233L31Very low37.6Very low158 Ų158133 Ų13383%0.82779%0.789SS**  171.4112.7121.8-89.8159.2000114.3
234S35.8Very low36.6Very low111 Ų111126.6 Ų126.678%0.77678%0.778SS**  trans75.8149.6142.4-76.40000124.3
235P44.3Very low36.2Very low113 Ų113130.2 Ų130.273%0.73479%0.785SS**  trans-125.9162.5-140.340.2-24.5000115.4
236Q31.7Very low36.3Very low198 Ų198131.4 Ų131.493%0.92578%0.783SS**  trans-160132.4141.5-113.4178.57.900112.5
237L32.9Very low36.4Very low163 Ų163137.2 Ų137.285%0.85379%0.789SS**  trans-94.1-171.7173.5-74.6161.1000110
238P52.6Low35.9Very low110 Ų110140.7 Ų140.771%0.71479%0.79SS**  -113.1-160-112.230.6-3.6000111.1
239P47.5Very low36.1Very low116 Ų116138.4 Ų138.475%0.75379%0.787SS**  -152.3143.390.237.3-17.2000117.5
240S28.3Very low36.5Very low99 Ų99141.4 Ų141.469%0.69279%0.788SS**  trans41.8138.5134.169.60000125.4
241C24.6Very low37.2Very low112 Ų112145.1 Ų145.176%0.75779%0.794SS**  trans92.2105.2148-67.20000117.5
242Q33.1Very low37.7Very low181 Ų181151.1 Ų151.185%0.84680%0.801SS**  115.2161.475-85-93.1-22.500108.8
243P40.7Very low37.7Very low113 Ų113149.2 Ų149.273%0.73480%0.8SS**  -104.5162.3-128.639.5-38000115.3
244G33.2Very low39.2Very low63 Ų63147.6 Ų147.665%0.64980%0.799SS**  trans100.7105.6161.500000113.9
245D31.4Very low39.9Very low171 Ų171147.7 Ų147.791%0.91480%0.797SS**  176117119.2-86.3-28.1000110
246Y35.8Very low40.7Very low207 Ų207147.1 Ų147.181%0.81279%0.794SS**  trans-79.5142.3179.4-117.7-99000109.4
247Y38Very low41.6Very low206 Ų206145.8 Ų145.881%0.80879%0.793SS**  trans82.292.5170.2-65.6-79.1000119.4
248K31.5Very low42.1Very low206 Ų206147.2 Ų147.290%0.89679%0.788SS**  trans-157.9114.6144.3-127.8-179.7-175.3177.10111.7
249P42Very low41.9Very low125 Ų125147.8 Ų147.881%0.81279%0.792SS**  trans-84126.3162.8-12.629.4000110.7
250Q37.1Very low41.4Very low179 Ų179151.7 Ų151.784%0.83680%0.798SS**  trans-73.4132.6171.2-86.1-157.9-2900112.4
251H48Very low42.2Very low180 Ų180156.3 Ų156.383%0.83381%0.805SS**  trans23.4114.8144.8-60.1-81.8000119.8
252R43.4Very low43.1Very low258 Ų258154.5 Ų154.597%0.97481%0.806SS**  trans-125135.1145.6-139.2177.2-168.5175.23.3108.4
253G48.2Very low43.3Very low64 Ų64154 Ų15466%0.6681%0.807SS**  trans-66.3-177.9-161.800000117.1
254P62.3Low42.8Very low124 Ų124154.6 Ų154.681%0.80581%0.812SS**PPolyproline II helixtrans-62.9146.7-173.426.7-33.1000111.4
255P51Low42.7Very low113 Ų113156.7 Ų156.773%0.73482%0.817SS**PPolyproline II helixtrans-65148.5-179.526.8-32.4000111.2
256P61.2Low43Very low101 Ų101155 Ų15566%0.65682%0.816SS**PPolyproline II helixtrans-66.5132.8-178.324.6-31.9000112.3Y258P256-Y258 HydrophobicContact CG-CE2 4.35Å; P256-Y258 PolarHBondContact O-N 3.3Å
257D50.3Low42.7Very low170 Ų170148.3 Ų148.391%0.90981%0.809SS**PPolyproline II helixtrans-67.7118.6174.6-78.1-49.1000111.2
258Y44.8Very low42.3Very low194 Ų194144.4 Ų144.476%0.76181%0.812SS**PPolyproline II helixtrans-100.5132.9170.1-83.6-85.1000110.6P256 F260P256-Y258 HydrophobicContact CG-CE2 4.35Å; P256-Y258 PolarHBondContact O-N 3.3Å; Y258-F260 PolarHBondContact O-N 2.91Å; Y258-F260 VanDerWaalsContact O-N 3.08Å
259P46.5Very low42.1Very low122 Ų122142.8 Ų142.879%0.79281%0.807SS**  trans-80.893.2-17931.6-31.2000110.3
260F37.7Very low41.8Very low198 Ų198142.2 Ų142.287%0.86880%0.803SS**  trans-83.6113.2166.6-115.4-89000109.8Y258 G262Y258-F260 PolarHBondContact O-N 2.91Å; Y258-F260 VanDerWaalsContact O-N 3.08Å; F260-G262 PolarHBondContact O-N 3.46Å
261K45.7Very low41.4Very low195 Ų195142.6 Ų142.685%0.84881%0.805SS**  trans-67.6123167.5-67.1-176.6178.1-169.70108.1
262G42.6Very low40.6Very low75 Ų75139.9 Ų139.977%0.77381%0.806SS**  trans-67.6141.4-17500000113.8F260F260-G262 PolarHBondContact O-N 3.46Å
263I37.8Very low40Very low171 Ų171131.5 Ų131.588%0.87780%0.801SS**  trans-135.490.6150.4-32170000105
264C31.4Very low39.2Very low125 Ų125132.1 Ų132.185%0.84581%0.806SS**PPolyproline II helixtrans-84.6125166.9-149.30000106.6
265S30.1Very low38.1Very low107 Ų107134.8 Ų134.875%0.74881%0.808SS**PPolyproline II helixtrans-61.1139.2168.4-64.30000109.9G267S265-G267 PolarHBondContact O-N 2.9Å
266P37.3Very low37.1Very low136 Ų136137.5 Ų137.588%0.88381%0.808SS**PPolyproline II helixtrans-79.8122.1179.331.8-29.8000109.4
267G29.9Very low35.7Very low65 Ų65141 Ų14167%0.6781%0.81SS**  trans-146.9110.2174.700000110.7S265S265-G267 PolarHBondContact O-N 2.9Å
268S29.1Very low34.7Very low124 Ų124140.6 Ų140.687%0.86780%0.802SS**  trans58.9100.4160.360.70000118.8
269H28.1Very low33.8Very low173 Ų173137.1 Ų137.180%0.80179%0.793SS**  trans-116.9133.2140.8-139.2-81.3000108.1
270P34.6Very low33.6Very low112 Ų112137.3 Ų137.373%0.72779%0.794SS**  trans-81.8134.4166.432.9-27.6000107.8
271E28.8Very low33.4Very low188 Ų188136.7 Ų136.788%0.87979%0.786SS**  trans-134.2137.5159.9-86.4-144.9128.800111.9
272S32.3Very low32.5Very low122 Ų122132.9 Ų132.985%0.85378%0.779SS**  trans-75143.9-176.1-59.20000111.9
273G31.2Very low31.8Very low83 Ų83139.1 Ų139.186%0.85678%0.779SS**  67.3113128.600000119
274G31.2Very low31.4Very low76 Ų76137.8 Ų137.878%0.78477%0.774SS**  trans170.19416000000114.3
275H39Very low31.5Very low180 Ų180140.5 Ų140.583%0.83377%0.774SS**  trans-55.9154.6174.6-68.2-95.8000114.2
276F30.3Very low31.4Very low170 Ų170140.2 Ų140.275%0.74677%0.772SS**  -175.6122.3110.4-113.4-115.8000113.2
277Y31.3Very low31.2Very low175 Ų175144.3 Ų144.369%0.68677%0.769SS**  trans66140.7145.9-81.1-117.1000120.1
278Q29.5Very low31.2Very low161 Ų161149.6 Ų149.675%0.75278%0.777SS**  cis-167.3135-8.9-163.6170.731.100106.1
279E26.6Very low31.7Very low121 Ų121150 Ų15057%0.56577%0.774SS**  trans-74.2158.6176.2178.8159.7-160.900111.6R281E279-R281 VanDerWaalsContact CD-NE 3.26Å; E279-R281 HydrophobicContact CG-CG 4.17Å; E279-R281 VanDerWaalsContact OE1-CD 3.25Å; E279-R281 WeakPolarHBondContact OE1-CD 3.4Å; E279-R281 IonicContact OE1-NE 3.86Å; E279-R281 PolarHBondContact OE1-NE 3.28Å; E279-R281 IonicContact OE2-CZ 3.88Å; E279-R281 IonicContact OE2-NE 3.94Å; E279-R281 PolarHBondContact OE2-NE 3.47Å; E279-R281 IonicContact OE2-NH2 2.89Å
280P41.5Very low32.5Very low126 Ų126147.3 Ų147.382%0.81877%0.771SS**  -127.4133.9118.29.410.6000113.6
281R32.4Very low33.1Very low186 Ų186148.1 Ų148.170%0.70277%0.774SS**  trans-49.3162.1170.7-59.1-82.5169.495.8-3.3109.7E279E279-R281 VanDerWaalsContact CD-NE 3.26Å; E279-R281 HydrophobicContact CG-CG 4.17Å; E279-R281 VanDerWaalsContact OE1-CD 3.25Å; E279-R281 WeakPolarHBondContact OE1-CD 3.4Å; E279-R281 IonicContact OE1-NE 3.86Å; E279-R281 PolarHBondContact OE1-NE 3.28Å; E279-R281 IonicContact OE2-CZ 3.88Å; E279-R281 IonicContact OE2-NE 3.94Å; E279-R281 PolarHBondContact OE2-NE 3.47Å; E279-R281 IonicContact OE2-NH2 2.89Å
282V28.7Very low33.9Very low114 Ų114145.8 Ų145.869%0.69177%0.773SS**  -176.9120.878.2167.10000109.3
283R27.7Very low34.3Very low206 Ų206151 Ų15178%0.77777%0.774SS**  trans78.296.8135.3-161.3178-63.1-171.20.6120.9
284N29.3Very low34.8Very low143 Ų143156.4 Ų156.477%0.76577%0.77SS**  26.2127.9120.1-63.5-41.2000119.1
285H32.8Very low35.5Very low183 Ų183161.1 Ų161.185%0.84777%0.771SS**  -152.599.5122.3-82.975.3000106
286S27.5Very low35.9Very low100 Ų100157.2 Ų157.270%0.69976%0.762SS**  6410392.7-160.40000115.4
287R33.2Very low37.1Very low222 Ų222153.8 Ų153.884%0.83876%0.757SS**  trans60.5115133.3-149.1-173.6-70-126.8-0.3118.7
288E30.8Very low38.4Very low176 Ų176151.3 Ų151.382%0.82276%0.762SS**  179.3132.5109-99.7173.7171.500111.8
289V39Very low39.2Very low134 Ų134152.9 Ų152.981%0.81277%0.769SS**  trans-100.3131.6172.5171.10000107.6
290P44.8Very low39.9Very low115 Ų115158.5 Ų158.575%0.74779%0.787SS**  trans-112121.5149.8-4.324.6000111.5V292P290-V292 PolarHBondContact O-N 3.27Å
291T46.4Very low39.9Very low129 Ų129155.3 Ų155.379%0.79178%0.777SS**  trans-58.1113.8170.5-56.20000111R293T291-R293 PolarHBondContact O-N 3.4Å
292V46.3Very low40.3Very low140 Ų140151.1 Ų151.185%0.84878%0.777SS**  trans-79.9106.7171.1178.10000108.9P290P290-V292 PolarHBondContact O-N 3.27Å
293R41.2Very low40.6Very low230 Ų230155.6 Ų155.687%0.86879%0.787SS**  trans-79.9121.5171.8-162.1-175.1-166.81472.2108.4T291 Q295T291-R293 PolarHBondContact O-N 3.4Å; R293-Q295 PolarHBondContact O-N 3.47Å
294Y41.3Very low41Very low198 Ų198156.8 Ų156.878%0.77679%0.792SS**  trans-67129177-173.2-101000110.7
295Q45.8Very low41.2Very low174 Ų174155.6 Ų155.681%0.81379%0.794SS**  trans-109.5123.3175.8-168.8170.945.700108R293R293-Q295 PolarHBondContact O-N 3.47Å
296P47.6Very low41Very low98 Ų98153.3 Ų153.364%0.63679%0.794SS**PPolyproline II helixtrans-71.9150.4177.527.8-32.1000111.5
297P55.3Low41.3Very low99 Ų99158.1 Ų158.164%0.64380%0.802SS**PPolyproline II helixtrans-70155-175.3-13.829000113
298P58.9Low41.3Very low122 Ų122156.8 Ų156.879%0.79281%0.805SS**PPolyproline II helixtrans-62.8135.9-178.8-18.330.3000113.1Y300P298-Y300 PolarHBondContact O-N 2.92Å
299E47.2Very low41.1Very low194 Ų194155 Ų15591%0.90781%0.806SS**  trans-73112.4176.9-68.5142.5-177.100110.4
300Y40.1Very low41.2Very low239 Ų239153.5 Ų153.594%0.93780%0.802SS**PPolyproline II helixtrans-80.2122169-114.7-93.7000110P298P298-Y300 PolarHBondContact O-N 2.92Å
301G42.1Very low40.5Very low59 Ų59155 Ų15561%0.60881%0.809SS**PPolyproline II helixtrans-73.1158.4-168.300000116.7
302S40.3Very low39.7Very low99 Ų99156.5 Ų156.569%0.69281%0.806SS**PPolyproline II helixtrans-46.9134.9166.5172.60000115.1
303F34.9Very low39Very low207 Ų207159.8 Ų159.891%0.90881%0.805SS**  trans-132.3114148.8-71.9-75.1000110.6
304R37.3Very low38.4Very low231 Ų231157 Ų15787%0.87280%0.802SS**  trans-78.3134.7164.3-68.3-162.3179.2-82.70.7109.1
305S32.6Very low37.6Very low118 Ų118158.7 Ų158.783%0.82581%0.806SS**  trans-95.2111.7168.4177.80000109.1
306T29.6Very low37.5Very low136 Ų136155.1 Ų155.183%0.83480%0.798SS**  trans-149.3112.9151.734.20000107.7
307K32.4Very low36.7Very low201 Ų201157.5 Ų157.587%0.87481%0.805SS**  trans-72.5131.3172.7-90173.8168.9175.40109.7
308E32.6Very low35.5Very low193 Ų193158.1 Ų158.190%0.90280%0.803SS**  trans-124.1140.4149.4-77.4-168176.800109.6
309V27.7Very low34.2Very low140 Ų140160 Ų16085%0.84880%0.801SS**  trans-103.7115.1174.6165.40000108.5
310S40.1Very low33.3Very low102 Ų102158.9 Ų158.971%0.71380%0.795SS**  trans14.7129.3143.8-132.50000120.4
311V31.2Very low32.9Very low147 Ų147152.9 Ų152.989%0.89179%0.789SS**  -160.8141.2111.9-95.80000113.2
312H29.4Very low34.1Very low160 Ų160156 Ų15674%0.74180%0.798SS**  trans-36.4146.4170.8-11954.1000118.8
313Y31.4Very low33.8Very low209 Ų209156.7 Ų156.782%0.8280%0.803SS**  -176.8148.4106.1-100.7-79.9000114.5
314Q28.1Very low34Very low171 Ų171151.6 Ų151.680%0.79979%0.793SS**  trans-11143.9174.9-72-170.59.600127.6
315R24.7Very low34.3Very low233 Ų233145.2 Ų145.288%0.87978%0.784SS**  trans-29.8-179.8147.4-106.9-169.9174.7146.22.8119.3
316P44.2Very low34.5Very low99 Ų99146.5 Ų146.564%0.64379%0.787SS**  cis-143.5175.4-21.835.7-15000117.5
317L30.8Very low34.8Very low148 Ų148146.4 Ų146.478%0.77579%0.786SS**  trans88.1138.2138.3-128.683.6000124
318N29.1Very low34.9Very low113 Ų113141.8 Ų141.860%0.60478%0.779SS**  trans69.9113.4155.9-80.410.3000119.9
319Q32.3Very low35.3Very low161 Ų161139.7 Ų139.775%0.75278%0.779SS**  55.2116.981.6-67.3-142.77200114.2
320H29.4Very low35.5Very low170 Ų170136.3 Ų136.379%0.78777%0.772SS**  165.3130.6127.9-74.3-52.8000111.1
321S31.5Very low35.4Very low114 Ų114137 Ų13780%0.79778%0.777SS**  trans-86.9-159.4171.8-520000110.7
322P65.8Low35.8Very low124 Ų124137.5 Ų137.581%0.80577%0.774SS**  -122-167.6-8235.9-16.4000110.8
323S35.6Very low36Very low114 Ų114135.1 Ų135.180%0.79778%0.776SS**  trans139.5142.3161.5-1770000108.6
324S37.9Very low36.2Very low99 Ų99136.6 Ų136.669%0.69278%0.78SS**  cis179.1169.87.4-103.60000104.1
325S43.4Very low36.6Very low97 Ų97132.5 Ų132.568%0.67878%0.775SS**  cis-179.2148.9-5.4-92.70000104.4
326V36.7Very low37.2Very low146 Ų146130.5 Ų130.589%0.88578%0.776SS**  -165.9128122.7-86.40000110.4
327T36.2Very low36.5Very low134 Ų134130.9 Ų130.982%0.82278%0.78SS**  trans-54.8170.3173.343.30000115.2
328S34.3Very low36.5Very low103 Ų103128.8 Ų128.872%0.7278%0.779SS**  cis163138.5-9.91730000105.7
329V41.5Very low36.8Very low149 Ų149129.4 Ų129.490%0.90379%0.786SS**  trans-171.9121.5136.6-87.40000112.1
330G32.4Very low36.8Very low69 Ų69130.3 Ų130.371%0.71180%0.795SS**  trans64102.6153.800000120.4
331S37.4Very low37Very low117 Ų117127 Ų12782%0.81879%0.791SS**  63.9122.874.9-58.70000113.3
332L39.5Very low36.8Very low157 Ų157126.5 Ų126.582%0.82279%0.788SS**  cis-156.4142.545.2-74.2165.5000113.3
333S34.4Very low35.2Very low111 Ų111128.7 Ų128.778%0.77679%0.789SS**  trans53.6137.8137.2-59.10000120.3
334R36Very low35.2Very low239 Ų239130.1 Ų130.190%0.90279%0.787SS**  cis-177.7153.15.5166.8175.2175164.9-1.8105.9
335A35.3Very low34.8Very low85 Ų85130.7 Ų130.770%0.70279%0.791SS**  trans95.490.8162.900000119
336Q36.4Very low34.1Very low192 Ų192131.1 Ų131.190%0.89780%0.801SS**  71.7104.9121.4-59.4-154.7-31.200119.9
337S29.8Very low33.8Very low106 Ų106128.4 Ų128.474%0.74179%0.794SS**  76101.8125.1-137.70000117.1
338S31.6Very low33.6Very low105 Ų105126.4 Ų126.473%0.73479%0.785SS**  88.188.588.7-53.70000112.8
339T35.8Very low33.4Very low125 Ų125130 Ų13077%0.76779%0.79SS**  trans-27.2138.1139.244.40000115.8
340L31.4Very low33Very low180 Ų180127.9 Ų127.994%0.94278%0.782SS**  trans-139.9122.3133.5-80.6-177.6000110.1
341S33.3Very low33Very low101 Ų101130 Ų13071%0.70679%0.786SS**  trans-93.1148.5167.4-60.60000110
342S29.1Very low32.7Very low103 Ų103132.7 Ų132.772%0.7279%0.785SS**  trans61.1117.6147.9-62.60000119.8
343M32.2Very low32.7Very low170 Ų170131.1 Ų131.184%0.83779%0.785SS**  174164.691.1-88.3-52.1-155.300111.6
344L35Very low32.5Very low144 Ų144131.6 Ų131.675%0.75479%0.788SS**  trans-61.5155.8-160.1-79.981.9000120.2
345S28.9Very low32.5Very low111 Ų111127.8 Ų127.878%0.77678%0.784SS**  trans85.7107.7134.8-74.60000122.5
346A28.3Very low32.4Very low107 Ų107129.2 Ų129.288%0.88479%0.786SS**  trans156.4135132.100000107.8
347A31.8Very low32.2Very low89 Ų89129.4 Ų129.474%0.73679%0.786SS**  cis-158.8154.97.100000109.3
348S32.3Very low32.3Very low91 Ų91133.3 Ų133.364%0.63679%0.793SS**  trans47.4127141.7-47.50000122.6
349H30Very low32.3Very low179 Ų179133.4 Ų133.483%0.82979%0.794SS**  167.5130.794.7-85.2-68.7000112.8
350S33Very low32.5Very low104 Ų104133.2 Ų133.273%0.72779%0.794SS**  trans-67.2144.1160.556.90000111.5
351S31.8Very low32.8Very low113 Ų113130.7 Ų130.779%0.7979%0.789SS**  172.1139.3118.848.10000113.9
352H31.6Very low32.6Very low175 Ų175131.4 Ų131.481%0.8179%0.793SS**  trans-25.6152.8168.2-65.8-94.1000120.3
353P38.8Very low32.7Very low124 Ų124135.6 Ų135.681%0.80580%0.802SS**  trans-87.5133.3157.334-26.2000110.8
354S30.8Very low32.4Very low121 Ų121130.6 Ų130.685%0.84679%0.794SS**  trans-139.1124.2161-69.70000108.7
355I36.2Very low32.4Very low159 Ų159130.6 Ų130.682%0.81579%0.79SS**  trans-78.2145.7-179-68.5172.5000108.9
356P33.3Very low33Very low115 Ų115130.9 Ų130.975%0.74779%0.789SS**  trans-83138.8-171.532.8-33.5000112.3
357H30.6Very low33Very low195 Ų195135 Ų13590%0.90378%0.783SS**  trans-118.7119160.8-113-76.9000108.9
358Q31.8Very low33.7Very low189 Ų189136 Ų13688%0.88378%0.782SS**PPolyproline II helixtrans-73.6136.9167.5-74.2-179.26900109.9
359S32.6Very low33.5Very low107 Ų107139.6 Ų139.675%0.74879%0.793SS**PPolyproline II helixtrans-96.4155.8158.5550000109.8
360P40.3Very low33.7Very low121 Ų121139.1 Ų139.179%0.78679%0.793SS**PPolyproline II helixtrans-79.8166.1-160.231.8-35.4000114.9
361P37.4Very low33.5Very low127 Ų127137.5 Ų137.583%0.82579%0.792SS**PPolyproline II helixtrans-86150.7177.434.9-33.1000113
362S29Very low34.3Very low115 Ų115138 Ų13880%0.80479%0.793SS**PPolyproline II helixtrans-93.1134.5166.649.10000111.5
363Q30.3Very low34.3Very low192 Ų192140.5 Ų140.590%0.89780%0.795SS**  trans-143.5123.2162-77-91.1-29.500108.8
364G26.9Very low33.9Very low65 Ų65140.6 Ų140.667%0.6779%0.794SS**  trans-81.6170.2162.200000110.5
365E34Very low34.9Very low143 Ų143139 Ų13967%0.66878%0.78SS**  cis-175.917249.1-89.4-73.6145.500107Y367E365-Y367 VanDerWaalsContact OE2-CD2 3.29Å; E365-Y367 WeakPolarHBondContact OE2-CD2 3.47Å; E365-Y367 WeakPolarHBondContact OE2-CE2 3.44Å
366P41.9Very low34.8Very low118 Ų118140.4 Ų140.477%0.76678%0.783SS**  cis-150.116240.837.9-13.1000120.7
367Y29.6Very low34.6Very low193 Ų193138 Ų13876%0.75778%0.778SS**  trans-20.1159.4160.6-68.3-76.2000121.5E365E365-Y367 VanDerWaalsContact OE2-CD2 3.29Å; E365-Y367 WeakPolarHBondContact OE2-CD2 3.47Å; E365-Y367 WeakPolarHBondContact OE2-CE2 3.44Å
368P45.5Very low34.7Very low110 Ų110135 Ų13571%0.71478%0.779SS**  -149.6154.253.639.8-18.1000120.4
369I28.6Very low34.6Very low167 Ų167129.9 Ų129.986%0.85678%0.778SS**  trans-129.4135.9152-81.2178.8000108.9
370M33.4Very low34.6Very low168 Ų168129.9 Ų129.983%0.82878%0.778SS**  trans-70.2151-179-65.2-84.993.200113.2
371G29.8Very low34.1Very low70 Ų70132 Ų13272%0.72278%0.777SS**  trans-73.4-159.7173.600000114.6
372P47.8Very low33.8Very low123 Ų123133.5 Ų133.580%0.79977%0.773SS**  cis-143.1160.732.239.3-18.8000119.4
373R31Very low33.8Very low228 Ų228133.9 Ų133.986%0.8677%0.77SS**  trans46.9118.2140.2-76.8-168169.4167.1-1.8122.1
374V31.1Very low33.8Very low127 Ų127129 Ų12977%0.7776%0.763SS**  85.3150.370.7167.50000112.6
375P51.2Low33.9Very low88 Ų88132.5 Ų132.557%0.57176%0.762SS**  cis-143.4177.5926.6-0.5000120.6
376H35.5Very low34.2Very low188 Ų188131.1 Ų131.187%0.8777%0.765SS**  trans82.1135.6148.6-56.6-44.6000119.8
377G28.7Very low33.7Very low63 Ų63133.3 Ų133.365%0.64976%0.763SS**  cis-176.9162.22.100000114.5
378S33.3Very low35.2Very low132 Ų132129.1 Ų129.192%0.92376%0.759SS**  trans51.9128.2145.348.30000122.8
379G28.8Very low35.3Very low82 Ų82129.8 Ų129.885%0.84576%0.763SS**  trans163.496.7153.200000117
380S31.8Very low35.3Very low108 Ų108125.2 Ų125.276%0.75576%0.757SS**  trans-68.7151-176.2-60.10000118.7
381H31Very low36.2Very low166 Ų166123.1 Ų123.177%0.76976%0.756SS**  trans66.1124133-79.2-61.3000124
382Q31.2Very low36.3Very low158 Ų158125.9 Ų125.974%0.73876%0.759SS**  86.4120.9125-64-97.577.400121.3
383V28.9Very low35.5Very low123 Ų123127.8 Ų127.875%0.74576%0.757SS**  86.7134.2124.4170.20000120.6
384A29.2Very low35.3Very low89 Ų89125.3 Ų125.374%0.73676%0.755SS**  trans106.2103149.600000119.3
385E29.2Very low35.2Very low139 Ų139124.1 Ų124.165%0.6575%0.748SS**  trans-43.6166.2137.7-87.8-111.3130.600113.1F387E385-F387 WeakPolarHBondContact OE1-CD2 3.47Å; E385-F387 WeakPolarHBondContact OE1-CE2 3.45Å
386P40.5Very low34.3Very low113 Ų113125.5 Ų125.573%0.73476%0.755SS**  cis-146.2169.932.929.2-3.1000118.6
387F31.4Very low34.1Very low165 Ų165124.2 Ų124.272%0.72475%0.749SS**  trans-46.3-169.9167-74.3-87.3000118.2E385E385-F387 WeakPolarHBondContact OE1-CD2 3.47Å; E385-F387 WeakPolarHBondContact OE1-CE2 3.45Å
388P61.4Low34.3Very low105 Ų105131.9 Ų131.968%0.68276%0.759SS**  -131.8-161.3-66.943-23.3000110.3
389P46.7Very low34Very low124 Ų124129.2 Ų129.281%0.80575%0.752SS**  -150.415873.932.6-8.7000116.5
390G28.8Very low34.3Very low71 Ų71134.1 Ų134.173%0.73275%0.753SS**  trans-83.3-142.5170.400000112.7
391P53.5Low34.2Very low124 Ų124133.7 Ų133.781%0.80576%0.756SS**  cis-116.2-177.3-32.624.4-1000110.1
392V31.4Very low34.4Very low127 Ų127135.3 Ų135.377%0.7776%0.761SS**  178131.798172.10000110.5
393H30.4Very low34.4Very low164 Ų164136.2 Ų136.276%0.75977%0.77SS**  trans6.1136.7151.6-82.9-122.5000122.9
394Q28.1Very low34.7Very low176 Ų176134.6 Ų134.682%0.82276%0.764SS**  178.4112.7110.9-102.117683.400111.3
395T27.6Very low34.7Very low102 Ų102137.9 Ų137.963%0.62677%0.769SS**  75.9127.494.9600000117.6
396T31.9Very low34.7Very low117 Ų117137.1 Ų137.172%0.71878%0.779SS**  trans95.4110138.5-58.70000120.3
397Q31.4Very low34.4Very low160 Ų160142.9 Ų142.975%0.74879%0.788SS**  trans65118.1139.2-64.5-15761.700120.8
398R33Very low34.6Very low224 Ų224138.1 Ų138.185%0.84579%0.785SS**  76.5110.180.9-159.4-168.1-145.2-174.77.9112.4
399G27.7Very low33.2Very low76 Ų76138.8 Ų138.878%0.78479%0.793SS**  trans178.8109.3167.300000112.3
400H35.2Very low32.8Very low186 Ų186139.2 Ų139.286%0.86179%0.793SS**  trans-71.1145.8170.9-64.7-91.4000110.8
401A30.1Very low33.3Very low99 Ų99142.1 Ų142.182%0.81880%0.799SS**  153.1142.4123.700000112
402F35.3Very low32.5Very low200 Ų200146.8 Ų146.888%0.87780%0.8SS**  trans-55.4149.6172.5-76.2-101.8000113.5
403L29.9Very low33Very low176 Ų176148.6 Ų148.692%0.92181%0.805SS**  trans-132.7122.7153.4-112.8152.1000107.7
404S36.3Very low33.7Very low89 Ų89149.5 Ų149.562%0.62281%0.809SS**  trans-83.6165.6175.5-59.30000111.8
405D29.1Very low34.6Very low158 Ų158149.5 Ų149.585%0.84581%0.809SS**  trans90.3112.6160.1-58.1-21.7000117.8
406S28Very low35.1Very low123 Ų123153 Ų15386%0.8682%0.818SS**  -177.8146.990.2-155.20000112.3
407Y34.6Very low35.7Very low235 Ų235156.1 Ų156.192%0.92282%0.824SS**  trans-59.3145.6-177.8-109.7-113.5000114.2
408G36.4Very low36.3Very low65 Ų65156.5 Ų156.567%0.6783%0.826SS**  trans72107.5139.200000118.3
409S30.9Very low36.8Very low119 Ų119154.4 Ų154.483%0.83283%0.825SS**  176.4128.1124.9-81.40000109.9
410T39.8Very low37.6Very low133 Ų133158 Ų15882%0.81683%0.827SS**  trans-53129.9165.135.30000111.8R412T410-R412 PolarHBondContact O-N 3.43Å
411P38.3Very low38Very low132 Ų132158.3 Ų158.386%0.85783%0.829SS**  trans-84.8100.4153.127.4-16.6000107.6
412R37Very low38.6Very low221 Ų221160 Ų16083%0.83483%0.832SS**  trans-34131.2160.7-173.4173.8178.2-117.24.1112.2T410 H414T410-R412 PolarHBondContact O-N 3.43Å; R412-H414 PolarHBondContact O-N 2.92Å
413L41.6Very low39.1Very low166 Ų166159 Ų15987%0.86983%0.831SS**  trans-36.1127168.6-59.4175.2000112.9
414H45.6Very low39.9Very low182 Ų182160 Ų16084%0.84383%0.83SS**  trans-104.9134.1151.5-10185.5000108.6R412R412-H414 PolarHBondContact O-N 2.92Å
415H46Very low40.4Very low176 Ų176164.8 Ų164.882%0.81584%0.843SS**  trans95.369.4160.8-131.878.8000118.8
416H39.4Very low41Very low176 Ų176166.1 Ų166.182%0.81584%0.844SS**  trans-149.675.7134.7-152.275.1000110.9
417Q43.9Very low41.8Very low183 Ų183168.8 Ų168.886%0.85585%0.848SS**  trans-118.881.4164-174.218074.700107.4
418Q44.5Very low42Very low167 Ų167166.9 Ų166.978%0.7885%0.848SS**  trans-143.653.5167.4-144.9-157.956.400111.8
419H42.7Very low42Very low181 Ų181167.1 Ų167.184%0.83885%0.85SS**SBendtrans-154.643.6165-13481.5000114.8
420N44Very low43.1Very low151 Ų151167.7 Ų167.781%0.80785%0.851SS**  trans-14238177.3-131.3-8.5000114.7
421Q44.3Very low42.7Very low193 Ų193166.8 Ų166.890%0.90285%0.85SS**  trans-100.59.3-176.8-133.8-168.596.500115.9
422C42Very low42.9Very low133 Ų133169.3 Ų169.390%0.89985%0.85SS**SBendtrans-106.97.6178.5-80.40000116.5
423Q45.9Very low43.6Very low181 Ų181164 Ų16485%0.84684%0.844SS**SBendtrans-138.973.6174.7-85.6-161.768.300112.5
424Q47.1Very low43.3Very low195 Ų195164.5 Ų164.591%0.91184%0.842SS**  trans-156.777.9149.2-151.2171.1103.800111.3
425Q46.4Very low43.9Very low191 Ų191163.4 Ų163.489%0.89384%0.841SS**  trans-151.185.4154.6-149.7166.499.300110.3
426Q43.6Very low43.3Very low186 Ų186160.6 Ų160.687%0.86984%0.842SS**  trans177.4109.6137.1-104.7175.356.400110
427L44.6Very low43.9Very low179 Ų179159 Ų15994%0.93784%0.836SS**  trans-153.785.1152.2-103.1139.6000107.6
428Q38.3Very low43.6Very low195 Ų195159.1 Ų159.191%0.91184%0.837SS**  trans-143110155.5-115.3163.64800106.9
429G35.7Very low43.8Very low70 Ų70158 Ų15872%0.72284%0.836SS**  trans-84.9-168.3165.100000110.9
430P55Low43.7Very low130 Ų130158.4 Ų158.484%0.84484%0.838SS**  -118.3154.3-7235.3-27.4000110.8
431S31Very low44.1Very low114 Ų114153.4 Ų153.480%0.79782%0.822SS**  trans-146.6104.9159.654.60000109.2
432H42.7Very low44.4Very low185 Ų185151.2 Ų151.286%0.85681%0.812SS**  trans-57.3143155-84-66.5000108.2
433P51.8Low45.6Very low111 Ų111149.5 Ų149.572%0.72180%0.799SS**  -143.2154.782.637.3-20.1000115.8
434Q35.3Very low46.9Very low175 Ų175148.6 Ų148.682%0.81879%0.793SS**  trans86.8108.4141.5-130.3172.6-79.500119.9
435L56.6Low48.6Very low159 Ų159141.9 Ų141.983%0.83277%0.77SS**  trans-29.1128.7146-66.8155.5000113.9
436S35.2Very low50.3Low117 Ų117137.3 Ų137.382%0.81876%0.756SS**  trans-153.9107.6138.763.80000110.5
437M50.8Low52.2Low143 Ų143134.4 Ų134.470%0.70474%0.743SS**  trans-14.8128.9159-61.2-84.382.600116.7L439M437-L439 HydrophobicContact CE-CB 4.48Å; M437-L439 HydrophobicContact SD-CB 4.49Å
438Q38.8Very low54.2Low186 Ų186128.3 Ų128.387%0.86972%0.719SS**  trans-138.963.5135.3-164.393.9-21.800107.3Q440Q438-Q440 PolarHBondContact O-N 3.36Å
439L48.2Very low56.6Low144 Ų144124.9 Ų124.975%0.75470%0.702SS**  trans-80.378.6170.2-166.774.6000108M437M437-L439 HydrophobicContact CE-CB 4.48Å; M437-L439 HydrophobicContact SD-CB 4.49Å
440Q41.2Very low59.3Low188 Ų188123.5 Ų123.588%0.87969%0.685SS**  trans-147.679164.5-133176.83500108.7Q438Q438-Q440 PolarHBondContact O-N 3.36Å
441G52.2Low61.1Low47 Ų47122.3 Ų122.349%0.48567%0.668SS.*SBendtrans-168.6115.1173.200000106.9
442E50.3Low64.1Low146 Ų146122.7 Ų122.768%0.68266%0.657SS**  trans-19.7131.4178.2-70.1-69.3142.500114.4F444 A445E442-F444 HydrophobicContact CB-CB 4.31Å; E442-F444 PolarHBondContact O-N 2.92Å; E442-A445 WeakPolarHBondContact O-CB 3.43Å; E442-A445 PolarHBondContact O-N 3.42Å
443P67.3Low66.6Low97 Ų97118.9 Ų118.963%0.6364%0.641SS**Hα-helixtrans-47.3-26.1174.5-26.432.4000113.8M447P443-M447 WeakPolarHBondContact O-CE 3.39Å; P443-M447 PolarHBondContact O-N 3.4Å
444F73.2Confident68.7Low162 Ų162117 Ų11771%0.71163%0.627SS**Hα-helixtrans-64.5-36.8174.4-162.8-101.1000114.3E442 A448E442-F444 HydrophobicContact CB-CB 4.31Å; E442-F444 PolarHBondContact O-N 2.92Å; F444-A448 WeakPolarHBondContact O-CB 3.22Å; F444-A448 PolarHBondContact O-N 3.29Å
445A81.5Confident71.6Confident54 Ų54113 Ų11345%0.44661%0.611SS.*Hα-helixtrans-73.6-37.7-17900000112.8E442 A448 H449E442-A445 WeakPolarHBondContact O-CB 3.43Å; E442-A445 PolarHBondContact O-N 3.42Å; A445-A448 PolarHBondContact O-N 2.89Å; A445-H449 PolarHBondContact O-N 3.23Å
446V82.9Confident73.5Confident96 Ų96109 Ų10958%0.58259%0.594SS**Hα-helixtrans-68.4-40.4175-178.90000110.6H449 A450V446-H449 PolarHBondContact O-N 3.48Å; V446-A450 WeakPolarHBondContact O-CB 3.33Å; V446-A450 PolarHBondContact O-N 2.9Å
447M83.3Confident76.4Confident124 Ų124108.2 Ų108.261%0.61158%0.578SS**Hα-helixtrans-64.7-39.8172.4-78.7-170.7-7300112.4P443 A450 Q451P443-M447 WeakPolarHBondContact O-CE 3.39Å; P443-M447 PolarHBondContact O-N 3.4Å; M447-A450 PolarHBondContact O-N 2.92Å; M447-Q451 VanDerWaalsContact O-CB 3.31Å; M447-Q451 WeakPolarHBondContact O-CB 3.27Å; M447-Q451 PolarHBondContact O-N 3.32Å
448A87.2Confident78.6Confident51 Ų51105.5 Ų105.542%0.42157%0.569SS.*Hα-helixtrans-63.9-41.7176.200000112.4F444 A445 Q451 Q452F444-A448 WeakPolarHBondContact O-CB 3.22Å; F444-A448 PolarHBondContact O-N 3.29Å; A445-A448 PolarHBondContact O-N 2.89Å; A448-Q451 PolarHBondContact O-N 3.39Å; A448-Q452 WeakPolarHBondContact O-CB 3.38Å; A448-Q452 PolarHBondContact O-N 3.48Å
449H87.7Confident81.3Confident123 Ų123100.4 Ų100.457%0.56955%0.546SS*.Hα-helixtrans-64.8-43.6174.5179.2-86.6000112.1A445 V446 Q451 Q452 M453A445-H449 PolarHBondContact O-N 3.23Å; V446-H449 PolarHBondContact O-N 3.48Å; H449-Q451 VanDerWaalsContact C-N 3.34Å; H449-Q451 PolarHBondContact O-N 3.43Å; H449-Q452 PolarHBondContact O-N 2.8Å; H449-M453 PolarHBondContact O-N 3.02Å
450A92.5Very high83.7Confident42 Ų4298.9 Ų98.935%0.34754%0.535SS..Hα-helixtrans-62.8-40.6175.500000111.9V446 M447 M453 V454V446-A450 WeakPolarHBondContact O-CB 3.33Å; V446-A450 PolarHBondContact O-N 2.9Å; M447-A450 PolarHBondContact O-N 2.92Å; A450-M453 PolarHBondContact O-N 3.26Å; A450-V454 WeakPolarHBondContact O-CG2 3.47Å; A450-V454 PolarHBondContact O-N 2.88Å
451Q92.6Very high86.3Confident104 Ų10493.8 Ų93.849%0.48651%0.514SS..Hα-helixtrans-63.7-44.8175.7-173.26151.400111.5M447 A448 H449 M453 V454 D455M447-Q451 VanDerWaalsContact O-CB 3.31Å; M447-Q451 WeakPolarHBondContact O-CB 3.27Å; M447-Q451 PolarHBondContact O-N 3.32Å; A448-Q451 PolarHBondContact O-N 3.39Å; H449-Q451 VanDerWaalsContact C-N 3.34Å; H449-Q451 PolarHBondContact O-N 3.43Å; Q451-M453 VanDerWaalsContact C-N 3.3Å; Q451-M453 PolarHBondContact O-N 3.22Å; Q451-V454 WeakPolarHBondContact O-CB 3.32Å; Q451-V454 PolarHBondContact O-N 3.43Å; Q451-V454 VanDerWaalsContact O-N 3.13Å; Q451-D455 PolarHBondContact NE2-OD1 3.08Å; Q451-D455 PolarHBondContact O-N 3.48Å
452Q95.4Very high88.5Confident122 Ų12297.8 Ų97.857%0.5751%0.514SS*.Hα-helixtrans-58.4-42.4175.9-177.3-178.12.300111.9A448 H449 D455 V456A448-Q452 WeakPolarHBondContact O-CB 3.38Å; A448-Q452 PolarHBondContact O-N 3.48Å; H449-Q452 PolarHBondContact O-N 2.8Å; Q452-D455 PolarHBondContact O-N 2.81Å; Q452-V456 WeakPolarHBondContact O-CG2 3.38Å; Q452-V456 PolarHBondContact O-N 3.18Å
453M94.4Very high90.8Very high106 Ų10694.1 Ų94.152%0.52250%0.498SS..Hα-helixtrans-64.8-40.9176.3-175.7171.260.400111.7H449 A450 Q451 D455 V456 M457H449-M453 PolarHBondContact O-N 3.02Å; A450-M453 PolarHBondContact O-N 3.26Å; Q451-M453 VanDerWaalsContact C-N 3.3Å; Q451-M453 PolarHBondContact O-N 3.22Å; M453-D455 VanDerWaalsContact C-N 3.33Å; M453-D455 PolarHBondContact O-N 2.81Å; M453-V456 PolarHBondContact O-N 2.89Å; M453-M457 HydrophobicContact CG-SD 4.3Å; M453-M457 WeakPolarHBondContact O-CB 3.4Å; M453-M457 VanDerWaalsContact O-CG 3.28Å; M453-M457 WeakPolarHBondContact O-CG 3.33Å; M453-M457 PolarHBondContact O-N 3.44Å
454V95.9Very high92.2Very high72 Ų7294 Ų9444%0.43649%0.492SS..Hα-helixtrans-61.3-41.9173.9169.20000111.1A450 Q451 M457 T458A450-V454 WeakPolarHBondContact O-CG2 3.47Å; A450-V454 PolarHBondContact O-N 2.88Å; Q451-V454 WeakPolarHBondContact O-CB 3.32Å; Q451-V454 PolarHBondContact O-N 3.43Å; Q451-V454 VanDerWaalsContact O-N 3.13Å; V454-M457 PolarHBondContact O-N 2.86Å; V454-T458 VanDerWaalsContact O-CB 3.26Å; V454-T458 WeakPolarHBondContact O-CB 3.5Å; V454-T458 PolarHBondContact O-N 3.31Å; V454-T458 PolarHBondContact O-OG1 3.45Å
455D96Very high93.4Very high89 Ų8995.1 Ų95.148%0.47649%0.491SS..Hα-helixtrans-65.5-44.7180-64.4-17.3000111.4Q451 Q452 M453 T458 E459Q451-D455 PolarHBondContact NE2-OD1 3.08Å; Q451-D455 PolarHBondContact O-N 3.48Å; Q452-D455 PolarHBondContact O-N 2.81Å; M453-D455 VanDerWaalsContact C-N 3.33Å; M453-D455 PolarHBondContact O-N 2.81Å; D455-T458 PolarHBondContact O-N 3.09Å; D455-E459 WeakPolarHBondContact O-CB 3.4Å; D455-E459 PolarHBondContact O-N 3.39Å
456V95.9Very high94.2Very high77 Ų7798 Ų9847%0.46750%0.496SS..Hα-helixtrans-62-47.8175.1173.70000110.9Q452 M453 T458 E459 E460Q452-V456 WeakPolarHBondContact O-CG2 3.38Å; Q452-V456 PolarHBondContact O-N 3.18Å; M453-V456 PolarHBondContact O-N 2.89Å; V456-T458 VanDerWaalsContact C-N 3.27Å; V456-T458 PolarHBondContact O-N 3.07Å; V456-E459 PolarHBondContact O-N 3.44Å; V456-E460 HydrophobicContact CG1-CG 4.48Å; V456-E460 WeakPolarHBondContact O-CG 3.39Å; V456-E460 PolarHBondContact O-N 2.87Å
457M96.9Very high94.9Very high100 Ų10098.9 Ų98.949%0.49349%0.494SS..Hα-helixtrans-62.8-34.6177.1-72.8-176.773.400112.4M453 V454 N461M453-M457 HydrophobicContact CG-SD 4.3Å; M453-M457 WeakPolarHBondContact O-CB 3.4Å; M453-M457 VanDerWaalsContact O-CG 3.28Å; M453-M457 WeakPolarHBondContact O-CG 3.33Å; M453-M457 PolarHBondContact O-N 3.44Å; V454-M457 PolarHBondContact O-N 2.86Å; M457-N461 WeakPolarHBondContact O-CB 3.33Å; M457-N461 PolarHBondContact O-N 3.47Å; M457-N461 PolarHBondContact O-ND2 2.86Å
458T96.3Very high95.6Very high85 Ų8598 Ų9852%0.52149%0.489SS..Hα-helixtrans-68-41.8177.1-59.70000110.4V454 D455 V456 N461 R462V454-T458 VanDerWaalsContact O-CB 3.26Å; V454-T458 WeakPolarHBondContact O-CB 3.5Å; V454-T458 PolarHBondContact O-N 3.31Å; V454-T458 PolarHBondContact O-OG1 3.45Å; D455-T458 PolarHBondContact O-N 3.09Å; V456-T458 VanDerWaalsContact C-N 3.27Å; V456-T458 PolarHBondContact O-N 3.07Å; T458-N461 PolarHBondContact O-N 3.45Å; T458-R462 WeakPolarHBondContact O-CB 3.35Å; T458-R462 PolarHBondContact O-N 3.38Å
459E97.2Very high96.1Very high79 Ų79101 Ų10137%0.36950%0.495SS..Hα-helixtrans-67-43.4176.1-175.957-161.500112D455 V456 N461 R462 I463D455-E459 WeakPolarHBondContact O-CB 3.4Å; D455-E459 PolarHBondContact O-N 3.39Å; V456-E459 PolarHBondContact O-N 3.44Å; E459-N461 VanDerWaalsContact C-N 3.34Å; E459-N461 PolarHBondContact O-N 2.97Å; E459-R462 WeakPolarHBondContact O-CA 3.43Å; E459-R462 VanDerWaalsContact O-CB 3.31Å; E459-R462 WeakPolarHBondContact O-CB 3.43Å; E459-R462 PolarHBondContact O-N 2.92Å; E459-R462 VanDerWaalsContact O-N 3.09Å; E459-R462 IonicContact OE1-CZ 2.69Å; E459-R462 VanDerWaalsContact OE1-CZ 3.3Å; E459-R462 IonicContact OE1-NE 3.93Å; E459-R462 PolarHBondContact OE1-NE 2.89Å; E459-R462 VanDerWaalsContact OE1-NE 3.16Å; E459-R462 IonicContact OE1-NH2 2.8Å; E459-R462 PolarHBondContact OE1-NH2 3.43Å; E459-R462 IonicContact OE2-CZ 2.87Å; E459-R462 IonicContact OE2-NE 2.75Å; E459-R462 PolarHBondContact OE2-NE 2.86Å; E459-R462 IonicContact OE2-NH2 3.34Å; E459-I463 HydrophobicContact CG-CD1 4.18Å; E459-I463 WeakPolarHBondContact O-CG1 3.47Å; E459-I463 PolarHBondContact O-N 3.48Å
460E97.2Very high96.6Very high112 Ų11296.9 Ų96.952%0.52348%0.482SS..Hα-helixtrans-59.5-43.5172.9-73.5-178.2164.300111.6V456 R462 I463 L464V456-E460 HydrophobicContact CG1-CG 4.48Å; V456-E460 WeakPolarHBondContact O-CG 3.39Å; V456-E460 PolarHBondContact O-N 2.87Å; E460-R462 VanDerWaalsContact C-N 3.3Å; E460-R462 PolarHBondContact O-N 3.46Å; E460-I463 PolarHBondContact O-N 3.27Å; E460-L464 WeakPolarHBondContact O-CB 3.43Å; E460-L464 VanDerWaalsContact O-CG 3.29Å; E460-L464 WeakPolarHBondContact O-CG 3.38Å; E460-L464 PolarHBondContact O-N 3.07Å
461N96.7Very high96.9Very high82 Ų8297.8 Ų97.844%0.43949%0.485SS..Hα-helixtrans-62.7-36.1173.9-88.8-77.4000112.5M457 T458 E459 R465M457-N461 WeakPolarHBondContact O-CB 3.33Å; M457-N461 PolarHBondContact O-N 3.47Å; M457-N461 PolarHBondContact O-ND2 2.86Å; T458-N461 PolarHBondContact O-N 3.45Å; E459-N461 VanDerWaalsContact C-N 3.34Å; E459-N461 PolarHBondContact O-N 2.97Å; N461-R465 WeakPolarHBondContact O-CB 3.26Å; N461-R465 VanDerWaalsContact O-CG 3.22Å; N461-R465 WeakPolarHBondContact O-CG 3.2Å; N461-R465 PolarHBondContact O-N 3.12Å
462R98Very high97.1Very high130 Ų130100.3 Ų100.349%0.49149%0.49SS..Hα-helixtrans-64.4-46.6175.2-168.4-171.173.174.61.2110.7T458 E459 E460 R465 Q466T458-R462 WeakPolarHBondContact O-CB 3.35Å; T458-R462 PolarHBondContact O-N 3.38Å; E459-R462 WeakPolarHBondContact O-CA 3.43Å; E459-R462 VanDerWaalsContact O-CB 3.31Å; E459-R462 WeakPolarHBondContact O-CB 3.43Å; E459-R462 PolarHBondContact O-N 2.92Å; E459-R462 VanDerWaalsContact O-N 3.09Å; E459-R462 IonicContact OE1-CZ 2.69Å; E459-R462 VanDerWaalsContact OE1-CZ 3.3Å; E459-R462 IonicContact OE1-NE 3.93Å; E459-R462 PolarHBondContact OE1-NE 2.89Å; E459-R462 VanDerWaalsContact OE1-NE 3.16Å; E459-R462 IonicContact OE1-NH2 2.8Å; E459-R462 PolarHBondContact OE1-NH2 3.43Å; E459-R462 IonicContact OE2-CZ 2.87Å; E459-R462 IonicContact OE2-NE 2.75Å; E459-R462 PolarHBondContact OE2-NE 2.86Å; E459-R462 IonicContact OE2-NH2 3.34Å; E460-R462 VanDerWaalsContact C-N 3.3Å; E460-R462 PolarHBondContact O-N 3.46Å; R462-R465 PolarHBondContact O-N 3.37Å; R462-Q466 PolarHBondContact O-N 3.01Å; R462-Q466 VanDerWaalsContact O-N 3.09Å
463I98Very high97.3Very high69 Ų6999.9 Ų99.935%0.35449%0.488SS..Hα-helixtrans-64.3-48178.2-66.2167.5000110.6E459 E460 R465 Q466 E467E459-I463 HydrophobicContact CG-CD1 4.18Å; E459-I463 WeakPolarHBondContact O-CG1 3.47Å; E459-I463 PolarHBondContact O-N 3.48Å; E460-I463 PolarHBondContact O-N 3.27Å; I463-R465 VanDerWaalsContact C-N 3.29Å; I463-R465 PolarHBondContact O-N 3.37Å; I463-Q466 CarbonylContact O-C 3.56Å; I463-Q466 WeakPolarHBondContact O-CA 3.24Å; I463-Q466 WeakPolarHBondContact O-CB 3.38Å; I463-Q466 PolarHBondContact O-N 3.35Å; I463-E467 HydrophobicContact CG2-CG 4.37Å; I463-E467 WeakPolarHBondContact O-CG 3.26Å; I463-E467 PolarHBondContact O-N 3.25Å
464L98.1Very high97.5Very high96 Ų96100.5 Ų100.550%0.50349%0.488SS..Hα-helixtrans-58.9-39.3178-74.5171.5000112.4E460 E467 M468E460-L464 WeakPolarHBondContact O-CB 3.43Å; E460-L464 VanDerWaalsContact O-CG 3.29Å; E460-L464 WeakPolarHBondContact O-CG 3.38Å; E460-L464 PolarHBondContact O-N 3.07Å; L464-E467 PolarHBondContact O-N 3Å; L464-M468 WeakPolarHBondContact O-CB 3.31Å; L464-M468 WeakPolarHBondContact O-CG 3.35Å; L464-M468 PolarHBondContact O-N 3.01Å
465R97.6Very high97.6Very high184 Ų184101.7 Ų101.769%0.69450%0.495SS*.Hα-helixtrans-63-43.2174-76.1172.6-177.4-121.82.7111.5N461 R462 I463 M468 E469N461-R465 WeakPolarHBondContact O-CB 3.26Å; N461-R465 VanDerWaalsContact O-CG 3.22Å; N461-R465 WeakPolarHBondContact O-CG 3.2Å; N461-R465 PolarHBondContact O-N 3.12Å; R462-R465 PolarHBondContact O-N 3.37Å; I463-R465 VanDerWaalsContact C-N 3.29Å; I463-R465 PolarHBondContact O-N 3.37Å; R465-M468 PolarHBondContact O-N 3.45Å; R465-E469 WeakPolarHBondContact O-CB 3.42Å; R465-E469 PolarHBondContact O-N 2.9Å
466Q98.3Very high97.7Very high116 Ų116101.2 Ų101.254%0.54250%0.496SS..Hα-helixtrans-63.4-40.5175.9-171.1176.52.300111.7R462 I463 E469 A470R462-Q466 PolarHBondContact O-N 3.01Å; R462-Q466 VanDerWaalsContact O-N 3.09Å; I463-Q466 CarbonylContact O-C 3.56Å; I463-Q466 WeakPolarHBondContact O-CA 3.24Å; I463-Q466 WeakPolarHBondContact O-CB 3.38Å; I463-Q466 PolarHBondContact O-N 3.35Å; Q466-E469 PolarHBondContact O-N 3.5Å; Q466-A470 WeakPolarHBondContact O-CB 3.47Å; Q466-A470 PolarHBondContact O-N 3.2Å
467E97.8Very high97.9Very high114 Ų114104.2 Ų104.253%0.53350%0.498SS..Hα-helixtrans-65.1-40.9175.2-72-172.4161.700112.5I463 L464 E469 A470 C471I463-E467 HydrophobicContact CG2-CG 4.37Å; I463-E467 WeakPolarHBondContact O-CG 3.26Å; I463-E467 PolarHBondContact O-N 3.25Å; L464-E467 PolarHBondContact O-N 3Å; E467-E469 VanDerWaalsContact C-N 3.31Å; E467-E469 PolarHBondContact O-N 2.8Å; E467-A470 PolarHBondContact O-N 3.3Å; E467-C471 WeakPolarHBondContact O-CB 3.45Å; E467-C471 PolarHBondContact O-N 3.28Å; E467-C471 PolarHBondContact O-SG 3.34Å
468M98.1Very high97.9Very high104 Ų104104.4 Ų104.451%0.51250%0.501SS..Hα-helixtrans-61.6-40.6174.1-80.2-62.4-54.100111.8L464 R465 C471 R472L464-M468 WeakPolarHBondContact O-CB 3.31Å; L464-M468 WeakPolarHBondContact O-CG 3.35Å; L464-M468 PolarHBondContact O-N 3.01Å; R465-M468 PolarHBondContact O-N 3.45Å; M468-C471 PolarHBondContact O-N 3.24Å; M468-R472 WeakPolarHBondContact O-CG 3.32Å; M468-R472 PolarHBondContact O-N 2.89Å
469E97.9Very high98.1Very high115 Ų115105.7 Ų105.754%0.53750%0.501SS..Hα-helixtrans-68.1-43.5176.8-158.3148.3-125.400111.5R465 Q466 E467 C471 R472 E473R465-E469 WeakPolarHBondContact O-CB 3.42Å; R465-E469 PolarHBondContact O-N 2.9Å; Q466-E469 PolarHBondContact O-N 3.5Å; E467-E469 VanDerWaalsContact C-N 3.31Å; E467-E469 PolarHBondContact O-N 2.8Å; E469-C471 VanDerWaalsContact C-N 3.27Å; E469-C471 PolarHBondContact O-N 3.33Å; E469-R472 WeakPolarHBondContact O-CB 3.49Å; E469-R472 PolarHBondContact O-N 3.09Å; E469-R472 VanDerWaalsContact O-N 3.09Å; E469-E473 PolarHBondContact O-N 3.36Å
470A97.8Very high98.1Very high37 Ų37107.9 Ų107.931%0.30651%0.509SS..Hα-helixtrans-60.2-36.517200000112.3Q466 E467 E473 K474Q466-A470 WeakPolarHBondContact O-CB 3.47Å; Q466-A470 PolarHBondContact O-N 3.2Å; E467-A470 PolarHBondContact O-N 3.3Å; A470-E473 PolarHBondContact O-N 3.03Å; A470-K474 WeakPolarHBondContact O-CG 3.38Å; A470-K474 PolarHBondContact O-N 3.31Å
471C98.1Very high98.2Very high61 Ų61107 Ų10741%0.41251%0.507SS..Hα-helixtrans-66.5-41.5173.5-72.30000112E467 M468 E469 E473 K474 V475E467-C471 WeakPolarHBondContact O-CB 3.45Å; E467-C471 PolarHBondContact O-N 3.28Å; E467-C471 PolarHBondContact O-SG 3.34Å; M468-C471 PolarHBondContact O-N 3.24Å; E469-C471 VanDerWaalsContact C-N 3.27Å; E469-C471 PolarHBondContact O-N 3.33Å; C471-E473 VanDerWaalsContact C-N 3.33Å; C471-E473 PolarHBondContact O-N 2.93Å; C471-K474 WeakPolarHBondContact O-CB 3.41Å; C471-K474 PolarHBondContact O-N 2.93Å; C471-V475 WeakPolarHBondContact O-CG2 3.1Å; C471-V475 PolarHBondContact O-N 3.5Å
472R98.4Very high98.3Very high157 Ų157108.1 Ų108.159%0.59251%0.51SS*.Hα-helixtrans-59.4-43174.4-73.2176.4-179.6136.20.6111.8M468 E469 K474 V475 T476M468-R472 WeakPolarHBondContact O-CG 3.32Å; M468-R472 PolarHBondContact O-N 2.89Å; E469-R472 WeakPolarHBondContact O-CB 3.49Å; E469-R472 PolarHBondContact O-N 3.09Å; E469-R472 VanDerWaalsContact O-N 3.09Å; R472-K474 PolarHBondContact O-N 3.09Å; R472-V475 PolarHBondContact O-N 3.21Å; R472-T476 PolarHBondContact O-N 3.28Å; R472-T476 PolarHBondContact O-OG1 2.81Å
473E98.5Very high98.3Very high112 Ų112104.4 Ų104.452%0.52350%0.502SS..Hα-helixtrans-64.6-38.6175.9-68.9-179175.900113E469 A470 C471 V475 T476 R477E469-E473 PolarHBondContact O-N 3.36Å; A470-E473 PolarHBondContact O-N 3.03Å; C471-E473 VanDerWaalsContact C-N 3.33Å; C471-E473 PolarHBondContact O-N 2.93Å; E473-V475 VanDerWaalsContact C-N 3.34Å; E473-T476 PolarHBondContact O-N 3.25Å; E473-R477 WeakPolarHBondContact O-CG 3.41Å; E473-R477 PolarHBondContact O-N 3.27Å
474K98.6Very high98.4Very high120 Ų120106.4 Ų106.452%0.52251%0.51SS..Hα-helixtrans-61.3-42.7174.2-74171.9-175.3174.40111.2A470 C471 R472 R477 L478A470-K474 WeakPolarHBondContact O-CG 3.38Å; A470-K474 PolarHBondContact O-N 3.31Å; C471-K474 WeakPolarHBondContact O-CB 3.41Å; C471-K474 PolarHBondContact O-N 2.93Å; R472-K474 PolarHBondContact O-N 3.09Å; K474-R477 PolarHBondContact O-N 2.88Å; K474-L478 WeakPolarHBondContact O-CB 3.48Å; K474-L478 WeakPolarHBondContact O-CG 3.37Å; K474-L478 PolarHBondContact O-N 3.33Å
475V98.8Very high98.4Very high97 Ų97107.2 Ų107.259%0.58851%0.513SS*.Hα-helixtrans-61.8-46.4175.71720000111.1C471 R472 E473 R477 L478 H479C471-V475 WeakPolarHBondContact O-CG2 3.1Å; C471-V475 PolarHBondContact O-N 3.5Å; R472-V475 PolarHBondContact O-N 3.21Å; E473-V475 VanDerWaalsContact C-N 3.34Å; V475-R477 VanDerWaalsContact C-N 3.3Å; V475-R477 PolarHBondContact O-N 2.9Å; V475-L478 PolarHBondContact O-N 3.35Å; V475-H479 WeakPolarHBondContact O-CB 3.46Å; V475-H479 PolarHBondContact O-N 3.29Å
476T98.6Very high98.4Very high79 Ų79104.7 Ų104.749%0.48551%0.509SS..Hα-helixtrans-60.7-40.1176.9-58.70000112R472 E473 K480R472-T476 PolarHBondContact O-N 3.28Å; R472-T476 PolarHBondContact O-OG1 2.81Å; E473-T476 PolarHBondContact O-N 3.25Å; T476-K480 WeakPolarHBondContact O-CG 3.23Å; T476-K480 PolarHBondContact O-N 3.5Å; T476-K480 VanDerWaalsContact O-N 3.15Å
477R98.6Very high98.5Very high140 Ų140104.6 Ų104.653%0.52851%0.512SS..Hα-helixtrans-66.9-43.9175.4-77.7-174.9-77.3-171.4-8.9112.4E473 K474 V475 H479 K480 L481E473-R477 WeakPolarHBondContact O-CG 3.41Å; E473-R477 PolarHBondContact O-N 3.27Å; K474-R477 PolarHBondContact O-N 2.88Å; V475-R477 VanDerWaalsContact C-N 3.3Å; V475-R477 PolarHBondContact O-N 2.9Å; R477-H479 VanDerWaalsContact C-N 3.31Å; R477-H479 PolarHBondContact O-N 3.49Å; R477-K480 PolarHBondContact O-N 3.34Å; R477-L481 WeakPolarHBondContact O-CG 3.37Å; R477-L481 PolarHBondContact O-N 3.37Å
478L98.6Very high98.5Very high103 Ų103104 Ų10454%0.53952%0.516SS..Hα-helixtrans-58.4-45.2175.1-80.1169000111.1K474 V475 K480 L481 E482K474-L478 WeakPolarHBondContact O-CB 3.48Å; K474-L478 WeakPolarHBondContact O-CG 3.37Å; K474-L478 PolarHBondContact O-N 3.33Å; V475-L478 PolarHBondContact O-N 3.35Å; L478-K480 VanDerWaalsContact C-N 3.32Å; L478-K480 PolarHBondContact O-N 3.08Å; L478-L481 PolarHBondContact O-N 3.49Å; L478-L481 VanDerWaalsContact O-N 3.15Å; L478-E482 WeakPolarHBondContact O-CG 3.33Å; L478-E482 PolarHBondContact O-N 3.5Å
479H98.8Very high98.6Very high113 Ų113102 Ų10252%0.52351%0.512SS..Hα-helixtrans-60.2-41177.7-172.259.2000112.5V475 R477 E482 T483V475-H479 WeakPolarHBondContact O-CB 3.46Å; V475-H479 PolarHBondContact O-N 3.29Å; R477-H479 VanDerWaalsContact C-N 3.31Å; R477-H479 PolarHBondContact O-N 3.49Å; H479-E482 IonicContact ND1-OE2 3.22Å; H479-E482 WeakPolarHBondContact O-CB 3.14Å; H479-E482 PolarHBondContact O-N 3.17Å; H479-T483 WeakPolarHBondContact O-CG2 3.47Å; H479-T483 PolarHBondContact O-N 3.45Å; H479-T483 PolarHBondContact O-OG1 3.07Å
480K98.7Very high98.6Very high124 Ų124102 Ų10254%0.53951%0.512SS..Hα-helixtrans-60.8-46.7173.8-71.7178-179.8-175.20111.9T476 R477 L478 E482 T483 E484T476-K480 WeakPolarHBondContact O-CG 3.23Å; T476-K480 PolarHBondContact O-N 3.5Å; T476-K480 VanDerWaalsContact O-N 3.15Å; R477-K480 PolarHBondContact O-N 3.34Å; L478-K480 VanDerWaalsContact C-N 3.32Å; L478-K480 PolarHBondContact O-N 3.08Å; K480-E482 VanDerWaalsContact C-N 3.31Å; K480-E482 PolarHBondContact O-N 3.47Å; K480-T483 WeakPolarHBondContact CA-OG1 3.23Å; K480-T483 PolarHBondContact O-N 3.48Å; K480-T483 PolarHBondContact O-OG1 3.37Å; K480-E484 WeakPolarHBondContact O-CG 3.31Å; K480-E484 PolarHBondContact O-N 2.74Å
481L98.7Very high98.6Very high94 Ų94103 Ų10349%0.49252%0.521SS..Hα-helixtrans-61.6-39.7176.8-66.9173.8000111.9R477 L478 T483 E484 I485R477-L481 WeakPolarHBondContact O-CG 3.37Å; R477-L481 PolarHBondContact O-N 3.37Å; L478-L481 PolarHBondContact O-N 3.49Å; L478-L481 VanDerWaalsContact O-N 3.15Å; L481-T483 VanDerWaalsContact C-N 3.34Å; L481-T483 PolarHBondContact O-N 2.89Å; L481-E484 PolarHBondContact O-N 3.26Å; L481-I485 VanDerWaalsContact O-CG1 3.27Å; L481-I485 WeakPolarHBondContact O-CG1 3.26Å; L481-I485 PolarHBondContact O-N 3.32Å
482E98.6Very high98.7Very high106 Ų106107.6 Ų107.650%0.49553%0.53SS..Hα-helixtrans-60.2-43.2174.3-73.9170.7171.700111.8L478 H479 K480 I485 Q486L478-E482 WeakPolarHBondContact O-CG 3.33Å; L478-E482 PolarHBondContact O-N 3.5Å; H479-E482 IonicContact ND1-OE2 3.22Å; H479-E482 WeakPolarHBondContact O-CB 3.14Å; H479-E482 PolarHBondContact O-N 3.17Å; K480-E482 VanDerWaalsContact C-N 3.31Å; K480-E482 PolarHBondContact O-N 3.47Å; E482-I485 PolarHBondContact O-N 2.83Å; E482-Q486 WeakPolarHBondContact O-CG 3.45Å; E482-Q486 PolarHBondContact O-N 2.82Å; E482-Q486 VanDerWaalsContact O-N 3.07Å
483T98.6Very high98.7Very high52 Ų52104.5 Ų104.532%0.31952%0.523SS..Hα-helixtrans-66.1-39.2175.857.80000112.5H479 K480 L481 Q486 L487H479-T483 WeakPolarHBondContact O-CG2 3.47Å; H479-T483 PolarHBondContact O-N 3.45Å; H479-T483 PolarHBondContact O-OG1 3.07Å; K480-T483 WeakPolarHBondContact CA-OG1 3.23Å; K480-T483 PolarHBondContact O-N 3.48Å; K480-T483 PolarHBondContact O-OG1 3.37Å; L481-T483 VanDerWaalsContact C-N 3.34Å; L481-T483 PolarHBondContact O-N 2.89Å; T483-Q486 PolarHBondContact O-N 2.95Å; T483-L487 WeakPolarHBondContact O-CG 3.44Å; T483-L487 PolarHBondContact O-N 2.85Å
484E98.6Very high98.7Very high111 Ų111103.1 Ų103.152%0.51952%0.519SS..Hα-helixtrans-65-41.7176.2-74.1177.5-162.400111.6K480 L481 Q486 L487 V488K480-E484 WeakPolarHBondContact O-CG 3.31Å; K480-E484 PolarHBondContact O-N 2.74Å; L481-E484 PolarHBondContact O-N 3.26Å; E484-Q486 VanDerWaalsContact C-N 3.31Å; E484-Q486 PolarHBondContact O-N 3.34Å; E484-L487 PolarHBondContact O-N 3.5Å; E484-V488 WeakPolarHBondContact O-CB 3.41Å; E484-V488 VanDerWaalsContact O-CG2 3.32Å; E484-V488 WeakPolarHBondContact O-CG2 3.44Å; E484-V488 PolarHBondContact O-N 3.45Å
485I98.8Very high98.7Very high112 Ų112102.5 Ų102.557%0.57452%0.521SS*.Hα-helixtrans-60.1-42.9174.9-70.9165.4000110.7L481 E482 V488 S489L481-I485 VanDerWaalsContact O-CG1 3.27Å; L481-I485 WeakPolarHBondContact O-CG1 3.26Å; L481-I485 PolarHBondContact O-N 3.32Å; E482-I485 PolarHBondContact O-N 2.83Å; I485-V488 PolarHBondContact O-N 2.88Å; I485-S489 WeakPolarHBondContact O-CB 3.44Å; I485-S489 PolarHBondContact O-N 3.5Å; I485-S489 PolarHBondContact O-OG 3.47Å
486Q98.8Very high98.7Very high132 Ų13299.8 Ų99.862%0.61751%0.509SS*.Hα-helixtrans-62.1-46.6177-74.4168.811.300111.6E482 T483 E484 V488 S489 E490E482-Q486 WeakPolarHBondContact O-CG 3.45Å; E482-Q486 PolarHBondContact O-N 2.82Å; E482-Q486 VanDerWaalsContact O-N 3.07Å; T483-Q486 PolarHBondContact O-N 2.95Å; E484-Q486 VanDerWaalsContact C-N 3.31Å; E484-Q486 PolarHBondContact O-N 3.34Å; Q486-V488 PolarHBondContact O-N 3.08Å; Q486-S489 PolarHBondContact O-N 3.3Å; Q486-E490 PolarHBondContact O-N 3.37Å
487L98.8Very high98.7Very high113 Ų113101.5 Ų101.559%0.59251%0.509SS*.Hα-helixtrans-61.9-43.4177.9-72.7171.7000112.2T483 E484 S489 E490 A491T483-L487 WeakPolarHBondContact O-CG 3.44Å; T483-L487 PolarHBondContact O-N 2.85Å; E484-L487 PolarHBondContact O-N 3.5Å; L487-S489 VanDerWaalsContact C-N 3.33Å; L487-E490 PolarHBondContact O-N 3.3Å; L487-A491 WeakPolarHBondContact O-CB 3.26Å; L487-A491 PolarHBondContact O-N 3.47Å
488V98.8Very high98.7Very high102 Ų10297.2 Ų97.262%0.61850%0.501SS*.Hα-helixtrans-63.6-41.3176171.20000111E484 I485 Q486 A491 Y492E484-V488 WeakPolarHBondContact O-CB 3.41Å; E484-V488 VanDerWaalsContact O-CG2 3.32Å; E484-V488 WeakPolarHBondContact O-CG2 3.44Å; E484-V488 PolarHBondContact O-N 3.45Å; I485-V488 PolarHBondContact O-N 2.88Å; Q486-V488 PolarHBondContact O-N 3.08Å; V488-A491 PolarHBondContact O-N 3.46Å; V488-Y492 WeakPolarHBondContact O-CB 3.38Å; V488-Y492 PolarHBondContact O-N 2.88Å
489S98.7Very high98.7Very high61 Ų6194.7 Ų94.743%0.42749%0.492SS..Hα-helixtrans-64.3-42.6178-57.30000111.5I485 Q486 L487 Y492 E493I485-S489 WeakPolarHBondContact O-CB 3.44Å; I485-S489 PolarHBondContact O-N 3.5Å; I485-S489 PolarHBondContact O-OG 3.47Å; Q486-S489 PolarHBondContact O-N 3.3Å; L487-S489 VanDerWaalsContact C-N 3.33Å; S489-Y492 PolarHBondContact O-N 3.2Å; S489-E493 WeakPolarHBondContact O-CG 3.46Å; S489-E493 PolarHBondContact O-N 2.83Å
490E98.7Very high98.7Very high115 Ų11592.8 Ų92.854%0.53749%0.491SS..Hα-helixtrans-63.6-45175.1-174.3-176.5171.700111.6Q486 L487 Y492 E493 N494Q486-E490 PolarHBondContact O-N 3.37Å; L487-E490 PolarHBondContact O-N 3.3Å; E490-Y492 VanDerWaalsContact C-N 3.3Å; E490-Y492 PolarHBondContact O-N 2.82Å; E490-E493 PolarHBondContact O-N 3.25Å; E490-N494 WeakPolarHBondContact O-CB 3.36Å; E490-N494 VanDerWaalsContact O-CG 3.3Å; E490-N494 PolarHBondContact O-N 3.41Å; E490-N494 PolarHBondContact O-ND2 2.73Å
491A98.8Very high98.7Very high60 Ų6094.5 Ų94.550%0.49650%0.499SS..Hα-helixtrans-60.5-41.3176.100000111.7L487 V488 N494 L495L487-A491 WeakPolarHBondContact O-CB 3.26Å; L487-A491 PolarHBondContact O-N 3.47Å; V488-A491 PolarHBondContact O-N 3.46Å; A491-N494 PolarHBondContact O-N 3.31Å; A491-L495 WeakPolarHBondContact O-CB 3.36Å; A491-L495 PolarHBondContact O-N 2.98Å
492Y98.8Very high98.7Very high156 Ų15696.7 Ų96.761%0.61250%0.5SS*.Hα-helixtrans-62.1-49.2175.3177-92.1000111.9V488 S489 E490 N494 L495 A496V488-Y492 WeakPolarHBondContact O-CB 3.38Å; V488-Y492 PolarHBondContact O-N 2.88Å; S489-Y492 PolarHBondContact O-N 3.2Å; E490-Y492 VanDerWaalsContact C-N 3.3Å; E490-Y492 PolarHBondContact O-N 2.82Å; Y492-N494 VanDerWaalsContact C-N 3.32Å; Y492-N494 PolarHBondContact O-N 3.32Å; Y492-L495 PolarHBondContact O-N 3.06Å; Y492-A496 WeakPolarHBondContact O-CB 3.35Å; Y492-A496 PolarHBondContact O-N 3.2Å
493E98.6Very high98.7Very high92 Ų9297.8 Ų97.843%0.4351%0.506SS..Hα-helixtrans-60.2-42.3178.1-79.1-61.8124.800111.9S489 E490 A496 K497S489-E493 WeakPolarHBondContact O-CG 3.46Å; S489-E493 PolarHBondContact O-N 2.83Å; E490-E493 PolarHBondContact O-N 3.25Å; E493-A496 PolarHBondContact O-N 3.39Å; E493-K497 WeakPolarHBondContact O-CB 3.46Å; E493-K497 VanDerWaalsContact O-CG 3.22Å; E493-K497 WeakPolarHBondContact O-CG 3.26Å; E493-K497 PolarHBondContact O-N 2.83Å
494N98.7Very high98.7Very high83 Ų8397.9 Ų97.944%0.44451%0.512SS..Hα-helixtrans-65-41.6176.2-74-27.8000111.7E490 A491 Y492 K497 S498E490-N494 WeakPolarHBondContact O-CB 3.36Å; E490-N494 VanDerWaalsContact O-CG 3.3Å; E490-N494 PolarHBondContact O-N 3.41Å; E490-N494 PolarHBondContact O-ND2 2.73Å; A491-N494 PolarHBondContact O-N 3.31Å; Y492-N494 VanDerWaalsContact C-N 3.32Å; Y492-N494 PolarHBondContact O-N 3.32Å; N494-K497 PolarHBondContact O-N 2.87Å; N494-S498 WeakPolarHBondContact O-CB 3.5Å; N494-S498 PolarHBondContact O-N 3.16Å; N494-S498 PolarHBondContact O-OG 2.88Å
495L98.8Very high98.7Very high107 Ų10797.8 Ų97.856%0.5651%0.514SS*.Hα-helixtrans-63-47.4175-178.759.9000111.1A491 Y492 K497 S498 S499A491-L495 WeakPolarHBondContact O-CB 3.36Å; A491-L495 PolarHBondContact O-N 2.98Å; Y492-L495 PolarHBondContact O-N 3.06Å; L495-K497 PolarHBondContact O-N 2.92Å; L495-S498 PolarHBondContact O-N 3.37Å; L495-S498 PolarHBondContact O-OG 3.48Å; L495-S499 WeakPolarHBondContact O-CB 3.36Å; L495-S499 PolarHBondContact O-N 3.49Å
496A98.8Very high98.7Very high41 Ų4198 Ų9834%0.33951%0.512SS..Hα-helixtrans-58.1-46.9177.300000111.6Y492 E493 S499 S500Y492-A496 WeakPolarHBondContact O-CB 3.35Å; Y492-A496 PolarHBondContact O-N 3.2Å; E493-A496 PolarHBondContact O-N 3.39Å; A496-S499 WeakPolarHBondContact O-CB 2.94Å; A496-S499 PolarHBondContact O-N 3.23Å; A496-S500 PolarHBondContact O-N 2.75Å
497K98.8Very high98.7Very high114 Ų11499.1 Ų99.150%0.49652%0.515SS..Hα-helixtrans-61.1-45.2175-72.4167.5-171167.10112.1E493 N494 L495 S499 S500 K501E493-K497 WeakPolarHBondContact O-CB 3.46Å; E493-K497 VanDerWaalsContact O-CG 3.22Å; E493-K497 WeakPolarHBondContact O-CG 3.26Å; E493-K497 PolarHBondContact O-N 2.83Å; N494-K497 PolarHBondContact O-N 2.87Å; L495-K497 PolarHBondContact O-N 2.92Å; K497-S499 VanDerWaalsContact C-N 3.3Å; K497-S499 PolarHBondContact O-N 2.87Å; K497-S500 PolarHBondContact O-N 3.49Å; K497-K501 WeakPolarHBondContact O-CG 3.35Å; K497-K501 PolarHBondContact O-N 3.18Å; K497-K501 VanDerWaalsContact O-N 3.08Å
498S98.7Very high98.7Very high51 Ų5197.1 Ų97.136%0.35751%0.508SS..Hα-helixtrans-65-36.2177.878.70000112N494 L495 K501 R502N494-S498 WeakPolarHBondContact O-CB 3.5Å; N494-S498 PolarHBondContact O-N 3.16Å; N494-S498 PolarHBondContact O-OG 2.88Å; L495-S498 PolarHBondContact O-N 3.37Å; L495-S498 PolarHBondContact O-OG 3.48Å; S498-K501 PolarHBondContact O-N 2.88Å; S498-R502 PolarHBondContact O-N 2.92Å
499S98.6Very high98.7Very high49 Ų4997.5 Ų97.534%0.34351%0.505SS..Hα-helixtrans-65.8-46.7176.4-165.10000111.2L495 A496 K497 K501 R502 E503L495-S499 WeakPolarHBondContact O-CB 3.36Å; L495-S499 PolarHBondContact O-N 3.49Å; A496-S499 WeakPolarHBondContact O-CB 2.94Å; A496-S499 PolarHBondContact O-N 3.23Å; K497-S499 VanDerWaalsContact C-N 3.3Å; K497-S499 PolarHBondContact O-N 2.87Å; S499-K501 VanDerWaalsContact C-N 3.33Å; S499-K501 PolarHBondContact O-N 3.41Å; S499-R502 WeakPolarHBondContact O-CB 3.42Å; S499-R502 PolarHBondContact O-N 3.35Å; S499-R502 VanDerWaalsContact O-N 3.12Å; S499-E503 PolarHBondContact O-N 3.49Å
500S98.7Very high98.7Very high73 Ų73102 Ų10251%0.5151%0.512SS..Hα-helixtrans-60.2-40.7175.9-178.40000112.3A496 K497 R502 E503 A504A496-S500 PolarHBondContact O-N 2.75Å; K497-S500 PolarHBondContact O-N 3.49Å; S500-R502 PolarHBondContact O-N 2.92Å; S500-E503 PolarHBondContact O-N 2.93Å; S500-A504 WeakPolarHBondContact O-CB 3.44Å; S500-A504 PolarHBondContact O-N 3.34Å
501K98.8Very high98.7Very high160 Ų16099.5 Ų99.570%0.69651%0.507SS*.Hα-helixtrans-61.5-42.8173.6-72.2175.8-177178.50112.1K497 S498 S499 A504 L505K497-K501 WeakPolarHBondContact O-CG 3.35Å; K497-K501 PolarHBondContact O-N 3.18Å; K497-K501 VanDerWaalsContact O-N 3.08Å; S498-K501 PolarHBondContact O-N 2.88Å; S499-K501 VanDerWaalsContact C-N 3.33Å; S499-K501 PolarHBondContact O-N 3.41Å; K501-A504 PolarHBondContact O-N 2.69Å; K501-L505 PolarHBondContact O-N 3.36Å; K501-L505 VanDerWaalsContact O-N 3.07Å
502R98.8Very high98.7Very high140 Ų140103.7 Ų103.753%0.52851%0.514SS..Hα-helixtrans-61.8-46.9177.2-168.2-169.3-52.8116.43.4111S498 S499 S500 A504 L505 E506S498-R502 PolarHBondContact O-N 2.92Å; S499-R502 WeakPolarHBondContact O-CB 3.42Å; S499-R502 PolarHBondContact O-N 3.35Å; S499-R502 VanDerWaalsContact O-N 3.12Å; S500-R502 PolarHBondContact O-N 2.92Å; R502-A504 PolarHBondContact O-N 2.95Å; R502-L505 PolarHBondContact O-N 3Å; R502-E506 WeakPolarHBondContact O-CB 3.43Å; R502-E506 PolarHBondContact O-N 3.48Å
503E98.5Very high98.7Very high130 Ų130101.3 Ų101.361%0.60751%0.511SS*.Hα-helixtrans-61.6-42.6178.5-171.2-174.5166.900111.9S499 S500 L505 E506 K507S499-E503 PolarHBondContact O-N 3.49Å; S500-E503 PolarHBondContact O-N 2.93Å; E503-L505 PolarHBondContact O-N 2.97Å; E503-E506 PolarHBondContact O-N 2.77Å; E503-K507 VanDerWaalsContact O-CB 3.26Å; E503-K507 WeakPolarHBondContact O-CB 3.19Å; E503-K507 PolarHBondContact O-N 2.89Å
504A98.8Very high98.7Very high54 Ų54101 Ų10145%0.44651%0.51SS..Hα-helixtrans-63.1-40.7176.700000112.6S500 K501 R502 T508S500-A504 WeakPolarHBondContact O-CB 3.44Å; S500-A504 PolarHBondContact O-N 3.34Å; K501-A504 PolarHBondContact O-N 2.69Å; R502-A504 PolarHBondContact O-N 2.95Å; A504-T508 PolarHBondContact O-N 2.93Å; A504-T508 PolarHBondContact O-OG1 3.36Å
505L98.8Very high98.7Very high108 Ų108100.1 Ų100.157%0.56551%0.505SS*.Hα-helixtrans-66.2-48175.8-179.565.5000111.1K501 R502 E503 K507 T508 M509K501-L505 PolarHBondContact O-N 3.36Å; K501-L505 VanDerWaalsContact O-N 3.07Å; R502-L505 PolarHBondContact O-N 3Å; E503-L505 PolarHBondContact O-N 2.97Å; L505-K507 VanDerWaalsContact C-N 3.32Å; L505-K507 PolarHBondContact O-N 3.17Å; L505-T508 WeakPolarHBondContact O-CB 3.35Å; L505-T508 PolarHBondContact O-N 2.97Å; L505-T508 VanDerWaalsContact O-N 3.09Å; L505-M509 HydrophobicContact CD1-CG 4.44Å; L505-M509 HydrophobicContact CD1-SD 4.44Å; L505-M509 HydrophobicContact CG-CG 4.49Å; L505-M509 HydrophobicContact CG-SD 4.09Å; L505-M509 WeakPolarHBondContact O-CG 3.48Å; L505-M509 PolarHBondContact O-N 3.21Å
506E98.7Very high98.7Very high116 Ų116100.5 Ų100.554%0.54250%0.504SS..Hα-helixtrans-57.3-47.3177.6-174.6-175.2155.200110.8R502 E503 T508 M509 R510R502-E506 WeakPolarHBondContact O-CB 3.43Å; R502-E506 PolarHBondContact O-N 3.48Å; E503-E506 PolarHBondContact O-N 2.77Å; E506-T508 VanDerWaalsContact C-N 3.27Å; E506-T508 PolarHBondContact O-N 3.29Å; E506-M509 PolarHBondContact O-N 2.92Å; E506-R510 VanDerWaalsContact O-CB 3.24Å; E506-R510 WeakPolarHBondContact O-CB 3.4Å; E506-R510 PolarHBondContact O-N 2.84Å
507K98.8Very high98.7Very high156 Ų156103.2 Ų103.268%0.67852%0.516SS*.Hα-helixtrans-57.1-41.4175.5-174.9174.9-176.9174.50111.9E503 L505 S511E503-K507 VanDerWaalsContact O-CB 3.26Å; E503-K507 WeakPolarHBondContact O-CB 3.19Å; E503-K507 PolarHBondContact O-N 2.89Å; L505-K507 VanDerWaalsContact C-N 3.32Å; L505-K507 PolarHBondContact O-N 3.17Å; K507-S511 WeakPolarHBondContact O-CB 3.37Å; K507-S511 PolarHBondContact O-N 3.4Å
508T98.8Very high98.7Very high72 Ų72104 Ų10444%0.44252%0.516SS..Hα-helixtrans-67.6-44.6177.7-58.20000111.7A504 L505 E506 S511 K512A504-T508 PolarHBondContact O-N 2.93Å; A504-T508 PolarHBondContact O-OG1 3.36Å; L505-T508 WeakPolarHBondContact O-CB 3.35Å; L505-T508 PolarHBondContact O-N 2.97Å; L505-T508 VanDerWaalsContact O-N 3.09Å; E506-T508 VanDerWaalsContact C-N 3.27Å; E506-T508 PolarHBondContact O-N 3.29Å; T508-S511 PolarHBondContact O-N 2.87Å; T508-K512 WeakPolarHBondContact O-CG 3.34Å; T508-K512 PolarHBondContact O-N 2.65Å
509M98.8Very high98.7Very high110 Ų110109.5 Ų109.554%0.54253%0.529SS..Hα-helixtrans-63.1-47.3177.5-71.7177.762.200111.2L505 E506 S511 K512 L513L505-M509 HydrophobicContact CD1-CG 4.44Å; L505-M509 HydrophobicContact CD1-SD 4.44Å; L505-M509 HydrophobicContact CG-CG 4.49Å; L505-M509 HydrophobicContact CG-SD 4.09Å; L505-M509 WeakPolarHBondContact O-CG 3.48Å; L505-M509 PolarHBondContact O-N 3.21Å; E506-M509 PolarHBondContact O-N 2.92Å; M509-S511 PolarHBondContact O-N 3.04Å; M509-K512 PolarHBondContact O-N 2.75Å; M509-L513 WeakPolarHBondContact O-CG 3.3Å; M509-L513 PolarHBondContact O-N 3.38Å
510R98.7Very high98.7Very high156 Ų156111.7 Ų111.759%0.58954%0.536SS*.Hα-helixtrans-58.8-48.2175.8-177.2175.4179.3149.23.3111.5E506 K512 L513 E514E506-R510 VanDerWaalsContact O-CB 3.24Å; E506-R510 WeakPolarHBondContact O-CB 3.4Å; E506-R510 PolarHBondContact O-N 2.84Å; R510-K512 VanDerWaalsContact C-N 3.31Å; R510-K512 PolarHBondContact O-N 3.43Å; R510-L513 PolarHBondContact O-N 3.47Å; R510-E514 HydrophobicContact CG-CG 4.35Å; R510-E514 VanDerWaalsContact CG-OE1 3.31Å; R510-E514 WeakPolarHBondContact CG-OE1 3.34Å; R510-E514 IonicContact CZ-OE1 2.8Å; R510-E514 IonicContact NE-OE1 3.58Å; R510-E514 PolarHBondContact NE-OE1 3.43Å; R510-E514 IonicContact NH2-OE1 3.67Å; R510-E514 WeakPolarHBondContact O-CB 2.99Å; R510-E514 VanDerWaalsContact O-CG 3.32Å; R510-E514 WeakPolarHBondContact O-CG 3.4Å; R510-E514 PolarHBondContact O-N 2.87Å
511S98.8Very high98.7Very high62 Ų62114.2 Ų114.243%0.43454%0.54SS..Hα-helixtrans-59.1-40.6177.5-175.60000112.6K507 T508 M509 L515K507-S511 WeakPolarHBondContact O-CB 3.37Å; K507-S511 PolarHBondContact O-N 3.4Å; T508-S511 PolarHBondContact O-N 2.87Å; M509-S511 PolarHBondContact O-N 3.04Å; S511-L515 WeakPolarHBondContact O-CB 3.45Å; S511-L515 PolarHBondContact O-N 2.76Å
512K98.8Very high98.7Very high148 Ų148109.6 Ų109.664%0.64352%0.523SS*.Hα-helixtrans-63.4-45.7175.9-77.4-179.3176.7-176.60112.2T508 M509 R510 L515 Q516T508-K512 WeakPolarHBondContact O-CG 3.34Å; T508-K512 PolarHBondContact O-N 2.65Å; M509-K512 PolarHBondContact O-N 2.75Å; R510-K512 VanDerWaalsContact C-N 3.31Å; R510-K512 PolarHBondContact O-N 3.43Å; K512-L515 PolarHBondContact O-N 3.47Å; K512-Q516 PolarHBondContact O-N 2.76Å
513L98.8Very high98.7Very high105 Ų105108.3 Ų108.355%0.5552%0.521SS..Hα-helixtrans-64.8-45.1177.8-69.3173.5000111.5M509 R510 L515 Q516 V517M509-L513 WeakPolarHBondContact O-CG 3.3Å; M509-L513 PolarHBondContact O-N 3.38Å; R510-L513 PolarHBondContact O-N 3.47Å; L513-L515 VanDerWaalsContact C-N 3.26Å; L513-L515 PolarHBondContact O-N 3.39Å; L513-Q516 WeakPolarHBondContact O-CB 3.34Å; L513-Q516 PolarHBondContact O-N 2.89Å; L513-Q516 VanDerWaalsContact O-N 3.09Å; L513-V517 WeakPolarHBondContact O-CG2 3.34Å; L513-V517 PolarHBondContact O-N 3.1Å
514E98.6Very high98.7Very high86 Ų86105.9 Ų105.940%0.40251%0.512SS..Hα-helixtrans-59.3-37.5176.6-74172.9-178.900112.2R510 R518R510-E514 HydrophobicContact CG-CG 4.35Å; R510-E514 VanDerWaalsContact CG-OE1 3.31Å; R510-E514 WeakPolarHBondContact CG-OE1 3.34Å; R510-E514 IonicContact CZ-OE1 2.8Å; R510-E514 IonicContact NE-OE1 3.58Å; R510-E514 PolarHBondContact NE-OE1 3.43Å; R510-E514 IonicContact NH2-OE1 3.67Å; R510-E514 WeakPolarHBondContact O-CB 2.99Å; R510-E514 VanDerWaalsContact O-CG 3.32Å; R510-E514 WeakPolarHBondContact O-CG 3.4Å; R510-E514 PolarHBondContact O-N 2.87Å; E514-R518 PolarHBondContact O-N 3.04Å; E514-R518 VanDerWaalsContact O-N 3.09Å; E514-R518 PolarHBondContact O-NE 3.26Å
515L98.7Very high98.7Very high64 Ų64108.4 Ų108.434%0.33551%0.51SS..Hα-helixtrans-69.4-39.6174.8-174.465.4000111.9S511 K512 L513 R518 R519S511-L515 WeakPolarHBondContact O-CB 3.45Å; S511-L515 PolarHBondContact O-N 2.76Å; K512-L515 PolarHBondContact O-N 3.47Å; L513-L515 VanDerWaalsContact C-N 3.26Å; L513-L515 PolarHBondContact O-N 3.39Å; L515-R518 PolarHBondContact O-N 3.29Å; L515-R519 WeakPolarHBondContact O-CG 3.49Å; L515-R519 PolarHBondContact O-N 3.43Å
516Q98.5Very high98.7Very high115 Ų115106.6 Ų106.654%0.53750%0.501SS..Hα-helixtrans-64.2-43.1176.7-171.5173.123.700111.4K512 L513 R518 R519 L520K512-Q516 PolarHBondContact O-N 2.76Å; L513-Q516 WeakPolarHBondContact O-CB 3.34Å; L513-Q516 PolarHBondContact O-N 2.89Å; L513-Q516 VanDerWaalsContact O-N 3.09Å; Q516-R518 PolarHBondContact O-N 3Å; Q516-R519 PolarHBondContact O-N 2.92Å; Q516-L520 HydrophobicContact CG-CD1 4.22Å; Q516-L520 WeakPolarHBondContact O-CB 3.38Å; Q516-L520 WeakPolarHBondContact O-CG 3.39Å; Q516-L520 PolarHBondContact O-N 2.92Å
517V98.7Very high98.7Very high99 Ų99105 Ų10560%0.650%0.496SS*.Hα-helixtrans-58.1-48173.8170.80000110.6L513 R519 L520 H521L513-V517 WeakPolarHBondContact O-CG2 3.34Å; L513-V517 PolarHBondContact O-N 3.1Å; V517-R519 PolarHBondContact O-N 3.44Å; V517-L520 PolarHBondContact O-N 3.37Å; V517-H521 WeakPolarHBondContact O-CB 3.5Å; V517-H521 PolarHBondContact O-N 2.87Å
518R98.8Very high98.7Very high129 Ų129106.3 Ų106.349%0.48750%0.497SS..Hα-helixtrans-59.4-48.2176.9-83.1-179.4-83.6134.4-8.8112.5E514 L515 Q516 L520 H521 D522E514-R518 PolarHBondContact O-N 3.04Å; E514-R518 VanDerWaalsContact O-N 3.09Å; E514-R518 PolarHBondContact O-NE 3.26Å; L515-R518 PolarHBondContact O-N 3.29Å; Q516-R518 PolarHBondContact O-N 3Å; R518-L520 VanDerWaalsContact C-N 3.35Å; R518-L520 PolarHBondContact O-N 2.95Å; R518-H521 WeakPolarHBondContact O-CB 3.06Å; R518-H521 PolarHBondContact O-N 2.96Å; R518-D522 VanDerWaalsContact O-CG 3.31Å; R518-D522 PolarHBondContact O-N 3.32Å
519R98.8Very high98.7Very high168 Ų168107.5 Ų107.563%0.63450%0.497SS*.Hα-helixtrans-60-42.5177.8-73.6176.4-177.8-177.30.3112.7L515 Q516 V517 D522 F523L515-R519 WeakPolarHBondContact O-CG 3.49Å; L515-R519 PolarHBondContact O-N 3.43Å; Q516-R519 PolarHBondContact O-N 2.92Å; V517-R519 PolarHBondContact O-N 3.44Å; R519-D522 PolarHBondContact O-N 3.08Å; R519-F523 WeakPolarHBondContact O-CB 3.39Å; R519-F523 PolarHBondContact O-N 2.96Å
520L98.8Very high98.7Very high94 Ų94109.1 Ų109.149%0.49250%0.497SS..Hα-helixtrans-66.9-39176.6-74.4173.1000111.5Q516 V517 R518 F523 N524Q516-L520 HydrophobicContact CG-CD1 4.22Å; Q516-L520 WeakPolarHBondContact O-CB 3.38Å; Q516-L520 WeakPolarHBondContact O-CG 3.39Å; Q516-L520 PolarHBondContact O-N 2.92Å; V517-L520 PolarHBondContact O-N 3.37Å; R518-L520 VanDerWaalsContact C-N 3.35Å; R518-L520 PolarHBondContact O-N 2.95Å; L520-F523 PolarHBondContact O-N 3.41Å; L520-N524 WeakPolarHBondContact O-CB 3.33Å; L520-N524 PolarHBondContact O-N 3.18Å; L520-N524 PolarHBondContact O-ND2 2.8Å
521H98.8Very high98.7Very high126 Ų126107.1 Ų107.158%0.58350%0.496SS*.Hα-helixtrans-64.5-44.5176.1-170.8-80.2000111.5V517 R518 N524 R525V517-H521 WeakPolarHBondContact O-CB 3.5Å; V517-H521 PolarHBondContact O-N 2.87Å; R518-H521 WeakPolarHBondContact O-CB 3.06Å; R518-H521 PolarHBondContact O-N 2.96Å; H521-N524 PolarHBondContact O-N 3.25Å; H521-R525 WeakPolarHBondContact O-CB 3.29Å; H521-R525 PolarHBondContact O-N 2.96Å
522D98.7Very high98.7Very high64 Ų64110.6 Ų110.634%0.34251%0.505SS..Hα-helixtrans-62-46.7175.3-68.4-31.8000111.3R518 R519 N524 R525 D526R518-D522 VanDerWaalsContact O-CG 3.31Å; R518-D522 PolarHBondContact O-N 3.32Å; R519-D522 PolarHBondContact O-N 3.08Å; D522-N524 VanDerWaalsContact C-N 3.33Å; D522-N524 PolarHBondContact O-N 2.89Å; D522-R525 WeakPolarHBondContact O-CB 3.46Å; D522-R525 PolarHBondContact O-N 3.37Å; D522-R525 VanDerWaalsContact O-N 3.16Å; D522-R525 IonicContact OD1-CZ 3.77Å; D522-R525 IonicContact OD1-NH1 3.75Å; D522-R525 PolarHBondContact OD1-NH1 3.28Å; D522-R525 IonicContact OD1-NH2 2.83Å; D522-R525 PolarHBondContact OD1-NH2 3.39Å; D522-D526 PolarHBondContact O-N 2.85Å
523F98.8Very high98.6Very high113 Ų113107.1 Ų107.150%0.49650%0.496SS..Hα-helixtrans-59.6-42.3176.3178.9-98.6000112.6R519 L520 D526 L527R519-F523 WeakPolarHBondContact O-CB 3.39Å; R519-F523 PolarHBondContact O-N 2.96Å; L520-F523 PolarHBondContact O-N 3.41Å; F523-D526 PolarHBondContact O-N 2.84Å; F523-L527 WeakPolarHBondContact O-CB 3.29Å; F523-L527 PolarHBondContact O-N 2.89Å
524N98.8Very high98.6Very high78 Ų78104.2 Ų104.242%0.41749%0.488SS..Hα-helixtrans-67-36.9176.7-80.9-53.1000112.2L520 H521 D522 L527 R528L520-N524 WeakPolarHBondContact O-CB 3.33Å; L520-N524 PolarHBondContact O-N 3.18Å; L520-N524 PolarHBondContact O-ND2 2.8Å; H521-N524 PolarHBondContact O-N 3.25Å; D522-N524 VanDerWaalsContact C-N 3.33Å; D522-N524 PolarHBondContact O-N 2.89Å; N524-L527 PolarHBondContact O-N 3.46Å; N524-R528 WeakPolarHBondContact O-CG 3.3Å; N524-R528 PolarHBondContact O-N 3.22Å
525R98.7Very high98.6Very high107 Ų107104.5 Ų104.540%0.40449%0.492SS..Hα-helixtrans-61.4-51.3172.8-178.6-179.663.3-120-11.4110.3H521 D522 L527 R528 E529H521-R525 WeakPolarHBondContact O-CB 3.29Å; H521-R525 PolarHBondContact O-N 2.96Å; D522-R525 WeakPolarHBondContact O-CB 3.46Å; D522-R525 PolarHBondContact O-N 3.37Å; D522-R525 VanDerWaalsContact O-N 3.16Å; D522-R525 IonicContact OD1-CZ 3.77Å; D522-R525 IonicContact OD1-NH1 3.75Å; D522-R525 PolarHBondContact OD1-NH1 3.28Å; D522-R525 IonicContact OD1-NH2 2.83Å; D522-R525 PolarHBondContact OD1-NH2 3.39Å; R525-L527 PolarHBondContact O-N 3.47Å; R525-R528 WeakPolarHBondContact O-CB 3.33Å; R525-R528 PolarHBondContact O-N 2.87Å; R525-R528 VanDerWaalsContact O-N 3.1Å; R525-E529 WeakPolarHBondContact CG-OE1 3.34Å; R525-E529 WeakPolarHBondContact O-CG 3.3Å; R525-E529 PolarHBondContact O-N 2.93Å
526D98.8Very high98.5Very high71 Ų71109.1 Ų109.138%0.3851%0.509SS..Hα-helixtrans-61.7-32.8179-66.42.5000112.4D522 F523 R530D522-D526 PolarHBondContact O-N 2.85Å; F523-D526 PolarHBondContact O-N 2.84Å; D526-R530 WeakPolarHBondContact O-CB 3.33Å; D526-R530 WeakPolarHBondContact O-CG 3.41Å; D526-R530 PolarHBondContact O-N 3.5Å; D526-R530 PolarHBondContact O-NE 3.37Å
527L98.8Very high98.4Very high81 Ų81108.3 Ų108.342%0.42451%0.506SS..Hα-helixtrans-69.6-43.6175.3-173.863.3000111.4F523 N524 R525 R530 M531F523-L527 WeakPolarHBondContact O-CB 3.29Å; F523-L527 PolarHBondContact O-N 2.89Å; N524-L527 PolarHBondContact O-N 3.46Å; R525-L527 PolarHBondContact O-N 3.47Å; L527-R530 PolarHBondContact O-N 3.47Å; L527-M531 WeakPolarHBondContact O-CB 3.44Å; L527-M531 PolarHBondContact O-N 2.85Å
528R98.6Very high98.3Very high185 Ų185108.2 Ų108.270%0.69850%0.501SS*.Hα-helixtrans-62.5-45.4174.9-72.6176.5-170.3-138.33.3111.3N524 R525 R530 M531 E532N524-R528 WeakPolarHBondContact O-CG 3.3Å; N524-R528 PolarHBondContact O-N 3.22Å; R525-R528 WeakPolarHBondContact O-CB 3.33Å; R525-R528 PolarHBondContact O-N 2.87Å; R525-R528 VanDerWaalsContact O-N 3.1Å; R528-R530 VanDerWaalsContact C-N 3.33Å; R528-R530 PolarHBondContact O-N 2.75Å; R528-M531 PolarHBondContact O-N 2.9Å; R528-E532 WeakPolarHBondContact O-CB 3.44Å; R528-E532 PolarHBondContact O-N 3.18Å
529E98.6Very high98.1Very high97 Ų97104.8 Ų104.845%0.45350%0.5SS..Hα-helixtrans-61.3-40.7177.1-72.8176.5-164.900111.9R525 E532 T533R525-E529 WeakPolarHBondContact CG-OE1 3.34Å; R525-E529 WeakPolarHBondContact O-CG 3.3Å; R525-E529 PolarHBondContact O-N 2.93Å; E529-E532 PolarHBondContact O-N 2.93Å; E529-T533 WeakPolarHBondContact O-CB 2.99Å; E529-T533 PolarHBondContact O-N 3.47Å; E529-T533 PolarHBondContact O-OG1 3.38Å
530R98.6Very high97.9Very high143 Ų14399.3 Ų99.354%0.5449%0.488SS..Hα-helixtrans-65.7-41.9174.5-82.6-175.5-75164.3-6.5112.7D526 L527 R528 T533 A534D526-R530 WeakPolarHBondContact O-CB 3.33Å; D526-R530 WeakPolarHBondContact O-CG 3.41Å; D526-R530 PolarHBondContact O-N 3.5Å; D526-R530 PolarHBondContact O-NE 3.37Å; L527-R530 PolarHBondContact O-N 3.47Å; R528-R530 VanDerWaalsContact C-N 3.33Å; R528-R530 PolarHBondContact O-N 2.75Å; R530-T533 PolarHBondContact O-N 3.3Å; R530-A534 WeakPolarHBondContact O-CB 3.44Å; R530-A534 PolarHBondContact O-N 3.24Å
531M98.4Very high97.6Very high114 Ų114101 Ų10156%0.56249%0.492SS*.Hα-helixtrans-63.1-45.3175.8-177.3-172.270.100111.1L527 R528 T533 A534 N535L527-M531 WeakPolarHBondContact O-CB 3.44Å; L527-M531 PolarHBondContact O-N 2.85Å; R528-M531 PolarHBondContact O-N 2.9Å; M531-T533 VanDerWaalsContact C-N 3.32Å; M531-T533 PolarHBondContact O-N 2.79Å; M531-A534 PolarHBondContact O-N 2.92Å; M531-N535 WeakPolarHBondContact O-CB 3.45Å; M531-N535 PolarHBondContact O-N 2.89Å
532E98.2Very high97.2Very high136 Ų136101.8 Ų101.864%0.63650%0.495SS*.Hα-helixtrans-60.9-43.1176-175.1178-179.600111.3R528 E529 N535 K536R528-E532 WeakPolarHBondContact O-CB 3.44Å; R528-E532 PolarHBondContact O-N 3.18Å; E529-E532 PolarHBondContact O-N 2.93Å; E532-N535 PolarHBondContact O-N 2.93Å; E532-K536 WeakPolarHBondContact O-CB 3.4Å; E532-K536 PolarHBondContact O-N 3.23Å
533T98.1Very high96.7Very high74 Ų74102.5 Ų102.545%0.45451%0.505SS..Hα-helixtrans-63.4-43.4176.3-580000111.7E529 R530 M531 K536 Q537E529-T533 WeakPolarHBondContact O-CB 2.99Å; E529-T533 PolarHBondContact O-N 3.47Å; E529-T533 PolarHBondContact O-OG1 3.38Å; R530-T533 PolarHBondContact O-N 3.3Å; M531-T533 VanDerWaalsContact C-N 3.32Å; M531-T533 PolarHBondContact O-N 2.79Å; T533-K536 PolarHBondContact O-N 3.19Å; T533-Q537 WeakPolarHBondContact O-CG 3.15Å; T533-Q537 PolarHBondContact O-N 2.95Å
534A98.1Very high96.3Very high45 Ų45101.5 Ų101.537%0.37250%0.504SS..Hα-helixtrans-63.7-44.5176.500000111.6R530 M531 K536 Q537 L538R530-A534 WeakPolarHBondContact O-CB 3.44Å; R530-A534 PolarHBondContact O-N 3.24Å; M531-A534 PolarHBondContact O-N 2.92Å; A534-K536 PolarHBondContact O-N 3.22Å; A534-Q537 WeakPolarHBondContact O-CB 3.28Å; A534-Q537 PolarHBondContact O-N 3.43Å; A534-L538 WeakPolarHBondContact O-CG 3.17Å; A534-L538 PolarHBondContact O-N 3.39Å
535N97.9Very high95.8Very high91 Ų91100.8 Ų100.849%0.48751%0.505SS..Hα-helixtrans-62.4-42.1175.6-78.1-7.1000111.8M531 E532 Q537 L538 A539M531-N535 WeakPolarHBondContact O-CB 3.45Å; M531-N535 PolarHBondContact O-N 2.89Å; E532-N535 PolarHBondContact O-N 2.93Å; N535-Q537 VanDerWaalsContact C-N 3.28Å; N535-Q537 PolarHBondContact O-N 3.41Å; N535-L538 PolarHBondContact O-N 3.48Å; N535-A539 WeakPolarHBondContact O-CB 3.49Å; N535-A539 PolarHBondContact O-N 2.8Å
536K97.4Very high95.4Very high161 Ų16199.3 Ų99.370%0.751%0.512SS*.Hα-helixtrans-60.4-40.3174.7-172.6175.3-178.9177.90111.4E532 T533 A534 S540E532-K536 WeakPolarHBondContact O-CB 3.4Å; E532-K536 PolarHBondContact O-N 3.23Å; T533-K536 PolarHBondContact O-N 3.19Å; A534-K536 PolarHBondContact O-N 3.22Å; K536-S540 WeakPolarHBondContact O-CB 3.07Å; K536-S540 PolarHBondContact O-N 3.11Å; K536-S540 PolarHBondContact O-OG 3.48Å
537Q96.9Very high95.1Very high98 Ų9899.5 Ų99.546%0.45851%0.51SS..Hα-helixtrans-66-42.1175.2-73.217729.900112.4T533 A534 N535 S540 K541T533-Q537 WeakPolarHBondContact O-CG 3.15Å; T533-Q537 PolarHBondContact O-N 2.95Å; A534-Q537 WeakPolarHBondContact O-CB 3.28Å; A534-Q537 PolarHBondContact O-N 3.43Å; N535-Q537 VanDerWaalsContact C-N 3.28Å; N535-Q537 PolarHBondContact O-N 3.41Å; Q537-S540 VanDerWaalsContact CA-OG 3.3Å; Q537-S540 WeakPolarHBondContact CA-OG 3.49Å; Q537-S540 PolarHBondContact O-N 3.1Å; Q537-S540 PolarHBondContact O-OG 2.87Å; Q537-K541 WeakPolarHBondContact O-CB 3.44Å; Q537-K541 VanDerWaalsContact O-CG 3.28Å; Q537-K541 WeakPolarHBondContact O-CG 3.45Å; Q537-K541 PolarHBondContact O-N 2.97Å
538L95.2Very high94.8Very high97 Ų9799.8 Ų99.851%0.50851%0.512SS..Hα-helixtrans-60.7-48.9175.5-70.5173.3000110.7A534 N535 S540 K541 E542A534-L538 WeakPolarHBondContact O-CG 3.17Å; A534-L538 PolarHBondContact O-N 3.39Å; N535-L538 PolarHBondContact O-N 3.48Å; L538-S540 VanDerWaalsContact C-N 3.35Å; L538-S540 PolarHBondContact O-N 3.38Å; L538-K541 PolarHBondContact O-N 3.5Å; L538-E542 WeakPolarHBondContact O-CG 3.49Å; L538-E542 PolarHBondContact O-N 3.48Å
539A95.4Very high94.5Very high57 Ų5795.4 Ų95.447%0.47150%0.502SS..Hα-helixtrans-60.2-41.5176.600000112.5N535 E542 C543N535-A539 WeakPolarHBondContact O-CB 3.49Å; N535-A539 PolarHBondContact O-N 2.8Å; A539-E542 PolarHBondContact O-N 2.89Å; A539-C543 PolarHBondContact O-N 3.32Å; A539-C543 VanDerWaalsContact O-N 3.09Å
540S93.9Very high94.3Very high53 Ų5397.7 Ų97.737%0.37151%0.507SS..Hα-helixtrans-64.4-41.9175.558.40000112.4K536 Q537 L538 E542 C543 D544K536-S540 WeakPolarHBondContact O-CB 3.07Å; K536-S540 PolarHBondContact O-N 3.11Å; K536-S540 PolarHBondContact O-OG 3.48Å; Q537-S540 VanDerWaalsContact CA-OG 3.3Å; Q537-S540 WeakPolarHBondContact CA-OG 3.49Å; Q537-S540 PolarHBondContact O-N 3.1Å; Q537-S540 PolarHBondContact O-OG 2.87Å; L538-S540 VanDerWaalsContact C-N 3.35Å; L538-S540 PolarHBondContact O-N 3.38Å; S540-E542 PolarHBondContact O-N 2.93Å; S540-C543 WeakPolarHBondContact O-CB 3.47Å; S540-C543 PolarHBondContact O-N 3.36Å; S540-D544 VanDerWaalsContact O-CG 3.28Å; S540-D544 PolarHBondContact O-N 3.2Å
541K92.9Very high94.2Very high131 Ų13195.8 Ų95.857%0.5750%0.502SS*.Hα-helixtrans-66.5-37.3179.3-74.8174.1-179178.90112.2Q537 L538 S545Q537-K541 WeakPolarHBondContact O-CB 3.44Å; Q537-K541 VanDerWaalsContact O-CG 3.28Å; Q537-K541 WeakPolarHBondContact O-CG 3.45Å; Q537-K541 PolarHBondContact O-N 2.97Å; L538-K541 PolarHBondContact O-N 3.5Å; K541-S545 WeakPolarHBondContact O-CB 3.45Å; K541-S545 PolarHBondContact O-N 3.2Å
542E89.9Confident94.1Very high142 Ų14293.9 Ų93.966%0.66450%0.497SS*.Hα-helixtrans-65.1-40174.1-75.1176.3-169.500111.6L538 A539 S540 S546L538-E542 WeakPolarHBondContact O-CG 3.49Å; L538-E542 PolarHBondContact O-N 3.48Å; A539-E542 PolarHBondContact O-N 2.89Å; S540-E542 PolarHBondContact O-N 2.93Å; E542-S546 WeakPolarHBondContact O-CB 3.44Å; E542-S546 PolarHBondContact O-N 2.96Å
543C88.6Confident94Very high79 Ų7992 Ų9253%0.53449%0.49SS..Hα-helixtrans-64.5-50.6175.8-169.80000111.8A539 S540 S545 S546 E547A539-C543 PolarHBondContact O-N 3.32Å; A539-C543 VanDerWaalsContact O-N 3.09Å; S540-C543 WeakPolarHBondContact O-CB 3.47Å; S540-C543 PolarHBondContact O-N 3.36Å; C543-S545 PolarHBondContact O-N 2.91Å; C543-S546 PolarHBondContact O-N 3.09Å; C543-E547 WeakPolarHBondContact O-CB 3.3Å; C543-E547 PolarHBondContact O-N 3.38Å
544D89.9Confident93.9Very high92 Ų9292.2 Ų92.249%0.49249%0.489SS..Hα-helixtrans-61.9-46.3-179.6-66-23.4000111.4S540 S546 E547 D548S540-D544 VanDerWaalsContact O-CG 3.28Å; S540-D544 PolarHBondContact O-N 3.2Å; D544-S546 PolarHBondContact O-N 3.49Å; D544-E547 PolarHBondContact O-N 2.96Å; D544-D548 PolarHBondContact O-N 2.91Å
545S89Confident93.8Very high62 Ų6293.1 Ų93.143%0.43449%0.493SS..Hα-helixtrans-62-43.4176.9178.60000112.2K541 C543 E547 D548 N549K541-S545 WeakPolarHBondContact O-CB 3.45Å; K541-S545 PolarHBondContact O-N 3.2Å; C543-S545 PolarHBondContact O-N 2.91Å; S545-E547 VanDerWaalsContact C-N 3.32Å; S545-E547 PolarHBondContact O-N 3.21Å; S545-D548 PolarHBondContact O-N 3.28Å; S545-N549 WeakPolarHBondContact O-CB 3.14Å; S545-N549 PolarHBondContact O-N 3.05Å; S545-N549 PolarHBondContact O-ND2 3.35Å
546S90Very high93.7Very high77 Ų7793.5 Ų93.554%0.53849%0.491SS..Hα-helixtrans-63-39.5174.9-1770000111.7E542 C543 D544 N549 R550E542-S546 WeakPolarHBondContact O-CB 3.44Å; E542-S546 PolarHBondContact O-N 2.96Å; C543-S546 PolarHBondContact O-N 3.09Å; D544-S546 PolarHBondContact O-N 3.49Å; S546-N549 PolarHBondContact O-N 2.93Å; S546-R550 VanDerWaalsContact O-CB 3.29Å; S546-R550 WeakPolarHBondContact O-CB 3.48Å; S546-R550 PolarHBondContact O-N 2.88Å
547E91.8Very high93.7Very high74 Ų7489.9 Ų89.935%0.34648%0.48SS..Hα-helixtrans-65.6-41.1177.1-159.8-171.1139.700112.1C543 D544 S545 R550 K551C543-E547 WeakPolarHBondContact O-CB 3.3Å; C543-E547 PolarHBondContact O-N 3.38Å; D544-E547 PolarHBondContact O-N 2.96Å; S545-E547 VanDerWaalsContact C-N 3.32Å; S545-E547 PolarHBondContact O-N 3.21Å; E547-R550 WeakPolarHBondContact O-CB 3.32Å; E547-R550 PolarHBondContact O-N 3.47Å; E547-K551 WeakPolarHBondContact O-CG 3.45Å; E547-K551 PolarHBondContact O-N 3.34Å; E547-K551 WeakPolarHBondContact OE1-CE 3.29Å; E547-K551 IonicContact OE1-NZ 2.93Å; E547-K551 PolarHBondContact OE1-NZ 3.03Å
548D92.8Very high93.7Very high88 Ų8893.9 Ų93.947%0.47149%0.49SS..Hα-helixtrans-67.7-43.1175.9-74.3-15.7000112D544 S545 R550 K551 T552D544-D548 PolarHBondContact O-N 2.91Å; S545-D548 PolarHBondContact O-N 3.28Å; D548-R550 VanDerWaalsContact C-N 3.29Å; D548-R550 PolarHBondContact O-N 3.3Å; D548-K551 WeakPolarHBondContact O-CB 3.34Å; D548-K551 PolarHBondContact O-N 3.45Å; D548-K551 VanDerWaalsContact O-N 3.11Å; D548-K551 IonicContact OD1-NZ 3.73Å; D548-T552 PolarHBondContact O-N 2.9Å; D548-T552 PolarHBondContact O-OG1 2.77Å; D548-T552 VanDerWaalsContact O-OG1 3.1Å
549N93.8Very high93.8Very high92 Ų9296.8 Ų96.849%0.49250%0.496SS..Hα-helixtrans-57.7-44.1172.1-70.7-26.4000111.1S545 S546 K551 T552 I553S545-N549 WeakPolarHBondContact O-CB 3.14Å; S545-N549 PolarHBondContact O-N 3.05Å; S545-N549 PolarHBondContact O-ND2 3.35Å; S546-N549 PolarHBondContact O-N 2.93Å; N549-K551 VanDerWaalsContact C-N 3.34Å; N549-K551 PolarHBondContact O-N 3.31Å; N549-T552 PolarHBondContact O-N 3.32Å; N549-I553 VanDerWaalsContact O-CG1 3.28Å; N549-I553 WeakPolarHBondContact O-CG1 3.35Å; N549-I553 PolarHBondContact O-N 3.48Å
550R94.2Very high93.8Very high146 Ų146101.3 Ų101.355%0.55150%0.502SS*.Hα-helixtrans-61.1-41.9175.5-174.1-178.968.4114.1-0.7111.4S546 E547 D548 N554S546-R550 VanDerWaalsContact O-CB 3.29Å; S546-R550 WeakPolarHBondContact O-CB 3.48Å; S546-R550 PolarHBondContact O-N 2.88Å; E547-R550 WeakPolarHBondContact O-CB 3.32Å; E547-R550 PolarHBondContact O-N 3.47Å; D548-R550 VanDerWaalsContact C-N 3.29Å; D548-R550 PolarHBondContact O-N 3.3Å; R550-N554 WeakPolarHBondContact O-CB 3.44Å; R550-N554 PolarHBondContact O-N 2.91Å; R550-N554 PolarHBondContact O-ND2 2.95Å
551K95.8Very high94Very high102 Ų102105.1 Ų105.144%0.44351%0.512SS..Hα-helixtrans-63.5-44.6176.1-73.6166.8-172.1154.70111.5E547 D548 N549 N554 S555E547-K551 WeakPolarHBondContact O-CG 3.45Å; E547-K551 PolarHBondContact O-N 3.34Å; E547-K551 WeakPolarHBondContact OE1-CE 3.29Å; E547-K551 IonicContact OE1-NZ 2.93Å; E547-K551 PolarHBondContact OE1-NZ 3.03Å; D548-K551 WeakPolarHBondContact O-CB 3.34Å; D548-K551 PolarHBondContact O-N 3.45Å; D548-K551 VanDerWaalsContact O-N 3.11Å; D548-K551 IonicContact OD1-NZ 3.73Å; N549-K551 VanDerWaalsContact C-N 3.34Å; N549-K551 PolarHBondContact O-N 3.31Å; K551-N554 PolarHBondContact O-N 3.47Å; K551-S555 PolarHBondContact O-N 3.07Å
552T96.2Very high94.2Very high74 Ų74103.9 Ų103.945%0.45451%0.508SS..Hα-helixtrans-60.3-51177.7-59.60000111.3D548 N549 N554 S555 E556D548-T552 PolarHBondContact O-N 2.9Å; D548-T552 PolarHBondContact O-OG1 2.77Å; D548-T552 VanDerWaalsContact O-OG1 3.1Å; N549-T552 PolarHBondContact O-N 3.32Å; T552-N554 VanDerWaalsContact C-N 3.28Å; T552-N554 PolarHBondContact O-N 3.15Å; T552-S555 WeakPolarHBondContact O-CA 3.48Å; T552-S555 WeakPolarHBondContact O-CB 3.42Å; T552-S555 PolarHBondContact O-N 3.16Å; T552-E556 PolarHBondContact O-N 3.13Å
553I95.9Very high94.6Very high96 Ų96100.3 Ų100.349%0.49249%0.493SS..Hα-helixtrans-56.6-43.8176.3-67165000110.8N549 S555 E556 L557N549-I553 VanDerWaalsContact O-CG1 3.28Å; N549-I553 WeakPolarHBondContact O-CG1 3.35Å; N549-I553 PolarHBondContact O-N 3.48Å; I553-S555 VanDerWaalsContact C-N 3.33Å; I553-S555 PolarHBondContact O-N 3.25Å; I553-E556 PolarHBondContact O-N 3.29Å; I553-L557 HydrophobicContact CG2-CD1 4Å; I553-L557 HydrophobicContact CG2-CG 4.36Å; I553-L557 WeakPolarHBondContact O-CB 3.14Å; I553-L557 VanDerWaalsContact O-CG 3.28Å; I553-L557 WeakPolarHBondContact O-CG 3.28Å; I553-L557 PolarHBondContact O-N 2.95Å
554N96.2Very high95Very high80 Ų80101 Ų10143%0.42849%0.49SS..Hα-helixtrans-65.1-35.3177.2-82.6-66.6000113.1R550 K551 T552 R558R550-N554 WeakPolarHBondContact O-CB 3.44Å; R550-N554 PolarHBondContact O-N 2.91Å; R550-N554 PolarHBondContact O-ND2 2.95Å; K551-N554 PolarHBondContact O-N 3.47Å; T552-N554 VanDerWaalsContact C-N 3.28Å; T552-N554 PolarHBondContact O-N 3.15Å; N554-R558 PolarHBondContact O-N 2.81Å; N554-R558 VanDerWaalsContact O-N 3.16Å
555S96.2Very high95.4Very high64 Ų64103.6 Ų103.645%0.44849%0.493SS..Hα-helixtrans-65.4-47.6174.3-168.20000111.3K551 T552 I553 L557 R558 Y559K551-S555 PolarHBondContact O-N 3.07Å; T552-S555 WeakPolarHBondContact O-CA 3.48Å; T552-S555 WeakPolarHBondContact O-CB 3.42Å; T552-S555 PolarHBondContact O-N 3.16Å; I553-S555 VanDerWaalsContact C-N 3.33Å; I553-S555 PolarHBondContact O-N 3.25Å; S555-L557 PolarHBondContact O-N 3.45Å; S555-R558 WeakPolarHBondContact O-CB 3.43Å; S555-R558 PolarHBondContact O-N 3.01Å; S555-R558 VanDerWaalsContact O-N 3.15Å; S555-Y559 PolarHBondContact O-N 3.28Å; S555-Y559 VanDerWaalsContact O-N 3.07Å
556E96.4Very high95.8Very high98 Ų98106.3 Ų106.346%0.45850%0.499SS..Hα-helixtrans-60.3-45.2176-70.3176.3-173.400111.4T552 I553 R558 Y559 Y560T552-E556 PolarHBondContact O-N 3.13Å; I553-E556 PolarHBondContact O-N 3.29Å; E556-R558 PolarHBondContact O-N 2.87Å; E556-Y559 CarbonylContact O-C 3.58Å; E556-Y559 WeakPolarHBondContact O-CA 3.28Å; E556-Y559 WeakPolarHBondContact O-CB 3.25Å; E556-Y559 PolarHBondContact O-N 3.39Å; E556-Y560 HydrophobicContact CB-CD2 4.31Å; E556-Y560 HydrophobicContact CB-CE2 4.23Å; E556-Y560 WeakPolarHBondContact O-CD2 3.34Å; E556-Y560 PolarHBondContact O-N 3.29Å
557L96.6Very high96.1Very high86 Ų86108.8 Ų108.845%0.4550%0.5SS..Hα-helixtrans-58.7-34.6176-76.3173.1000112.8I553 S555 K561I553-L557 HydrophobicContact CG2-CD1 4Å; I553-L557 HydrophobicContact CG2-CG 4.36Å; I553-L557 WeakPolarHBondContact O-CB 3.14Å; I553-L557 VanDerWaalsContact O-CG 3.28Å; I553-L557 WeakPolarHBondContact O-CG 3.28Å; I553-L557 PolarHBondContact O-N 2.95Å; S555-L557 PolarHBondContact O-N 3.45Å; L557-K561 WeakPolarHBondContact O-CG 3.41Å; L557-K561 PolarHBondContact O-N 3.39Å; L557-K561 VanDerWaalsContact O-N 3.11Å
558R96.8Very high96.4Very high181 Ų181110.2 Ų110.268%0.68351%0.507SS*.Hα-helixtrans-66.7-45172.8-77.6-171.5-73.6179.1-1.7111.4N554 S555 E556 K561 E562N554-R558 PolarHBondContact O-N 2.81Å; N554-R558 VanDerWaalsContact O-N 3.16Å; S555-R558 WeakPolarHBondContact O-CB 3.43Å; S555-R558 PolarHBondContact O-N 3.01Å; S555-R558 VanDerWaalsContact O-N 3.15Å; E556-R558 PolarHBondContact O-N 2.87Å; R558-K561 PolarHBondContact O-N 3.37Å; R558-E562 PolarHBondContact O-N 2.88Å; R558-E562 VanDerWaalsContact O-N 3.13Å
559Y97.1Very high96.7Very high159 Ų159112.6 Ų112.662%0.62451%0.513SS*.Hα-helixtrans-62-44.5176.9-179.2-111.9000112S555 E556 K561 E562 I563S555-Y559 PolarHBondContact O-N 3.28Å; S555-Y559 VanDerWaalsContact O-N 3.07Å; E556-Y559 CarbonylContact O-C 3.58Å; E556-Y559 WeakPolarHBondContact O-CA 3.28Å; E556-Y559 WeakPolarHBondContact O-CB 3.25Å; E556-Y559 PolarHBondContact O-N 3.39Å; Y559-K561 VanDerWaalsContact C-N 3.34Å; Y559-K561 PolarHBondContact O-N 2.89Å; Y559-E562 WeakPolarHBondContact O-CB 3.44Å; Y559-E562 PolarHBondContact O-N 2.97Å; Y559-E562 VanDerWaalsContact O-N 3.07Å; Y559-I563 HydrophobicContact CD1-CD1 3.55Å; Y559-I563 HydrophobicContact CD1-CG1 4.43Å; Y559-I563 HydrophobicContact CE1-CD1 3.12Å; Y559-I563 HydrophobicContact CE1-CG1 4.07Å; Y559-I563 HydrophobicContact CE2-CD1 4.19Å; Y559-I563 HydrophobicContact CE2-CG1 4.29Å; Y559-I563 HydrophobicContact CG-CD1 4.25Å; Y559-I563 VanDerWaalsContact CZ-CD1 3.47Å; Y559-I563 PolarHBondContact O-N 3.3Å
560Y96.8Very high96.9Very high151 Ų151112.8 Ų112.859%0.59251%0.514SS*.Hα-helixtrans-58.7-42.2174.9-82-66.1000112.9E556 E562 I563 L564E556-Y560 HydrophobicContact CB-CD2 4.31Å; E556-Y560 HydrophobicContact CB-CE2 4.23Å; E556-Y560 WeakPolarHBondContact O-CD2 3.34Å; E556-Y560 PolarHBondContact O-N 3.29Å; Y560-E562 VanDerWaalsContact C-N 3.27Å; Y560-E562 PolarHBondContact O-N 3.07Å; Y560-I563 PolarHBondContact O-N 3.11Å; Y560-L564 WeakPolarHBondContact O-CB 3.49Å; Y560-L564 PolarHBondContact O-N 3.29Å
561K97.9Very high97.1Very high134 Ų134110.7 Ų110.758%0.58351%0.51SS*.Hα-helixtrans-62.3-36.7175.3-77.6177.6-179.9-177.10112L557 R558 Y559 L564 R565L557-K561 WeakPolarHBondContact O-CG 3.41Å; L557-K561 PolarHBondContact O-N 3.39Å; L557-K561 VanDerWaalsContact O-N 3.11Å; R558-K561 PolarHBondContact O-N 3.37Å; Y559-K561 VanDerWaalsContact C-N 3.34Å; Y559-K561 PolarHBondContact O-N 2.89Å; K561-L564 PolarHBondContact O-N 3.13Å; K561-R565 PolarHBondContact O-N 3.28Å; K561-R565 VanDerWaalsContact O-N 3.14Å
562E97.1Very high97.1Very high104 Ų104112 Ų11249%0.48652%0.519SS..Hα-helixtrans-71-45.2178.9-162.958-157.600111.9R558 Y559 Y560 L564 R565 E566R558-E562 PolarHBondContact O-N 2.88Å; R558-E562 VanDerWaalsContact O-N 3.13Å; Y559-E562 WeakPolarHBondContact O-CB 3.44Å; Y559-E562 PolarHBondContact O-N 2.97Å; Y559-E562 VanDerWaalsContact O-N 3.07Å; Y560-E562 VanDerWaalsContact C-N 3.27Å; Y560-E562 PolarHBondContact O-N 3.07Å; E562-L564 PolarHBondContact O-N 3.42Å; E562-R565 PolarHBondContact O-N 3.14Å; E562-R565 VanDerWaalsContact O-N 3.13Å; E562-R565 IonicContact OE2-NH1 3.67Å; E562-R565 PolarHBondContact OE2-NH1 3.5Å; E562-E566 PolarHBondContact O-N 3.45Å
563I97.3Very high97.2Very high68 Ų68113.7 Ų113.735%0.34952%0.522SS..Hα-helixtrans-55.7-41.8172.3-68164.5000110.8Y559 Y560 R565 E566 K567Y559-I563 HydrophobicContact CD1-CD1 3.55Å; Y559-I563 HydrophobicContact CD1-CG1 4.43Å; Y559-I563 HydrophobicContact CE1-CD1 3.12Å; Y559-I563 HydrophobicContact CE1-CG1 4.07Å; Y559-I563 HydrophobicContact CE2-CD1 4.19Å; Y559-I563 HydrophobicContact CE2-CG1 4.29Å; Y559-I563 HydrophobicContact CG-CD1 4.25Å; Y559-I563 VanDerWaalsContact CZ-CD1 3.47Å; Y559-I563 PolarHBondContact O-N 3.3Å; Y560-I563 PolarHBondContact O-N 3.11Å; I563-R565 PolarHBondContact O-N 3.46Å; I563-E566 PolarHBondContact O-N 2.98Å; I563-K567 WeakPolarHBondContact O-CB 3.43Å; I563-K567 PolarHBondContact O-N 2.88Å
564L97.5Very high97.3Very high93 Ų93113.2 Ų113.249%0.48752%0.52SS..Hα-helixtrans-63.9-41.9-179.9-168.866.7000111.7Y560 K561 E562 E566 K567 E568Y560-L564 WeakPolarHBondContact O-CB 3.49Å; Y560-L564 PolarHBondContact O-N 3.29Å; K561-L564 PolarHBondContact O-N 3.13Å; E562-L564 PolarHBondContact O-N 3.42Å; L564-E566 VanDerWaalsContact C-N 3.35Å; L564-K567 WeakPolarHBondContact O-CB 3.46Å; L564-K567 PolarHBondContact O-N 3.26Å; L564-E568 WeakPolarHBondContact O-CG 3.4Å; L564-E568 PolarHBondContact O-N 3.07Å
565R97.7Very high97.4Very high146 Ų146113.4 Ų113.455%0.55152%0.521SS*.Hα-helixtrans-62.7-41.6174.2-73-168.6-170.1103.72.2112.5K561 E562 I563 K567 E568 K569K561-R565 PolarHBondContact O-N 3.28Å; K561-R565 VanDerWaalsContact O-N 3.14Å; E562-R565 PolarHBondContact O-N 3.14Å; E562-R565 VanDerWaalsContact O-N 3.13Å; E562-R565 IonicContact OE2-NH1 3.67Å; E562-R565 PolarHBondContact OE2-NH1 3.5Å; I563-R565 PolarHBondContact O-N 3.46Å; R565-K567 VanDerWaalsContact C-N 3.32Å; R565-E568 PolarHBondContact O-N 2.94Å; R565-K569 WeakPolarHBondContact O-CB 3.37Å; R565-K569 PolarHBondContact O-N 3.37Å
566E97.4Very high97.5Very high120 Ų120113.1 Ų113.156%0.56152%0.523SS*.Hα-helixtrans-64.6-40.9177.7-172.6170.1-161.900111.1E562 I563 L564 K569 L570E562-E566 PolarHBondContact O-N 3.45Å; I563-E566 PolarHBondContact O-N 2.98Å; L564-E566 VanDerWaalsContact C-N 3.35Å; E566-K569 WeakPolarHBondContact O-CB 3.46Å; E566-K569 PolarHBondContact O-N 3.28Å; E566-L570 HydrophobicContact CG-CD1 4.37Å; E566-L570 WeakPolarHBondContact O-CG 3.45Å; E566-L570 PolarHBondContact O-N 2.89Å
567K97.8Very high97.5Very high129 Ų129113.8 Ų113.856%0.56153%0.529SS*.Hα-helixtrans-58.9-50.5172.5-176.1-166.3170.5-166.70111.7I563 L564 R565 K569 L570 E571I563-K567 WeakPolarHBondContact O-CB 3.43Å; I563-K567 PolarHBondContact O-N 2.88Å; L564-K567 WeakPolarHBondContact O-CB 3.46Å; L564-K567 PolarHBondContact O-N 3.26Å; R565-K567 VanDerWaalsContact C-N 3.32Å; K567-K569 VanDerWaalsContact C-N 3.26Å; K567-K569 PolarHBondContact O-N 3.42Å; K567-L570 PolarHBondContact O-N 3.33Å; K567-E571 WeakPolarHBondContact O-CB 3.37Å; K567-E571 PolarHBondContact O-N 2.93Å
568E97.9Very high97.6Very high104 Ų104117.1 Ų117.149%0.48654%0.535SS..Hα-helixtrans-58.9-39.2178-74.4175.5173.200111.6L564 R565 E571 M572L564-E568 WeakPolarHBondContact O-CG 3.4Å; L564-E568 PolarHBondContact O-N 3.07Å; R565-E568 PolarHBondContact O-N 2.94Å; E568-E571 PolarHBondContact O-N 2.95Å; E568-M572 WeakPolarHBondContact O-CG 3.44Å; E568-M572 PolarHBondContact O-N 3.43Å
569K98Very high97.7Very high138 Ų138111.5 Ų111.560%0.652%0.524SS*.Hα-helixtrans-63.1-49.6175.9-176.7-174.3174.8-169.20112.1R565 E566 K567 E571 M572 E573R565-K569 WeakPolarHBondContact O-CB 3.37Å; R565-K569 PolarHBondContact O-N 3.37Å; E566-K569 WeakPolarHBondContact O-CB 3.46Å; E566-K569 PolarHBondContact O-N 3.28Å; K567-K569 VanDerWaalsContact C-N 3.26Å; K567-K569 PolarHBondContact O-N 3.42Å; K569-E571 VanDerWaalsContact C-N 3.26Å; K569-E571 PolarHBondContact O-N 3.36Å; K569-M572 PolarHBondContact O-N 3.29Å; K569-E573 PolarHBondContact O-N 2.95Å; K569-E573 VanDerWaalsContact O-N 3.07Å
570L98Very high97.7Very high96 Ų96107.3 Ų107.350%0.50352%0.515SS..Hα-helixtrans-63.7-34.8178.1-70.7174000111.6E566 K567 E573 L574E566-L570 HydrophobicContact CG-CD1 4.37Å; E566-L570 WeakPolarHBondContact O-CG 3.45Å; E566-L570 PolarHBondContact O-N 2.89Å; K567-L570 PolarHBondContact O-N 3.33Å; L570-E573 PolarHBondContact O-N 3.39Å; L570-L574 VanDerWaalsContact O-CB 3.29Å; L570-L574 WeakPolarHBondContact O-CB 3.44Å; L570-L574 PolarHBondContact O-N 3.02Å
571E97.8Very high97.8Very high101 Ų101102 Ų10247%0.47250%0.502SS..Hα-helixtrans-65.3-42.8175.4-175.9168.7-166.500112K567 E568 K569 L574 N575K567-E571 WeakPolarHBondContact O-CB 3.37Å; K567-E571 PolarHBondContact O-N 2.93Å; E568-E571 PolarHBondContact O-N 2.95Å; K569-E571 VanDerWaalsContact C-N 3.26Å; K569-E571 PolarHBondContact O-N 3.36Å; E571-L574 PolarHBondContact O-N 3.32Å; E571-N575 WeakPolarHBondContact O-CB 3.42Å; E571-N575 PolarHBondContact O-N 3.42Å; E571-N575 PolarHBondContact O-ND2 3.25Å
572M97.4Very high97.8Very high129 Ų12999.4 Ų99.464%0.63550%0.495SS*.Hα-helixtrans-61-43.6172.9-72.9-171.4-66.300112.2E568 K569 N575 A576E568-M572 WeakPolarHBondContact O-CG 3.44Å; E568-M572 PolarHBondContact O-N 3.43Å; K569-M572 PolarHBondContact O-N 3.29Å; M572-N575 PolarHBondContact O-N 3.44Å; M572-A576 PolarHBondContact O-N 2.9Å
573E97.5Very high97.8Very high110 Ų11097.5 Ų97.551%0.51449%0.488SS..Hα-helixtrans-64.4-44178.4-173.7173.7-179.900111.8K569 L570 N575 A576 L577K569-E573 PolarHBondContact O-N 2.95Å; K569-E573 VanDerWaalsContact O-N 3.07Å; L570-E573 PolarHBondContact O-N 3.39Å; E573-N575 VanDerWaalsContact C-N 3.33Å; E573-N575 PolarHBondContact O-N 3.38Å; E573-A576 PolarHBondContact O-N 2.97Å; E573-L577 HydrophobicContact CG-CD1 4.44Å; E573-L577 WeakPolarHBondContact O-CG 3.41Å; E573-L577 PolarHBondContact O-N 3.25Å
574L97.8Very high97.9Very high87 Ų8799.8 Ų99.846%0.45550%0.497SS..Hα-helixtrans-61.1-42.8176.6-167.4158.5000111.1L570 E571 L577 R578L570-L574 VanDerWaalsContact O-CB 3.29Å; L570-L574 WeakPolarHBondContact O-CB 3.44Å; L570-L574 PolarHBondContact O-N 3.02Å; E571-L574 PolarHBondContact O-N 3.32Å; L574-L577 PolarHBondContact O-N 3.36Å; L574-R578 HydrophobicContact CD2-CG 4.06Å; L574-R578 WeakPolarHBondContact O-CG 3.29Å; L574-R578 PolarHBondContact O-N 2.98Å
575N97.9Very high97.9Very high84 Ų84104 Ų10445%0.44951%0.506SS..Hα-helixtrans-65-40.5176.2-75.5-25.1000112.5E571 M572 E573 R578 S579E571-N575 WeakPolarHBondContact O-CB 3.42Å; E571-N575 PolarHBondContact O-N 3.42Å; E571-N575 PolarHBondContact O-ND2 3.25Å; M572-N575 PolarHBondContact O-N 3.44Å; E573-N575 VanDerWaalsContact C-N 3.33Å; E573-N575 PolarHBondContact O-N 3.38Å; N575-R578 PolarHBondContact O-N 3.41Å; N575-S579 PolarHBondContact O-N 2.93Å
576A98.2Very high97.9Very high58 Ų58103.2 Ų103.248%0.47950%0.503SS..Hα-helixtrans-63.1-43175.700000112.1M572 E573 S579 T580M572-A576 PolarHBondContact O-N 2.9Å; E573-A576 PolarHBondContact O-N 2.97Å; A576-S579 PolarHBondContact O-N 2.93Å; A576-T580 PolarHBondContact O-N 3.38Å; A576-T580 PolarHBondContact O-OG1 3.15Å
577L97.9Very high98Very high111 Ų111102.4 Ų102.458%0.58150%0.499SS*.Hα-helixtrans-64.1-42.6175.1-72.3174.3000112E573 L574 T580 A581E573-L577 HydrophobicContact CG-CD1 4.44Å; E573-L577 WeakPolarHBondContact O-CG 3.41Å; E573-L577 PolarHBondContact O-N 3.25Å; L574-L577 PolarHBondContact O-N 3.36Å; L577-T580 PolarHBondContact O-N 2.96Å; L577-A581 WeakPolarHBondContact O-CB 3.28Å; L577-A581 PolarHBondContact O-N 3.45Å
578R98Very high98Very high156 Ų156100.5 Ų100.559%0.58950%0.495SS*.Hα-helixtrans-58.5-46.9173.9-79.3-177.7176.7-176.53.6111.9L574 N575 T580 A581 D582L574-R578 HydrophobicContact CD2-CG 4.06Å; L574-R578 WeakPolarHBondContact O-CG 3.29Å; L574-R578 PolarHBondContact O-N 2.98Å; N575-R578 PolarHBondContact O-N 3.41Å; R578-T580 VanDerWaalsContact C-N 3.29Å; R578-T580 PolarHBondContact O-N 3.36Å; R578-A581 PolarHBondContact O-N 2.95Å; R578-A581 VanDerWaalsContact O-N 3.15Å; R578-D582 PolarHBondContact O-N 3.04Å
579S98.1Very high98Very high63 Ų63100.8 Ų100.844%0.44150%0.496SS..Hα-helixtrans-57.5-43.8176.5-172.10000111.7N575 A576 A581 D582 D583N575-S579 PolarHBondContact O-N 2.93Å; A576-S579 PolarHBondContact O-N 2.93Å; S579-A581 PolarHBondContact O-N 2.88Å; S579-D582 PolarHBondContact O-N 2.98Å; S579-D583 PolarHBondContact O-N 2.62Å
580T98.1Very high98Very high72 Ų7299.2 Ų99.244%0.44249%0.493SS..Hα-helixtrans-64.4-40.6178.1-53.30000111.6A576 L577 R578 D583 Q584A576-T580 PolarHBondContact O-N 3.38Å; A576-T580 PolarHBondContact O-OG1 3.15Å; L577-T580 PolarHBondContact O-N 2.96Å; R578-T580 VanDerWaalsContact C-N 3.29Å; R578-T580 PolarHBondContact O-N 3.36Å; T580-D583 PolarHBondContact O-N 2.91Å; T580-Q584 VanDerWaalsContact O-CG 3.28Å; T580-Q584 WeakPolarHBondContact O-CG 3.4Å; T580-Q584 PolarHBondContact O-N 3.49Å
581A98.1Very high98Very high38 Ų38102.6 Ų102.631%0.31450%0.499SS..Hα-helixtrans-66.4-39.4176.700000112.1L577 R578 S579 Q584 R585L577-A581 WeakPolarHBondContact O-CB 3.28Å; L577-A581 PolarHBondContact O-N 3.45Å; R578-A581 PolarHBondContact O-N 2.95Å; R578-A581 VanDerWaalsContact O-N 3.15Å; S579-A581 PolarHBondContact O-N 2.88Å; A581-Q584 PolarHBondContact O-N 2.94Å; A581-R585 WeakPolarHBondContact O-CG 3.49Å; A581-R585 PolarHBondContact O-N 2.88Å
582D97.9Very high98Very high81 Ų81101.5 Ų101.543%0.43350%0.496SS..Hα-helixtrans-67.2-39.6175.7-72.8-20.8000111.6R578 S579 R585 R586R578-D582 PolarHBondContact O-N 3.04Å; S579-D582 PolarHBondContact O-N 2.98Å; D582-R585 PolarHBondContact O-N 3.42Å; D582-R586 WeakPolarHBondContact O-CG 3.5Å; D582-R586 PolarHBondContact O-N 3.27Å
583D97.9Very high98Very high63 Ų63100.9 Ų100.934%0.33749%0.492SS..Hα-helixtrans-59.4-47.2170.7-83.4-33.2000111.5S579 T580 R585 R586 H587S579-D583 PolarHBondContact O-N 2.62Å; T580-D583 PolarHBondContact O-N 2.91Å; D583-R585 VanDerWaalsContact C-N 3.33Å; D583-R585 PolarHBondContact O-N 3.29Å; D583-R586 WeakPolarHBondContact O-CB 3.31Å; D583-R586 PolarHBondContact O-N 3.34Å; D583-R586 IonicContact OD1-CZ 3.35Å; D583-R586 IonicContact OD1-NE 3.34Å; D583-R586 PolarHBondContact OD1-NE 3.45Å; D583-R586 IonicContact OD1-NH2 2.62Å; D583-R586 PolarHBondContact OD1-NH2 3.2Å; D583-H587 PolarHBondContact O-CD2 3.17Å; D583-H587 PolarHBondContact O-N 3.34Å
584Q98.2Very high98Very high117 Ų11798.5 Ų98.555%0.54749%0.491SS..Hα-helixtrans-59.1-43.1175.3-73.2174-2.900111.9T580 A581 H587 I588T580-Q584 VanDerWaalsContact O-CG 3.28Å; T580-Q584 WeakPolarHBondContact O-CG 3.4Å; T580-Q584 PolarHBondContact O-N 3.49Å; A581-Q584 PolarHBondContact O-N 2.94Å; Q584-H587 WeakPolarHBondContact O-CB 3.36Å; Q584-H587 PolarHBondContact O-N 3.23Å; Q584-I588 VanDerWaalsContact O-CG1 3.31Å; Q584-I588 WeakPolarHBondContact O-CG1 3.49Å; Q584-I588 PolarHBondContact O-N 3.44Å
585R98.3Very high98Very high182 Ų18299.2 Ų99.269%0.68750%0.495SS*.Hα-helixtrans-60.5-46.3174.8-75.9176.3-179-126.41.7111.8A581 D582 D583 H587 I588 E589A581-R585 WeakPolarHBondContact O-CG 3.49Å; A581-R585 PolarHBondContact O-N 2.88Å; D582-R585 PolarHBondContact O-N 3.42Å; D583-R585 VanDerWaalsContact C-N 3.33Å; D583-R585 PolarHBondContact O-N 3.29Å; R585-H587 VanDerWaalsContact C-N 3.32Å; R585-H587 PolarHBondContact O-N 3.34Å; R585-I588 PolarHBondContact O-N 3.3Å; R585-E589 PolarHBondContact O-N 2.88Å
586R98.3Very high98Very high128 Ų128100 Ų10048%0.48350%0.499SS..Hα-helixtrans-58.7-43.7174.4-74.7-169.4-76.6-104.610.2111.6D582 D583 I588 E589 I590D582-R586 WeakPolarHBondContact O-CG 3.5Å; D582-R586 PolarHBondContact O-N 3.27Å; D583-R586 WeakPolarHBondContact O-CB 3.31Å; D583-R586 PolarHBondContact O-N 3.34Å; D583-R586 IonicContact OD1-CZ 3.35Å; D583-R586 IonicContact OD1-NE 3.34Å; D583-R586 PolarHBondContact OD1-NE 3.45Å; D583-R586 IonicContact OD1-NH2 2.62Å; D583-R586 PolarHBondContact OD1-NH2 3.2Å; R586-I588 VanDerWaalsContact C-N 3.33Å; R586-I588 PolarHBondContact O-N 2.99Å; R586-E589 PolarHBondContact O-N 2.85Å; R586-I590 VanDerWaalsContact O-CG1 3.32Å; R586-I590 WeakPolarHBondContact O-CG1 3.37Å; R586-I590 PolarHBondContact O-N 2.93Å
587H98.3Very high98Very high104 Ų104101.2 Ų101.248%0.48150%0.497SS..Hα-helixtrans-62.3-39176.7-74.7-58.9000112.7D583 Q584 R585 R591D583-H587 PolarHBondContact O-CD2 3.17Å; D583-H587 PolarHBondContact O-N 3.34Å; Q584-H587 WeakPolarHBondContact O-CB 3.36Å; Q584-H587 PolarHBondContact O-N 3.23Å; R585-H587 VanDerWaalsContact C-N 3.32Å; R585-H587 PolarHBondContact O-N 3.34Å; H587-R591 WeakPolarHBondContact O-CG 3.41Å; H587-R591 PolarHBondContact O-N 2.93Å
588I97.8Very high97.9Very high89 Ų8998.4 Ų98.446%0.45649%0.49SS..Hα-helixtrans-64.1-48.8174.4-68.3163.5000109.9Q584 R585 R586 I590 R591 D592Q584-I588 VanDerWaalsContact O-CG1 3.31Å; Q584-I588 WeakPolarHBondContact O-CG1 3.49Å; Q584-I588 PolarHBondContact O-N 3.44Å; R585-I588 PolarHBondContact O-N 3.3Å; R586-I588 VanDerWaalsContact C-N 3.33Å; R586-I588 PolarHBondContact O-N 2.99Å; I588-I590 VanDerWaalsContact C-N 3.32Å; I588-I590 PolarHBondContact O-N 3.24Å; I588-R591 CarbonylContact O-C 3.6Å; I588-R591 WeakPolarHBondContact O-CA 3.33Å; I588-R591 WeakPolarHBondContact O-CB 3.43Å; I588-R591 PolarHBondContact O-N 3.49Å; I588-D592 PolarHBondContact O-N 3.32Å
589E97.9Very high97.8Very high110 Ų11096.6 Ų96.651%0.51449%0.488SS..Hα-helixtrans-56.8-44.3179.6-176.8179.5-166.200112.3R585 R586 R591 D592 Q593R585-E589 PolarHBondContact O-N 2.88Å; R586-E589 PolarHBondContact O-N 2.85Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3.29Å; E589-D592 PolarHBondContact O-N 2.89Å; E589-Q593 VanDerWaalsContact O-CG 3.32Å; E589-Q593 WeakPolarHBondContact O-CG 3.32Å; E589-Q593 PolarHBondContact O-N 2.85Å
590I98.1Very high97.8Very high104 Ų10496.5 Ų96.553%0.53349%0.491SS..Hα-helixtrans-61.7-41.6176.3-67.3165.7000111R586 I588 Q593 A594R586-I590 VanDerWaalsContact O-CG1 3.32Å; R586-I590 WeakPolarHBondContact O-CG1 3.37Å; R586-I590 PolarHBondContact O-N 2.93Å; I588-I590 VanDerWaalsContact C-N 3.32Å; I588-I590 PolarHBondContact O-N 3.24Å; I590-Q593 PolarHBondContact O-N 3.24Å; I590-A594 WeakPolarHBondContact O-CB 3.32Å; I590-A594 PolarHBondContact O-N 3.37Å
591R98.1Very high97.7Very high167 Ų16799 Ų9963%0.6350%0.496SS*.Hα-helixtrans-65.1-43.1176.9-74.1174.6-178.3156.62111.4H587 I588 E589 Q593 A594 L595H587-R591 WeakPolarHBondContact O-CG 3.41Å; H587-R591 PolarHBondContact O-N 2.93Å; I588-R591 CarbonylContact O-C 3.6Å; I588-R591 WeakPolarHBondContact O-CA 3.33Å; I588-R591 WeakPolarHBondContact O-CB 3.43Å; I588-R591 PolarHBondContact O-N 3.49Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3.29Å; R591-Q593 VanDerWaalsContact C-N 3.34Å; R591-Q593 PolarHBondContact O-N 2.85Å; R591-A594 PolarHBondContact O-N 3.43Å; R591-L595 WeakPolarHBondContact O-CB 3.48Å; R591-L595 WeakPolarHBondContact O-CG 3.45Å; R591-L595 PolarHBondContact O-N 3.01Å
592D98.1Very high97.5Very high78 Ų78100.7 Ų100.742%0.41750%0.503SS..Hα-helixtrans-63.9-40177.4-69.8-19.9000111.2I588 E589 L595 N596I588-D592 PolarHBondContact O-N 3.32Å; E589-D592 PolarHBondContact O-N 2.89Å; D592-L595 PolarHBondContact O-N 2.93Å; D592-N596 WeakPolarHBondContact O-CB 3.41Å; D592-N596 PolarHBondContact O-N 3.44Å; D592-N596 PolarHBondContact O-ND2 3.42Å
593Q97.7Very high97.4Very high116 Ų116100.3 Ų100.354%0.54250%0.503SS..Hα-helixtrans-62.3-44.4173.1-72.8177.716.500111.9E589 I590 R591 N596 N597E589-Q593 VanDerWaalsContact O-CG 3.32Å; E589-Q593 WeakPolarHBondContact O-CG 3.32Å; E589-Q593 PolarHBondContact O-N 2.85Å; I590-Q593 PolarHBondContact O-N 3.24Å; R591-Q593 VanDerWaalsContact C-N 3.34Å; R591-Q593 PolarHBondContact O-N 2.85Å; Q593-N596 PolarHBondContact O-N 2.95Å; Q593-N597 WeakPolarHBondContact O-CB 3.47Å; Q593-N597 PolarHBondContact O-N 3.45Å
594A97.8Very high97.2Very high60 Ų60103.5 Ų103.550%0.49651%0.514SS..Hα-helixtrans-64.7-41.5177.400000112.3I590 R591 N597 A598I590-A594 WeakPolarHBondContact O-CB 3.32Å; I590-A594 PolarHBondContact O-N 3.37Å; R591-A594 PolarHBondContact O-N 3.43Å; A594-N597 PolarHBondContact O-N 2.98Å; A594-A598 WeakPolarHBondContact O-CB 3.34Å; A594-A598 PolarHBondContact O-N 2.91Å
595L97.9Very high96.9Very high102 Ų102102.8 Ų102.853%0.53451%0.513SS..Hα-helixtrans-61.8-49174.9-76.2171.2000111.3R591 D592 N597 A598 Q599R591-L595 WeakPolarHBondContact O-CB 3.48Å; R591-L595 WeakPolarHBondContact O-CG 3.45Å; R591-L595 PolarHBondContact O-N 3.01Å; D592-L595 PolarHBondContact O-N 2.93Å; L595-N597 VanDerWaalsContact C-N 3.32Å; L595-N597 PolarHBondContact O-N 3.46Å; L595-A598 PolarHBondContact O-N 2.9Å; L595-Q599 WeakPolarHBondContact O-CB 3.48Å; L595-Q599 WeakPolarHBondContact O-CG 3.36Å; L595-Q599 PolarHBondContact O-N 2.84Å
596N97.7Very high96.6Very high100 Ų10099.1 Ų99.154%0.53550%0.504SS..Hα-helixtrans-59.1-42.1175.8-80.2-56.2000111.8D592 Q593 Q599 A600D592-N596 WeakPolarHBondContact O-CB 3.41Å; D592-N596 PolarHBondContact O-N 3.44Å; D592-N596 PolarHBondContact O-ND2 3.42Å; Q593-N596 PolarHBondContact O-N 2.95Å; N596-Q599 PolarHBondContact O-N 3.05Å; N596-A600 WeakPolarHBondContact O-CB 3.4Å; N596-A600 PolarHBondContact O-N 2.89Å
597N97.6Very high96.2Very high85 Ų8597.4 Ų97.446%0.45550%0.501SS..Hα-helixtrans-63.7-42.4177-170.5-90.3000112.4Q593 A594 L595 A600 K601Q593-N597 WeakPolarHBondContact O-CB 3.47Å; Q593-N597 PolarHBondContact O-N 3.45Å; A594-N597 PolarHBondContact O-N 2.98Å; L595-N597 VanDerWaalsContact C-N 3.32Å; L595-N597 PolarHBondContact O-N 3.46Å; N597-A600 PolarHBondContact O-N 3.4Å; N597-K601 WeakPolarHBondContact O-CG 3.38Å; N597-K601 PolarHBondContact O-N 2.87Å; N597-K601 WeakPolarHBondContact OD1-CE 3.37Å; N597-K601 PolarHBondContact OD1-NZ 3.36Å
598A97Very high95.7Very high52 Ų5296.7 Ų96.743%0.4350%0.498SS..Hα-helixtrans-64.5-45.1176.400000111.4A594 L595 A600 K601 V602A594-A598 WeakPolarHBondContact O-CB 3.34Å; A594-A598 PolarHBondContact O-N 2.91Å; L595-A598 PolarHBondContact O-N 2.9Å; A598-A600 PolarHBondContact O-N 3.48Å; A598-K601 WeakPolarHBondContact O-CB 3.42Å; A598-K601 PolarHBondContact O-N 3.26Å; A598-V602 WeakPolarHBondContact O-CG2 3.44Å; A598-V602 PolarHBondContact O-N 3.07Å
599Q96.1Very high95Very high117 Ų11797.2 Ų97.255%0.54751%0.505SS..Hα-helixtrans-59.9-45.7175.4-73.2174.3-13.400111.8L595 N596 K601 V602 V603L595-Q599 WeakPolarHBondContact O-CB 3.48Å; L595-Q599 WeakPolarHBondContact O-CG 3.36Å; L595-Q599 PolarHBondContact O-N 2.84Å; N596-Q599 PolarHBondContact O-N 3.05Å; Q599-K601 VanDerWaalsContact C-N 3.31Å; Q599-K601 PolarHBondContact O-N 2.83Å; Q599-V602 PolarHBondContact O-N 2.95Å; Q599-V602 VanDerWaalsContact O-N 3.16Å; Q599-V603 WeakPolarHBondContact O-CG2 3.39Å; Q599-V603 PolarHBondContact O-N 3.16Å
600A96.4Very high94.4Very high61 Ų61100.9 Ų100.950%0.50452%0.515SS..Hα-helixtrans-60.3-39176.300000112.6N596 N597 A598 K604N596-A600 WeakPolarHBondContact O-CB 3.4Å; N596-A600 PolarHBondContact O-N 2.89Å; N597-A600 PolarHBondContact O-N 3.4Å; A598-A600 PolarHBondContact O-N 3.48Å; A600-K604 WeakPolarHBondContact O-CB 3.17Å; A600-K604 PolarHBondContact O-N 2.96Å; A600-K604 VanDerWaalsContact O-N 3.07Å
601K95.9Very high93.6Very high125 Ų125104.1 Ų104.154%0.54353%0.525SS..Hα-helixtrans-64.5-42.9173.6-76.9169.5174.5159.30112.2N597 A598 Q599 K604 L605N597-K601 WeakPolarHBondContact O-CG 3.38Å; N597-K601 PolarHBondContact O-N 2.87Å; N597-K601 WeakPolarHBondContact OD1-CE 3.37Å; N597-K601 PolarHBondContact OD1-NZ 3.36Å; A598-K601 WeakPolarHBondContact O-CB 3.42Å; A598-K601 PolarHBondContact O-N 3.26Å; Q599-K601 VanDerWaalsContact C-N 3.31Å; Q599-K601 PolarHBondContact O-N 2.83Å; K601-K604 PolarHBondContact O-N 3.37Å; K601-L605 WeakPolarHBondContact O-CG 3.47Å; K601-L605 PolarHBondContact O-N 3.33Å
602V95.4Very high92.1Very high74 Ų74105.6 Ų105.645%0.44854%0.543SS..Hα-helixtrans-60.2-49.8176.5170.10000110.6A598 Q599 K604 L605 E606A598-V602 WeakPolarHBondContact O-CG2 3.44Å; A598-V602 PolarHBondContact O-N 3.07Å; Q599-V602 PolarHBondContact O-N 2.95Å; Q599-V602 VanDerWaalsContact O-N 3.16Å; V602-K604 VanDerWaalsContact C-N 3.3Å; V602-K604 PolarHBondContact O-N 3.24Å; V602-L605 PolarHBondContact O-N 3.1Å; V602-L605 VanDerWaalsContact O-N 3.1Å; V602-E606 HydrophobicContact CG1-CG 4.28Å; V602-E606 WeakPolarHBondContact O-CG 3.5Å; V602-E606 PolarHBondContact O-N 2.97Å
603V94.9Very high91.8Very high73 Ų73107 Ų10744%0.44255%0.549SS..Hα-helixtrans-56.8-44.4177.5172.30000111.3Q599 L605 E606 E607Q599-V603 WeakPolarHBondContact O-CG2 3.39Å; Q599-V603 PolarHBondContact O-N 3.16Å; V603-L605 PolarHBondContact O-N 2.86Å; V603-E606 WeakPolarHBondContact O-CB 3.42Å; V603-E606 PolarHBondContact O-N 3.31Å; V603-E607 WeakPolarHBondContact O-CG 3.48Å; V603-E607 PolarHBondContact O-N 2.95Å
604K93.3Very high91.5Very high129 Ų129106.5 Ų106.556%0.56155%0.55SS*.Hα-helixtrans-61.9-43.1177-170.7-176.9177.3-169.80112.3A600 K601 V602 E607 E608A600-K604 WeakPolarHBondContact O-CB 3.17Å; A600-K604 PolarHBondContact O-N 2.96Å; A600-K604 VanDerWaalsContact O-N 3.07Å; K601-K604 PolarHBondContact O-N 3.37Å; V602-K604 VanDerWaalsContact C-N 3.3Å; V602-K604 PolarHBondContact O-N 3.24Å; K604-E607 WeakPolarHBondContact O-CB 3.43Å; K604-E607 PolarHBondContact O-N 3.5Å; K604-E608 VanDerWaalsContact CE-OE1 3.31Å; K604-E608 WeakPolarHBondContact CE-OE1 3.4Å; K604-E608 WeakPolarHBondContact O-CG 3.34Å; K604-E608 PolarHBondContact O-N 2.94Å
605L92.3Very high91.2Very high102 Ų102109.1 Ų109.153%0.53455%0.553SS.*Hα-helixtrans-65.5-38.5175.7-71.5171.8000111.8K601 V602 V603 E607 E608 V609K601-L605 WeakPolarHBondContact O-CG 3.47Å; K601-L605 PolarHBondContact O-N 3.33Å; V602-L605 PolarHBondContact O-N 3.1Å; V602-L605 VanDerWaalsContact O-N 3.1Å; V603-L605 PolarHBondContact O-N 2.86Å; L605-E607 VanDerWaalsContact C-N 3.32Å; L605-E607 PolarHBondContact O-N 3.24Å; L605-E608 PolarHBondContact O-N 3.47Å; L605-V609 WeakPolarHBondContact O-CG2 3.39Å; L605-V609 PolarHBondContact O-N 3.47Å
606E91.5Very high90.8Very high105 Ų105109.5 Ų109.549%0.49155%0.554SS.*Hα-helixtrans-61.9-38.9173.5-71.9176.3171.200111.8V602 V603 R610V602-E606 HydrophobicContact CG1-CG 4.28Å; V602-E606 WeakPolarHBondContact O-CG 3.5Å; V602-E606 PolarHBondContact O-N 2.97Å; V603-E606 WeakPolarHBondContact O-CB 3.42Å; V603-E606 PolarHBondContact O-N 3.31Å; E606-R610 WeakPolarHBondContact O-CB 3.31Å; E606-R610 PolarHBondContact O-N 3.44Å
607E90.9Very high90.3Very high93 Ų93110.1 Ų110.144%0.43556%0.555SS.*Hα-helixtrans-67.4-37.8173.3-72.4178.5-178.700112.9V603 K604 L605 K611V603-E607 WeakPolarHBondContact O-CG 3.48Å; V603-E607 PolarHBondContact O-N 2.95Å; K604-E607 WeakPolarHBondContact O-CB 3.43Å; K604-E607 PolarHBondContact O-N 3.5Å; L605-E607 VanDerWaalsContact C-N 3.32Å; L605-E607 PolarHBondContact O-N 3.24Å; E607-K611 WeakPolarHBondContact O-CG 3.49Å; E607-K611 PolarHBondContact O-N 3.04Å
608E87.8Confident89.9Confident89 Ų89111.8 Ų111.842%0.41656%0.562SS.*Hα-helixtrans-67.5-42.9175.3-74.1174.2-168.500111.5K604 L605 R610 K611K604-E608 VanDerWaalsContact CE-OE1 3.31Å; K604-E608 WeakPolarHBondContact CE-OE1 3.4Å; K604-E608 WeakPolarHBondContact O-CG 3.34Å; K604-E608 PolarHBondContact O-N 2.94Å; L605-E608 PolarHBondContact O-N 3.47Å; E608-R610 VanDerWaalsContact C-N 3.33Å; E608-R610 PolarHBondContact O-N 3.19Å; E608-K611 PolarHBondContact O-N 3.46Å
609V83.8Confident89.4Confident100 Ų100116.1 Ų116.161%0.60657%0.571SS**Hα-helixtrans-62.8-38.4174.71700000111.5L605 K611 I612L605-V609 WeakPolarHBondContact O-CG2 3.39Å; L605-V609 PolarHBondContact O-N 3.47Å; V609-K611 PolarHBondContact O-N 3.25Å; V609-I612 PolarHBondContact O-N 3.24Å
610R84.9Confident88.8Confident187 Ų187116 Ų11671%0.70657%0.573SS**THydrogen-bonded Turntrans-67.1-17.1178-163.6-178.6-61.6139.95.2113.6E606 E608E606-R610 WeakPolarHBondContact O-CB 3.31Å; E606-R610 PolarHBondContact O-N 3.44Å; E608-R610 VanDerWaalsContact C-N 3.33Å; E608-R610 PolarHBondContact O-N 3.19Å
611K80.4Confident88.2Confident171 Ų171120.6 Ų120.674%0.74358%0.579SS**THydrogen-bonded Turntrans-89-12.4178.2-72.6170.6-175.8170.50113.5E607 E608 V609E607-K611 WeakPolarHBondContact O-CG 3.49Å; E607-K611 PolarHBondContact O-N 3.04Å; E608-K611 PolarHBondContact O-N 3.46Å; V609-K611 PolarHBondContact O-N 3.25Å
612I67.4Low87.5Confident199 Ų199120.2 Ų120.2100%1.02158%0.582SS**  trans-91.60173.7-58.5172.9000107.7V609V609-I612 PolarHBondContact O-N 3.24Å

Retrieved 612 of 612 residues in 384.8 ms (Link to these results)