X2JDM5_DROME Loading...

Max-binding protein MNT

Binds DNA as a heterodimer with MAX and represses transcription. Binds to the canonical E box sequence 5'-CACGTG-3' and, with higher affinity, to 5'-CACGCG-3'.

AlphaFold DB , UniProt , Accession X2JDM5, Species DROME (Drosophila melanogaster, Fruit fly), Gene Mnt, Length 716 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.7Very low56.7Low249 Ų249107.9 Ų107.9100%1.22768%0.68SS**  0136.80-64125.274.700107.5
2S42Very low57.7Low98 Ų98110.5 Ų110.569%0.68568%0.677SS**  trans-130.4128.6-175.4-167.50000111.2I4S2-I4 PolarHBondContact O-N 3.34Å; S2-I4 VanDerWaalsContact O-N 3.1Å; S2-I4 VanDerWaalsContact OG-CD1 3.31Å; S2-I4 WeakPolarHBondContact OG-CD1 3.48Å; S2-I4 WeakPolarHBondContact OG-CG1 3.23Å
3G44Very low57.9Low80 Ų80105.8 Ų105.883%0.82566%0.657SS**  trans-78.316.9-169.500000116.2G5G3-G5 PolarHBondContact O-N 3.03Å
4I50Low58.3Low143 Ų143102.5 Ų102.573%0.73365%0.645SS**THydrogen-bonded Turntrans-68.3-18.3-167.4-64.3168.8000113.2S2 G6S2-I4 PolarHBondContact O-N 3.34Å; S2-I4 VanDerWaalsContact O-N 3.1Å; S2-I4 VanDerWaalsContact OG-CD1 3.31Å; S2-I4 WeakPolarHBondContact OG-CD1 3.48Å; S2-I4 WeakPolarHBondContact OG-CG1 3.23Å; I4-G6 PolarHBondContact O-N 3.15Å
5G48.8Very low58.7Low52 Ų52104.5 Ų104.554%0.53664%0.643SS.*THydrogen-bonded Turntrans-71.4-22.6-175.400000116.4G3 I7 G8 V9G3-G5 PolarHBondContact O-N 3.03Å; G5-I7 PolarHBondContact O-N 3.2Å; G5-G8 PolarHBondContact O-N 3.23Å; G5-V9 PolarHBondContact O-N 2.6Å
6G59.4Low59.1Low43 Ų43106.4 Ų106.444%0.44364%0.64SS.*Hα-helixtrans-63.2-40.2-165.700000115.3I4 L10I4-G6 PolarHBondContact O-N 3.15Å; G6-L10 PolarHBondContact O-N 3.29Å; G6-L10 VanDerWaalsContact O-N 3.14Å
7I66.5Low59.4Low131 Ų131107.6 Ų107.667%0.67264%0.641SS**Hα-helixtrans-72.3-35.3-174.2-59170.3000111.4G5 L10 L11G5-I7 PolarHBondContact O-N 3.2Å; I7-L10 PolarHBondContact O-N 3.31Å; I7-L11 PolarHBondContact O-N 2.98Å; I7-L11 VanDerWaalsContact O-N 3.15Å
8G69.3Low59.4Low46 Ų46110.4 Ų110.447%0.47465%0.647SS.*Hα-helixtrans-64.1-48.1176.600000112G5 L10 L11 E12G5-G8 PolarHBondContact O-N 3.23Å; G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 3.01Å; G8-L11 PolarHBondContact O-N 3.28Å; G8-E12 WeakPolarHBondContact O-CB 3.48Å; G8-E12 PolarHBondContact O-N 3.34Å
9V70Confident58.9Low94 Ų94112.7 Ų112.757%0.5765%0.651SS**Hα-helixtrans-64.3-34.3178.6179.40000111.6G5 E12 A13G5-V9 PolarHBondContact O-N 2.6Å; V9-E12 PolarHBondContact O-N 3.41Å; V9-A13 VanDerWaalsContact O-CB 3.24Å; V9-A13 WeakPolarHBondContact O-CB 3.45Å; V9-A13 PolarHBondContact O-N 3.49Å
10L67.7Low58.5Low126 Ų126114.1 Ų114.166%0.6665%0.651SS**Hα-helixtrans-66.2-39.8174.2-87.7162.5000113.1G6 I7 G8 A14G6-L10 PolarHBondContact O-N 3.29Å; G6-L10 VanDerWaalsContact O-N 3.14Å; I7-L10 PolarHBondContact O-N 3.31Å; G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 3.01Å; L10-A14 WeakPolarHBondContact O-CB 3.1Å; L10-A14 PolarHBondContact O-N 3.23Å; L10-A14 VanDerWaalsContact O-N 3.07Å
11L68.1Low57.9Low125 Ų125117.4 Ų117.465%0.65466%0.66SS**Hα-helixtrans-66.7-42.9173.4-10670.3000111.7I7 G8 A14 Q15I7-L11 PolarHBondContact O-N 2.98Å; I7-L11 VanDerWaalsContact O-N 3.15Å; G8-L11 PolarHBondContact O-N 3.28Å; L11-A14 PolarHBondContact O-N 3.36Å; L11-Q15 WeakPolarHBondContact O-CB 3.47Å; L11-Q15 PolarHBondContact O-N 3Å
12E68.4Low58.1Low139 Ų139114.7 Ų114.765%0.6564%0.642SS**Hα-helixtrans-65.8-40.8-179.8-167.9164.3-157.300111.6G8 V9 Q15 F16G8-E12 WeakPolarHBondContact O-CB 3.48Å; G8-E12 PolarHBondContact O-N 3.34Å; V9-E12 PolarHBondContact O-N 3.41Å; E12-Q15 PolarHBondContact O-N 3.03Å; E12-F16 WeakPolarHBondContact O-CB 3.45Å; E12-F16 PolarHBondContact O-N 3.04Å
13A60.8Low58.1Low50 Ų50117.5 Ų117.541%0.41365%0.649SS.*Hα-helixtrans-66.8-39.7173.800000113V9 F16 L17V9-A13 VanDerWaalsContact O-CB 3.24Å; V9-A13 WeakPolarHBondContact O-CB 3.45Å; V9-A13 PolarHBondContact O-N 3.49Å; A13-F16 PolarHBondContact O-N 2.88Å; A13-L17 WeakPolarHBondContact O-CG 3.26Å; A13-L17 PolarHBondContact O-N 3.37Å
14A62.9Low57.9Low59 Ų59119.8 Ų119.849%0.48865%0.649SS.*Hα-helixtrans-62.7-43.5174.600000111.5L10 L11 F16 L17 E18L10-A14 WeakPolarHBondContact O-CB 3.1Å; L10-A14 PolarHBondContact O-N 3.23Å; L10-A14 VanDerWaalsContact O-N 3.07Å; L11-A14 PolarHBondContact O-N 3.36Å; A14-F16 VanDerWaalsContact C-N 3.31Å; A14-F16 PolarHBondContact O-N 3.19Å; A14-L17 PolarHBondContact O-N 3.17Å; A14-E18 PolarHBondContact O-N 2.87Å; A14-E18 VanDerWaalsContact O-N 3.13Å
15Q65.3Low57.2Low133 Ų133122.2 Ų122.262%0.62166%0.657SS**Hα-helixtrans-67.7-30.1176.8-169161.245.600112.6L11 E12 Q19L11-Q15 WeakPolarHBondContact O-CB 3.47Å; L11-Q15 PolarHBondContact O-N 3Å; E12-Q15 PolarHBondContact O-N 3.03Å; Q15-Q19 WeakPolarHBondContact O-CG 3.35Å; Q15-Q19 PolarHBondContact O-N 3.31Å
16F65.2Low56.6Low134 Ų134124.8 Ų124.859%0.58867%0.673SS**Hα-helixtrans-70.5-38.3173.6-169.2-95.4000112.7E12 A13 A14 Q19E12-F16 WeakPolarHBondContact O-CB 3.45Å; E12-F16 PolarHBondContact O-N 3.04Å; A13-F16 PolarHBondContact O-N 2.88Å; A14-F16 VanDerWaalsContact C-N 3.31Å; A14-F16 PolarHBondContact O-N 3.19Å; F16-Q19 PolarHBondContact O-N 3.38Å
17L63.3Low55.3Low127 Ų127126.8 Ų126.867%0.66569%0.693SS**Hα-helixtrans-66.9-42.9175.9-71.5167.7000111.9A13 A14 Q19 H20 E21A13-L17 WeakPolarHBondContact O-CG 3.26Å; A13-L17 PolarHBondContact O-N 3.37Å; A14-L17 PolarHBondContact O-N 3.17Å; L17-Q19 PolarHBondContact O-N 2.89Å; L17-H20 PolarHBondContact O-N 3.48Å; L17-H20 VanDerWaalsContact O-N 3.08Å; L17-E21 PolarHBondContact O-N 3.25Å
18E59.7Low53.7Low159 Ų159124.7 Ų124.774%0.74370%0.704SS**Hα-helixtrans-61.8-25.9176.8-170.3175.6-149.200113A14A14-E18 PolarHBondContact O-N 2.87Å; A14-E18 VanDerWaalsContact O-N 3.13Å
19Q50.9Low51.9Low154 Ų154126.4 Ų126.472%0.7272%0.722SS**Hα-helixtrans-78.7-18.6176-68.8-80.5-65.400113.9Q15 F16 L17Q15-Q19 WeakPolarHBondContact O-CG 3.35Å; Q15-Q19 PolarHBondContact O-N 3.31Å; F16-Q19 PolarHBondContact O-N 3.38Å; L17-Q19 PolarHBondContact O-N 2.89Å
20H50.7Low50.1Low140 Ų140126 Ų12665%0.64874%0.737SS**Hα-helixtrans-116.3-4.3-165.5-105.1-73.8000116.4L17 K22L17-H20 PolarHBondContact O-N 3.48Å; L17-H20 VanDerWaalsContact O-N 3.08Å; H20-K22 PolarHBondContact O-N 3.3Å
21E46.1Very low48.3Very low183 Ų183123.5 Ų123.586%0.85574%0.741SS**  trans-79.164.6173.4-161.3175.8-172.300112.4L17L17-E21 PolarHBondContact O-N 3.25Å
22K40.9Very low46.7Very low192 Ų192123.2 Ų123.284%0.83575%0.75SS**  trans-124.492.6170.8-163.6175.7-175-178.90111.2H20H20-K22 PolarHBondContact O-N 3.3Å
23L41.4Very low45.1Very low158 Ų158120.9 Ų120.983%0.82775%0.754SS**  trans-53.2130176-77.8164.6000112.1Q25L23-Q25 PolarHBondContact O-N 3.45Å
24P39.5Very low43.9Very low127 Ų127127.1 Ų127.183%0.82578%0.78SS**  trans-81.1107.3169.631.3-31.2000110.3
25Q37Very low42.4Very low195 Ų195127.4 Ų127.491%0.91179%0.789SS**  trans-10196.7174-172.8-179.324.800111.1L23L23-Q25 PolarHBondContact O-N 3.45Å
26A35Very low40.9Very low105 Ų105129 Ų12987%0.86881%0.807SS**  trans-160.3131.816400000110.8
27G31.5Very low39.1Very low85 Ų85126.2 Ų126.288%0.87682%0.817SS**  trans14576.5179.600000112.7
28G34.4Very low37.8Very low87 Ų87127.5 Ų127.590%0.89783%0.829SS**  trans-85.2150179.500000113.1
29G31.1Very low36.4Very low82 Ų82124.5 Ų124.585%0.84583%0.832SS**  trans-175.758-177.300000117.1
30G31.5Very low35.6Very low87 Ų87125.3 Ų125.390%0.89784%0.84SS**  trans61.6137.5152.400000121.3
31G31.1Very low35.2Very low72 Ų72123.7 Ų123.774%0.74284%0.842SS**  trans133.8104.1153.600000117.8
32S33.3Very low34.3Very low119 Ų119123.6 Ų123.683%0.83284%0.842SS**  trans51.791.9139.9-54.60000121.7
33A36Very low34.2Very low90 Ų90123.2 Ų123.274%0.74484%0.843SS**  62.9147.4119.700000123
34L35.6Very low33.7Very low181 Ų181124.8 Ų124.895%0.94885%0.846SS**  trans69.5140.5172.3-42.3180000115.2
35G30.8Very low33.3Very low66 Ų66127.1 Ų127.168%0.6885%0.846SS**  cis161.2132.1-10.800000112.7
36V32.9Very low33.1Very low166 Ų166126.8 Ų126.8100%1.00684%0.844SS**  trans68.7138.1173.1-170.60000116.3
37G29.2Very low32.8Very low76 Ų76127.8 Ų127.878%0.78484%0.839SS**  trans162.79617000000114.5
38V35.8Very low32.9Very low153 Ų153130.2 Ų130.293%0.92784%0.837SS**  trans-99.6128.7175.51730000110.4
39A29Very low32.6Very low97 Ų97133.5 Ų133.580%0.80283%0.829SS**  trans-161.1139.7156.900000112.3
40L35.8Very low32.5Very low170 Ų170134.6 Ų134.689%0.8982%0.822SS**  trans-135.2124.8167-175.683.5000108.7
41P42.2Very low32.6Very low106 Ų106139.4 Ų139.469%0.68882%0.819SS**  trans-131.7128.714413.58000110.6
42Q27.3Very low32.6Very low182 Ų182141.3 Ų141.385%0.8582%0.821SS**  81.1124.473.1-165.4175.323.200113.5
43Q38.1Very low32.4Very low183 Ų183143.5 Ų143.586%0.85582%0.823SS**  trans-72.5148.3179.4-75.2-176.6-2700113.1
44Q29.8Very low32.1Very low192 Ų192143.5 Ų143.590%0.89782%0.818SS**  trans-140.5142.2150.8-158.5168.927.100111
45Q32.8Very low32Very low176 Ų176143 Ų14382%0.82281%0.814SS**  trans-85.1140.2-179.7-63.2172.87.600110.5
46Q31Very low32.1Very low188 Ų188146.2 Ų146.288%0.87981%0.814SS**  trans-106.9124.2168.3-82.2-169.3-300111.9
47T29.6Very low32Very low125 Ų125145.3 Ų145.377%0.76780%0.804SS**  trans-81.6114.8172.1-61.40000109.6H49T47-H49 PolarHBondContact O-N 2.89Å; T47-H49 VanDerWaalsContact O-N 3.16Å
48V34.6Very low31.9Very low137 Ų137148.4 Ų148.483%0.8380%0.802SS**  trans-75.6105.5179.5-168.60000109.8
49H27.9Very low31.8Very low155 Ų155148.1 Ų148.172%0.71880%0.796SS**  trans-93.5115.2178.2-133.799.5000110.1T47 K51T47-H49 PolarHBondContact O-N 2.89Å; T47-H49 VanDerWaalsContact O-N 3.16Å; H49-K51 PolarHBondContact O-N 2.92Å
50C28Very low31.8Very low105 Ų105150.3 Ų150.371%0.70979%0.794SS**PPolyproline II helixtrans-64.4121.9175.4-59.10000110
51K33Very low31.6Very low188 Ų188147 Ų14782%0.81779%0.785SS**PPolyproline II helixtrans-83.9127.1173.9-96.789.9172.5-169.80110.5H49H49-K51 PolarHBondContact O-N 2.92Å
52S30.9Very low31Very low113 Ų113147.2 Ų147.279%0.7979%0.789SS**PPolyproline II helixtrans-75.1122.1166.7-53.60000110.3S54S52-S54 VanDerWaalsContact C-N 3.31Å; S52-S54 PolarHBondContact O-N 3.4Å
53N30.1Very low31.2Very low164 Ų164146.7 Ų146.788%0.87779%0.787SS**  trans-74.483.4170.7-87-13.1000110.4
54S28.8Very low30.9Very low91 Ų91146.6 Ų146.664%0.63679%0.786SS**  trans-85.5111.3167.9-166.10000109.5S52 I56S52-S54 VanDerWaalsContact C-N 3.31Å; S52-S54 PolarHBondContact O-N 3.4Å; S54-I56 VanDerWaalsContact C-N 3.33Å; S54-I56 PolarHBondContact O-N 3.32Å
55I33.9Very low31Very low170 Ų170143.5 Ų143.587%0.87278%0.775SS**  trans-78.586.1175.5-56.7178.3000108.3
56I33.8Very low30.8Very low133 Ų133146.2 Ų146.268%0.68278%0.778SS**  trans-97.4105170.6-59.4-179.2000108.1S54 N58S54-I56 VanDerWaalsContact C-N 3.33Å; S54-I56 PolarHBondContact O-N 3.32Å; I56-N58 PolarHBondContact O-N 2.97Å; I56-N58 VanDerWaalsContact O-N 3.15Å
57N30.8Very low30.7Very low148 Ų148143.6 Ų143.679%0.79177%0.77SS**  trans-64.4108.5167.3175.730000109
58N27.7Very low30.6Very low140 Ų140142 Ų14275%0.74976%0.764SS**  trans-119.6108.4175.6-1676.1000109.9I56I56-N58 PolarHBondContact O-N 2.97Å; I56-N58 VanDerWaalsContact O-N 3.15Å
59N31.8Very low30.3Very low148 Ų148140.2 Ų140.279%0.79176%0.758SS**  trans-105.4110.8178.4-174.620.8000108
60N30.4Very low30.4Very low142 Ų142138.7 Ų138.776%0.75977%0.765SS**  trans-126.6127.8178.9-168.919.9000111.5
61S30.5Very low30.5Very low101 Ų101139.1 Ų139.171%0.70677%0.769SS**  trans-72.2138.1179-57.50000111.5
62S31Very low30.6Very low111 Ų111135.7 Ų135.778%0.77677%0.768SS**  trans-112.4125.2159.6-173.10000109.1
63Q30.2Very low30.7Very low171 Ų171138.2 Ų138.280%0.79977%0.773SS**  trans-84.1134.8-179.3-78.7-76.50.700111
64H31.8Very low30.7Very low180 Ų180133.8 Ų133.883%0.83377%0.766SS**  trans-139.680166.6-110.9-70.7000113.7
65N31.5Very low30.7Very low127 Ų127137.7 Ų137.768%0.67978%0.778SS**  trans-8.6123.9153175.917.8000118.1
66R30Very low30.6Very low233 Ų233136.8 Ų136.888%0.87977%0.773SS**  trans171.8152.6136.7-89.7148-174.1175.12.5109.2
67N28.4Very low30.4Very low133 Ų133135.3 Ų135.371%0.71178%0.782SS**  cis-170.9148.3-24.3173.751.8000108.4
68S27.3Very low30.5Very low92 Ų92134 Ų13464%0.64378%0.779SS**  trans62.9154.1166.1-77.30000118.3
69S28.3Very low30.9Very low100 Ų100132.6 Ų132.670%0.69978%0.778SS**  cis-162.6171.5-12.6-100.40000110.2
70S30.1Very low31.3Very low122 Ų122131.7 Ų131.785%0.85378%0.779SS**  trans90.4149.9168.2-50.60000117.5
71S29.5Very low31.3Very low114 Ų114134.8 Ų134.880%0.79779%0.787SS**  cis178.1108.7-30.5164.90000108.7
72S36.8Very low31.3Very low116 Ų116136.9 Ų136.981%0.81180%0.795SS**  trans-169.3119.3157.4530000112.7
73N32.5Very low31.3Very low166 Ų166138.8 Ų138.889%0.88880%0.797SS**  trans-70153.9150.5-52.9-57.5000107.6
74G30.1Very low31.3Very low71 Ų71134.2 Ų134.273%0.73280%0.795SS**  cis121.198.812.900000109.4
75I28.7Very low31.3Very low173 Ų173133.1 Ų133.189%0.88780%0.795SS**  trans-132.6144.4173.6-72.2-174.6000108.9
76I31.3Very low31.3Very low151 Ų151130.5 Ų130.577%0.77480%0.799SS**  trans-112.1144.5-171.9-63.1168.1000109.5T78I76-T78 HydrophobicContact CG2-CG2 4.16Å
77A28.7Very low31.4Very low103 Ų103127.2 Ų127.285%0.85180%0.798SS**  trans-137.4126.8159.300000109.8
78T33.3Very low31.5Very low120 Ų120124.3 Ų124.374%0.73680%0.8SS**PPolyproline II helixtrans-97.5143-172.447.10000113I76I76-T78 HydrophobicContact CG2-CG2 4.16Å
79P36.7Very low31.6Very low111 Ų111126 Ų12672%0.72181%0.807SS**PPolyproline II helixtrans-72.5153.115533.3-32.8000110.4
80P39.9Very low31.7Very low128 Ų128128.3 Ų128.383%0.83182%0.816SS**PPolyproline II helixtrans-79.5145.1-173.331.4-35.4000113.4
81F30.7Very low31.7Very low208 Ų208126 Ų12691%0.91281%0.812SS**PPolyproline II helixtrans-77.5146.6164.5-76.1-91.2000111.1
82T30.8Very low31.6Very low144 Ų144128 Ų12888%0.88382%0.819SS**  trans-116.7152.5151.1-173.80000109
83N31.7Very low31.3Very low152 Ų152125.9 Ų125.981%0.81382%0.815SS**  trans-102.1142.2-158.8-171.99.6000112.5
84G29Very low31.1Very low74 Ų74125.3 Ų125.376%0.76381%0.812SS**  trans-156.762.6-174.700000112.6
85N32.6Very low31.2Very low157 Ų157126.7 Ų126.784%0.8482%0.816SS**  trans-58.9135.2177.3-179.934.8000112.5
86G31.7Very low31.2Very low72 Ų72124 Ų12474%0.74281%0.813SS**  trans-168.287.3-176.900000114.5
87N31.9Very low31.3Very low164 Ų164121 Ų12188%0.87781%0.811SS**  trans-79.1138.5167.7175.844.8000110.5
88G30.9Very low31.4Very low72 Ų72123.5 Ų123.574%0.74281%0.808SS**  trans173.2111.3176.300000116.8
89T28.6Very low31.3Very low128 Ų128127.3 Ų127.379%0.78582%0.815SS**  trans-89.1160.8171.546.20000113.5
90V29.6Very low31Very low149 Ų149128.6 Ų128.690%0.90382%0.816SS**  trans70.9145163.1-143.90000117.7
91G29.9Very low30.4Very low74 Ų74128.1 Ų128.176%0.76381%0.81SS**  trans156.897.7162.300000115.7
92V28.5Very low30.2Very low156 Ų156123.1 Ų123.195%0.94580%0.801SS**  trans-83.4140.2179.3175.90000112.3
93G30Very low30Very low70 Ų70122.2 Ų122.272%0.72280%0.795SS**  trans163.395.5164.500000112.8
94N28.8Very low29.6Very low154 Ų154122 Ų12282%0.82479%0.794SS**  97.6101.363.3178.535.1000113
95A32.2Very low29.5Very low100 Ų100122.8 Ų122.883%0.82679%0.794SS**  trans-166.1136.3151.500000110.7
96S28.7Very low29.4Very low117 Ų117123 Ų12382%0.81880%0.795SS**  trans-93.2149.5179.5-58.70000112.8
97A32.4Very low29.3Very low88 Ų88122.7 Ų122.773%0.72779%0.791SS**  trans-146.8103.8157.400000110.8F99A97-F99 HydrophobicContact CB-CE2 4.34Å
98I32.1Very low29.3Very low155 Ų155122.4 Ų122.480%0.79579%0.79SS**  trans-93.5135.2164.7-62.1171.4000106.8
99F30.9Very low29.2Very low200 Ų200122.8 Ų122.888%0.87779%0.794SS**  trans-133130166-82.1-72.9000111.8A97A97-F99 HydrophobicContact CB-CE2 4.34Å
100N30.4Very low29.3Very low139 Ų139124.9 Ų124.974%0.74380%0.799SS**  trans-138.1112.8178.9-170.429.3000109.5
101V26.4Very low29.4Very low117 Ų117123 Ų12371%0.70979%0.793SS**  trans41118.8147.4-179.90000120.3
102S26.6Very low29.6Very low104 Ų104127 Ų12773%0.72780%0.796SS**  trans72.6164.5155.3-60.20000118
103V26.4Very low29.9Very low124 Ų124123.2 Ų123.275%0.75279%0.789SS**  cis-148.8171.515.5-1410000112.5
104N24.1Very low29.9Very low147 Ų147128.2 Ų128.279%0.78679%0.793SS**  trans68.5142.2163.7-75.8-8.2000118.2
105A26.5Very low29.9Very low92 Ų92125.3 Ų125.376%0.7679%0.785SS**  cis78.9142.434.100000113.3
106N30.2Very low30Very low161 Ų161126.2 Ų126.286%0.86179%0.786SS**  cis-154.6156.1-4.2175.826.2000107.6
107G30.3Very low30.6Very low65 Ų65126 Ų12667%0.6778%0.781SS**  trans-166.474.8-172.600000118.8
108N32.4Very low30.7Very low159 Ų159133.6 Ų133.685%0.8579%0.791SS**  trans33.9120152.8-66.2-3.3000121.5
109G28.6Very low30.7Very low80 Ų80130.5 Ų130.583%0.82578%0.784SS**  trans-159.374.1164.600000112.4
110L31.6Very low31.1Very low172 Ų172128.8 Ų128.890%0.90178%0.778SS**  trans-75.3122.2179.5-70.1167.2000111.6
111S31.3Very low31.1Very low109 Ų109130.1 Ų130.176%0.76278%0.784SS**  176.3143.3128.840.80000114.9
112N32.7Very low31.2Very low157 Ų157128.2 Ų128.284%0.8478%0.781SS**  trans40.196.2146.6-59.517.1000119.9
113G35Very low31.4Very low78 Ų78128.2 Ų128.280%0.80479%0.787SS**  trans-85.2114.4143.700000110.5
114H31Very low31.6Very low174 Ų174127 Ų12781%0.80679%0.79SS**  trans-156.8111.1163.3-131.6-119.4000112.7
115S29.2Very low31.8Very low93 Ų93124 Ų12465%0.6579%0.786SS**  trans35.791.6131.1-50.80000121
116S32.6Very low32Very low119 Ų119126.2 Ų126.283%0.83279%0.791SS**  trans64.5173.8137.2-590000118.8
117P41Very low32Very low113 Ų113121.9 Ų121.973%0.73478%0.777SS**  cis-116.4173.8-13.740.4-28.7000113.3S119P117-S119 VanDerWaalsContact C-N 3.26Å; P117-S119 PolarHBondContact O-N 3.23Å
118R35.1Very low32Very low247 Ų247126.5 Ų126.593%0.93278%0.781SS**  trans-77.773.6164.6-174.9176.8168.7172.3-4.1110.8
119S31.6Very low31.8Very low91 Ų91124.5 Ų124.564%0.63677%0.77SS**  trans-70.4138.2160.2-148.50000108P117P117-S119 VanDerWaalsContact C-N 3.26Å; P117-S119 PolarHBondContact O-N 3.23Å
120Q40.8Very low31.8Very low164 Ų164130.5 Ų130.577%0.76677%0.769SS**  cis68.8139.932.3-58.9-141.853.100114.7
121L29.3Very low31.6Very low166 Ų166130 Ų13087%0.86976%0.762SS**  trans67.6151.3-176-99.566.9000115.4
122A29.6Very low31.5Very low78 Ų78134.6 Ų134.665%0.64576%0.764SS**  cis-156.2153.8-3.900000113.1
123A30.2Very low31.3Very low103 Ų103130.9 Ų130.985%0.85175%0.751SS**  trans54.3170.3139.900000119.8
124A30.4Very low31.1Very low98 Ų98131.8 Ų131.881%0.8175%0.75SS**  cis-139.5177.3-6.500000107.8
125A28.5Very low31.2Very low86 Ų86128.3 Ų128.371%0.71175%0.752SS**  cis-146.1-177.65.900000107.8
126T31.1Very low31.1Very low138 Ų138127.2 Ų127.285%0.84776%0.755SS**  cis-150.3169.718.4-37.70000110.1
127A28.8Very low31Very low69 Ų69128.7 Ų128.757%0.5776%0.759SS**  trans-47.1152.9-178.600000115.1
128H31.8Very low30.5Very low163 Ų163127 Ų12776%0.75575%0.754SS**  -157.5170.451-82.1-87.3000111.2
129D26.6Very low30.3Very low116 Ų116123 Ų12362%0.6275%0.751SS**  cis-162.4169.41.5-124.3-0.9000114.1
130Y30.1Very low30.2Very low206 Ų206121.6 Ų121.681%0.80875%0.751SS**  trans59.4172.7159.1-79.5-70.1000121.5
131E26.1Very low29.7Very low162 Ų162122.5 Ų122.576%0.75776%0.755SS**  -140.9149-125.7-125.3-160.5124.600118.2
132Y28.9Very low29.9Very low206 Ų206118.9 Ų118.981%0.80874%0.743SS**  trans33.8119.7137-151.1-130.8000121.7
133S30.4Very low30Very low79 Ų79124.9 Ų124.955%0.55276%0.758SS**  147.5158.487.7-141.90000119.9
134A30.5Very low29.9Very low96 Ų96123.3 Ų123.379%0.79375%0.752SS**  trans67.6168.4139.900000122.8
135A31.5Very low30.1Very low102 Ų102129.8 Ų129.884%0.84376%0.756SS**  trans-152.6145.8-171.100000114.4
136G28.5Very low31Very low69 Ų69130.8 Ų130.871%0.71176%0.755SS**  trans92.2135.3142.300000120.8
137V29.6Very low31Very low151 Ų151132.6 Ų132.692%0.91575%0.753SS**  trans74.1132.4149.5-179.80000116.2
138A31Very low31.1Very low76 Ų76134 Ų13463%0.62876%0.755SS**  cis-167.8-167.5-8.500000112.4
139N31.3Very low31.2Very low164 Ų164131.8 Ų131.888%0.87776%0.757SS**  trans80.4153.6169.1-62.5-15.6000117.6
140G28.9Very low31.6Very low61 Ų61133.4 Ų133.463%0.62977%0.766SS**  cis169.8-166.5-6.500000114.6
141H31.3Very low31.6Very low184 Ų184130.9 Ų130.985%0.85276%0.759SS**  trans70154.8173-69.5-82.2000119.7
142S33.3Very low31.8Very low90 Ų90130.5 Ų130.563%0.62976%0.76SS**  174.2143.1-51.8510000110.5
143E31Very low31.8Very low203 Ų203126 Ų12695%0.94975%0.749SS**  trans163.8138.5146.4-75-126.5138.300108
144G29Very low31.7Very low71 Ų71129.4 Ų129.473%0.73276%0.76SS**  cis-174.8138.6-14.100000113
145R33.1Very low31.6Very low234 Ų234129.1 Ų129.188%0.88376%0.758SS**  trans31.8168143.9-91.8-176.1163.1-146.4-4.3123.5
146P48.8Very low31.5Very low107 Ų107129.1 Ų129.170%0.69576%0.758SS**  cis-117.9-179-12.642.9-28.4000111.7
147H31.3Very low31.4Very low175 Ų175130.8 Ų130.881%0.8177%0.765SS**  -158.3174.459.1-159.3-99.7000113.3
148V31Very low31.5Very low99 Ų99127.8 Ų127.860%0.676%0.756SS**  trans-101.9154-160.1-69.30000116.5
149S33.2Very low31.5Very low116 Ų116130 Ų13081%0.81176%0.762SS**  -175.6120.8120.956.50000113.8
150D34.2Very low31.4Very low150 Ų150127.4 Ų127.480%0.80276%0.757SS**  trans-80.1-179.7162.6-58.2-80.7000110.8
151F31.6Very low31.5Very low153 Ų153128.6 Ų128.667%0.67176%0.76SS**  cis-152.2-169.914.1-152.8-160.9000107.6L153F151-L153 HydrophobicContact CE1-CD1 4.48Å; F151-L153 HydrophobicContact CE1-CD2 3.92Å; F151-L153 HydrophobicContact CE2-CD1 3.74Å; F151-L153 HydrophobicContact CZ-CD1 3.71Å; F151-L153 HydrophobicContact CZ-CD2 3.75Å; F151-L153 HydrophobicContact CZ-CG 4.28Å
152M30.3Very low31.5Very low154 Ų154125.7 Ų125.776%0.75976%0.756SS**  cis-139-175.919-89.4-167.5171.500109.1
153L28.4Very low31.3Very low113 Ų113126.9 Ų126.959%0.59276%0.764SS**  cis72.5141.332.2-8964.5000115F151F151-L153 HydrophobicContact CE1-CD1 4.48Å; F151-L153 HydrophobicContact CE1-CD2 3.92Å; F151-L153 HydrophobicContact CE2-CD1 3.74Å; F151-L153 HydrophobicContact CZ-CD1 3.71Å; F151-L153 HydrophobicContact CZ-CD2 3.75Å; F151-L153 HydrophobicContact CZ-CG 4.28Å
154L27.5Very low31.3Very low150 Ų150121.7 Ų121.779%0.78576%0.756SS**  cis-162.4159.2-11.1-171.356.4000111.8
155A28.4Very low31.3Very low90 Ų90124.5 Ų124.574%0.74476%0.759SS**  trans65.3162.2155.900000118.7
156A29.3Very low31.9Very low101 Ų101118.9 Ų118.984%0.83575%0.753SS**  cis-156.5170.4-21.800000109.2
157A27.6Very low31Very low104 Ų104117.5 Ų117.586%0.8675%0.75SS**  trans-97.1133.1176.700000112.5
158A30.4Very low30.9Very low88 Ų88116 Ų11673%0.72775%0.754SS**  trans-159.8138.816200000113.5
159T31.1Very low30.9Very low123 Ų123115.2 Ų115.276%0.75576%0.757SS**  trans46113.7144.455.70000122.6
160S30.4Very low30.8Very low110 Ų110116.1 Ų116.177%0.76976%0.759SS**  75.4123.9114.4-52.70000122.9
161A30.6Very low30.7Very low86 Ų86114 Ų11471%0.71176%0.755SS**  trans83123.8131.900000122.2
162T30.5Very low30.6Very low123 Ų123111 Ų11176%0.75576%0.759SS**  trans58.1106.3136.956.10000122.1
163S29.7Very low30.5Very low115 Ų115108.7 Ų108.780%0.80476%0.764SS**  75.8159.3124.473.10000122
164A30.6Very low30.7Very low94 Ų94107.5 Ų107.578%0.77777%0.771SS**  trans77.9101.5161.100000119.9
165T30.1Very low30.9Very low130 Ų130107.1 Ų107.180%0.79878%0.775SS**  trans-58.6173140.255.10000112
166P45.7Very low30.9Very low115 Ų115107 Ų10775%0.74777%0.774SS**  cis-143.4-173.69.342.8-23.3000117.1
167A28.6Very low31Very low78 Ų78106.9 Ų106.965%0.64577%0.773SS**  trans78.6142.5136.800000123.7
168T29.4Very low31.2Very low144 Ų144107.4 Ų107.488%0.88377%0.77SS**  trans64.4143.815632.10000117.9
169A30.9Very low31.2Very low82 Ų82110.5 Ų110.568%0.67878%0.775SS**  cis-151.6-1661.200000108.4
170T31.3Very low31.9Very low136 Ų136110 Ų11083%0.83477%0.774SS**  cis-144.3-101.39.8-35.20000113.3
171S31.8Very low31.8Very low104 Ų104108.9 Ų108.973%0.72777%0.771SS**  trans-170.6175.4-162.258.30000113.8
172A29.2Very low31.7Very low92 Ų92113.5 Ų113.576%0.7678%0.775SS**  trans73.9121.5174.200000115.6
173A29.2Very low31.7Very low105 Ų105118.6 Ų118.687%0.86878%0.78SS**  cis84.2118.616.200000117.5
174A32.4Very low31.7Very low88 Ų88121 Ų12173%0.72778%0.776SS**  trans-171130.4147.900000112.9
175T30.8Very low31.7Very low141 Ų141123.4 Ų123.487%0.86578%0.775SS**  trans46.8148.5141.949.90000123.4
176A30.3Very low31.6Very low89 Ų89122 Ų12274%0.73677%0.77SS**  cis-166.7166.6-6.100000112.7
177A29.4Very low31Very low98 Ų98121.1 Ų121.181%0.8177%0.768SS**  trans48130.2152.800000120
178S32.5Very low31.2Very low114 Ų114125.1 Ų125.180%0.79778%0.776SS**  cis-169.5173.247.3460000113.7
179N30.2Very low31.3Very low154 Ų154122.6 Ų122.682%0.82477%0.77SS**  trans-134.4174.8173.5-112.4-85.4000107.5
180P46.3Very low31.3Very low113 Ų113127 Ų12773%0.73478%0.777SS**  cis-106.8-154.113.244.7-36000112.3
181A28.1Very low31.5Very low86 Ų86127.6 Ų127.671%0.71177%0.773SS**  cis-147.9165.6500000110.2
182K28.6Very low31.8Very low183 Ų183128.7 Ų128.780%0.79678%0.778SS**  cis94.2104.421.5-88.6178.7179.9168.60117.9
183R30Very low31.9Very low229 Ų229129.2 Ų129.286%0.86478%0.776SS**  trans91147.1150.2-65.1-175.8174.3-175.5-0.2118.9
184K30.8Very low32Very low165 Ų165133.1 Ų133.172%0.71777%0.773SS**  cis-175.4144.8-13.7168.6176.8-177.5-165.30113.2
185L29.3Very low32Very low146 Ų146138.7 Ų138.776%0.76478%0.782SS**  trans67.7159.5165.8-77.1169.7000117.9
186S28.3Very low32Very low99 Ų99139.5 Ų139.569%0.69278%0.78SS**  cis-135.3146.14.452.80000111.6
187S34Very low31.9Very low98 Ų98142.2 Ų142.269%0.68579%0.787SS**  49.7132.886.4-143.70000113.9
188I32.4Very low32Very low161 Ų161143.5 Ų143.583%0.82678%0.784SS**  cis-150.6172.618-155.8152.5000108.1
189A32.6Very low32Very low92 Ų92144.2 Ų144.276%0.7679%0.789SS**  cis-143.3-136.318.500000113.9
190E30.2Very low31.9Very low175 Ų175143.6 Ų143.682%0.81879%0.786SS**  trans-153.7160.5-142.9-167.1166.7-166.500116.2
191I34.7Very low31.3Very low148 Ų148143 Ų14376%0.75979%0.79SS**  trans-128.7137.6176.8-66.4176.9000108.7
192P38.5Very low31.5Very low126 Ų126148.5 Ų148.582%0.81880%0.798SS**  trans-75.7139.5-165.728.6-36.6000115.9
193S32.4Very low31.6Very low103 Ų103143 Ų14372%0.7279%0.794SS**  trans-86.7154.9-172.2-48.10000115.2
194K29.8Very low31.6Very low187 Ų187137.7 Ų137.781%0.81379%0.786SS**  trans-138.2143154.2-70.1-172.9179.8177.50110
195F34.1Very low31.5Very low206 Ų206140 Ų14090%0.90479%0.792SS**  trans66.5113.9-178.2-58.1-78.9000116.1
196L30.7Very low31.3Very low158 Ų158138.2 Ų138.283%0.82779%0.792SS**  trans-147.4103.2171.8-145.1-177000108.7
197V28.1Very low31.2Very low145 Ų145137.6 Ų137.688%0.87979%0.793SS**  trans-145.899.8166.4-178.20000108.3
198V30.4Very low30.8Very low125 Ų125141.5 Ų141.576%0.75880%0.799SS**  trans-145.1130.3163.8179.90000108
199S32.9Very low30.6Very low129 Ų129140.5 Ų140.590%0.90280%0.801SS**  trans-158.7102.4158.5-77.70000108.5
200D27.1Very low30.4Very low142 Ų142145 Ų14576%0.75981%0.806SS**  trans-110.6141.9161.4179.823.4000107.6
201A33.5Very low31.1Very low99 Ų99141.6 Ų141.682%0.81880%0.799SS**  trans-157.4127.7179.300000109.2
202K32.7Very low30.9Very low203 Ų203142.2 Ų142.288%0.88380%0.804SS**  trans-145124.6-167.2-168.3173.3-175.2174.40113.9
203G30.8Very low30.4Very low68 Ų68140 Ų14070%0.70180%0.803SS**  trans136157.2162.400000115.1
204V31.4Very low30.3Very low117 Ų117145.5 Ų145.571%0.70982%0.815SS**  cis-165.5128.2-24.497.40000110.2
205Y27.3Very low30.2Very low214 Ų214141.6 Ų141.684%0.83982%0.818SS**  trans57.2156.7167.3-59.2-54.8000118.8
206S25.7Very low30.2Very low108 Ų108136.7 Ų136.776%0.75582%0.815SS**  cis-161.8169.9-6.9-120.60000113.3
207A25.8Very low30.3Very low86 Ų86136.9 Ų136.971%0.71182%0.817SS**  trans82.6120.1151.800000123.3
208H26.1Very low30.9Very low179 Ų179135.1 Ų135.183%0.82981%0.811SS**  trans44.5108.2145.1-69.3-86.8000122.7
209T28.5Very low31.3Very low141 Ų141137 Ų13787%0.86582%0.816SS**  -175.7149.597.924.80000113.1
210H28.1Very low31.8Very low186 Ų186133.9 Ų133.986%0.86181%0.805SS**  trans-107.9168.5165.9-77.1-64.8000108.1
211P45.6Very low32.7Very low103 Ų103132.3 Ų132.367%0.66980%0.8SS**  cis-141.1-178.720.841.8-22.7000117.7
212N30.4Very low33.4Very low162 Ų162132.5 Ų132.587%0.86679%0.787SS**  trans124.2139.5149.9-66.3-24.1000115.9
213G28Very low34.4Very low78 Ų78128.6 Ų128.680%0.80478%0.776SS**  trans113.992.3170.400000114.8
214F28.6Very low35.5Very low220 Ų220130.2 Ų130.297%0.96577%0.768SS**  trans-84.8132.3167.1-77.3-100.4000110.8
215A29.4Very low36.7Very low105 Ų105130.2 Ų130.287%0.86876%0.761SS**  trans-173128.7134.100000109.4
216A33.9Very low38.4Very low102 Ų102123.7 Ų123.784%0.84374%0.743SS**  trans-115.9132.4162.400000107.1
217D31.4Very low40.5Very low163 Ų163124.5 Ų124.587%0.87274%0.737SS**  trans-150.1159.4170.6-136.4-31.6000112.8
218S41.3Very low42.8Very low108 Ų108125.2 Ų125.276%0.75573%0.727SS**  trans-105.8115.5-156.2-60.70000114.2
219L39.7Very low45.1Very low163 Ų163122.4 Ų122.485%0.85371%0.713SS**  trans-135.9100.6166.1-71.3177.4000111.1
220G41.8Very low47.1Very low65 Ų65123 Ų12367%0.6770%0.703SS**  trans-146.117.8-173.600000115.8
221V47.2Very low49.5Very low109 Ų109119.5 Ų119.566%0.66169%0.69SS**SBendtrans-121-40.5-169.9-175.60000113.1N223 N224V221-N223 VanDerWaalsContact C-N 3.34Å; V221-N223 PolarHBondContact O-N 3.43Å; V221-N224 PolarHBondContact O-N 2.89Å
222D47.8Very low50.7Low103 Ų103120 Ų12055%0.55169%0.685SS**Hα-helixtrans-72.3-22.9-164.1-47.9-82.6000114.9N224 T226D222-N224 PolarHBondContact O-N 2.98Å; D222-T226 WeakPolarHBondContact O-CG2 3.48Å; D222-T226 PolarHBondContact O-N 2.98Å; D222-T226 PolarHBondContact O-OG1 3.13Å
223N54.5Low52.8Low120 Ų120118.1 Ų118.164%0.64267%0.671SS**Hα-helixtrans-64.1-28.2179-73.2-34.4000112.8V221 T226 M227V221-N223 VanDerWaalsContact C-N 3.34Å; V221-N223 PolarHBondContact O-N 3.43Å; N223-T226 WeakPolarHBondContact CA-OG1 3.35Å; N223-T226 PolarHBondContact O-OG1 2.84Å; N223-M227 VanDerWaalsContact O-CB 3.26Å; N223-M227 WeakPolarHBondContact O-CB 3.35Å; N223-M227 PolarHBondContact O-N 3.24Å
224N53.1Low55.1Low103 Ų103119.2 Ų119.255%0.55166%0.658SS**Hα-helixtrans-77.7-43.8-178.8-68.5-34.1000111.9V221 D222 M227 I228V221-N224 PolarHBondContact O-N 2.89Å; D222-N224 PolarHBondContact O-N 2.98Å; N224-M227 PolarHBondContact O-N 3.38Å; N224-I228 VanDerWaalsContact O-CG1 3.27Å; N224-I228 WeakPolarHBondContact O-CG1 3.47Å; N224-I228 PolarHBondContact O-N 2.88Å
225E56.9Low57.4Low117 Ų117113.3 Ų113.355%0.54764%0.637SS.*Hα-helixtrans-68.6-39.1179.8-163.1-174.6144.700111.7I228 K229E225-I228 PolarHBondContact O-N 3.29Å; E225-K229 HydrophobicContact CG-CD 4.28Å; E225-K229 WeakPolarHBondContact O-CB 3.31Å; E225-K229 VanDerWaalsContact O-CG 3.31Å; E225-K229 WeakPolarHBondContact O-CG 3.38Å; E225-K229 PolarHBondContact O-N 2.97Å; E225-K229 WeakPolarHBondContact OE1-CE 3.48Å; E225-K229 IonicContact OE1-NZ 2.6Å; E225-K229 PolarHBondContact OE1-NZ 3.03Å
226T62Low59.4Low76 Ų76114.3 Ų114.347%0.46662%0.623SS.*Hα-helixtrans-65.7-36.417551.10000112.6D222 N223 K230D222-T226 WeakPolarHBondContact O-CG2 3.48Å; D222-T226 PolarHBondContact O-N 2.98Å; D222-T226 PolarHBondContact O-OG1 3.13Å; N223-T226 WeakPolarHBondContact CA-OG1 3.35Å; N223-T226 PolarHBondContact O-OG1 2.84Å; T226-K230 PolarHBondContact O-N 2.95Å
227M70.3Confident60.9Low126 Ų126112.1 Ų112.162%0.62160%0.601SS**Hα-helixtrans-68.9-42.2173.9-164.1-175.6-53.500112.1N223 N224 K230 L231N223-M227 VanDerWaalsContact O-CB 3.26Å; N223-M227 WeakPolarHBondContact O-CB 3.35Å; N223-M227 PolarHBondContact O-N 3.24Å; N224-M227 PolarHBondContact O-N 3.38Å; M227-K230 PolarHBondContact O-N 3.47Å; M227-L231 WeakPolarHBondContact O-CB 3.33Å; M227-L231 PolarHBondContact O-N 3.33Å
228I74.6Confident62.7Low101 Ų101109.2 Ų109.252%0.51858%0.583SS.*Hα-helixtrans-63.3-42.4175.2-69.8164.7000111.1N224 E225 L231 M232N224-I228 VanDerWaalsContact O-CG1 3.27Å; N224-I228 WeakPolarHBondContact O-CG1 3.47Å; N224-I228 PolarHBondContact O-N 2.88Å; E225-I228 PolarHBondContact O-N 3.29Å; I228-L231 PolarHBondContact O-N 2.9Å; I228-M232 HydrophobicContact CG2-SD 4.39Å; I228-M232 PolarHBondContact O-N 3.3Å
229K73.6Confident63.7Low119 Ų119113.1 Ų113.152%0.51758%0.581SS.*Hα-helixtrans-60-45.8173.8-78166.4169.5167.80111.7E225 L231 M232 Q233E225-K229 HydrophobicContact CG-CD 4.28Å; E225-K229 WeakPolarHBondContact O-CB 3.31Å; E225-K229 VanDerWaalsContact O-CG 3.31Å; E225-K229 WeakPolarHBondContact O-CG 3.38Å; E225-K229 PolarHBondContact O-N 2.97Å; E225-K229 WeakPolarHBondContact OE1-CE 3.48Å; E225-K229 IonicContact OE1-NZ 2.6Å; E225-K229 PolarHBondContact OE1-NZ 3.03Å; K229-L231 PolarHBondContact O-N 3.5Å; K229-M232 PolarHBondContact O-N 3.33Å; K229-Q233 WeakPolarHBondContact O-CB 3.32Å; K229-Q233 PolarHBondContact O-N 3.44Å
230K70.6Confident64.8Low155 Ų155111.5 Ų111.567%0.67457%0.569SS**Hα-helixtrans-61.7-39.6174-81.9-177.8174.2177.30112.7T226 M227 Q233 N234T226-K230 PolarHBondContact O-N 2.95Å; M227-K230 PolarHBondContact O-N 3.47Å; K230-Q233 PolarHBondContact O-N 2.94Å; K230-N234 WeakPolarHBondContact O-CB 3.36Å; K230-N234 PolarHBondContact O-N 2.92Å
231L79.8Confident65.7Low111 Ų111114.4 Ų114.458%0.58157%0.565SS**Hα-helixtrans-66.5-45.6178.1-175.862.4000111.8M227 I228 K229 Q233 N234 L235M227-L231 WeakPolarHBondContact O-CB 3.33Å; M227-L231 PolarHBondContact O-N 3.33Å; I228-L231 PolarHBondContact O-N 2.9Å; K229-L231 PolarHBondContact O-N 3.5Å; L231-Q233 PolarHBondContact O-N 3.41Å; L231-N234 PolarHBondContact O-N 3.44Å; L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 WeakPolarHBondContact O-CD1 3.27Å; L231-L235 PolarHBondContact O-N 2.86Å
232M70.1Confident66.2Low113 Ų113114.5 Ų114.556%0.55756%0.558SS**Hα-helixtrans-58.6-46.1172.5-82.9173.945.900112.1I228 K229 N234 L235 Q236I228-M232 HydrophobicContact CG2-SD 4.39Å; I228-M232 PolarHBondContact O-N 3.3Å; K229-M232 PolarHBondContact O-N 3.33Å; M232-N234 VanDerWaalsContact C-N 3.33Å; M232-N234 PolarHBondContact O-N 3.33Å; M232-L235 PolarHBondContact O-N 3.47Å; M232-Q236 WeakPolarHBondContact O-CG 3.47Å; M232-Q236 PolarHBondContact O-N 2.92Å
233Q74.4Confident66.5Low123 Ų123112.3 Ų112.358%0.57555%0.551SS**Hα-helixtrans-64.1-38.9179.4-167.9173.225.100111.5K229 K230 L231 Q236 S237K229-Q233 WeakPolarHBondContact O-CB 3.32Å; K229-Q233 PolarHBondContact O-N 3.44Å; K230-Q233 PolarHBondContact O-N 2.94Å; L231-Q233 PolarHBondContact O-N 3.41Å; Q233-Q236 PolarHBondContact O-N 3.39Å; Q233-S237 PolarHBondContact O-N 3.46Å; Q233-S237 PolarHBondContact O-OG 2.92Å; Q233-S237 VanDerWaalsContact O-OG 3.13Å
234N75.8Confident66.5Low101 Ų101111.1 Ų111.154%0.5454%0.544SS..Hα-helixtrans-62.4-47.1174.9-165.4-61.5000111.6K230 L231 M232 Q236 S237 Q238K230-N234 WeakPolarHBondContact O-CB 3.36Å; K230-N234 PolarHBondContact O-N 2.92Å; L231-N234 PolarHBondContact O-N 3.44Å; M232-N234 VanDerWaalsContact C-N 3.33Å; M232-N234 PolarHBondContact O-N 3.33Å; N234-Q236 VanDerWaalsContact C-N 3.32Å; N234-Q236 PolarHBondContact O-N 2.89Å; N234-S237 PolarHBondContact O-N 3.47Å; N234-Q238 WeakPolarHBondContact O-CB 3.38Å; N234-Q238 PolarHBondContact O-N 3.13Å
235L77.4Confident66.6Low97 Ų97112.7 Ų112.751%0.50855%0.548SS..Hα-helixtrans-59.1-40.1174.1-97.767.7000112.4L231 M232 Q238 R239L231-L235 HydrophobicContact CD1-CD1 4.14Å; L231-L235 WeakPolarHBondContact O-CD1 3.27Å; L231-L235 PolarHBondContact O-N 2.86Å; M232-L235 PolarHBondContact O-N 3.47Å; L235-Q238 PolarHBondContact O-N 3.33Å; L235-R239 WeakPolarHBondContact O-CB 3.36Å; L235-R239 PolarHBondContact O-N 3.49Å
236Q71.3Confident66.3Low126 Ų126113.8 Ų113.859%0.58955%0.554SS**Hα-helixtrans-66.6-42.6175.8-74.5177.9-32.800112.4M232 Q233 N234 R239 Q240M232-Q236 WeakPolarHBondContact O-CG 3.47Å; M232-Q236 PolarHBondContact O-N 2.92Å; Q233-Q236 PolarHBondContact O-N 3.39Å; N234-Q236 VanDerWaalsContact C-N 3.32Å; N234-Q236 PolarHBondContact O-N 2.89Å; Q236-R239 WeakPolarHBondContact O-CB 3.43Å; Q236-R239 PolarHBondContact O-N 3.01Å; Q236-Q240 PolarHBondContact O-N 3.48Å
237S65.7Low65.6Low55 Ų55116.1 Ų116.139%0.38556%0.563SS.*Hα-helixtrans-64.8-39.7174.3-62.40000112.3Q233 N234 Q240 Q241Q233-S237 PolarHBondContact O-N 3.46Å; Q233-S237 PolarHBondContact O-OG 2.92Å; Q233-S237 VanDerWaalsContact O-OG 3.13Å; N234-S237 PolarHBondContact O-N 3.47Å; S237-Q240 PolarHBondContact O-N 3.04Å; S237-Q241 WeakPolarHBondContact O-CG 3.43Å; S237-Q241 PolarHBondContact O-N 2.98Å
238Q68.4Low64.6Low102 Ų102119.8 Ų119.848%0.47757%0.569SS.*Hα-helixtrans-64.7-41.5176.7-165.4177.756.700111.3N234 L235 Q240 Q241 Q242N234-Q238 WeakPolarHBondContact O-CB 3.38Å; N234-Q238 PolarHBondContact O-N 3.13Å; L235-Q238 PolarHBondContact O-N 3.33Å; Q238-Q240 PolarHBondContact O-N 3.1Å; Q238-Q241 PolarHBondContact O-N 3.48Å; Q238-Q242 WeakPolarHBondContact O-CG 3.27Å; Q238-Q242 PolarHBondContact O-N 3.32Å
239R62.9Low63.1Low191 Ų191119.7 Ų119.772%0.72158%0.578SS**Hα-helixtrans-56.5-44.7169.8-91.5-84.7-64.9-121.2-1.3112.7L235 Q236 Q242 S243L235-R239 WeakPolarHBondContact O-CB 3.36Å; L235-R239 PolarHBondContact O-N 3.49Å; Q236-R239 WeakPolarHBondContact O-CB 3.43Å; Q236-R239 PolarHBondContact O-N 3.01Å; R239-Q242 PolarHBondContact O-N 2.95Å; R239-S243 PolarHBondContact O-N 3.23Å; R239-S243 VanDerWaalsContact O-N 3.1Å
240Q63Low61.6Low128 Ų128120.6 Ų120.660%0.59859%0.587SS**Hα-helixtrans-69.3-36.3177.8-76.6-176.7-22.500113Q236 S237 Q238 S243 L244Q236-Q240 PolarHBondContact O-N 3.48Å; S237-Q240 PolarHBondContact O-N 3.04Å; Q238-Q240 PolarHBondContact O-N 3.1Å; Q240-S243 PolarHBondContact O-N 3.41Å; Q240-S243 PolarHBondContact O-OG 3.34Å; Q240-S243 VanDerWaalsContact O-OG 3.08Å; Q240-L244 WeakPolarHBondContact O-CB 3.39Å; Q240-L244 WeakPolarHBondContact O-CG 3.34Å; Q240-L244 PolarHBondContact O-N 3.27Å
241Q59.5Low59.8Low126 Ų126122.4 Ų122.459%0.58959%0.59SS**Hα-helixtrans-66.4-38.1174.6-73-177.3-2.200111.9S237 Q238 Q245S237-Q241 WeakPolarHBondContact O-CG 3.43Å; S237-Q241 PolarHBondContact O-N 2.98Å; Q238-Q241 PolarHBondContact O-N 3.48Å; Q241-Q245 WeakPolarHBondContact O-CG 3.34Å; Q241-Q245 PolarHBondContact O-N 2.88Å; Q241-Q245 VanDerWaalsContact O-N 3.07Å
242Q57.5Low57.7Low111 Ų111122.3 Ų122.352%0.51960%0.596SS.*Hα-helixtrans-65.6-43.7174.9-73.8176.1-12.200112.5Q238 R239 L244 Q245 Q246Q238-Q242 WeakPolarHBondContact O-CG 3.27Å; Q238-Q242 PolarHBondContact O-N 3.32Å; R239-Q242 PolarHBondContact O-N 2.95Å; Q242-L244 PolarHBondContact O-N 3.47Å; Q242-Q245 PolarHBondContact O-N 3.49Å; Q242-Q246 PolarHBondContact O-N 3.08Å
243S54.8Low55.9Low58 Ų58120.9 Ų120.941%0.40660%0.602SS.*Hα-helixtrans-66.2-37.8177.264.20000112.6R239 Q240 Q245 Q246 L247R239-S243 PolarHBondContact O-N 3.23Å; R239-S243 VanDerWaalsContact O-N 3.1Å; Q240-S243 PolarHBondContact O-N 3.41Å; Q240-S243 PolarHBondContact O-OG 3.34Å; Q240-S243 VanDerWaalsContact O-OG 3.08Å; S243-Q245 VanDerWaalsContact C-N 3.31Å; S243-Q245 PolarHBondContact O-N 3.16Å; S243-Q246 PolarHBondContact O-N 2.95Å; S243-L247 PolarHBondContact O-N 2.91Å
244L54.8Low54Low95 Ų95122.4 Ų122.450%0.49761%0.61SS.*Hα-helixtrans-71.2-20.9175.4-70.9174.3000114.3Q240 Q242 R248Q240-L244 WeakPolarHBondContact O-CB 3.39Å; Q240-L244 WeakPolarHBondContact O-CG 3.34Å; Q240-L244 PolarHBondContact O-N 3.27Å; Q242-L244 PolarHBondContact O-N 3.47Å; L244-R248 PolarHBondContact O-N 3.44Å
245Q54.3Low52.3Low135 Ų135124.4 Ų124.463%0.63162%0.619SS**Hα-helixtrans-78.2-41.9168.6-74177.918.200111.2Q241 Q242 S243 R248 S249Q241-Q245 WeakPolarHBondContact O-CG 3.34Å; Q241-Q245 PolarHBondContact O-N 2.88Å; Q241-Q245 VanDerWaalsContact O-N 3.07Å; Q242-Q245 PolarHBondContact O-N 3.49Å; S243-Q245 VanDerWaalsContact C-N 3.31Å; S243-Q245 PolarHBondContact O-N 3.16Å; Q245-R248 PolarHBondContact O-N 2.92Å; Q245-S249 PolarHBondContact O-N 2.66Å
246Q51.2Low50.1Low141 Ų141124.5 Ų124.566%0.65963%0.627SS**Hα-helixtrans-66.5-37.6175.4-70.4-169.3-10.800112.8Q242 S243 R248 S249 L250Q242-Q246 PolarHBondContact O-N 3.08Å; S243-Q246 PolarHBondContact O-N 2.95Å; Q246-R248 VanDerWaalsContact C-N 3.31Å; Q246-R248 PolarHBondContact O-N 3.31Å; Q246-S249 WeakPolarHBondContact O-CB 3.49Å; Q246-S249 PolarHBondContact O-N 3.46Å; Q246-L250 PolarHBondContact O-N 3.23Å
247L48.4Very low48.4Very low125 Ų125126.8 Ų126.865%0.65464%0.643SS**Hα-helixtrans-62.2-35.3173-113.469.6000112.9S243 S249 L250S243-L247 PolarHBondContact O-N 2.91Å; L247-S249 VanDerWaalsContact C-N 3.27Å; L247-S249 PolarHBondContact O-N 3.48Å; L247-L250 PolarHBondContact O-N 3.38Å
248R48.5Very low47.3Very low202 Ų202130.1 Ų130.176%0.76266%0.661SS**Hα-helixtrans-68.1-24.9172.3-82.5-172.8173.784.8-4.7113.4L244 Q245 Q246L244-R248 PolarHBondContact O-N 3.44Å; Q245-R248 PolarHBondContact O-N 2.92Å; Q246-R248 VanDerWaalsContact C-N 3.31Å; Q246-R248 PolarHBondContact O-N 3.31Å
249S43.5Very low46.2Very low99 Ų99130.8 Ų130.869%0.69267%0.674SS**THydrogen-bonded Turntrans-84.5-5.5177.7-168.20000114.1Q245 Q246 L247Q245-S249 PolarHBondContact O-N 2.66Å; Q246-S249 WeakPolarHBondContact O-CB 3.49Å; Q246-S249 PolarHBondContact O-N 3.46Å; L247-S249 VanDerWaalsContact C-N 3.27Å; L247-S249 PolarHBondContact O-N 3.48Å
250L41.3Very low45.2Very low138 Ų138127.7 Ų127.772%0.72368%0.678SS**  trans-120.838-174.2-66.4175.5000112.4Q246 L247 P252Q246-L250 PolarHBondContact O-N 3.23Å; L247-L250 PolarHBondContact O-N 3.38Å; L250-P252 WeakPolarHBondContact O-CD 3.4Å
251R33.7Very low44Very low193 Ų193127.9 Ų127.973%0.72869%0.691SS**  trans-106.7101.2172.9-133.9-74.5-176143.81.7108.7
252P35.5Very low43Very low109 Ų109126.4 Ų126.471%0.70870%0.7SS**  trans-57.4153.1171-23.634.5000111.3L250L250-P252 WeakPolarHBondContact O-CD 3.4Å
253A32.3Very low41.8Very low83 Ų83125.5 Ų125.569%0.68671%0.712SS**  trans-70131.7170.400000109.9I255A253-I255 HydrophobicContact CB-CG1 4.4Å; A253-I255 PolarHBondContact O-N 3.4Å; A253-I255 VanDerWaalsContact O-N 3.1Å
254E33.8Very low41Very low156 Ų156128.4 Ų128.473%0.72973%0.727SS**  trans-67.2101.8165.7-82.1-71.3159.200108.5
255I39.5Very low40.1Very low143 Ų143135.3 Ų135.373%0.73375%0.747SS**  trans-10193.5171.6-52.7176.4000107A253 L257A253-I255 HydrophobicContact CB-CG1 4.4Å; A253-I255 PolarHBondContact O-N 3.4Å; A253-I255 VanDerWaalsContact O-N 3.1Å; I255-L257 PolarHBondContact O-N 3.13Å
256S32.1Very low39.1Very low98 Ų98138.3 Ų138.369%0.68576%0.757SS**  trans-60.3121.4-177.3-530000111.5T258S256-T258 PolarHBondContact O-N 3.38Å
257L36.1Very low38.4Very low175 Ų175137.1 Ų137.192%0.91676%0.76SS**  trans-70.2113.6179.1-69.1168.5000111I255I255-L257 PolarHBondContact O-N 3.13Å
258T41.4Very low37.8Very low125 Ų125138.7 Ų138.777%0.76777%0.769SS**  trans-112.6126.7164.548.90000110.1S256S256-T258 PolarHBondContact O-N 3.38Å
259P46.8Very low37.2Very low116 Ų116135.4 Ų135.475%0.75377%0.765SS**PPolyproline II helixtrans-73.7147.3178.330.8-34.5000111.4
260P41.1Very low36.7Very low125 Ų125135.8 Ų135.881%0.81277%0.768SS**PPolyproline II helixtrans-69.2137.4175.729-34.1000111
261P37.9Very low36.3Very low132 Ų132136.3 Ų136.386%0.85777%0.771SS**PPolyproline II helixtrans-75.5141.5-179.130.6-34.9000112.1
262A39.4Very low36.3Very low95 Ų95132.5 Ų132.579%0.78577%0.774SS**PPolyproline II helixtrans-92.3127.317300000111.7
263A31.2Very low36.4Very low92 Ų92137.2 Ų137.276%0.7678%0.778SS**  trans-140.398.8164.200000106.8
264T38.1Very low36.4Very low119 Ų119139.4 Ų139.473%0.7378%0.783SS**  64.112468.780.40000114.5
265R36.6Very low36.5Very low241 Ų241140 Ų14091%0.90978%0.778SS**  trans70.7144.2177.1-57174.9175.9-179.9-2114.5
266K32.9Very low36Very low197 Ų197137.8 Ų137.886%0.85778%0.775SS**  cis-139.4153.96.1-144.3-178.8-177.7-167.60110.7
267V37Very low36.1Very low116 Ų116141.3 Ų141.370%0.70378%0.775SS**  trans-74.5137.2167.5172.70000108.9I269V267-I269 HydrophobicContact CG1-CD1 3.83Å; V267-I269 HydrophobicContact CG1-CG1 3.7Å
268D34.2Very low35.8Very low159 Ų159138.3 Ų138.385%0.8577%0.768SS**  trans-140.8150.6145.8-144.8-36.8000109.2
269I37.3Very low35.4Very low133 Ų133139.6 Ų139.668%0.68277%0.77SS**  trans-136.1109.8-168.5-62170.9000109.7V267V267-I269 HydrophobicContact CG1-CD1 3.83Å; V267-I269 HydrophobicContact CG1-CG1 3.7Å
270S32.8Very low34.6Very low107 Ų107139.8 Ų139.875%0.74877%0.774SS**  trans-174.3153.3148.4-90.80000114.4
271N33.4Very low34Very low149 Ų149140.3 Ų140.380%0.79777%0.77SS**  trans63.776.9159.2-67.9-46.3000120.1
272S33.8Very low33.8Very low113 Ų113140.7 Ų140.779%0.7977%0.77SS**  45.3117.8109.8-166.60000119.4
273R36.4Very low33.3Very low208 Ų208141.5 Ų141.579%0.78577%0.77SS**  -176.299.492.5-168.2177.2-158.4-167.89112.7
274T33.3Very low33.4Very low128 Ų128141.8 Ų141.879%0.78577%0.772SS**  trans-68.1131.7174.6-46.50000111.7
275R34.8Very low33.1Very low168 Ų168140.9 Ų140.963%0.63478%0.777SS**  trans-133.778.4160.6-90.9-162.5168.4-130.8-3.2111Y277R275-Y277 HydrophobicContact CB-CE2 4.43Å; R275-Y277 WeakPolarHBondContact CD-OH 3.2Å; R275-Y277 PolarHBondContact NH1-OH 3.06Å
276S29.1Very low32.9Very low97 Ų97141.6 Ų141.668%0.67878%0.779SS**  trans-78.9122.3162.849.10000109.6
277Y34.4Very low32.9Very low173 Ų173139 Ų13968%0.67877%0.774SS**  trans-102.597.6171.6-58.9-79.7000110R275R275-Y277 HydrophobicContact CB-CE2 4.43Å; R275-Y277 WeakPolarHBondContact CD-OH 3.2Å; R275-Y277 PolarHBondContact NH1-OH 3.06Å
278S29.7Very low32.8Very low111 Ų111140.5 Ų140.578%0.77677%0.774SS**  trans-91.4122.5160-590000108
279L32.1Very low32.8Very low152 Ų152140.4 Ų140.480%0.79677%0.768SS**  trans-135.8111.1165.3-76.1179000109.4
280S30.1Very low32.5Very low120 Ų120140 Ų14084%0.83977%0.768SS**  trans-108.7117.6169.5-60.20000107.8
281N29.5Very low32.7Very low136 Ų136143.4 Ų143.473%0.72777%0.772SS**  trans-120.188.5175.6-82.891.5000110.5
282V34.3Very low33.6Very low141 Ų141141.3 Ų141.386%0.85577%0.766SS**  trans-91.2115.9155.6173.90000106.7
283S28.8Very low33.6Very low112 Ų112143.4 Ų143.478%0.78376%0.763SS**  trans-97.2104.3172.7-61.70000109.2
284A32.9Very low33.5Very low97 Ų97141 Ų14180%0.80276%0.76SS**  trans-77.6152.5169.500000110.6
285A30.9Very low33.6Very low101 Ų101141.1 Ų141.184%0.83575%0.752SS**  trans-124.897175.800000110.8
286R32.9Very low33.5Very low256 Ų256139.6 Ų139.697%0.96675%0.752SS**  trans-163.6162.6148-124.7178175.8143.21.3112
287D33.7Very low33.5Very low141 Ų141143 Ų14375%0.75476%0.757SS**  trans-119.3171.5-177.4-167.96.7000109.6
288Q34.4Very low33.6Very low149 Ų149138.5 Ų138.570%0.69676%0.756SS**  trans79.495.7168.9-61.6178.20.200119.5
289Q34Very low33.7Very low156 Ų156141.1 Ų141.173%0.72976%0.761SS**  76.8135.7113.3-74.6-179.8-97.700124.5
290D30.6Very low33.7Very low126 Ų126141.1 Ų141.167%0.67476%0.757SS**  trans70.1100143.9-55.6-33.2000123.7
291H36.6Very low33.8Very low178 Ų178142.6 Ų142.682%0.82475%0.752SS**  30.1155.6117-83.4-9.5000123
292P54Low33.9Very low104 Ų104143.1 Ų143.168%0.67575%0.75SS**  -144.4-167-50.836.3-13.6000113.8
293Q32.6Very low33.7Very low157 Ų157142.9 Ų142.973%0.73474%0.743SS**  trans124.9143.1143.1-66.4-149.4-45.600121.4
294H33.8Very low33.8Very low157 Ų157143.9 Ų143.973%0.72774%0.735SS**  trans57.1146.7156.9-66.9-57000122.4
295Q35.5Very low33.5Very low132 Ų132147.3 Ų147.362%0.61773%0.734SS**  cis140.5146.7-20.9178.669.851.100111.1
296Q32.7Very low33.3Very low136 Ų136148.2 Ų148.264%0.63672%0.721SS**  trans79.1128.7-178.2-45.1-47.610.200115.3
297H30.9Very low33.1Very low168 Ų168146.5 Ų146.578%0.77872%0.716SS**  71.8141.950.9-68.5-140.1000113.8
298A35.3Very low32.8Very low78 Ų78142.9 Ų142.965%0.64571%0.712SS**  cis-177.8142.7-24.600000108.6
299N32.5Very low32.5Very low166 Ų166146.3 Ų146.389%0.88872%0.72SS**  trans-172.6170.1156.3-119.2-77.1000114.6
300H30.9Very low32.3Very low153 Ų153147.4 Ų147.471%0.70873%0.728SS**  trans-156.4169.9-176.973.70.8000111.8
301M32.5Very low32.1Very low151 Ų151151.2 Ų151.274%0.74473%0.733SS**  cis-131.9-1026.5-165.8-159.5-55.200111.9
302Q32.1Very low31.7Very low146 Ų146147.9 Ų147.968%0.68273%0.729SS**  cis-159.8130.1-9.3-169.2168.6-27.200111.5
303I30.9Very low30.6Very low137 Ų137148 Ų14870%0.70372%0.724SS**  trans63.8149.4163.3-78.2172000118.1
304Q29.2Very low30.7Very low132 Ų132148.2 Ų148.262%0.61773%0.729SS**  cis-174.4135.6-34.3-178.5170.8-300109.6
305Q28.4Very low30.6Very low170 Ų170144.4 Ų144.479%0.79473%0.732SS**  trans-176.2160138.2-71-37.9-32.600107.1
306H25.9Very low30.5Very low119 Ų119141.7 Ų141.755%0.55174%0.739SS**  cis179.9149.1-39.3-157.9111.3000103.8
307Y29Very low30.4Very low220 Ų220141.1 Ų141.186%0.86375%0.745SS**  trans68.2150.6-175.6-52.6-78.7000115.7
308G26.7Very low30.4Very low65 Ų65140.4 Ų140.467%0.6775%0.745SS**  cis173.1115.4-1000000115.3
309Y29.1Very low30.4Very low222 Ų222147.1 Ų147.187%0.87176%0.755SS**  trans70.9136.5156.9-83.7-76.2000123.8
310M28.6Very low30.3Very low179 Ų179142.9 Ų142.988%0.88275%0.751SS**  trans78.4149153.2-70.4-50.9-155.700122.2
311R26.8Very low30.2Very low206 Ų206143.2 Ų143.278%0.77776%0.757SS**  trans-130.5135.5-158.7165.3-172.4179.3-955.6109.9
312S27.9Very low30Very low108 Ų108145 Ų14576%0.75576%0.763SS**  trans-145.9137.8161-162.40000110.5
313N32Very low30Very low105 Ų105146.1 Ų146.156%0.56177%0.766SS**  trans-81.1135.4172.2-69.926.8000107.7
314I34.8Very low29.9Very low162 Ų162146.8 Ų146.883%0.83177%0.771SS**  59118.160.6-54.6171.9000111.1
315G31.5Very low30Very low77 Ų77146.1 Ų146.179%0.79478%0.781SS**  cis-149.9-165-600000108.6
316G32.6Very low30.3Very low75 Ų75142.5 Ų142.577%0.77378%0.78SS**  cis169.6-179.65.700000107
317V30.5Very low30.4Very low124 Ų124144.1 Ų144.175%0.75279%0.792SS**  cis-148.2159.4-2.8-178.90000106.5Y319V317-Y319 HydrophobicContact CG1-CE2 4.19Å
318I30.3Very low30.6Very low154 Ų154138.2 Ų138.279%0.7978%0.784SS**  trans-103.8130.6-176.4-63.7-68.2000113
319Y36.4Very low30.7Very low219 Ų219140 Ų14086%0.85979%0.791SS**  trans-148149.5153.4-58.1-80.5000107.4V317V317-Y319 HydrophobicContact CG1-CE2 4.19Å
320G30.2Very low30.8Very low77 Ų77133.5 Ų133.579%0.79478%0.784SS**  cis167.4118.4-5.300000108.2
321L28.5Very low30.9Very low160 Ų160130.5 Ų130.584%0.83878%0.781SS**  trans-98.1143-173.2-159.483.4000111.5
322H27.8Very low31.1Very low189 Ų189126.3 Ų126.388%0.87578%0.783SS**  trans-147.5157.9161.3-105.674.8000110.2
323K32.8Very low31.2Very low169 Ų169125.8 Ų125.874%0.73579%0.785SS**  trans-122.1152.1168.3-58.7178174.7-179.10108.8
324D28.9Very low31.1Very low150 Ų150127.1 Ų127.180%0.80280%0.801SS**  172.3-167.6102.8-86.5-35.7000109.3
325S32.2Very low30.9Very low118 Ų118123.1 Ų123.183%0.82580%0.8SS**  trans-105.3161.9-148.2-620000117.6
326A34.8Very low30.9Very low94 Ų94124.8 Ų124.878%0.77781%0.806SS**  trans92.1109.6140.500000121.8
327D27.9Very low30.9Very low153 Ų153124.8 Ų124.882%0.81881%0.806SS**  92.7143.6128.2-127.6-47.2000123.5
328S32.7Very low31Very low97 Ų97124 Ų12468%0.67881%0.812SS**  trans76.9100.8149.4-75.80000123.3
329A29.1Very low31Very low101 Ų101120.2 Ų120.284%0.83581%0.812SS**  59.9150.8128.600000120.6
330A30.2Very low30.6Very low86 Ų86114.7 Ų114.771%0.71181%0.811SS**  cis-159.7163.21700000114.2
331S30.5Very low30.6Very low116 Ų116115.6 Ų115.681%0.81181%0.811SS**  trans65.3150.2163.579.90000117.3
332S32.1Very low30.7Very low118 Ų118112.6 Ų112.683%0.82581%0.81SS**  cis-138.2160.822-73.50000115.3
333A29.5Very low30.9Very low98 Ų98110.8 Ų110.881%0.8181%0.812SS**  trans-63.1145.7-165.800000119.3
334C30.3Very low30.8Very low132 Ų132106 Ų10689%0.89281%0.81SS**  175.7143.6108.355.90000111
335G29.4Very low31Very low78 Ų78107.3 Ų107.380%0.80481%0.813SS**  cis-165.5147.6-12.700000110.5
336A31.9Very low31.1Very low112 Ų112106.4 Ų106.493%0.92681%0.807SS**  trans-96.3175.1171.900000109.8
337G31.8Very low30.8Very low75 Ų75109.7 Ų109.777%0.77381%0.81SS**  cis177.7177.44.400000109
338A32.8Very low30.8Very low107 Ų107106.8 Ų106.888%0.88481%0.807SS**  trans-104.7150.7-175.400000113.7
339G30.6Very low30.7Very low75 Ų75108 Ų10877%0.77382%0.815SS**  trans90.9107.1141.600000120.2
340A29.3Very low30.9Very low103 Ų103108.3 Ų108.385%0.85181%0.812SS**  trans73.5112.5138.700000123.1
341A30.1Very low31Very low96 Ų96108.8 Ų108.879%0.79382%0.816SS**  80.290.8124.900000123.4
342A29Very low31.6Very low97 Ų97109.7 Ų109.780%0.80282%0.819SS**  61.9123.1114.500000124.2
343V34Very low31.7Very low152 Ų152109.3 Ų109.392%0.92182%0.823SS**  trans-141.1160132.1178.60000107.9
344G29.5Very low32Very low67 Ų67109.6 Ų109.669%0.69183%0.825SS**  trans-72.4-175.2-174.200000117
345M32.9Very low32.1Very low178 Ų178107.1 Ų107.188%0.87782%0.822SS**  cis-144.1159.928.3-51.7-171.677.200115.3
346S34.2Very low32.4Very low100 Ų100108.6 Ų108.670%0.69982%0.82SS**  trans30.5140.1146.7-45.40000121.3
347I29.1Very low32.9Very low162 Ų162112 Ų11283%0.83182%0.817SS**  cis-157.7162.846.141.3172.2000114.1
348A27.7Very low33.4Very low93 Ų93116.5 Ų116.577%0.76982%0.822SS**  trans83.2122.7155.300000122.1
349S30Very low33.5Very low121 Ų121116.9 Ų116.985%0.84682%0.818SS**  trans27.4145.1141.7-63.30000123.2
350S34Very low33.9Very low109 Ų109117.6 Ų117.676%0.76282%0.817SS**  cis-166149.1-0.542.60000113.6
351A33.4Very low34.1Very low95 Ų95119.7 Ų119.779%0.78581%0.808SS**  trans34.5123.5152.500000121.8
352P41.4Very low34.6Very low136 Ų136123.3 Ų123.388%0.88381%0.809SS**  trans-88.4150.1161.736.1-32000112.5
353A34.9Very low35.1Very low109 Ų109124.1 Ų124.190%0.90180%0.796SS**  trans-127.2150.6169.200000110.4
354A36.8Very low35.4Very low105 Ų105123.6 Ų123.687%0.86879%0.793SS**  trans-101.4149.6-164.700000114.5
355G32.1Very low35.7Very low79 Ų79124 Ų12481%0.81480%0.797SS**  trans91.3123.8150.300000117.6
356S35.3Very low36.8Very low110 Ų110125.1 Ų125.177%0.76980%0.8SS**  -156.7139.5128.3-169.10000110.1
357Q41.7Very low37.1Very low184 Ų184123.8 Ų123.886%0.8680%0.802SS**  trans-105.4119.9171.3-75.6-85.7-2000107.6
358L42.3Very low37.9Very low169 Ų169119.1 Ų119.189%0.88579%0.793SS**  trans-135.3147.9165.3-77.6-179.6000110.1
359S34.7Very low38.8Very low115 Ų115126 Ų12680%0.80480%0.8SS**  trans-124.7141.4-155.9-169.60000113.3
360A40.1Very low39.5Very low89 Ų89130.9 Ų130.974%0.73680%0.799SS**  trans66.4155.815100000121.5
361H34Very low40.6Very low147 Ų147136.6 Ų136.668%0.68180%0.804SS**  trans90.981.8139-149.3-86.4000120.8H363H361-H363 AromaticContact CE1-CE1 3.46Å; H361-H363 PolarHBondContact CE1-CE1 3.32Å; H361-H363 VanDerWaalsContact CE1-CE1 3.46Å; H361-H363 AromaticContact CE1-NE2 3.09Å; H361-H363 PolarHBondContact CE1-NE2 3.5Å; H361-H363 AromaticContact NE2-CE1 3.4Å; H361-H363 PolarHBondContact NE2-CE1 3.26Å; H361-H363 AromaticContact NE2-NE2 3.56Å
362H38.8Very low41.6Very low172 Ų172137.4 Ų137.480%0.79680%0.799SS**  -145.7164.8128.2-152.3-101.2000112.8
363H39.6Very low42.3Very low115 Ų115136.8 Ų136.853%0.53279%0.793SS.*  trans-97.1164.8-161.4-53.8-85.2000115.9H361H361-H363 AromaticContact CE1-CE1 3.46Å; H361-H363 PolarHBondContact CE1-CE1 3.32Å; H361-H363 VanDerWaalsContact CE1-CE1 3.46Å; H361-H363 AromaticContact CE1-NE2 3.09Å; H361-H363 PolarHBondContact CE1-NE2 3.5Å; H361-H363 AromaticContact NE2-CE1 3.4Å; H361-H363 PolarHBondContact NE2-CE1 3.26Å; H361-H363 AromaticContact NE2-NE2 3.56Å
364T41.3Very low43Very low141 Ų141136.2 Ų136.287%0.86578%0.783SS**  trans50.692.7146.2-53.90000117.4
365G36.6Very low43.8Very low75 Ų75136.4 Ų136.477%0.77378%0.777SS**  trans-13774.8168.600000111.9G367G365-G367 PolarHBondContact O-N 3.39Å
366H54.2Low44.8Very low202 Ų202138.8 Ų138.894%0.93577%0.772SS**  trans-77.260174.4-134.931.9000110.6G368H366-G368 PolarHBondContact O-N 2.88Å
367G40.4Very low45.7Very low72 Ų72137.6 Ų137.674%0.74276%0.763SS**  trans-72.558179.900000112.3G365 R369G365-G367 PolarHBondContact O-N 3.39Å; G367-R369 VanDerWaalsContact C-N 3.31Å; G367-R369 PolarHBondContact O-N 3.27Å
368G46.9Very low46.4Very low63 Ų63136.2 Ų136.265%0.64976%0.762SS**  trans-59.49417200000109.2H366 R370H366-G368 PolarHBondContact O-N 2.88Å; G368-R370 VanDerWaalsContact C-N 3.34Å; G368-R370 PolarHBondContact O-N 3.23Å
369R45.3Very low47.1Very low239 Ų239130.1 Ų130.190%0.90274%0.74SS**  trans-59.396.1-176.3-172.4179.7-171.1-172.34.1108.4G367 R371G367-R369 VanDerWaalsContact C-N 3.31Å; G367-R369 PolarHBondContact O-N 3.27Å; R369-R371 PolarHBondContact O-N 3.44Å
370R46.3Very low48.3Very low222 Ų222127.9 Ų127.984%0.83873%0.729SS**  trans-48.5112.2-178.7-64.9177.486.1-143.610.1107.1G368 T372G368-R370 VanDerWaalsContact C-N 3.34Å; G368-R370 PolarHBondContact O-N 3.23Å; R370-T372 VanDerWaalsContact C-N 3.29Å; R370-T372 PolarHBondContact O-N 3.07Å
371R56.3Low49.5Very low230 Ų230125.5 Ų125.587%0.86871%0.712SS**  trans-61.2103.3163.8-68-179.9-174.5150.41.7104.3R369 T373R369-R371 PolarHBondContact O-N 3.44Å; R371-T373 VanDerWaalsContact C-N 3.33Å; R371-T373 PolarHBondContact O-N 3.5Å
372T54.2Low51.7Low111 Ų111123.4 Ų123.468%0.68171%0.71SS**  trans-65.399.4177440000106.8R370 S374R370-T372 VanDerWaalsContact C-N 3.29Å; R370-T372 PolarHBondContact O-N 3.07Å; T372-S374 PolarHBondContact O-N 3.05Å; T372-S374 PolarHBondContact O-OG 3.08Å
373T55.9Low54.2Low123 Ų123123.6 Ų123.676%0.75570%0.704SS**  trans-74.144.3176.251.30000110.9R371 S375R371-T373 VanDerWaalsContact C-N 3.33Å; R371-T373 PolarHBondContact O-N 3.5Å; T373-S375 PolarHBondContact O-N 3.3Å
374S50.4Low56.7Low98 Ų98122.4 Ų122.469%0.68570%0.698SS**  trans-7555.816155.80000108.7T372 N376T372-S374 PolarHBondContact O-N 3.05Å; T372-S374 PolarHBondContact O-OG 3.08Å; S374-N376 PolarHBondContact O-N 3.42Å
375S53Low59.3Low108 Ų108119.8 Ų119.876%0.75568%0.682SS**  trans-7866.2-178.450.60000110.2T373T373-S375 PolarHBondContact O-N 3.3Å
376N54Low62.1Low129 Ų129122 Ų12269%0.6967%0.672SS**  trans-147.446.2174.6-152.298000112.5S374 N378S374-N376 PolarHBondContact O-N 3.42Å; N376-N378 PolarHBondContact ND2-OD1 3.37Å; N376-N378 VanDerWaalsContact ND2-OD1 3.1Å
377S53.1Low64.1Low85 Ų85116 Ų11659%0.59465%0.647SS**  trans-86.9118.7161.351.20000109G379 A380S377-G379 PolarHBondContact O-N 3.03Å; S377-A380 PolarHBondContact O-N 2.98Å
378N56.5Low66.8Low155 Ų155118.3 Ų118.383%0.82964%0.636SS**THydrogen-bonded Turntrans-73.938.5-168.8-63-23.4000114.7N376N376-N378 PolarHBondContact ND2-OD1 3.37Å; N376-N378 VanDerWaalsContact ND2-OD1 3.1Å
379G57.9Low69.1Low42 Ų42120.2 Ų120.243%0.43363%0.631SS.*THydrogen-bonded Turntrans-142.9-9.7172.200000114.2S377 G381 T382S377-G379 PolarHBondContact O-N 3.03Å; G379-G381 PolarHBondContact O-N 3.31Å; G379-T382 PolarHBondContact O-N 3.02Å
380A59.8Low71.6Confident68 Ų68110.7 Ų110.756%0.56260%0.597SS**THydrogen-bonded Turntrans-83.534.9-178.500000114S377S377-A380 PolarHBondContact O-N 2.98Å
381G64.4Low74Confident38 Ų38107.5 Ų107.539%0.39259%0.589SS.*THydrogen-bonded Turntrans-138.7-33.9165.400000111.1G379 R383 E384 V385G379-G381 PolarHBondContact O-N 3.31Å; G381-R383 VanDerWaalsContact C-N 3.32Å; G381-R383 PolarHBondContact O-N 3.29Å; G381-E384 VanDerWaalsContact CA-OE2 3.28Å; G381-E384 WeakPolarHBondContact CA-OE2 3.33Å; G381-E384 PolarHBondContact N-OE2 2.85Å; G381-E384 VanDerWaalsContact N-OE2 3.11Å; G381-E384 PolarHBondContact O-N 3.4Å; G381-V385 WeakPolarHBondContact O-CB 3.36Å; G381-V385 WeakPolarHBondContact O-CG2 3.41Å; G381-V385 PolarHBondContact O-N 3.46Å
382T81.6Confident76Confident103 Ų103100.3 Ų100.363%0.63257%0.565SS**Hα-helixtrans-60.5-38.9175.9-42.80000112.3G379 H386G379-T382 PolarHBondContact O-N 3.02Å; T382-H386 WeakPolarHBondContact O-CB 3.43Å; T382-H386 PolarHBondContact O-N 2.94Å
383R90.7Very high78.1Confident177 Ų177101.8 Ų101.867%0.66856%0.559SS**Hα-helixtrans-68.5-37.6178.5-174.5-172.8-169.4-160.34.5111.5G381 N387G381-R383 VanDerWaalsContact C-N 3.32Å; G381-R383 PolarHBondContact O-N 3.29Å; R383-N387 VanDerWaalsContact O-CB 3.26Å; R383-N387 WeakPolarHBondContact O-CB 3.46Å; R383-N387 PolarHBondContact O-N 3.49Å; R383-N387 PolarHBondContact O-ND2 3.01Å
384E92.8Very high80.1Confident89 Ų89103.4 Ų103.442%0.41655%0.551SS.*Hα-helixtrans-72.6-44.2-177.9-67.657-129.600110.1G381 N387 K388G381-E384 VanDerWaalsContact CA-OE2 3.28Å; G381-E384 WeakPolarHBondContact CA-OE2 3.33Å; G381-E384 PolarHBondContact N-OE2 2.85Å; G381-E384 VanDerWaalsContact N-OE2 3.11Å; G381-E384 PolarHBondContact O-N 3.4Å; E384-N387 PolarHBondContact O-N 3.03Å; E384-K388 WeakPolarHBondContact O-CB 3.32Å; E384-K388 PolarHBondContact O-N 3.34Å
385V94.6Very high82.3Confident87 Ų87101.6 Ų101.653%0.52754%0.542SS..Hα-helixtrans-62.3-48171171.20000111.1G381 N387 K388 L389G381-V385 WeakPolarHBondContact O-CB 3.36Å; G381-V385 WeakPolarHBondContact O-CG2 3.41Å; G381-V385 PolarHBondContact O-N 3.46Å; V385-N387 VanDerWaalsContact C-N 3.34Å; V385-N387 PolarHBondContact O-N 2.87Å; V385-K388 WeakPolarHBondContact O-CB 3.43Å; V385-K388 PolarHBondContact O-N 3.46Å; V385-K388 VanDerWaalsContact O-N 3.1Å; V385-L389 HydrophobicContact CG1-CD1 3.82Å; V385-L389 HydrophobicContact CG1-CG 4.3Å; V385-L389 WeakPolarHBondContact O-CG 3.37Å; V385-L389 PolarHBondContact O-N 3.45Å
386H95.9Very high84.4Confident120 Ų120102.4 Ų102.456%0.55653%0.534SS*.Hα-helixtrans-56.9-46175.4174.3-87.6000112T382 K388 L389 E390T382-H386 WeakPolarHBondContact O-CB 3.43Å; T382-H386 PolarHBondContact O-N 2.94Å; H386-K388 VanDerWaalsContact C-N 3.29Å; H386-K388 PolarHBondContact O-N 2.98Å; H386-L389 PolarHBondContact O-N 3.15Å; H386-E390 WeakPolarHBondContact O-CB 3.42Å; H386-E390 PolarHBondContact O-N 3.07Å
387N95.7Very high86.5Confident76 Ų76100 Ų10041%0.40652%0.521SS..Hα-helixtrans-65-30.1177.1-74.3-21.9000113.1R383 E384 V385 K391R383-N387 VanDerWaalsContact O-CB 3.26Å; R383-N387 WeakPolarHBondContact O-CB 3.46Å; R383-N387 PolarHBondContact O-N 3.49Å; R383-N387 PolarHBondContact O-ND2 3.01Å; E384-N387 PolarHBondContact O-N 3.03Å; V385-N387 VanDerWaalsContact C-N 3.34Å; V385-N387 PolarHBondContact O-N 2.87Å; N387-K391 WeakPolarHBondContact O-CB 3.48Å; N387-K391 WeakPolarHBondContact O-CD 3.32Å; N387-K391 WeakPolarHBondContact O-CG 3.43Å; N387-K391 PolarHBondContact O-N 3.36Å
388K96.6Very high88.5Confident121 Ų121101.9 Ų101.953%0.52652%0.518SS..Hα-helixtrans-72.1-49.7173.4-175.5173.4-179.5-68.70111E384 V385 H386 E390 K391 E392E384-K388 WeakPolarHBondContact O-CB 3.32Å; E384-K388 PolarHBondContact O-N 3.34Å; V385-K388 WeakPolarHBondContact O-CB 3.43Å; V385-K388 PolarHBondContact O-N 3.46Å; V385-K388 VanDerWaalsContact O-N 3.1Å; H386-K388 VanDerWaalsContact C-N 3.29Å; H386-K388 PolarHBondContact O-N 2.98Å; K388-E390 PolarHBondContact O-N 3.22Å; K388-K391 WeakPolarHBondContact O-CB 3.44Å; K388-K391 PolarHBondContact O-N 2.87Å; K388-E392 WeakPolarHBondContact CE-OE1 3.41Å; K388-E392 WeakPolarHBondContact CG-OE1 3.46Å; K388-E392 IonicContact NZ-OE1 2.65Å; K388-E392 PolarHBondContact NZ-OE1 3.21Å; K388-E392 IonicContact NZ-OE2 2.63Å; K388-E392 WeakPolarHBondContact O-CG 3.45Å; K388-E392 PolarHBondContact O-N 3.3Å
389L96.3Very high90.4Very high103 Ų103100.2 Ų100.254%0.53951%0.505SS..Hα-helixtrans-61.7-41.6179.2-68172.8000112.5V385 H386 E392 R393V385-L389 HydrophobicContact CG1-CD1 3.82Å; V385-L389 HydrophobicContact CG1-CG 4.3Å; V385-L389 WeakPolarHBondContact O-CG 3.37Å; V385-L389 PolarHBondContact O-N 3.45Å; H386-L389 PolarHBondContact O-N 3.15Å; L389-E392 PolarHBondContact O-N 2.67Å; L389-R393 VanDerWaalsContact O-CB 3.29Å; L389-R393 WeakPolarHBondContact O-CB 3.38Å; L389-R393 PolarHBondContact O-N 2.67Å
390E97.4Very high92.3Very high40 Ų40102 Ų10219%0.18751%0.51CS..Hα-helixtrans-73.8-25.4177.4176.860.4179.500112.6H386 K388 R393 R394H386-E390 WeakPolarHBondContact O-CB 3.42Å; H386-E390 PolarHBondContact O-N 3.07Å; K388-E390 PolarHBondContact O-N 3.22Å; E390-R393 IonicContact OE1-NH1 3.73Å; E390-R393 PolarHBondContact OE1-NH1 3.48Å; E390-R393 WeakPolarHBondContact OE2-CD 3.46Å; E390-R393 IonicContact OE2-CZ 2.75Å; E390-R393 IonicContact OE2-NE 3.24Å; E390-R393 IonicContact OE2-NH1 3.25Å; E390-R393 PolarHBondContact OE2-NH1 3.41Å; E390-R394 VanDerWaalsContact CG-NH2 3.35Å; E390-R394 WeakPolarHBondContact O-CB 3.45Å; E390-R394 WeakPolarHBondContact O-CD 3.47Å; E390-R394 WeakPolarHBondContact O-CG 3.23Å; E390-R394 PolarHBondContact O-N 2.84Å; E390-R394 IonicContact OE1-CZ 3.14Å; E390-R394 IonicContact OE1-NE 2.74Å; E390-R394 PolarHBondContact OE1-NE 2.87Å; E390-R394 IonicContact OE1-NH2 2.74Å; E390-R394 PolarHBondContact OE1-NH2 3.01Å
391K97.8Very high94Very high155 Ų155100.9 Ų100.967%0.67449%0.492SS*.Hα-helixtrans-68-45.2167.1-79.9172.7-179.2-177.50111.5N387 K388 R394 A395N387-K391 WeakPolarHBondContact O-CB 3.48Å; N387-K391 WeakPolarHBondContact O-CD 3.32Å; N387-K391 WeakPolarHBondContact O-CG 3.43Å; N387-K391 PolarHBondContact O-N 3.36Å; K388-K391 WeakPolarHBondContact O-CB 3.44Å; K388-K391 PolarHBondContact O-N 2.87Å; K391-R394 PolarHBondContact O-N 3.48Å; K391-A395 PolarHBondContact O-N 2.85Å
392E97.3Very high95.4Very high78 Ų78101.4 Ų101.436%0.36449%0.486SS..Hα-helixtrans-63.1-44.7177.7-73.6164.8-177.600111.1K388 L389 R394 A395 Q396K388-E392 WeakPolarHBondContact CE-OE1 3.41Å; K388-E392 WeakPolarHBondContact CG-OE1 3.46Å; K388-E392 IonicContact NZ-OE1 2.65Å; K388-E392 PolarHBondContact NZ-OE1 3.21Å; K388-E392 IonicContact NZ-OE2 2.63Å; K388-E392 WeakPolarHBondContact O-CG 3.45Å; K388-E392 PolarHBondContact O-N 3.3Å; L389-E392 PolarHBondContact O-N 2.67Å; E392-R394 VanDerWaalsContact C-N 3.35Å; E392-R394 PolarHBondContact O-N 2.85Å; E392-A395 WeakPolarHBondContact O-CB 3.29Å; E392-A395 PolarHBondContact O-N 2.99Å; E392-Q396 WeakPolarHBondContact O-CG 3.48Å; E392-Q396 PolarHBondContact O-N 3.1Å
393R98.1Very high96Very high143 Ų143100.8 Ų100.854%0.5448%0.478SS..Hα-helixtrans-59.6-39.9172.6179.3172.3167.6-83.9-6.2112.8L389 E390 L397L389-R393 VanDerWaalsContact O-CB 3.29Å; L389-R393 WeakPolarHBondContact O-CB 3.38Å; L389-R393 PolarHBondContact O-N 2.67Å; E390-R393 IonicContact OE1-NH1 3.73Å; E390-R393 PolarHBondContact OE1-NH1 3.48Å; E390-R393 WeakPolarHBondContact OE2-CD 3.46Å; E390-R393 IonicContact OE2-CZ 2.75Å; E390-R393 IonicContact OE2-NE 3.24Å; E390-R393 IonicContact OE2-NH1 3.25Å; E390-R393 PolarHBondContact OE2-NH1 3.41Å; R393-L397 VanDerWaalsContact O-CB 3.31Å; R393-L397 WeakPolarHBondContact O-CB 3.24Å; R393-L397 PolarHBondContact O-N 3.49Å
394R97.7Very high96.2Very high156 Ų15695 Ų9559%0.58946%0.46SS*.Hα-helixtrans-69.8-33.9175-75170.6-168.1177.67.9112.8E390 K391 E392 K398E390-R394 VanDerWaalsContact CG-NH2 3.35Å; E390-R394 WeakPolarHBondContact O-CB 3.45Å; E390-R394 WeakPolarHBondContact O-CD 3.47Å; E390-R394 WeakPolarHBondContact O-CG 3.23Å; E390-R394 PolarHBondContact O-N 2.84Å; E390-R394 IonicContact OE1-CZ 3.14Å; E390-R394 IonicContact OE1-NE 2.74Å; E390-R394 PolarHBondContact OE1-NE 2.87Å; E390-R394 IonicContact OE1-NH2 2.74Å; E390-R394 PolarHBondContact OE1-NH2 3.01Å; K391-R394 PolarHBondContact O-N 3.48Å; E392-R394 VanDerWaalsContact C-N 3.35Å; E392-R394 PolarHBondContact O-N 2.85Å; R394-K398 WeakPolarHBondContact O-CB 3.39Å; R394-K398 PolarHBondContact O-N 2.91Å
395A97.8Very high96.3Very high61 Ų6192.1 Ų92.150%0.50445%0.446SS..Hα-helixtrans-65.6-48.5173.500000111.2K391 E392 L397 K398 E399K391-A395 PolarHBondContact O-N 2.85Å; E392-A395 WeakPolarHBondContact O-CB 3.29Å; E392-A395 PolarHBondContact O-N 2.99Å; A395-L397 PolarHBondContact O-N 3.19Å; A395-K398 PolarHBondContact O-N 3.24Å; A395-E399 PolarHBondContact O-N 3.27Å
396Q97.6Very high96.1Very high124 Ų12494.8 Ų94.858%0.57945%0.451SS*.Hα-helixtrans-58.7-45173.9-69.7171-1.800112E392 K398 E399 C400E392-Q396 WeakPolarHBondContact O-CG 3.48Å; E392-Q396 PolarHBondContact O-N 3.1Å; Q396-K398 VanDerWaalsContact C-N 3.32Å; Q396-K398 PolarHBondContact O-N 3.14Å; Q396-E399 WeakPolarHBondContact O-CB 3.16Å; Q396-E399 PolarHBondContact O-N 3.45Å; Q396-E399 VanDerWaalsContact O-N 3.16Å; Q396-C400 PolarHBondContact O-N 3.39Å; Q396-C400 PolarHBondContact O-SG 3.23Å; Q396-C400 VanDerWaalsContact O-SG 3.34Å
397L97.1Very high95.9Very high80 Ų8094 Ų9442%0.41945%0.453SS..Hα-helixtrans-62.3-39.7177.5-177.760.1000111.8R393 A395 C400 Y401R393-L397 VanDerWaalsContact O-CB 3.31Å; R393-L397 WeakPolarHBondContact O-CB 3.24Å; R393-L397 PolarHBondContact O-N 3.49Å; A395-L397 PolarHBondContact O-N 3.19Å; L397-C400 PolarHBondContact O-N 3.45Å; L397-Y401 HydrophobicContact CD1-CD2 4.16Å; L397-Y401 HydrophobicContact CD1-CE2 3.75Å; L397-Y401 HydrophobicContact CD2-CE2 4.41Å; L397-Y401 HydrophobicContact CG-CD2 4.1Å; L397-Y401 HydrophobicContact CG-CE2 3.86Å; L397-Y401 WeakPolarHBondContact O-CD2 3.36Å; L397-Y401 PolarHBondContact O-N 3.31Å; L397-Y401 VanDerWaalsContact O-N 3.09Å
398K95.9Very high95.7Very high124 Ų12490.6 Ų90.654%0.53944%0.436SS..Hα-helixtrans-62.7-43173172.7163.9170.347.20111.7R394 A395 Q396 C400 Y401 D402R394-K398 WeakPolarHBondContact O-CB 3.39Å; R394-K398 PolarHBondContact O-N 2.91Å; A395-K398 PolarHBondContact O-N 3.24Å; Q396-K398 VanDerWaalsContact C-N 3.32Å; Q396-K398 PolarHBondContact O-N 3.14Å; K398-C400 VanDerWaalsContact C-N 3.34Å; K398-C400 PolarHBondContact O-N 3.28Å; K398-Y401 PolarHBondContact O-N 3.35Å; K398-D402 WeakPolarHBondContact CE-OD2 3.43Å; K398-D402 WeakPolarHBondContact CG-OD2 3.5Å; K398-D402 VanDerWaalsContact NZ-CG 3.34Å; K398-D402 IonicContact NZ-OD1 3.75Å; K398-D402 PolarHBondContact NZ-OD1 3.42Å; K398-D402 IonicContact NZ-OD2 3.18Å; K398-D402 PolarHBondContact NZ-OD2 3.31Å; K398-D402 PolarHBondContact O-N 2.91Å
399E96.5Very high95.2Very high120 Ų12089.1 Ų89.156%0.56144%0.438SS*.Hα-helixtrans-59.4-43.6175-174.6178.2-177.300111.6A395 Q396 Y401 D402 L403A395-E399 PolarHBondContact O-N 3.27Å; Q396-E399 WeakPolarHBondContact O-CB 3.16Å; Q396-E399 PolarHBondContact O-N 3.45Å; Q396-E399 VanDerWaalsContact O-N 3.16Å; E399-Y401 VanDerWaalsContact C-N 3.35Å; E399-Y401 PolarHBondContact O-N 3.16Å; E399-D402 PolarHBondContact O-N 3.47Å; E399-L403 HydrophobicContact CG-CD1 4.15Å; E399-L403 HydrophobicContact CG-CG 4.45Å; E399-L403 WeakPolarHBondContact O-CB 3.26Å; E399-L403 WeakPolarHBondContact O-CG 3.31Å; E399-L403 PolarHBondContact O-N 3.27Å
400C96.9Very high94.5Very high78 Ų7885.5 Ų85.553%0.52742%0.419SS..Hα-helixtrans-59.2-41.8174-65.10000112.8Q396 L397 K398 L404Q396-C400 PolarHBondContact O-N 3.39Å; Q396-C400 PolarHBondContact O-SG 3.23Å; Q396-C400 VanDerWaalsContact O-SG 3.34Å; L397-C400 PolarHBondContact O-N 3.45Å; K398-C400 VanDerWaalsContact C-N 3.34Å; K398-C400 PolarHBondContact O-N 3.28Å; C400-L404 WeakPolarHBondContact O-CB 3.48Å; C400-L404 PolarHBondContact O-N 2.97Å
401Y96.2Very high93.6Very high46 Ų4685.3 Ų85.318%0.1843%0.428CS..Hα-helixtrans-66.5-41.7174.1-82.1-69000112.6L397 K398 E399 L403 L404 K405 N420 I423 L424L397-Y401 HydrophobicContact CD1-CD2 4.16Å; L397-Y401 HydrophobicContact CD1-CE2 3.75Å; L397-Y401 HydrophobicContact CD2-CE2 4.41Å; L397-Y401 HydrophobicContact CG-CD2 4.1Å; L397-Y401 HydrophobicContact CG-CE2 3.86Å; L397-Y401 WeakPolarHBondContact O-CD2 3.36Å; L397-Y401 PolarHBondContact O-N 3.31Å; L397-Y401 VanDerWaalsContact O-N 3.09Å; K398-Y401 PolarHBondContact O-N 3.35Å; E399-Y401 VanDerWaalsContact C-N 3.35Å; E399-Y401 PolarHBondContact O-N 3.16Å; Y401-L403 VanDerWaalsContact C-N 3.31Å; Y401-L403 PolarHBondContact O-N 3.28Å; Y401-L404 PolarHBondContact O-N 3.16Å; Y401-K405 WeakPolarHBondContact O-CB 3.27Å; Y401-K405 PolarHBondContact O-N 3.45Å; Y401-N420 HydrophobicContact CD1-CB 4.46Å; Y401-N420 HydrophobicContact CE1-CB 4.06Å; Y401-I423 HydrophobicContact CD1-CB 4.35Å; Y401-I423 HydrophobicContact CD1-CD1 4.2Å; Y401-I423 HydrophobicContact CD1-CG2 4.17Å; Y401-L424 HydrophobicContact CE1-CD1 4.49Å; Y401-L424 HydrophobicContact CE1-CD2 3.9Å; Y401-L424 HydrophobicContact CE1-CG 4.02Å
402D93.3Very high92.5Very high49 Ų4983.3 Ų83.326%0.26242%0.424SS..Hα-helixtrans-71.6-24.3178.8-69.1-30.7000112.6K398 E399 K406K398-D402 WeakPolarHBondContact CE-OD2 3.43Å; K398-D402 WeakPolarHBondContact CG-OD2 3.5Å; K398-D402 VanDerWaalsContact NZ-CG 3.34Å; K398-D402 IonicContact NZ-OD1 3.75Å; K398-D402 PolarHBondContact NZ-OD1 3.42Å; K398-D402 IonicContact NZ-OD2 3.18Å; K398-D402 PolarHBondContact NZ-OD2 3.31Å; K398-D402 PolarHBondContact O-N 2.91Å; E399-D402 PolarHBondContact O-N 3.47Å; D402-K406 WeakPolarHBondContact O-CD 3.46Å; D402-K406 VanDerWaalsContact O-CE 3.25Å; D402-K406 WeakPolarHBondContact O-CE 3.39Å; D402-K406 WeakPolarHBondContact O-CG 3.4Å
403L94.8Very high91.5Very high90 Ų9085.1 Ų85.147%0.47143%0.433SS..Hα-helixtrans-74.6-51.3168.6-75.3171000111.3E399 Y401 K405 K406E399-L403 HydrophobicContact CG-CD1 4.15Å; E399-L403 HydrophobicContact CG-CG 4.45Å; E399-L403 WeakPolarHBondContact O-CB 3.26Å; E399-L403 WeakPolarHBondContact O-CG 3.31Å; E399-L403 PolarHBondContact O-N 3.27Å; Y401-L403 VanDerWaalsContact C-N 3.31Å; Y401-L403 PolarHBondContact O-N 3.28Å; L403-K405 VanDerWaalsContact C-N 3.31Å; L403-K405 PolarHBondContact O-N 2.9Å; L403-K406 WeakPolarHBondContact O-CB 3.43Å; L403-K406 PolarHBondContact O-N 3.5Å
404L94.6Very high90.6Very high56 Ų5682.7 Ų82.729%0.29343%0.431SS..Hα-helixtrans-54.1-49.8176.8178.256.5000110.5C400 Y401 K406 V407 L408 I423 L424 A427C400-L404 WeakPolarHBondContact O-CB 3.48Å; C400-L404 PolarHBondContact O-N 2.97Å; Y401-L404 PolarHBondContact O-N 3.16Å; L404-K406 PolarHBondContact O-N 3.49Å; L404-V407 PolarHBondContact O-N 3.18Å; L404-L408 HydrophobicContact CD1-CD2 4.02Å; L404-L408 HydrophobicContact CD1-CG 4.32Å; L404-L408 HydrophobicContact CG-CD1 4.32Å; L404-L408 HydrophobicContact CG-CG 4.49Å; L404-L408 WeakPolarHBondContact O-CG 3.35Å; L404-L408 PolarHBondContact O-N 2.83Å; L404-I423 HydrophobicContact CB-CG2 4.38Å; L404-I423 HydrophobicContact CD2-CG2 3.81Å; L404-I423 HydrophobicContact CG-CG2 3.88Å; L404-L424 HydrophobicContact CD2-CD2 4.49Å; L404-A427 HydrophobicContact CD1-CB 3.98Å; L404-A427 HydrophobicContact CD2-CB 4.08Å; L404-A427 HydrophobicContact CG-CB 4.34Å
405K93.7Very high89.9Confident28 Ų2878.3 Ų78.312%0.12241%0.414CS..Hα-helixtrans-52.9-24.6176.1173179.2-83.1-168.20114.8Y401 L403 R415 T418 I423Y401-K405 WeakPolarHBondContact O-CB 3.27Å; Y401-K405 PolarHBondContact O-N 3.45Å; L403-K405 VanDerWaalsContact C-N 3.31Å; L403-K405 PolarHBondContact O-N 2.9Å; K405-R415 HydrophobicContact CD-CB 4.37Å; K405-R415 WeakPolarHBondContact CD-O 3.45Å; K405-R415 WeakPolarHBondContact CE-O 3.37Å; K405-R415 HydrophobicContact CG-CB 4.41Å; K405-R415 HydrophobicContact CG-CG 4.29Å; K405-R415 PolarHBondContact NZ-O 2.95Å; K405-R415 PolarHBondContact O-NH1 3.1Å; K405-T418 WeakPolarHBondContact CE-OG1 3.42Å; K405-T418 PolarHBondContact NZ-OG1 3.34Å; K405-T418 VanDerWaalsContact NZ-OG1 3.15Å; K405-I423 HydrophobicContact CB-CD1 4.44Å
406K90.9Very high89.1Confident143 Ų14382 Ų8262%0.62242%0.418SS*.Hα-helixtrans-78.6-38.8175.1-68.4160.8-170.6169.20111.9D402 L403 L404 L408 R415D402-K406 WeakPolarHBondContact O-CD 3.46Å; D402-K406 VanDerWaalsContact O-CE 3.25Å; D402-K406 WeakPolarHBondContact O-CE 3.39Å; D402-K406 WeakPolarHBondContact O-CG 3.4Å; L403-K406 WeakPolarHBondContact O-CB 3.43Å; L403-K406 PolarHBondContact O-N 3.5Å; L404-K406 PolarHBondContact O-N 3.49Å; K406-L408 VanDerWaalsContact C-N 3.32Å; K406-L408 PolarHBondContact O-N 2.71Å; K406-R415 PolarHBondContact O-NH1 3.44Å; K406-R415 VanDerWaalsContact O-NH1 3.16Å
407V91.8Very high88.5Confident102 Ų10284.5 Ų84.562%0.61843%0.428SS*.Hα-helixtrans-70.3-29.1-178.5-1780000112L404 Y430L404-V407 PolarHBondContact O-N 3.18Å; V407-Y430 HydrophobicContact CG1-CE1 4.5Å
408L90.9Very high88.2Confident6 Ų681.7 Ų81.73%0.03141%0.414CS..SBendtrans-74146.8-176.3-55.2-175.5000113.3L404 K406 M410 R415 I423 T426 A427 Y430L404-L408 HydrophobicContact CD1-CD2 4.02Å; L404-L408 HydrophobicContact CD1-CG 4.32Å; L404-L408 HydrophobicContact CG-CD1 4.32Å; L404-L408 HydrophobicContact CG-CG 4.49Å; L404-L408 WeakPolarHBondContact O-CG 3.35Å; L404-L408 PolarHBondContact O-N 2.83Å; K406-L408 VanDerWaalsContact C-N 3.32Å; K406-L408 PolarHBondContact O-N 2.71Å; L408-M410 HydrophobicContact CB-CG 4.06Å; L408-M410 HydrophobicContact CD1-SD 4.45Å; L408-M410 PolarHBondContact O-N 2.94Å; L408-R415 PolarHBondContact O-NH1 2.95Å; L408-R415 PolarHBondContact O-NH2 3.03Å; L408-R415 VanDerWaalsContact O-NH2 3.12Å; L408-I423 HydrophobicContact CD1-CG2 4.01Å; L408-I423 WeakPolarHBondContact CD1-O 3.21Å; L408-T426 VanDerWaalsContact CD1-OG1 3.23Å; L408-T426 WeakPolarHBondContact CD1-OG1 3.28Å; L408-A427 HydrophobicContact CD1-CB 3.97Å; L408-A427 HydrophobicContact CD2-CB 3.87Å; L408-Y430 HydrophobicContact CD2-CD1 3.85Å
409P86.1Confident88.1Confident89 Ų8979 Ų7958%0.57841%0.411SS*.  trans-76.386169.932.1-34.6000110.1Y430P409-Y430 HydrophobicContact CG-CD2 3.59Å; P409-Y430 HydrophobicContact CG-CE2 3.86Å; P409-Y430 HydrophobicContact CG-CG 3.97Å
410M82.6Confident87.9Confident28 Ų2877.5 Ų77.514%0.13841%0.407CS..  trans-126.8152.7175.2-60.9-164.568.600110.8L408 D414 R415 T418 T426L408-M410 HydrophobicContact CB-CG 4.06Å; L408-M410 HydrophobicContact CD1-SD 4.45Å; L408-M410 PolarHBondContact O-N 2.94Å; M410-D414 HydrophobicContact CE-CB 3.93Å; M410-R415 HydrophobicContact CB-CG 4.07Å; M410-R415 PolarHBondContact O-NE 3.49Å; M410-R415 PolarHBondContact O-NH2 3.42Å; M410-T418 HydrophobicContact CE-CG2 3.53Å; M410-T418 HydrophobicContact SD-CG2 4.04Å; M410-T426 HydrophobicContact CE-CG2 4.13Å; M410-T426 HydrophobicContact SD-CG2 4.15Å; M410-T426 PolarHBondContact SD-OG1 3.34Å; M410-T426 VanDerWaalsContact SD-OG1 3.4Å
411G77.6Confident87.8Confident36 Ų3679 Ų7937%0.37141%0.409SS..  trans-70.3149174.400000111.5E413 D414 R415G411-E413 PolarHBondContact O-N 2.81Å; G411-D414 PolarHBondContact N-OD2 2.89Å; G411-D414 WeakPolarHBondContact O-CB 3.5Å; G411-D414 PolarHBondContact O-N 3.28Å; G411-R415 WeakPolarHBondContact O-CG 3.45Å; G411-R415 PolarHBondContact O-N 3.29Å
412D76.1Confident87.7Confident112 Ų11279.6 Ų79.660%0.59942%0.417SS*.Hα-helixtrans-66.9-22.2-175.9-66.1-36.7000113.6R415 K416D412-R415 WeakPolarHBondContact OD1-CD 3.36Å; D412-R415 IonicContact OD1-NE 3.74Å; D412-R415 PolarHBondContact OD1-NE 3.48Å; D412-K416 WeakPolarHBondContact O-CD 3.43Å; D412-K416 VanDerWaalsContact O-CE 3.28Å; D412-K416 WeakPolarHBondContact O-CE 3.4Å; D412-K416 WeakPolarHBondContact O-CG 3.33Å; D412-K416 PolarHBondContact O-N 3.37Å
413E76Confident87.7Confident116 Ų11677.3 Ų77.354%0.54241%0.405SS..Hα-helixtrans-70.8-44.3168.1-65.9-48.4118.200112.1G411 R415 K416G411-E413 PolarHBondContact O-N 2.81Å; E413-R415 VanDerWaalsContact C-N 3.32Å; E413-R415 PolarHBondContact O-N 2.91Å; E413-K416 PolarHBondContact O-N 3.28Å; E413-K416 IonicContact OE1-NZ 2.67Å; E413-K416 PolarHBondContact OE1-NZ 3.01Å; E413-K416 IonicContact OE2-NZ 2.67Å
414D77.7Confident87.8Confident93 Ų9376.9 Ų76.950%0.49740%0.403SS..Hα-helixtrans-61.3-43.2174.8-55.1-53.5000110.5M410 G411 K416 K417 T418M410-D414 HydrophobicContact CE-CB 3.93Å; G411-D414 PolarHBondContact N-OD2 2.89Å; G411-D414 WeakPolarHBondContact O-CB 3.5Å; G411-D414 PolarHBondContact O-N 3.28Å; D414-K416 PolarHBondContact O-N 2.96Å; D414-K416 VanDerWaalsContact O-N 3.12Å; D414-K417 PolarHBondContact O-N 3.04Å; D414-T418 PolarHBondContact O-N 3.42Å; D414-T418 PolarHBondContact O-OG1 2.76Å
415R82.9Confident87.8Confident64 Ų6477.6 Ų77.624%0.24241%0.407CS..Hα-helixtrans-56.6-27.7178.8-69.7-176.8-151.7-96.22.6112.5K405 K406 L408 M410 G411 D412 E413 T418K405-R415 HydrophobicContact CD-CB 4.37Å; K405-R415 WeakPolarHBondContact CD-O 3.45Å; K405-R415 WeakPolarHBondContact CE-O 3.37Å; K405-R415 HydrophobicContact CG-CB 4.41Å; K405-R415 HydrophobicContact CG-CG 4.29Å; K405-R415 PolarHBondContact NZ-O 2.95Å; K405-R415 PolarHBondContact O-NH1 3.1Å; K406-R415 PolarHBondContact O-NH1 3.44Å; K406-R415 VanDerWaalsContact O-NH1 3.16Å; L408-R415 PolarHBondContact O-NH1 2.95Å; L408-R415 PolarHBondContact O-NH2 3.03Å; L408-R415 VanDerWaalsContact O-NH2 3.12Å; M410-R415 HydrophobicContact CB-CG 4.07Å; M410-R415 PolarHBondContact O-NE 3.49Å; M410-R415 PolarHBondContact O-NH2 3.42Å; G411-R415 WeakPolarHBondContact O-CG 3.45Å; G411-R415 PolarHBondContact O-N 3.29Å; D412-R415 WeakPolarHBondContact OD1-CD 3.36Å; D412-R415 IonicContact OD1-NE 3.74Å; D412-R415 PolarHBondContact OD1-NE 3.48Å; E413-R415 VanDerWaalsContact C-N 3.32Å; E413-R415 PolarHBondContact O-N 2.91Å; R415-T418 WeakPolarHBondContact CA-OG1 3.44Å
416K81.8Confident87.8Confident137 Ų13777.9 Ų77.960%0.59641%0.411SS*.Hα-helixtrans-75.2-30.3177-66.8160.1-166.2172.90113.1D412 E413 D414D412-K416 WeakPolarHBondContact O-CD 3.43Å; D412-K416 VanDerWaalsContact O-CE 3.28Å; D412-K416 WeakPolarHBondContact O-CE 3.4Å; D412-K416 WeakPolarHBondContact O-CG 3.33Å; D412-K416 PolarHBondContact O-N 3.37Å; E413-K416 PolarHBondContact O-N 3.28Å; E413-K416 IonicContact OE1-NZ 2.67Å; E413-K416 PolarHBondContact OE1-NZ 3.01Å; E413-K416 IonicContact OE2-NZ 2.67Å; D414-K416 PolarHBondContact O-N 2.96Å; D414-K416 VanDerWaalsContact O-N 3.12Å
417K85Confident88Confident178 Ų17871.7 Ų71.777%0.77439%0.387SS*.Hα-helixtrans-123.94.1-168-62.8172.8-174.4165.70114.9D414 S419D414-K417 PolarHBondContact O-N 3.04Å; K417-S419 PolarHBondContact O-N 2.84Å
418T90.4Very high88.2Confident20 Ų2072.7 Ų72.712%0.12338%0.384CS..  trans-58.7130.2-177.5-14.70000112.9K405 M410 D414 R415 T422 I423K405-T418 WeakPolarHBondContact CE-OG1 3.42Å; K405-T418 PolarHBondContact NZ-OG1 3.34Å; K405-T418 VanDerWaalsContact NZ-OG1 3.15Å; M410-T418 HydrophobicContact CE-CG2 3.53Å; M410-T418 HydrophobicContact SD-CG2 4.04Å; D414-T418 PolarHBondContact O-N 3.42Å; D414-T418 PolarHBondContact O-OG1 2.76Å; R415-T418 WeakPolarHBondContact CA-OG1 3.44Å; T418-T422 HydrophobicContact CG2-CG2 3.91Å; T418-I423 HydrophobicContact CG2-CG1 3.71Å
419S93.7Very high88.4Confident69 Ų6978.8 Ų78.848%0.48341%0.41SS..  trans-71.1148.7166.1177.30000111.3K417 L421 T422 I423K417-S419 PolarHBondContact O-N 2.84Å; S419-L421 VanDerWaalsContact C-N 3.25Å; S419-L421 PolarHBondContact O-N 3.02Å; S419-T422 WeakPolarHBondContact O-CB 3.25Å; S419-T422 PolarHBondContact O-N 3.21Å; S419-I423 WeakPolarHBondContact O-CG1 3.4Å; S419-I423 PolarHBondContact O-N 3.44Å
420N93.4Very high88.9Confident88 Ų8878 Ų7847%0.47140%0.397SS..Hα-helixtrans-56-38.8177.8-68.64.7000112.5Y401 I423 L424Y401-N420 HydrophobicContact CD1-CB 4.46Å; Y401-N420 HydrophobicContact CE1-CB 4.06Å; N420-I423 PolarHBondContact O-N 2.89Å; N420-L424 PolarHBondContact O-N 3.22Å
421L94.8Very high89.5Confident109 Ų10980.6 Ų80.657%0.57141%0.414SS*.Hα-helixtrans-60.3-47.8175.5175.960000110.9S419 I423 L424 D425S419-L421 VanDerWaalsContact C-N 3.25Å; S419-L421 PolarHBondContact O-N 3.02Å; L421-I423 VanDerWaalsContact C-N 3.27Å; L421-I423 PolarHBondContact O-N 2.63Å; L421-L424 WeakPolarHBondContact O-CB 3.48Å; L421-L424 PolarHBondContact O-N 3.49Å; L421-D425 PolarHBondContact O-N 3.12Å
422T93.8Very high90.4Very high59 Ų5982.7 Ų82.736%0.36242%0.416SS..Hα-helixtrans-61.8-33.7178.6-48.80000112.2T418 S419 D425 T426T418-T422 HydrophobicContact CG2-CG2 3.91Å; S419-T422 WeakPolarHBondContact O-CB 3.25Å; S419-T422 PolarHBondContact O-N 3.21Å; T422-D425 PolarHBondContact O-N 3.07Å; T422-T426 HydrophobicContact CG2-CG2 4.48Å; T422-T426 WeakPolarHBondContact O-CG2 3.33Å; T422-T426 PolarHBondContact O-N 3.42Å; T422-T426 PolarHBondContact O-OG1 3.41Å
423I94.1Very high91.2Very high1 Ų180.9 Ų80.91%0.00541%0.413CS..Hα-helixtrans-65.2-38.7173.3-58.6167.4000111Y401 L404 K405 L408 T418 S419 N420 L421 T426 A427Y401-I423 HydrophobicContact CD1-CB 4.35Å; Y401-I423 HydrophobicContact CD1-CD1 4.2Å; Y401-I423 HydrophobicContact CD1-CG2 4.17Å; L404-I423 HydrophobicContact CB-CG2 4.38Å; L404-I423 HydrophobicContact CD2-CG2 3.81Å; L404-I423 HydrophobicContact CG-CG2 3.88Å; K405-I423 HydrophobicContact CB-CD1 4.44Å; L408-I423 HydrophobicContact CD1-CG2 4.01Å; L408-I423 WeakPolarHBondContact CD1-O 3.21Å; T418-I423 HydrophobicContact CG2-CG1 3.71Å; S419-I423 WeakPolarHBondContact O-CG1 3.4Å; S419-I423 PolarHBondContact O-N 3.44Å; N420-I423 PolarHBondContact O-N 2.89Å; L421-I423 VanDerWaalsContact C-N 3.27Å; L421-I423 PolarHBondContact O-N 2.63Å; I423-T426 PolarHBondContact O-OG1 2.93Å; I423-A427 WeakPolarHBondContact O-CB 3.41Å; I423-A427 PolarHBondContact O-N 3.03Å
424L95.8Very high92.1Very high80 Ų8078.5 Ų78.542%0.41940%0.403SS..Hα-helixtrans-69.7-42.7175.7-63175.7000111.7Y401 L404 N420 L421 A427 H428Y401-L424 HydrophobicContact CE1-CD1 4.49Å; Y401-L424 HydrophobicContact CE1-CD2 3.9Å; Y401-L424 HydrophobicContact CE1-CG 4.02Å; L404-L424 HydrophobicContact CD2-CD2 4.49Å; N420-L424 PolarHBondContact O-N 3.22Å; L421-L424 WeakPolarHBondContact O-CB 3.48Å; L421-L424 PolarHBondContact O-N 3.49Å; L424-A427 PolarHBondContact O-N 3.33Å; L424-H428 WeakPolarHBondContact O-CB 3.35Å; L424-H428 PolarHBondContact O-N 2.94Å
425D94.3Very high93Very high71 Ų7177.4 Ų77.438%0.3840%0.403SS..Hα-helixtrans-63-43.9177.8-72.4-33.6000112.1L421 T422 K429L421-D425 PolarHBondContact O-N 3.12Å; T422-D425 PolarHBondContact O-N 3.07Å; D425-K429 WeakPolarHBondContact O-CB 3.42Å; D425-K429 WeakPolarHBondContact O-CD 3.43Å; D425-K429 WeakPolarHBondContact O-CG 3.42Å; D425-K429 PolarHBondContact O-N 2.86Å
426T93.7Very high93.5Very high34 Ų3480.5 Ų80.521%0.20942%0.42CS..Hα-helixtrans-71.8-32176.854.20000111.9L408 M410 T422 I423 Y430L408-T426 VanDerWaalsContact CD1-OG1 3.23Å; L408-T426 WeakPolarHBondContact CD1-OG1 3.28Å; M410-T426 HydrophobicContact CE-CG2 4.13Å; M410-T426 HydrophobicContact SD-CG2 4.15Å; M410-T426 PolarHBondContact SD-OG1 3.34Å; M410-T426 VanDerWaalsContact SD-OG1 3.4Å; T422-T426 HydrophobicContact CG2-CG2 4.48Å; T422-T426 WeakPolarHBondContact O-CG2 3.33Å; T422-T426 PolarHBondContact O-N 3.42Å; T422-T426 PolarHBondContact O-OG1 3.41Å; I423-T426 PolarHBondContact O-OG1 2.93Å; T426-Y430 WeakPolarHBondContact O-CB 3.39Å; T426-Y430 PolarHBondContact O-N 2.95Å
427A96Very high94.2Very high14 Ų1478.7 Ų78.712%0.11641%0.413CS..Hα-helixtrans-63.4-48.9171.500000112.3L404 L408 I423 L424 K429 Y430 V431L404-A427 HydrophobicContact CD1-CB 3.98Å; L404-A427 HydrophobicContact CD2-CB 4.08Å; L404-A427 HydrophobicContact CG-CB 4.34Å; L408-A427 HydrophobicContact CD1-CB 3.97Å; L408-A427 HydrophobicContact CD2-CB 3.87Å; I423-A427 WeakPolarHBondContact O-CB 3.41Å; I423-A427 PolarHBondContact O-N 3.03Å; L424-A427 PolarHBondContact O-N 3.33Å; A427-K429 PolarHBondContact O-N 3.16Å; A427-Y430 PolarHBondContact O-N 3.21Å; A427-V431 WeakPolarHBondContact O-CG2 3.35Å; A427-V431 PolarHBondContact O-N 3.36Å
428H95.5Very high94.7Very high122 Ų12273.8 Ų73.857%0.56540%0.398SS*.Hα-helixtrans-62.5-44.1178.6-178.4-130.6000111.6L424 Y430 V431 N432L424-H428 WeakPolarHBondContact O-CB 3.35Å; L424-H428 PolarHBondContact O-N 2.94Å; H428-Y430 PolarHBondContact O-N 3.22Å; H428-V431 PolarHBondContact O-N 3.41Å; H428-N432 PolarHBondContact CD2-ND2 3.27Å; H428-N432 PolarHBondContact CE1-ND2 3.49Å; H428-N432 PolarHBondContact NE2-ND2 3.17Å; H428-N432 VanDerWaalsContact NE2-ND2 3.13Å; H428-N432 VanDerWaalsContact O-CG 3.23Å; H428-N432 PolarHBondContact O-N 2.89Å; H428-N432 VanDerWaalsContact O-N 3.11Å; H428-N432 PolarHBondContact O-ND2 2.9Å
429K95.2Very high94.9Very high134 Ų13476.6 Ų76.658%0.58342%0.418SS*.Hα-helixtrans-58.9-47173.6-72.8166.8-175.1173.10111.8D425 A427 N432 S433D425-K429 WeakPolarHBondContact O-CB 3.42Å; D425-K429 WeakPolarHBondContact O-CD 3.43Å; D425-K429 WeakPolarHBondContact O-CG 3.42Å; D425-K429 PolarHBondContact O-N 2.86Å; A427-K429 PolarHBondContact O-N 3.16Å; K429-N432 PolarHBondContact O-N 3.09Å; K429-S433 PolarHBondContact O-N 3.13Å; K429-S433 PolarHBondContact O-OG 3.49Å
430Y95.8Very high94.9Very high74 Ų7478.9 Ų78.929%0.2942%0.421SS..Hα-helixtrans-64.7-41.9-178.6-177.7-133.2000112.8V407 L408 P409 T426 A427 H428 N432 S433 L434V407-Y430 HydrophobicContact CG1-CE1 4.5Å; L408-Y430 HydrophobicContact CD2-CD1 3.85Å; P409-Y430 HydrophobicContact CG-CD2 3.59Å; P409-Y430 HydrophobicContact CG-CE2 3.86Å; P409-Y430 HydrophobicContact CG-CG 3.97Å; T426-Y430 WeakPolarHBondContact O-CB 3.39Å; T426-Y430 PolarHBondContact O-N 2.95Å; A427-Y430 PolarHBondContact O-N 3.21Å; H428-Y430 PolarHBondContact O-N 3.22Å; Y430-N432 VanDerWaalsContact C-N 3.31Å; Y430-N432 PolarHBondContact O-N 3.47Å; Y430-S433 PolarHBondContact O-N 3.4Å; Y430-L434 HydrophobicContact CD1-CD1 4.15Å; Y430-L434 HydrophobicContact CD2-CD1 4.32Å; Y430-L434 HydrophobicContact CD2-CG 4.12Å; Y430-L434 HydrophobicContact CE1-CD1 3.77Å; Y430-L434 HydrophobicContact CE2-CD1 3.95Å; Y430-L434 HydrophobicContact CE2-CD2 3.94Å; Y430-L434 HydrophobicContact CE2-CG 3.78Å; Y430-L434 HydrophobicContact CG-CD1 4.41Å; Y430-L434 WeakPolarHBondContact O-CG 3.13Å; Y430-L434 PolarHBondContact O-N 3.11Å
431V96Very high94.9Very high82 Ų8279.2 Ų79.250%0.49742%0.42SS..Hα-helixtrans-60.8-40.3174.2170.30000111.4A427 H428 S435A427-V431 WeakPolarHBondContact O-CG2 3.35Å; A427-V431 PolarHBondContact O-N 3.36Å; H428-V431 PolarHBondContact O-N 3.41Å; V431-S435 WeakPolarHBondContact O-CB 3.38Å; V431-S435 PolarHBondContact O-N 3.19Å; V431-S435 PolarHBondContact O-OG 3.24Å
432N95.5Very high94.9Very high79 Ų7980 Ų8042%0.42242%0.42SS..Hα-helixtrans-69-39.9177.2-66.9-23.2000112H428 K429 Y430 S435 H436H428-N432 PolarHBondContact CD2-ND2 3.27Å; H428-N432 PolarHBondContact CE1-ND2 3.49Å; H428-N432 PolarHBondContact NE2-ND2 3.17Å; H428-N432 VanDerWaalsContact NE2-ND2 3.13Å; H428-N432 VanDerWaalsContact O-CG 3.23Å; H428-N432 PolarHBondContact O-N 2.89Å; H428-N432 VanDerWaalsContact O-N 3.11Å; H428-N432 PolarHBondContact O-ND2 2.9Å; K429-N432 PolarHBondContact O-N 3.09Å; Y430-N432 VanDerWaalsContact C-N 3.31Å; Y430-N432 PolarHBondContact O-N 3.47Å; N432-S435 PolarHBondContact O-N 3.49Å; N432-H436 PolarHBondContact O-N 3.39Å
433S94.5Very high94.9Very high75 Ų7579.9 Ų79.952%0.52443%0.425SS..Hα-helixtrans-61.5-47.2172.8-64.30000112.4K429 Y430 S435 H436 E437K429-S433 PolarHBondContact O-N 3.13Å; K429-S433 PolarHBondContact O-OG 3.49Å; Y430-S433 PolarHBondContact O-N 3.4Å; S433-S435 VanDerWaalsContact C-N 3.31Å; S433-S435 PolarHBondContact O-N 2.65Å; S433-H436 PolarHBondContact O-N 2.91Å; S433-E437 WeakPolarHBondContact O-CB 3.21Å; S433-E437 PolarHBondContact O-N 3.4Å
434L95.3Very high95Very high66 Ų6686.1 Ų86.135%0.34645%0.453SS..Hα-helixtrans-61-39.8175.5-72.6174.3000111.8Y430 H436 E437 V438Y430-L434 HydrophobicContact CD1-CD1 4.15Å; Y430-L434 HydrophobicContact CD2-CD1 4.32Å; Y430-L434 HydrophobicContact CD2-CG 4.12Å; Y430-L434 HydrophobicContact CE1-CD1 3.77Å; Y430-L434 HydrophobicContact CE2-CD1 3.95Å; Y430-L434 HydrophobicContact CE2-CD2 3.94Å; Y430-L434 HydrophobicContact CE2-CG 3.78Å; Y430-L434 HydrophobicContact CG-CD1 4.41Å; Y430-L434 WeakPolarHBondContact O-CG 3.13Å; Y430-L434 PolarHBondContact O-N 3.11Å; L434-H436 VanDerWaalsContact C-N 3.35Å; L434-H436 PolarHBondContact O-N 3.24Å; L434-E437 PolarHBondContact O-N 3.01Å; L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 2.95Å
435S94.6Very high95Very high70 Ų7087.7 Ų87.749%0.4946%0.46SS..Hα-helixtrans-65.7-37.7178.7-57.60000112.1V431 N432 S433 C439V431-S435 WeakPolarHBondContact O-CB 3.38Å; V431-S435 PolarHBondContact O-N 3.19Å; V431-S435 PolarHBondContact O-OG 3.24Å; N432-S435 PolarHBondContact O-N 3.49Å; S433-S435 VanDerWaalsContact C-N 3.31Å; S433-S435 PolarHBondContact O-N 2.65Å; S435-C439 PolarHBondContact O-N 2.86Å
436H95Very high95.1Very high129 Ų12988.7 Ų88.760%0.59746%0.463SS*.Hα-helixtrans-67.3-44.4171.7-176-73.7000111.6N432 S433 L434 V438 C439 E440N432-H436 PolarHBondContact O-N 3.39Å; S433-H436 PolarHBondContact O-N 2.91Å; L434-H436 VanDerWaalsContact C-N 3.35Å; L434-H436 PolarHBondContact O-N 3.24Å; H436-V438 PolarHBondContact O-N 3.03Å; H436-C439 WeakPolarHBondContact O-CB 3.34Å; H436-C439 PolarHBondContact O-N 2.79Å; H436-E440 PolarHBondContact O-N 3.12Å
437E95.1Very high95.2Very high98 Ų9893.5 Ų93.546%0.45848%0.48SS..Hα-helixtrans-62.1-42.8-179.9-164.1-172.3162.500111.8S433 L434 C439 E440 Q441S433-E437 WeakPolarHBondContact O-CB 3.21Å; S433-E437 PolarHBondContact O-N 3.4Å; L434-E437 PolarHBondContact O-N 3.01Å; E437-C439 VanDerWaalsContact C-N 3.35Å; E437-C439 PolarHBondContact O-N 3Å; E437-E440 PolarHBondContact O-N 2.9Å; E437-Q441 HydrophobicContact CG-CG 4.42Å; E437-Q441 WeakPolarHBondContact O-CB 3.36Å; E437-Q441 VanDerWaalsContact O-CG 3.27Å; E437-Q441 WeakPolarHBondContact O-CG 3.42Å; E437-Q441 PolarHBondContact O-N 3.01Å; E437-Q441 PolarHBondContact OE1-NE2 2.94Å
438V95.6Very high95.2Very high75 Ų7597.6 Ų97.646%0.45550%0.5SS..Hα-helixtrans-58.4-46.1174.1168.90000111.1L434 H436 E440 Q441 E442L434-V438 WeakPolarHBondContact O-CG2 3.46Å; L434-V438 PolarHBondContact O-N 2.95Å; H436-V438 PolarHBondContact O-N 3.03Å; V438-E440 PolarHBondContact O-N 2.62Å; V438-Q441 PolarHBondContact O-N 3.15Å; V438-E442 HydrophobicContact CG1-CG 4.4Å; V438-E442 WeakPolarHBondContact O-CB 3.43Å; V438-E442 WeakPolarHBondContact O-CG 3.41Å; V438-E442 PolarHBondContact O-N 2.92Å
439C94.9Very high95.2Very high79 Ų7993.8 Ų93.853%0.53449%0.49SS..Hα-helixtrans-60.9-42.5177.4-1740000112.4S435 H436 E437 E442 A443S435-C439 PolarHBondContact O-N 2.86Å; H436-C439 WeakPolarHBondContact O-CB 3.34Å; H436-C439 PolarHBondContact O-N 2.79Å; E437-C439 VanDerWaalsContact C-N 3.35Å; E437-C439 PolarHBondContact O-N 3Å; C439-E442 PolarHBondContact O-N 3.26Å; C439-A443 WeakPolarHBondContact O-CB 3.23Å; C439-A443 PolarHBondContact O-N 3.04Å
440E94.4Very high95.2Very high117 Ų11792.9 Ų92.955%0.54749%0.486SS..Hα-helixtrans-66.3-42.6175.9-168.3-172.4146.700111.9H436 E437 V438 A443 K444H436-E440 PolarHBondContact O-N 3.12Å; E437-E440 PolarHBondContact O-N 2.9Å; V438-E440 PolarHBondContact O-N 2.62Å; E440-A443 PolarHBondContact O-N 2.92Å; E440-K444 VanDerWaalsContact O-CB 3.26Å; E440-K444 WeakPolarHBondContact O-CB 3.34Å; E440-K444 PolarHBondContact O-N 3.2Å
441Q93Very high95.3Very high95 Ų9593.8 Ų93.844%0.44449%0.493SS..Hα-helixtrans-62.6-42.9176.1-72-177.519.900111.4E437 V438 K444 I445E437-Q441 HydrophobicContact CG-CG 4.42Å; E437-Q441 WeakPolarHBondContact O-CB 3.36Å; E437-Q441 VanDerWaalsContact O-CG 3.27Å; E437-Q441 WeakPolarHBondContact O-CG 3.42Å; E437-Q441 PolarHBondContact O-N 3.01Å; E437-Q441 PolarHBondContact OE1-NE2 2.94Å; V438-Q441 PolarHBondContact O-N 3.15Å; Q441-K444 PolarHBondContact O-N 2.62Å; Q441-I445 WeakPolarHBondContact O-CB 3.35Å; Q441-I445 WeakPolarHBondContact O-CD1 3.43Å; Q441-I445 VanDerWaalsContact O-CG1 3.23Å; Q441-I445 WeakPolarHBondContact O-CG1 3.39Å; Q441-I445 PolarHBondContact O-N 3.18Å
442E94.1Very high95.3Very high126 Ų12696.2 Ų96.259%0.58950%0.497SS*.Hα-helixtrans-61.6-47.7175-75.5-179.5163.600111.8V438 C439 K444 I445 E446V438-E442 HydrophobicContact CG1-CG 4.4Å; V438-E442 WeakPolarHBondContact O-CB 3.43Å; V438-E442 WeakPolarHBondContact O-CG 3.41Å; V438-E442 PolarHBondContact O-N 2.92Å; C439-E442 PolarHBondContact O-N 3.26Å; E442-K444 VanDerWaalsContact C-N 3.29Å; E442-K444 PolarHBondContact O-N 2.95Å; E442-I445 PolarHBondContact O-N 3.46Å; E442-E446 WeakPolarHBondContact O-CB 3.22Å; E442-E446 PolarHBondContact O-N 3.42Å
443A95Very high95.3Very high56 Ų5697.6 Ų97.646%0.46350%0.503SS..Hα-helixtrans-61.5-36.5175.900000112.6C439 E440 E446 K447C439-A443 WeakPolarHBondContact O-CB 3.23Å; C439-A443 PolarHBondContact O-N 3.04Å; E440-A443 PolarHBondContact O-N 2.92Å; A443-E446 PolarHBondContact O-N 3.31Å; A443-K447 WeakPolarHBondContact O-CB 3.07Å; A443-K447 PolarHBondContact O-N 3.17Å
444K94.9Very high95.4Very high133 Ų13398.4 Ų98.458%0.57850%0.498SS*.Hα-helixtrans-68.4-41.3175.3-171.4174.4-175.2173.20111.9E440 Q441 E442 K447 L448E440-K444 VanDerWaalsContact O-CB 3.26Å; E440-K444 WeakPolarHBondContact O-CB 3.34Å; E440-K444 PolarHBondContact O-N 3.2Å; Q441-K444 PolarHBondContact O-N 2.62Å; E442-K444 VanDerWaalsContact C-N 3.29Å; E442-K444 PolarHBondContact O-N 2.95Å; K444-K447 PolarHBondContact O-N 3.3Å; K444-L448 HydrophobicContact CG-CD1 4.41Å; K444-L448 WeakPolarHBondContact O-CB 3.47Å; K444-L448 VanDerWaalsContact O-CG 3.29Å; K444-L448 WeakPolarHBondContact O-CG 3.43Å; K444-L448 PolarHBondContact O-N 3.28Å
445I96.7Very high95.4Very high113 Ų113100 Ų10058%0.57951%0.507SS*.Hα-helixtrans-62.8-44.7173.4-71.1162.4000110.3Q441 E442 K447 L448 A449Q441-I445 WeakPolarHBondContact O-CB 3.35Å; Q441-I445 WeakPolarHBondContact O-CD1 3.43Å; Q441-I445 VanDerWaalsContact O-CG1 3.23Å; Q441-I445 WeakPolarHBondContact O-CG1 3.39Å; Q441-I445 PolarHBondContact O-N 3.18Å; E442-I445 PolarHBondContact O-N 3.46Å; I445-K447 PolarHBondContact O-N 2.97Å; I445-L448 PolarHBondContact O-N 3.06Å; I445-A449 WeakPolarHBondContact O-CB 3.22Å; I445-A449 PolarHBondContact O-N 2.9Å
446E95.9Very high95.5Very high92 Ų92101.2 Ų101.243%0.4351%0.505SS..Hα-helixtrans-62.5-43.4178.6-160.3-139.9-167.200111.8E442 A443 A449 K450E442-E446 WeakPolarHBondContact O-CB 3.22Å; E442-E446 PolarHBondContact O-N 3.42Å; A443-E446 PolarHBondContact O-N 3.31Å; E446-A449 PolarHBondContact O-N 3.44Å; E446-K450 WeakPolarHBondContact O-CG 3.45Å; E446-K450 PolarHBondContact O-N 3.01Å; E446-K450 WeakPolarHBondContact OE1-CE 3.49Å; E446-K450 IonicContact OE1-NZ 3.3Å; E446-K450 PolarHBondContact OE1-NZ 3.36Å; E446-K450 WeakPolarHBondContact OE2-CE 3.44Å; E446-K450 IonicContact OE2-NZ 2.66Å; E446-K450 PolarHBondContact OE2-NZ 3.4Å
447K96.3Very high95.5Very high134 Ų134101.4 Ų101.458%0.58350%0.504SS*.Hα-helixtrans-60.9-44.8174.4-175.5175.8-179.6177.20112.3A443 K444 I445 K450 Q451A443-K447 WeakPolarHBondContact O-CB 3.07Å; A443-K447 PolarHBondContact O-N 3.17Å; K444-K447 PolarHBondContact O-N 3.3Å; I445-K447 PolarHBondContact O-N 2.97Å; K447-K450 PolarHBondContact O-N 2.89Å; K447-Q451 WeakPolarHBondContact O-CG 3.31Å; K447-Q451 PolarHBondContact O-N 3.1Å
448L95.3Very high95.4Very high100 Ų100103.1 Ų103.152%0.52451%0.506SS..Hα-helixtrans-66.9-36.2177-71.6169.5000112K444 I445 Q451 K452K444-L448 HydrophobicContact CG-CD1 4.41Å; K444-L448 WeakPolarHBondContact O-CB 3.47Å; K444-L448 VanDerWaalsContact O-CG 3.29Å; K444-L448 WeakPolarHBondContact O-CG 3.43Å; K444-L448 PolarHBondContact O-N 3.28Å; I445-L448 PolarHBondContact O-N 3.06Å; L448-Q451 PolarHBondContact O-N 3.48Å; L448-K452 WeakPolarHBondContact O-CB 3.43Å; L448-K452 PolarHBondContact O-N 3.05Å
449A95.9Very high95.4Very high43 Ų43105.1 Ų105.136%0.35551%0.514SS..Hα-helixtrans-64.4-45.117400000111.7I445 E446 K452 I453I445-A449 WeakPolarHBondContact O-CB 3.22Å; I445-A449 PolarHBondContact O-N 2.9Å; E446-A449 PolarHBondContact O-N 3.44Å; A449-K452 PolarHBondContact O-N 3.15Å; A449-I453 WeakPolarHBondContact O-CG1 3.5Å; A449-I453 PolarHBondContact O-N 3.18Å
450K96.5Very high95.3Very high115 Ų115108.8 Ų108.850%0.552%0.52SS..Hα-helixtrans-58-47.9174-73.6168.1179170.20111.6E446 K447 K452 I453 E454E446-K450 WeakPolarHBondContact O-CG 3.45Å; E446-K450 PolarHBondContact O-N 3.01Å; E446-K450 WeakPolarHBondContact OE1-CE 3.49Å; E446-K450 IonicContact OE1-NZ 3.3Å; E446-K450 PolarHBondContact OE1-NZ 3.36Å; E446-K450 WeakPolarHBondContact OE2-CE 3.44Å; E446-K450 IonicContact OE2-NZ 2.66Å; E446-K450 PolarHBondContact OE2-NZ 3.4Å; K447-K450 PolarHBondContact O-N 2.89Å; K450-K452 PolarHBondContact O-N 2.83Å; K450-I453 PolarHBondContact O-N 3.27Å; K450-E454 PolarHBondContact O-N 3.45Å
451Q96.6Very high95.1Very high93 Ų93108.7 Ų108.744%0.43552%0.52SS..Hα-helixtrans-62.2-41.7175.9-73.4-179.3-3400112.7K447 L448 E454 L455K447-Q451 WeakPolarHBondContact O-CG 3.31Å; K447-Q451 PolarHBondContact O-N 3.1Å; L448-Q451 PolarHBondContact O-N 3.48Å; Q451-E454 PolarHBondContact O-N 2.75Å; Q451-L455 WeakPolarHBondContact O-CB 3.49Å; Q451-L455 WeakPolarHBondContact O-CG 3.38Å; Q451-L455 PolarHBondContact O-N 3.27Å
452K96Very high94.8Very high133 Ų133109.1 Ų109.158%0.57853%0.525SS*.Hα-helixtrans-60.6-45.3175.8-179-179.9177.8-178.60111.7L448 A449 K450 L455 Q456L448-K452 WeakPolarHBondContact O-CB 3.43Å; L448-K452 PolarHBondContact O-N 3.05Å; A449-K452 PolarHBondContact O-N 3.15Å; K450-K452 PolarHBondContact O-N 2.83Å; K452-L455 PolarHBondContact O-N 3.33Å; K452-Q456 WeakPolarHBondContact O-CB 3.29Å; K452-Q456 VanDerWaalsContact O-CG 3.27Å; K452-Q456 WeakPolarHBondContact O-CG 3.38Å; K452-Q456 PolarHBondContact O-N 2.92Å
453I96.6Very high94.3Very high108 Ų108106.5 Ų106.555%0.55452%0.52SS*.Hα-helixtrans-64.2-42177.3-69.1162.6000110.7A449 K450 Q456 K457A449-I453 WeakPolarHBondContact O-CG1 3.5Å; A449-I453 PolarHBondContact O-N 3.18Å; K450-I453 PolarHBondContact O-N 3.27Å; I453-Q456 PolarHBondContact O-N 3.42Å; I453-K457 WeakPolarHBondContact O-CB 3.44Å; I453-K457 PolarHBondContact O-N 3.26Å
454E96.5Very high93.4Very high91 Ų91110 Ų11043%0.42553%0.531SS..Hα-helixtrans-62.1-49.1176.6-167.2-168.5173.800111.8K450 Q451 Q456 K457 R458K450-E454 PolarHBondContact O-N 3.45Å; Q451-E454 PolarHBondContact O-N 2.75Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; E454-Q456 PolarHBondContact O-N 2.97Å; E454-K457 WeakPolarHBondContact O-CB 3.43Å; E454-K457 PolarHBondContact O-N 3.18Å; E454-K457 VanDerWaalsContact O-N 3.13Å; E454-R458 WeakPolarHBondContact O-CG 3.43Å; E454-R458 PolarHBondContact O-N 2.9Å; E454-R458 IonicContact OE1-CZ 2.62Å; E454-R458 VanDerWaalsContact OE1-CZ 3.3Å; E454-R458 IonicContact OE1-NE 3.16Å; E454-R458 PolarHBondContact OE1-NE 2.74Å; E454-R458 VanDerWaalsContact OE1-NE 3.16Å; E454-R458 IonicContact OE1-NH2 3.96Å; E454-R458 PolarHBondContact OE1-NH2 3.25Å
455L95.6Very high92.2Very high100 Ų100113.4 Ų113.452%0.52454%0.54SS..Hα-helixtrans-62.2-40.8177.5-69.4173000111.5Q451 K452 K457 R458 L459Q451-L455 WeakPolarHBondContact O-CB 3.49Å; Q451-L455 WeakPolarHBondContact O-CG 3.38Å; Q451-L455 PolarHBondContact O-N 3.27Å; K452-L455 PolarHBondContact O-N 3.33Å; L455-K457 VanDerWaalsContact C-N 3.34Å; L455-K457 PolarHBondContact O-N 2.89Å; L455-R458 PolarHBondContact O-N 3.41Å; L455-L459 WeakPolarHBondContact O-CB 3.17Å; L455-L459 WeakPolarHBondContact O-CG 3.36Å; L455-L459 PolarHBondContact O-N 2.74Å
456Q95.1Very high90.8Very high96 Ų96118.6 Ų118.645%0.44955%0.552SS.*Hα-helixtrans-63.7-36.5173.3-75.3-179.4-24.300112.6K452 I453 E454 K460K452-Q456 WeakPolarHBondContact O-CB 3.29Å; K452-Q456 VanDerWaalsContact O-CG 3.27Å; K452-Q456 WeakPolarHBondContact O-CG 3.38Å; K452-Q456 PolarHBondContact O-N 2.92Å; I453-Q456 PolarHBondContact O-N 3.42Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; E454-Q456 PolarHBondContact O-N 2.97Å; Q456-K460 WeakPolarHBondContact O-CB 3.36Å; Q456-K460 WeakPolarHBondContact O-CG 3.28Å; Q456-K460 PolarHBondContact O-N 3.07Å
457K95.4Very high88.6Confident133 Ų133121.5 Ų121.558%0.57857%0.566SS**Hα-helixtrans-65.7-45.2173.9-175.1178.9179.2-179.40111.4I453 E454 L455 K460 Q461I453-K457 WeakPolarHBondContact O-CB 3.44Å; I453-K457 PolarHBondContact O-N 3.26Å; E454-K457 WeakPolarHBondContact O-CB 3.43Å; E454-K457 PolarHBondContact O-N 3.18Å; E454-K457 VanDerWaalsContact O-N 3.13Å; L455-K457 VanDerWaalsContact C-N 3.34Å; L455-K457 PolarHBondContact O-N 2.89Å; K457-K460 PolarHBondContact O-N 3.1Å; K457-Q461 WeakPolarHBondContact O-CG 3.42Å; K457-Q461 PolarHBondContact O-N 2.92Å
458R94.3Very high86Confident134 Ų134119 Ų11951%0.50657%0.565SS.*Hα-helixtrans-60.2-44.8174.8-67.6176.4-175.4-153.44.9111.3E454 L455 Q461 L462E454-R458 WeakPolarHBondContact O-CG 3.43Å; E454-R458 PolarHBondContact O-N 2.9Å; E454-R458 IonicContact OE1-CZ 2.62Å; E454-R458 VanDerWaalsContact OE1-CZ 3.3Å; E454-R458 IonicContact OE1-NE 3.16Å; E454-R458 PolarHBondContact OE1-NE 2.74Å; E454-R458 VanDerWaalsContact OE1-NE 3.16Å; E454-R458 IonicContact OE1-NH2 3.96Å; E454-R458 PolarHBondContact OE1-NH2 3.25Å; L455-R458 PolarHBondContact O-N 3.41Å; R458-Q461 PolarHBondContact O-N 2.9Å; R458-L462 WeakPolarHBondContact O-CG 3.19Å; R458-L462 PolarHBondContact O-N 3.38Å
459L94.4Very high83.5Confident117 Ų117119 Ų11961%0.61357%0.571SS**Hα-helixtrans-61-45.2175.7-73171.6000112.2L455 Q461 L462 S463L455-L459 WeakPolarHBondContact O-CB 3.17Å; L455-L459 WeakPolarHBondContact O-CG 3.36Å; L455-L459 PolarHBondContact O-N 2.74Å; L459-Q461 VanDerWaalsContact C-N 3.33Å; L459-Q461 PolarHBondContact O-N 3.43Å; L459-L462 PolarHBondContact O-N 3.11Å; L459-S463 PolarHBondContact O-N 2.75Å; L459-S463 PolarHBondContact O-OG 3.19Å
460K93.2Very high81.1Confident156 Ų156123 Ų12368%0.67859%0.594SS**Hα-helixtrans-61.9-37.1175.6-76.1179.4177.1-1730113Q456 K457 S463 L464Q456-K460 WeakPolarHBondContact O-CB 3.36Å; Q456-K460 WeakPolarHBondContact O-CG 3.28Å; Q456-K460 PolarHBondContact O-N 3.07Å; K457-K460 PolarHBondContact O-N 3.1Å; K460-S463 WeakPolarHBondContact CA-OG 3.49Å; K460-S463 PolarHBondContact O-OG 2.96Å; K460-L464 WeakPolarHBondContact O-CB 3.26Å; K460-L464 PolarHBondContact O-N 3.37Å
461Q90.1Very high78.5Confident114 Ų114123.7 Ų123.753%0.53361%0.607SS.*Hα-helixtrans-67.1-41.3174.7-72.8170.9-3100111.7K457 R458 L459 L464 R465K457-Q461 WeakPolarHBondContact O-CG 3.42Å; K457-Q461 PolarHBondContact O-N 2.92Å; R458-Q461 PolarHBondContact O-N 2.9Å; L459-Q461 VanDerWaalsContact C-N 3.33Å; L459-Q461 PolarHBondContact O-N 3.43Å; Q461-L464 PolarHBondContact O-N 2.82Å; Q461-R465 WeakPolarHBondContact O-CB 3.19Å; Q461-R465 PolarHBondContact O-N 2.93Å
462L86.6Confident76Confident105 Ų105126 Ų12655%0.5562%0.623SS.*Hα-helixtrans-70.5-34177.7-69.2172.5000113R458 L459 R466R458-L462 WeakPolarHBondContact O-CG 3.19Å; R458-L462 PolarHBondContact O-N 3.38Å; L459-L462 PolarHBondContact O-N 3.11Å; L462-R466 PolarHBondContact O-N 2.76Å
463S82.8Confident73.5Confident70 Ų70127 Ų12749%0.4963%0.629SS.*Hα-helixtrans-69-43.8172.5620000111.4L459 K460 R465 R466 E467L459-S463 PolarHBondContact O-N 2.75Å; L459-S463 PolarHBondContact O-OG 3.19Å; K460-S463 WeakPolarHBondContact CA-OG 3.49Å; K460-S463 PolarHBondContact O-OG 2.96Å; S463-R465 VanDerWaalsContact C-N 3.33Å; S463-R465 PolarHBondContact O-N 2.89Å; S463-R466 WeakPolarHBondContact O-CB 3.44Å; S463-R466 PolarHBondContact O-N 3Å; S463-E467 PolarHBondContact O-N 2.81Å
464L78.1Confident70.8Confident130 Ų130129 Ų12968%0.68164%0.637SS**Hα-helixtrans-62.9-38.8178.4-164.870.5000111.9K460 Q461 R466 E467K460-L464 WeakPolarHBondContact O-CB 3.26Å; K460-L464 PolarHBondContact O-N 3.37Å; Q461-L464 PolarHBondContact O-N 2.82Å; L464-R466 PolarHBondContact O-N 2.88Å; L464-E467 PolarHBondContact O-N 2.81Å
465R68.8Low68Low204 Ų204130.8 Ų130.877%0.7765%0.647SS**Hα-helixtrans-65-21.2172.9-173.9176.5-179.9-151.9-1.3113.6Q461 S463 S468Q461-R465 WeakPolarHBondContact O-CB 3.19Å; Q461-R465 PolarHBondContact O-N 2.93Å; S463-R465 VanDerWaalsContact C-N 3.33Å; S463-R465 PolarHBondContact O-N 2.89Å; R465-S468 PolarHBondContact O-OG 2.81Å
466R68.2Low65.7Low223 Ų223133.1 Ų133.184%0.84266%0.659SS**Hα-helixtrans-89.5-13.8177.3-163.6-177.8-69.6167.7-4.3112.7L462 S463 L464L462-R466 PolarHBondContact O-N 2.76Å; S463-R466 WeakPolarHBondContact O-CB 3.44Å; S463-R466 PolarHBondContact O-N 3Å; L464-R466 PolarHBondContact O-N 2.88Å
467E48.1Very low63.4Low153 Ų153134 Ų13472%0.71567%0.673SS**Hα-helixtrans-98.8-10.2-176.3-134.6-87.7131.700113S463 L464 P469S463-E467 PolarHBondContact O-N 2.81Å; L464-E467 PolarHBondContact O-N 2.81Å; E467-P469 VanDerWaalsContact O-CD 3.23Å; E467-P469 WeakPolarHBondContact O-CD 3.49Å
468S43Very low60.6Low82 Ų82136.2 Ų136.257%0.57369%0.685SS**SBendtrans-71.711316856.10000110.6R465R465-S468 PolarHBondContact O-OG 2.81Å
469P42.7Very low58.2Low100 Ų100134.1 Ų134.165%0.64970%0.696SS**  trans-70.9153.6178.130.9-35.8000111.4E467 T471E467-P469 VanDerWaalsContact O-CD 3.23Å; E467-P469 WeakPolarHBondContact O-CD 3.49Å; P469-T471 PolarHBondContact O-N 3.09Å
470P43.8Very low55.6Low127 Ų127133.9 Ų133.983%0.82570%0.696SS**  trans-75.492.2174.231.3-33.6000110.6D472P470-D472 PolarHBondContact O-N 2.85Å; P470-D472 VanDerWaalsContact O-N 3.15Å
471T42.3Very low53.2Low129 Ų129135.1 Ų135.179%0.79170%0.701SS**  trans-77.791.3162.7-53.30000108.5P469P469-T471 PolarHBondContact O-N 3.09Å
472D44Very low50.8Low141 Ų141133.8 Ų133.875%0.75471%0.71SS**  trans-81.7164.4171-145.8-29.4000111P470P470-D472 PolarHBondContact O-N 2.85Å; P470-D472 VanDerWaalsContact O-N 3.15Å
473Q43.9Very low48.2Very low153 Ų153135.9 Ų135.972%0.71573%0.726SS**  trans72137.9-165.7-50.2-179.963.800113.7
474Q40.1Very low45.7Very low152 Ų152137.6 Ų137.671%0.7174%0.738SS**  cis-158.9166.90.9-123.6-179.784.100107.3
475I38.1Very low43.6Very low127 Ų127140.2 Ų140.265%0.65175%0.751SS**  cis-151.9168.17.8-167.3172.9000108.5
476I47.2Very low41.8Very low149 Ų149134.9 Ų134.976%0.76475%0.751SS**  trans-88.7128.9166.1-61.1167.7000110.3
477P45.9Very low40.1Very low114 Ų114130.5 Ų130.574%0.7475%0.749SS**  trans-107.2136.6150.3-7.227.5000111.5
478Q37.1Very low39.3Very low181 Ų181129.1 Ų129.185%0.84675%0.751SS**  trans-107.1124.8-174.9176.4172.1-19.600112.6
479A43.5Very low38.8Very low89 Ų89129 Ų12974%0.73676%0.755SS**  trans66.6162.4154.200000121.2
480D40.5Very low38.3Very low112 Ų112130.2 Ų130.260%0.59976%0.761SS**  trans64.694.6152.7-173.140.1000120.1
481K42.8Very low37.8Very low182 Ų182130.5 Ų130.579%0.79176%0.761SS**  -144.2144106.1-65.9-51.3153.9-1570111.7
482A38.7Very low37.2Very low86 Ų86128.8 Ų128.871%0.71176%0.76SS**  trans-102.6145.4172.900000111.8
483V33.5Very low37.4Very low149 Ų149127.8 Ų127.890%0.90376%0.761SS**  trans-138.3135.2155.8175.30000108
484C30Very low37.7Very low107 Ų107125.8 Ų125.872%0.72376%0.761SS**  trans-85.5157.1-176.4-50.90000112.2
485L33Very low37.5Very low184 Ų184125 Ų12596%0.96377%0.766SS**  trans-152.1109.3144.5-139.372.5000110
486A31.6Very low37.3Very low93 Ų93123.6 Ų123.677%0.76977%0.774SS**  trans-142.7112.1-17900000110.8
487T33Very low36.7Very low131 Ų131120.8 Ų120.880%0.80477%0.773SS**  trans-179.3137.3-175.3-85.70000107.6
488T31.7Very low36Very low124 Ų124121.5 Ų121.576%0.76178%0.781SS**  cis-163.4150.9-17.834.10000106.5
489A31.1Very low35.7Very low79 Ų79116.6 Ų116.665%0.65378%0.779SS**  cis-169.8-172.2-15.700000108.3
490T33Very low35.6Very low126 Ų126120.4 Ų120.477%0.77378%0.781SS**  trans37.6116.9149.7-35.40000118.6
491T33.2Very low35.6Very low133 Ų133123 Ų12382%0.81679%0.794SS**  -152.416569.438.80000115.6
492A30.1Very low35.2Very low93 Ų93117.6 Ų117.677%0.76979%0.791SS**  trans81.198.1157.600000122
493P47.3Very low35.1Very low120 Ų120120.2 Ų120.278%0.77980%0.798SS**  trans-99.7-168.9151.942.1-33.8000110.5
494P50.1Low35.4Very low111 Ų111118.9 Ų118.972%0.72179%0.791SS**  cis-142.3161.39.943.1-23.4000120.3
495T36.1Very low35.9Very low134 Ų134120.5 Ų120.582%0.82279%0.791SS**  trans31.8121.5135.6-46.30000123.3
496A34.4Very low35.9Very low98 Ų98118 Ų11881%0.8178%0.778SS**  170.1171.112300000112.3
497A34.5Very low36.2Very low91 Ų91122.3 Ų122.375%0.75278%0.779SS**  -176.4143.3-60.300000110.9
498S31.8Very low36Very low129 Ų129122.8 Ų122.890%0.90278%0.777SS**  trans68.1155.5164.3-154.40000119.6
499G29.9Very low36.2Very low77 Ų77121 Ų12179%0.79477%0.774SS**  trans165.456.7-174.400000113.4
500H42.1Very low36.2Very low170 Ų170120.7 Ų120.779%0.78778%0.78SS**  trans-72162.7178.2-130.861.3000112.3
501N39.7Very low36.3Very low165 Ų165122.9 Ų122.988%0.88279%0.786SS**  trans169.4103.9143.8-87.5-23.9000114.4
502G33.9Very low36.2Very low70 Ų70121.6 Ų121.672%0.72279%0.79SS**  trans63178151.900000119.4
503T38.1Very low36.2Very low140 Ų140123 Ų12386%0.85979%0.792SS**  cis-151152.7-25.9-77.10000108.6
504T38Very low35.5Very low121 Ų121122 Ų12274%0.74279%0.794SS**  trans-55.3168.8-178.1-21.50000116.6
505I41.7Very low34.7Very low142 Ų142123.5 Ų123.573%0.72880%0.802SS**  trans115115.1135.4-98.7175.8000120.3
506L33.3Very low34.4Very low131 Ų131120 Ų12069%0.68679%0.792SS**  trans68.9122.6145.8-53.3175.6000124.3
507F36.9Very low34.2Very low184 Ų184124.1 Ų124.181%0.80779%0.794SS**  trans53.9157.6130.6-73.9-91.6000121.3
508D30.3Very low33.9Very low140 Ų140126.5 Ų126.575%0.74979%0.794SS**  cis-148.4170.5-1.1-170.727.6000111.2
509A34.6Very low33.8Very low86 Ų86126.6 Ų126.671%0.71179%0.789SS**  trans73.3135.3154.200000119.4
510G31.8Very low34Very low74 Ų74128.1 Ų128.176%0.76378%0.783SS**  cis171.9119-8.600000111.7
511N34.2Very low33.4Very low171 Ų171126.6 Ų126.691%0.91479%0.785SS**  trans-138.688.3-179.7-159.757.2000110.5C513N511-C513 PolarHBondContact O-N 3.4Å
512A32.6Very low33Very low107 Ų107125.1 Ų125.188%0.88478%0.776SS**  trans-79.4109.7-17100000112.4
513C29.1Very low32.9Very low122 Ų122128.9 Ų128.982%0.82478%0.78SS**  trans-87.9134.4156.5-173.70000108.6N511N511-C513 PolarHBondContact O-N 3.4Å
514A32.5Very low32.6Very low98 Ų98131.3 Ų131.381%0.8178%0.778SS**  trans-102.8143.5-179.100000112
515T33.4Very low32.4Very low144 Ų144131.2 Ų131.288%0.88378%0.778SS**  trans-104.6145.5-161.2-53.60000114.3
516G30.5Very low31.9Very low61 Ų61131.9 Ų131.963%0.62978%0.783SS**  trans-172.7119.1158.800000109.5
517Q29.8Very low31.6Very low183 Ų183129.3 Ų129.386%0.85579%0.789SS**  62.6131.476.9-74-166.1-7.400113.5
518L27.9Very low31.3Very low142 Ų142124.2 Ų124.274%0.74379%0.787SS**  cis-165.5164.8-3.2-170.170000110.6
519T30.4Very low31.4Very low131 Ų131122.2 Ų122.280%0.80479%0.791SS**  trans86.7153.6149.64.40000122.4
520T32.4Very low31.1Very low109 Ų109125.6 Ų125.667%0.66980%0.802SS**  trans-107.7141.9-165.4-58.10000113.8I522T520-I522 HydrophobicContact CG2-CD1 3.92Å; T520-I522 HydrophobicContact CG2-CG1 4Å
521V31.3Very low31Very low137 Ų137126.4 Ų126.483%0.8380%0.802SS**  trans-167.1133.6141.4-95.10000106.9
522I31.3Very low30.9Very low135 Ų135122.8 Ų122.869%0.69280%0.796SS**  cis81.683.138.4-54.4176.2000114.4T520T520-I522 HydrophobicContact CG2-CD1 3.92Å; T520-I522 HydrophobicContact CG2-CG1 4Å
523N31.4Very low30.8Very low149 Ų149122.1 Ų122.180%0.79779%0.791SS**  trans166.1135.9136.6-89.6-12.3000108.9
524K31Very low30.8Very low190 Ų190122 Ų12283%0.82679%0.791SS**  cis85.365.95.8-149.3-174.4-177-178.10119.2
525T33.2Very low30.8Very low119 Ų119121 Ų12173%0.7378%0.778SS**  trans-153.2130.4143.629.50000107
526N32.7Very low30.5Very low156 Ų156123.3 Ų123.383%0.83478%0.776SS**  61.6133.571-58.1-6000112.4
527G26.8Very low30.5Very low78 Ų78128.5 Ų128.580%0.80478%0.783SS**  cis165.9170.8-1.600000111.5
528G29.7Very low30.5Very low76 Ų76126.6 Ų126.678%0.78478%0.779SS**  trans91.1126.3-175.300000112.3
529A31.8Very low30.7Very low99 Ų99122.9 Ų122.982%0.81878%0.775SS**  cis72.8103.815.700000116.5
530T29.1Very low30.8Very low156 Ų156123.1 Ų123.196%0.95777%0.771SS**  trans-167.5165.1135.8-72.30000107.3
531A30.9Very low31.1Very low91 Ų91125.3 Ų125.375%0.75277%0.774SS**  trans-122.9179.9-159.600000115.4
532A30.8Very low31.1Very low96 Ų96125.2 Ų125.279%0.79377%0.774SS**  trans90.1122.415200000121.3
533A30.2Very low31.2Very low93 Ų93122.3 Ų122.377%0.76978%0.777SS**  trans66.2108.6130.200000122.9
534S30.3Very low31.2Very low118 Ų118119 Ų11983%0.82578%0.778SS**  81.7150.3121-156.70000122
535S31.7Very low31.3Very low77 Ų77114.1 Ų114.154%0.53877%0.773SS.*  trans77.1108.5144.9177.70000121.8
536K28.4Very low31.3Very low193 Ų193114.7 Ų114.784%0.83978%0.776SS**  trans71.3127.9142.4-61.6168.2-161.3169.10116.8
537H29.4Very low31.4Very low171 Ų171112.6 Ų112.679%0.79277%0.769SS**  cis99.9136.946.5-171.4-45.1000111.8
538N30.8Very low31.5Very low142 Ų142114.7 Ų114.776%0.75977%0.767SS**  trans82.5144.2172.7-13638.4000115.5
539G31.3Very low31.6Very low64 Ų64118.2 Ų118.266%0.6677%0.767SS**  cis-137.7-160.8-7.500000110.5
540N33.1Very low31.8Very low136 Ų136119.7 Ų119.773%0.72777%0.766SS**  cis-162.1133.117.1-169.759.3000112
541H37.3Very low32.6Very low156 Ų156118 Ų11872%0.72276%0.757SS**  trans34.5136.8149.5-68.8-113.6000121.3
542T32.2Very low32.8Very low135 Ų135118.2 Ų118.283%0.82876%0.759SS**  -161.1138.857.7-54.40000107.8
543G32.5Very low32.7Very low74 Ų74122.6 Ų122.676%0.76377%0.766SS**  cis99.9127.541.500000109.2
544G31.6Very low32.7Very low79 Ų79121.4 Ų121.481%0.81476%0.762SS**  cis-169.4-172.8-4.100000108.4
545A33.6Very low32.6Very low87 Ų87122.7 Ų122.772%0.71976%0.758SS**  cis-165.5173.5-2.400000111.4
546T33.8Very low32.4Very low131 Ų131127 Ų12780%0.80477%0.773SS**  trans62.9142.5158.557.70000120.2
547T33.8Very low32.6Very low112 Ų112123.5 Ų123.569%0.68777%0.767SS**  cis-161.6134.3-1526.50000106.5
548T29.4Very low32.8Very low123 Ų123123.4 Ų123.476%0.75577%0.771SS**  46.2144.782.148.80000116
549L30.8Very low32.8Very low149 Ų149124.9 Ų124.978%0.7877%0.771SS**  cis-154.11679.4-133.4-180000111
550T37.8Very low32.8Very low131 Ų131129.3 Ų129.380%0.80478%0.779SS**  trans-122.7125.7167.6-48.90000111.2
551P44.2Very low32.7Very low119 Ų119125.8 Ų125.877%0.77378%0.775SS**  trans-140.6179.5141.435.9-19.9000112.9
552A36.5Very low32.4Very low96 Ų96127 Ų12779%0.79379%0.787SS**  trans-122.2152.3-175.600000113.2
553M29.1Very low32.3Very low188 Ų188123.3 Ų123.393%0.92678%0.776SS**  trans-167.8158.9151.6-106.2175.273.300109.8
554G28.9Very low32.4Very low68 Ų68125.1 Ų125.170%0.70178%0.777SS**  trans-117.3-144.9-170.700000115.3
555I28.2Very low32.6Very low145 Ų145128.7 Ų128.774%0.74478%0.777SS**  trans109.2126.4169.3-60.3171.8000116.6
556M28.8Very low32.6Very low169 Ų169128.4 Ų128.483%0.83378%0.783SS**  trans62.2165.7163.1-76.5-173-71.800120.8
557T31.9Very low32.5Very low119 Ų119128.9 Ų128.973%0.7378%0.78SS**  cis177.1110.1-46.2-86.30000108.2
558I32.7Very low32.4Very low168 Ų168131.9 Ų131.986%0.86279%0.789SS**  trans-148.5127.4162.1-52.9179.8000105.9
559K32.2Very low32.5Very low174 Ų174133.1 Ų133.176%0.75779%0.79SS**  cis91.459.721-16559.8-179.2-174.90116.2
560N31.1Very low32.4Very low156 Ų156130.6 Ų130.683%0.83479%0.79SS**  trans178.6159.3136.9-94.2-4.6000110
561G29.5Very low32Very low63 Ų63132.2 Ų132.265%0.64979%0.793SS**  cis145.1109.2-9.400000113.6
562N31.5Very low31.4Very low180 Ų180131 Ų13196%0.96379%0.787SS**  trans60.3157.6-178.6-856.3000117.1
563G30.5Very low31.6Very low59 Ų59132.8 Ų132.861%0.60879%0.791SS**  cis156.3134.3-12.500000114.5
564S33.7Very low31.7Very low111 Ų111130.6 Ų130.678%0.77679%0.788SS**  trans67.5149.1169.5-45.20000116.1
565N36.7Very low31.8Very low155 Ų155130.8 Ų130.883%0.82979%0.79SS**  cis-153.7147.827.6-70.9-85.2000112.9
566G33.1Very low31.8Very low81 Ų81127.2 Ų127.284%0.83579%0.789SS**  trans71.2157.2149.900000118.9
567N33.2Very low32Very low140 Ų140127.4 Ų127.475%0.74979%0.787SS**  cis-151.9141.1-12-170.732.8000110.4
568M29.9Very low31.9Very low175 Ų175128.7 Ų128.786%0.86279%0.79SS**  trans-97.9137.3165.4-74.6-165.8-65.300109.4
569L33Very low32Very low149 Ų149128 Ų12878%0.7878%0.783SS**  trans-133.7117162.4-84.7172.6000110.5
570A28.4Very low31.8Very low96 Ų96127 Ų12779%0.79378%0.781SS**  trans-79.9152.7161.300000109.4
571I29.9Very low31.7Very low165 Ų165125.7 Ų125.785%0.84677%0.773SS**  trans-125.1113.2172.9-60.4-179.5000108.5
572S29.8Very low31.7Very low93 Ų93129.8 Ų129.865%0.6578%0.775SS**  trans-76.7154.9171.7-60.90000111.2T574S572-T574 PolarHBondContact O-N 3.46Å
573P40.7Very low31.7Very low135 Ų135127.7 Ų127.788%0.87776%0.759SS**  trans-66.6131.6177.528.5-35.1000111
574T32Very low31.7Very low141 Ų141132 Ų13287%0.86576%0.763SS**  trans-128.1137.6174.4-55.40000108.6S572S572-T574 PolarHBondContact O-N 3.46Å
575G31.6Very low31.6Very low72 Ų72135.6 Ų135.674%0.74277%0.767SS**  trans-119.3149.6-178.300000113.5
576G28.3Very low31.5Very low71 Ų71136.1 Ų136.173%0.73277%0.771SS**  trans170.8163.3164.300000111.5
577H32.4Very low31.4Very low172 Ų172135.5 Ų135.580%0.79676%0.764SS**  cis174119.2-21.8-117.6112.2000104.9
578N30.3Very low31.6Very low146 Ų146134.6 Ų134.678%0.78177%0.768SS**  trans-168.6107.1152.6-99.8-21000106.4
579H33.6Very low32.5Very low154 Ų154132.1 Ų132.171%0.71377%0.766SS**  77.7119.981.2-82.6121.1000113.1
580Q29.2Very low32.4Very low153 Ų153130.1 Ų130.172%0.71577%0.77SS**  -178.495.1111.1-165.366.534.500112.2
581L28.5Very low32.4Very low128 Ų128129.3 Ų129.367%0.6777%0.771SS**  trans63.7156.7163.5-49173.1000116
582H30.4Very low32.7Very low150 Ų150127 Ų12769%0.69477%0.77SS**  cis-159.3174.4-9.9-112.9163.6000105.8
583Q31Very low33.5Very low135 Ų135128.8 Ų128.863%0.63178%0.779SS**  cis-151.5-1643.6-125.1-71.7-15.300107.2
584H31Very low33.3Very low149 Ų149127.9 Ų127.969%0.6978%0.776SS**  trans-108.7148.7-179.1-58.5-105.4000113.2
585H30.8Very low33.2Very low187 Ų187124.5 Ų124.587%0.86677%0.769SS**  173.9164.5102.8-95.9-71.8000112.8
586N35.4Very low33.3Very low167 Ų167129.3 Ų129.389%0.89378%0.776SS**  trans-127.2135.3-177.6-176.847.7000108.8
587G29.6Very low33.4Very low67 Ų67129.3 Ų129.369%0.69178%0.776SS**  trans-178.3141.1-177.300000117
588S37.1Very low33.4Very low121 Ų121125.7 Ų125.785%0.84678%0.776SS**  trans-137.6170.7162.5-580000105.9
589P49Very low33.6Very low124 Ų124125.1 Ų125.181%0.80578%0.778SS**  cis-140.8-157.412.543.7-23.7000114.5
590A30.9Very low33.7Very low106 Ų106124.5 Ų124.588%0.87679%0.785SS**  trans81.7146.115700000119.9
591G29.5Very low33.8Very low79 Ų79121.1 Ų121.181%0.81479%0.791SS**  trans141.382.1169.900000116
592S35.2Very low34Very low117 Ų117119.5 Ų119.582%0.81880%0.796SS**  trans-96.1156.1160.7-540000109.8
593P47.3Very low34.2Very low130 Ų130119.3 Ų119.384%0.84481%0.805SS**  -147-177.910138.9-22.7000115
594S36.2Very low34.5Very low117 Ų117119.8 Ų119.882%0.81881%0.811SS**  trans-109.8158.4-172.5-52.50000114.6
595G30.6Very low34.6Very low69 Ų69118.7 Ų118.771%0.71182%0.815SS**  trans-177.5121.6163.100000108.1
596I33.8Very low34.6Very low174 Ų174121.6 Ų121.689%0.89282%0.818SS**  cis82.2120.132.6-49171.6000112.9
597G28.9Very low34.3Very low70 Ų70117.3 Ų117.372%0.72281%0.814SS**  trans112.4104.2-17400000111.4
598A32.6Very low34.6Very low97 Ų97119.6 Ų119.680%0.80282%0.819SS**  cis82.4106.724.400000116
599T36.1Very low35.1Very low134 Ų134119.4 Ų119.482%0.82282%0.815SS**  trans-170.4119.8140.729.90000112.9
600T35.3Very low34.6Very low141 Ų141119.6 Ų119.687%0.86581%0.814SS**  trans28.3131.9140.257.50000123.2
601G31.3Very low35.4Very low81 Ų81119.8 Ų119.884%0.83581%0.806SS**  trans178.5111.4153.100000112.2
602A33Very low35.4Very low94 Ų94121.5 Ų121.578%0.77781%0.806SS**  trans-142.3145.3-174.100000113.5
603T33.2Very low35.5Very low146 Ų146122.2 Ų122.290%0.89681%0.805SS**  trans-147151.4168.2-62.10000108.3
604I37.2Very low35.3Very low145 Ų145122 Ų12274%0.74480%0.804SS**  trans-127166.4-153.2-47.1177000111.4
605T33.1Very low35.3Very low127 Ų127121.6 Ų121.678%0.77980%0.802SS**  trans90.2148.2165.980.60000115.5
606R31.4Very low35.7Very low247 Ų247124.4 Ų124.493%0.93281%0.807SS**  cis-156.1152.49.5-151.9173.8-179.3-178.3-0.3111.6
607G30Very low35.4Very low78 Ų78121.1 Ų121.180%0.80480%0.8SS**  trans109.796.6151.400000118.8
608S34.8Very low35.9Very low114 Ų114123.9 Ų123.980%0.79781%0.805SS**  trans-88.9178.5154.755.90000109.8
609P48.2Very low35.8Very low118 Ų118125.2 Ų125.277%0.76681%0.808SS**  cis-144.3-179.51745.3-25.6000118.3
610T38.6Very low35.5Very low128 Ų128124.2 Ų124.279%0.78581%0.807SS**  trans-93.8-171.616155.90000109.6
611P47.4Very low35.3Very low109 Ų109123.2 Ų123.271%0.70881%0.806SS**  cis-140.1-159.83.637.9-13.8000115.4
612S29.8Very low35.5Very low115 Ų115125 Ų12580%0.80481%0.805SS**  trans102127.5150.4-58.70000120.3
613T35.8Very low35.8Very low132 Ų132126.6 Ų126.681%0.8181%0.811SS**  trans-89.7156.4166.152.30000111.1
614P44Very low35.7Very low125 Ų125123.2 Ų123.281%0.81280%0.804SS**  -149.4173.696.239.9-23.8000115.7
615S35.4Very low35.5Very low110 Ų110123.4 Ų123.477%0.76981%0.812SS**  trans-81.1162.4163.3-45.20000111.1
616P40Very low35.4Very low128 Ų128122.9 Ų122.983%0.83181%0.814SS**  -153.6-166.69141.9-22.4000116
617S27.6Very low35.4Very low105 Ų105119.7 Ų119.773%0.73481%0.814SS**  trans-64.8160.8-173.7-420000117.4
618P39.8Very low35.4Very low127 Ų127121.1 Ų121.183%0.82581%0.812SS**  trans-82.5150.3167.634.7-34.6000113.1
619S28.7Very low35.3Very low125 Ų125122.7 Ų122.787%0.87482%0.817SS**  trans-141.1156.9174-78.80000112.4
620S30.3Very low34.5Very low114 Ų114122.3 Ų122.380%0.79782%0.817SS**  trans-48.7137.9-169.3-46.30000119.1
621S31.7Very low34.2Very low120 Ų120126.2 Ų126.284%0.83982%0.824SS**  trans-170.3128.3133.1-790000108.4
622S34.9Very low33.4Very low118 Ų118130.1 Ų130.183%0.82584%0.835SS**  cis9674.932.8-172.80000114.5
623S39.4Very low33.3Very low128 Ų128128.6 Ų128.690%0.89584%0.837SS**  trans-159.9145.6152.652.50000110.7
624G32.4Very low32.8Very low74 Ų74125.7 Ų125.776%0.76383%0.833SS**  cis155.240.8-8.300000117.1
625V32Very low32Very low150 Ų150125.4 Ų125.491%0.90983%0.834SS**  trans-142.8137.8168.9-81.80000111.8
626S31.2Very low31.8Very low116 Ų116126 Ų12681%0.81184%0.838SS**  trans-96.3155.5179.1-49.50000111.6
627L30.5Very low31.4Very low179 Ų179125.8 Ų125.894%0.93784%0.84SS**  trans-164.6135.1132.2-105.9172000109.9
628S31.5Very low31.5Very low108 Ų108126.2 Ų126.276%0.75584%0.843SS**  trans-103.9139-173.9-51.30000111.9
629T32.8Very low31.1Very low147 Ų147125.6 Ų125.690%0.90284%0.842SS**  trans-150.3156145.429.40000109.3
630S31.2Very low31.2Very low111 Ų111125.1 Ų125.178%0.77684%0.838SS**  trans-153.1137.2-164.949.40000112.6
631F30.9Very low31.3Very low210 Ų210125.6 Ų125.692%0.92184%0.841SS**  trans-158.4166.6155.646.4-93.4000111.2
632M31Very low31.3Very low191 Ų191125.7 Ų125.794%0.94184%0.842SS**  trans-101.9159.7-162.3-65.2160.250.500113.8
633G27.6Very low31.3Very low82 Ų82126 Ų12685%0.84584%0.844SS**  trans138.5133.8160.400000112.9
634G26.3Very low30.9Very low71 Ų71126 Ų12673%0.73284%0.844SS**  cis152.9118.8-6.900000112.2
635S27Very low31Very low120 Ų120128.1 Ų128.184%0.83985%0.848SS**  trans57121.5160.2-56.20000119.6
636S30.8Very low31Very low121 Ų121127.1 Ų127.185%0.84685%0.847SS**  trans-155.783.5148.8-83.70000110.4
637S31Very low31.1Very low125 Ų125126.5 Ų126.587%0.87484%0.843SS**  trans-113.8111.4169.8-57.10000108.1
638S30.4Very low31.2Very low113 Ų113123.1 Ų123.179%0.7983%0.834SS**  trans-123.1117.3-178.7-63.50000109.7
639S31.6Very low31.2Very low115 Ų115124.3 Ų124.380%0.80484%0.842SS**  trans-158170.6178-73.40000108.6
640S30.1Very low31.3Very low115 Ų115123 Ų12380%0.80484%0.839SS**  trans75.395.5176.2-46.60000115.6
641S33.8Very low31.2Very low123 Ų123123.2 Ų123.286%0.8684%0.841SS**  trans-46.9148.5142.950.70000112.7
642S31.1Very low31.4Very low123 Ų123119.1 Ų119.186%0.8684%0.838SS**  trans-139.3144.7156.357.40000110.2
643S34.2Very low31.3Very low123 Ų123115.8 Ų115.886%0.8683%0.834SS**  trans-124.9138-179.952.30000109.8
644S31.7Very low31.5Very low129 Ų129117.2 Ų117.290%0.90283%0.831SS**  trans-147144.3173.651.20000110.2
645S35.1Very low31.7Very low119 Ų119119.6 Ų119.683%0.83284%0.836SS**  trans-124134.5-173.255.10000110.3
646S31Very low32Very low129 Ų129119.3 Ų119.390%0.90283%0.834SS**  trans-142.8162.9169.657.20000110.3
647S33Very low32.9Very low103 Ų103119.2 Ų119.272%0.7283%0.831SS**  trans-125.6151.1-156.2550000114.2
648S34.2Very low32.9Very low108 Ų108118.6 Ų118.676%0.75582%0.822SS**  trans50.2113.1145.561.80000119.5
649S30.4Very low33Very low132 Ų132121.2 Ų121.292%0.92382%0.822SS**  trans-158.4153.4130.332.30000110.6
650S34.1Very low33Very low119 Ų119124.3 Ų124.383%0.83282%0.824SS**  trans-123.7134-178.554.40000109.8
651S30.8Very low33.1Very low116 Ų116126.5 Ų126.581%0.81182%0.821SS**  trans-143139.7167.851.20000110.4
652S34Very low33Very low124 Ų124128.4 Ų128.487%0.86782%0.816SS**  trans-125.3116.7-179.3-550000108.4
653S28.7Very low33Very low122 Ų122129.6 Ų129.685%0.85381%0.811SS**  trans-137.9101.2179.3-61.40000110.8
654S33.1Very low32.9Very low112 Ų112131.3 Ų131.378%0.78381%0.809SS**  trans-77143.5161.851.30000110.6
655S29.8Very low32.8Very low120 Ų120131.3 Ų131.384%0.83980%0.804SS**  trans-171.5132.1142.9-83.80000113.6
656S33.5Very low33.4Very low114 Ų114131.1 Ų131.180%0.79780%0.8SS**  trans-120.9178.4148.7-54.10000105.5
657P50.3Low33.3Very low119 Ų119131.3 Ų131.377%0.77380%0.796SS**  cis-118.1-155.42.523.14.1000110.6
658T30.3Very low33.3Very low113 Ų113130.4 Ų130.469%0.69379%0.794SS**  cis-163.5143.435.443.50000115.6
659Q32Very low33Very low168 Ų168132 Ų13279%0.78580%0.8SS**  trans27.8126.7138.1-56.1-171.149.400123.8
660Q32Very low33.1Very low180 Ų180129.7 Ų129.784%0.84179%0.789SS**  -167.2121.5113.1-97.9168.711.200107.8
661Q31.8Very low33.1Very low161 Ų161135.6 Ų135.675%0.75279%0.793SS**  57.6130.896.3-66.3-171-100114.3
662Q32.1Very low33.2Very low163 Ų163134.2 Ų134.276%0.76278%0.784SS**  cis-145.8147.428.5-70.3-177.6-15.400116.1
663I30.7Very low33.5Very low147 Ų147135.4 Ų135.475%0.75479%0.785SS**  trans39.3125.1134.1-43165.7000121.3
664I31.3Very low33.8Very low159 Ų159132.7 Ų132.782%0.81578%0.776SS**  173.6146.5124.4-88162.6000110.3
665T30.6Very low34.1Very low130 Ų130135.6 Ų135.680%0.79878%0.782SS**  trans-129.2148.2173.5-17.50000109
666P46.9Very low34.3Very low114 Ų114137 Ų13774%0.7477%0.773SS**  -155.7167.691.940.3-20.6000118.8
667T29.4Very low34.5Very low134 Ų134139.1 Ų139.182%0.82277%0.768SS**  trans-21.8149.6155.8-270000120.9
668A32.9Very low34Very low83 Ų83141.9 Ų141.969%0.68677%0.77SS**  136.4141.4112.800000121.1
669T29.2Very low33.9Very low142 Ų142140.4 Ų140.487%0.87178%0.778SS**  trans85158.6141.7-58.20000121.6
670A31.6Very low34Very low84 Ų84136.3 Ų136.369%0.69478%0.781SS**  trans-144.9-163.2-169.700000112.1
671R34.2Very low34.2Very low242 Ų242133.2 Ų133.291%0.91379%0.786SS**  trans90.1163.6177.5-59.1176174179.1-2.2115.7
672S33.3Very low34.2Very low88 Ų88129.3 Ų129.362%0.61579%0.789SS**  cis-179.4169.8-32.863.60000111.3
673V40Very low34Very low148 Ų148127 Ų12790%0.89780%0.797SS**  trans63.1159.4164.1-55.80000118.8
674G34.6Very low34Very low65 Ų65124.4 Ų124.467%0.6780%0.798SS**  cis164.5-173.2-8.700000114
675L39.1Very low34.1Very low173 Ų173123.4 Ų123.491%0.90680%0.799SS**  trans83.6152.4163-53.8-174.2000119.5
676K35.5Very low35.2Very low150 Ų150122.9 Ų122.965%0.65280%0.798SS**  cis-176.1117.9-12.8164.8115.5-172.41770116.9
677F36Very low34.5Very low159 Ų159122.6 Ų122.670%0.69781%0.805SS**  trans66.5172.9147.4-69.2-114.2000121.8
678H39.7Very low34.5Very low176 Ų176120.3 Ų120.382%0.81581%0.808SS**  cis-161.7159.310.9-121.9132.4000114.1
679G29.7Very low34.4Very low82 Ų82120.4 Ų120.485%0.84582%0.818SS**  trans152.6169164.600000115.6
680G33.2Very low34.4Very low82 Ų82117.4 Ų117.485%0.84582%0.815SS**  cis-156.6-78.4-0.900000116.2
681A35.4Very low34.5Very low116 Ų116119 Ų11996%0.95982%0.821SS**  trans91153.117700000122.2
682G32.1Very low34.5Very low78 Ų78114.5 Ų114.580%0.80482%0.82SS**  trans148.1144.4157.800000122
683A29Very low34.6Very low114 Ų114118.5 Ų118.594%0.94284%0.835SS**  trans74.1155158.100000123.8
684A30.1Very low34.1Very low94 Ų94114.8 Ų114.878%0.77783%0.826SS**  trans-173.5179.4176.400000115.6
685V33.2Very low33.8Very low137 Ų137120.9 Ų120.983%0.8383%0.834SS**  trans78.4145.8155.3153.70000120.3
686P53.3Low33.6Very low119 Ų119122 Ų12277%0.77384%0.835SS**  cis-140.8179.3-2941.8-22.9000117.8
687A32.6Very low33.5Very low108 Ų108122.8 Ų122.889%0.89384%0.841SS**  trans-154.9169.6165.300000111.4
688G29.8Very low33.5Very low86 Ų86118.9 Ų118.989%0.88784%0.838SS**  cis-168.9-48.7-0.200000117.6
689G30.5Very low33.3Very low86 Ų86117.8 Ų117.889%0.88784%0.838SS**  trans124.7169.1-171.800000113.1
690G30Very low33.6Very low79 Ų79122.3 Ų122.381%0.81483%0.834SS**  cis179.2132.2-8.500000113.2
691S33Very low33.8Very low118 Ų118125.5 Ų125.583%0.82583%0.832SS**  trans6.2140171.1-55.60000124.3
692V34.4Very low34.1Very low147 Ų147131.3 Ų131.389%0.89183%0.829SS**  -171.2167106.4-87.40000112.9
693N35.8Very low34.2Very low172 Ų172134 Ų13492%0.9283%0.825SS**  trans-100.7162.3-168-61.3-41.6000115.3
694G29.8Very low34.5Very low69 Ų69139.9 Ų139.971%0.71182%0.824SS**  trans-177.881.2169.600000119
695F28.3Very low34.9Very low193 Ų193141.1 Ų141.185%0.84682%0.822SS**  trans25.8127.8154.8-76.2-94.9000123.2
696H34.9Very low35Very low197 Ų197144 Ų14491%0.91282%0.824SS**  trans-125.2146.9148.1-79.3-27.5000110.3
697Q33.6Very low34.3Very low167 Ų167145.6 Ų145.678%0.7883%0.826SS**  trans-114.3144.9-170.9-170.270.859.900112.2
698A35Very low34.5Very low77 Ų77152.2 Ų152.264%0.63683%0.827SS**  trans-33.8135.9174.200000116.3
699D34.8Very low35Very low153 Ų153155.1 Ų155.182%0.81882%0.822SS**  93.316862.5-158.13.3000111.8
700K36Very low35.3Very low176 Ų176156.6 Ų156.677%0.76582%0.819SS**  trans93.9135.8-171.1-60.5172.8-175.5175.40115.2
701D38.5Very low35.8Very low149 Ų149157.9 Ų157.980%0.79782%0.821SS**  cis-148.1154.9-9.3-98.1-39.2000110.4
702R42.4Very low35.9Very low239 Ų239155.9 Ų155.990%0.90282%0.82SS**  trans-120143.3174.7-96.5-178.1169.9176.6-2.1111.2
703N33.7Very low36.5Very low134 Ų134155.7 Ų155.772%0.71782%0.819SS**  trans65.1111.5155.8-173.617.9000118.6
704Y34.3Very low37Very low237 Ų237154.1 Ų154.193%0.92982%0.815SS**  trans-143.4110143.1-91.1-76.4000110.7
705T39.1Very low37.7Very low120 Ų120155.3 Ų155.374%0.73682%0.819SS**  trans-142.193.3165.9-60.20000110.1
706F35.3Very low38.5Very low199 Ų199159 Ų15987%0.87384%0.839SS**  trans-163.7155.9156.1-115.2-72.6000111.7
707L38.7Very low38.7Very low152 Ų152157.2 Ų157.280%0.79684%0.835SS**  trans61.896.2164.9-61.1173.8000118.9
708R36.3Very low39Very low247 Ų247156.6 Ų156.693%0.93284%0.838SS**  -146.8134.4120.6-163.9162.363.9-150.9-0.7110.3
709L41Very low39.2Very low147 Ų147161.1 Ų161.177%0.7785%0.849SS**  trans-125165-176.3-104.1161.6000110
710S37.4Very low39.5Very low117 Ų117161.5 Ų161.582%0.81885%0.851SS**  trans70.1145.9173.4-57.20000115.5
711A38.6Very low39.7Very low105 Ų105160.6 Ų160.687%0.86886%0.856SS**  cis-147.3172.7-2.800000110.3
712G35.7Very low39.8Very low77 Ų77161.4 Ų161.479%0.79486%0.86SS**  trans14560.7162.600000117.3
713T46.7Very low39.6Very low142 Ų142155.9 Ų155.987%0.87186%0.857SS**  trans-96.7126.3167.2-20.70000110
714T47.7Very low40Very low139 Ų139157.5 Ų157.585%0.85387%0.868SS**  trans-142.7139166.1-590000109.3
715A44.5Very low40.5Very low94 Ų94150.9 Ų150.978%0.77786%0.863SS**  trans-136.2141.2168.300000109.7
716Q45.1Very low40.6Very low272 Ų272153.7 Ų153.7100%1.27188%0.875SS**  trans-143.80153.1-78.3-160.7-2400107.2

Retrieved 716 of 716 residues in 109.3 ms (Link to these results)