A0A096NWA9_PAPAN Loading...

Transcription factor 4

AlphaFold DB (A0A1B0GVB8), UniProt , Accession A0A096NWA9, Species PAPAN (Papio anubis, Olive baboon), Gene TCF4, Length 631 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.6Very low41.4Very low246 Ų246167.2 Ų167.2100%1.21288%0.88SS**  01560-69.2179.6176.900108.5
2H36.7Very low42Very low178 Ų178165.1 Ų165.182%0.82488%0.879SS**  trans-61.7156.6172.7-92.7-156.1000111.9
3H40.3Very low42.4Very low200 Ų200160.2 Ų160.293%0.92685%0.853SS**  trans-116.8147.4145.3-116.559.1000109.1
4Q39.3Very low43.5Very low179 Ų179160.1 Ų160.184%0.83684%0.842SS**  trans-110152.1-150-159170.51800112.3
5Q44.4Very low44.3Very low182 Ų182159.5 Ų159.585%0.8583%0.833SS**  trans-58.6142.5174.1-64.7164.7-65.400111.5
6R40.2Very low45Very low235 Ų235156.3 Ų156.389%0.88782%0.816SS**  trans-144.699.2146.2-165.1171.5-63.2-150.82.5110.4
7M40.9Very low45.7Very low183 Ų183150.7 Ų150.790%0.90179%0.793SS**  trans-65134.9160.1-71.7-84.2-81.600108.2
8A40.7Very low46.5Very low86 Ų86149 Ų14971%0.71179%0.785SS**  trans-131.7116.7166.900000107.4
9A47.6Very low47.2Very low106 Ų106148.3 Ų148.388%0.87678%0.781SS**PPolyproline II helixtrans-74128.7173.100000108.9
10L42.5Very low48Very low169 Ų169147.5 Ų147.589%0.88578%0.776SS**PPolyproline II helixtrans-101.5147.2165.8-68.6174.3000108.7
11G45.7Very low48.6Very low75 Ų75144.8 Ų144.877%0.77376%0.763SS**PPolyproline II helixtrans-67.4156.3-160.200000114.7D13G11-D13 PolarHBondContact O-N 3.25Å; G11-D13 VanDerWaalsContact O-N 3.13Å
12T49Very low49.9Very low142 Ų142139.5 Ų139.587%0.87173%0.733SS**  trans-62.5107.9163.749.10000109.1K14T12-K14 PolarHBondContact O-N 3.21Å
13D47.3Very low50.8Low101 Ų101135.2 Ų135.254%0.5472%0.723SS.*  trans-65.4121.6170.4-167.6-20.2000109.1G11 E15 L16G11-D13 PolarHBondContact O-N 3.25Å; G11-D13 VanDerWaalsContact O-N 3.13Å; D13-E15 PolarHBondContact OD1-N 2.99Å; D13-E15 VanDerWaalsContact OD1-N 3.17Å; D13-L16 HydrophobicContact CB-CD1 4.1Å; D13-L16 HydrophobicContact CB-CG 4.26Å
14K57.1Low51.6Low159 Ų159130.1 Ų130.169%0.69172%0.716SS**SBendtrans-89.6-19.8-169.7-155.6175.8-177.6-174.60112.3T12 L16 S17T12-K14 PolarHBondContact O-N 3.21Å; K14-L16 VanDerWaalsContact C-N 3.3Å; K14-S17 PolarHBondContact O-N 3.47Å; K14-S17 PolarHBondContact O-OG 3.35Å
15E55.8Low52.5Low152 Ų152127.7 Ų127.771%0.7171%0.706SS**Hα-helixtrans-76.4-24.2179.9-58.4-175.1178.900111D13 L19D13-E15 PolarHBondContact OD1-N 2.99Å; D13-E15 VanDerWaalsContact OD1-N 3.17Å; E15-L19 PolarHBondContact O-N 2.89Å
16L56.4Low53.2Low108 Ų108126.9 Ų126.957%0.56570%0.7SS**Hα-helixtrans-72.9-25.1173.4-62.7-178.3000113.9D13 K14D13-L16 HydrophobicContact CB-CD1 4.1Å; D13-L16 HydrophobicContact CB-CG 4.26Å; K14-L16 VanDerWaalsContact C-N 3.3Å
17S56.8Low53.8Low61 Ų61121.1 Ų121.143%0.42770%0.696SS.*Hα-helixtrans-73.3-40.5173.226.20000112.2K14 L19 L20 D21K14-S17 PolarHBondContact O-N 3.47Å; K14-S17 PolarHBondContact O-OG 3.35Å; S17-L19 VanDerWaalsContact C-N 3.29Å; S17-L19 PolarHBondContact O-N 2.73Å; S17-L20 PolarHBondContact O-N 3.46Å; S17-D21 PolarHBondContact O-N 3.07Å
18D59.6Low54.4Low120 Ų120117.4 Ų117.464%0.64269%0.685SS**Hα-helixtrans-70.8-27.9-175-64.33.7000111.5L20 D21D18-L20 PolarHBondContact O-N 3.34Å; D18-D21 PolarHBondContact O-N 2.79Å
19L59.6Low54.7Low135 Ų135119.4 Ų119.471%0.70769%0.691SS**THydrogen-bonded Turntrans-69.6-9170.3-79168.4000114.7E15 S17E15-L19 PolarHBondContact O-N 2.89Å; S17-L19 VanDerWaalsContact C-N 3.29Å; S17-L19 PolarHBondContact O-N 2.73Å
20L64.4Low54.8Low132 Ų132121 Ų12169%0.69169%0.69SS**THydrogen-bonded Turntrans-111.7-7178.3-65.2173.9000113.1S17 D18 F22S17-L20 PolarHBondContact O-N 3.46Å; D18-L20 PolarHBondContact O-N 3.34Å; L20-F22 PolarHBondContact O-N 3.03Å
21D59.6Low55Low92 Ų92118.6 Ų118.649%0.49269%0.687SS.*  trans-87.285.7179.7-171.116.6000112.9S17 D18 S23S17-D21 PolarHBondContact O-N 3.07Å; D18-D21 PolarHBondContact O-N 2.79Å; D21-S23 PolarHBondContact O-N 3.35Å; D21-S23 WeakPolarHBondContact OD1-CB 3.46Å; D21-S23 PolarHBondContact OD1-N 3.36Å; D21-S23 PolarHBondContact OD1-OG 3.07Å
22F63.3Low54.7Low135 Ų135120.5 Ų120.559%0.59269%0.688SS**G310 helixtrans-71.60.7173.7-64-70000114.5L20 A24 M25L20-F22 PolarHBondContact O-N 3.03Å; F22-A24 PolarHBondContact O-N 3.45Å; F22-A24 VanDerWaalsContact O-N 3.16Å; F22-M25 HydrophobicContact CB-CE 4.42Å; F22-M25 HydrophobicContact CD1-CE 3.63Å; F22-M25 HydrophobicContact CD1-SD 4.32Å; F22-M25 HydrophobicContact CE1-CE 4.37Å; F22-M25 HydrophobicContact CG-CE 4.41Å; F22-M25 PolarHBondContact O-N 3.03Å
23S56.9Low54.2Low88 Ų88117 Ų11762%0.61568%0.68SS**G310 helixtrans-60.7-26.7-177.4-53.80000113.3D21 M25D21-S23 PolarHBondContact O-N 3.35Å; D21-S23 WeakPolarHBondContact OD1-CB 3.46Å; D21-S23 PolarHBondContact OD1-N 3.36Å; D21-S23 PolarHBondContact OD1-OG 3.07Å; S23-M25 VanDerWaalsContact C-N 3.25Å; S23-M25 PolarHBondContact O-N 3.24Å
24A56.9Low53.7Low93 Ų93121.5 Ų121.577%0.76970%0.695SS**G310 helixtrans-68.6-17.8176.600000114.2F22F22-A24 PolarHBondContact O-N 3.45Å; F22-A24 VanDerWaalsContact O-N 3.16Å
25M57.2Low52.7Low127 Ų127121.7 Ų121.763%0.62670%0.703SS**G310 helixtrans-89.9-14.3-177.5-56.3-160.8-45.700114.2F22 S23F22-M25 HydrophobicContact CB-CE 4.42Å; F22-M25 HydrophobicContact CD1-CE 3.63Å; F22-M25 HydrophobicContact CD1-SD 4.32Å; F22-M25 HydrophobicContact CE1-CE 4.37Å; F22-M25 HydrophobicContact CG-CE 4.41Å; F22-M25 PolarHBondContact O-N 3.03Å; S23-M25 VanDerWaalsContact C-N 3.25Å; S23-M25 PolarHBondContact O-N 3.24Å
26F59.9Low51.8Low166 Ų166117.8 Ų117.873%0.72870%0.704SS**  trans-132.583.8-175.6-71.9-79.8000111.7P28F26-P28 WeakPolarHBondContact O-CD 3.48Å
27S51.6Low51.6Low114 Ų114118.8 Ų118.880%0.79772%0.717SS**PPolyproline II helixtrans-59.6120.6170.9-58.60000111
28P55.1Low50.5Low104 Ų104122.2 Ų122.268%0.67574%0.736SS**PPolyproline II helixtrans-67.6153171.628.9-34.2000110.7F26 V30F26-P28 WeakPolarHBondContact O-CD 3.48Å; P28-V30 PolarHBondContact O-N 3.48Å
29P47.3Very low49.3Very low129 Ų129121.9 Ų121.984%0.83874%0.742SS**PPolyproline II helixtrans-63.9121.1-17825.6-34.1000111.5S31P29-S31 PolarHBondContact O-N 3.08Å
30V49.7Very low48.3Very low140 Ų140123.3 Ų123.385%0.84875%0.75SS**  trans-75.2103.2-175-75.20000112.6P28 S32P28-V30 PolarHBondContact O-N 3.48Å; V30-S32 PolarHBondContact O-N 3.3Å; V30-S32 VanDerWaalsContact O-N 3.08Å
31S46.2Very low46.6Very low118 Ų118121.7 Ų121.783%0.82576%0.756SS**  trans-74.193.6168.558.70000110.6P29 G33P29-S31 PolarHBondContact O-N 3.08Å; S31-G33 PolarHBondContact O-N 3.39Å
32S38.5Very low45.1Very low114 Ų114123.3 Ų123.380%0.79777%0.774SS**  trans-72.964.4-178.3179.10000113.8V30V30-S32 PolarHBondContact O-N 3.3Å; V30-S32 VanDerWaalsContact O-N 3.08Å
33G38.1Very low43.6Very low68 Ų68120 Ų12070%0.70178%0.778SS**  trans-90.2107167.400000111S31S31-G33 PolarHBondContact O-N 3.39Å
34K37Very low42.5Very low197 Ų197123.7 Ų123.786%0.85779%0.785SS**  trans-105.878-165-167.6174.3179.7177.90113
35N37.3Very low41.3Very low162 Ų162127.9 Ų127.987%0.86679%0.787SS**  trans-85.1115.2171.2-64.920.5000109.3
36G37.2Very low40Very low70 Ų70128.2 Ų128.272%0.72280%0.796SS**  trans-72.5159.3-176.700000114.7
37P50.9Low38.6Very low130 Ų130123.9 Ų123.984%0.84480%0.798SS**  trans-100.9173.5-166.940.2-37.3000114.6
38T34.7Very low37.9Very low133 Ų133123.7 Ų123.782%0.81680%0.797SS**  trans-131.7102.3170.4370000113.2
39S35.1Very low36.9Very low112 Ų112125.1 Ų125.178%0.78380%0.799SS**  trans65.6151.3149.2-59.60000118.9
40L37.4Very low36.4Very low166 Ų166123.6 Ų123.687%0.86979%0.787SS**  cis-139.2147.730.5-75.8160.2000115
41A28.5Very low35.9Very low98 Ų98124 Ų12481%0.8178%0.78SS**  trans38.6126.8146.600000120.4
42S28.6Very low35.4Very low126 Ų126123.6 Ų123.688%0.88177%0.768SS**  -175.2161.963.9-173.80000111.3
43G32.1Very low35.4Very low66 Ų66126.8 Ų126.868%0.6876%0.763SS**  trans131.341.9159.600000122.9
44H34.4Very low35.2Very low164 Ų164126.4 Ų126.476%0.75975%0.749SS**  trans42.5126.6148.8-73-94.4000124.9
45F31.7Very low35.1Very low182 Ų182122.3 Ų122.380%0.79875%0.745SS**  trans92128.4139.1-85-57.2000125.2
46T29.8Very low35Very low133 Ų133119.8 Ų119.882%0.81674%0.74SS**  trans67.9119.2149.253.60000124.4
47G30.6Very low34.7Very low75 Ų75120.3 Ų120.377%0.77375%0.746SS**  trans98.4102.8149.400000116.6
48S36.2Very low33.7Very low111 Ų111118.7 Ų118.778%0.77674%0.738SS**  76.9128.860-161.90000112.7
49N33Very low33.5Very low133 Ų133124.4 Ų124.471%0.71175%0.745SS**  cis-161.3153.813.5-136.421.3000114.5
50V37.6Very low33.3Very low97 Ų97123 Ų12359%0.58875%0.747SS**  trans14.3169.2142.3-52.70000123.3
51E38.4Very low33Very low150 Ų150123.3 Ų123.370%0.70175%0.75SS**  cis-163.2138.4-0.4-130.246.8142.300105.4
52D36Very low33.1Very low108 Ų108122.1 Ų122.158%0.57875%0.747SS**  59.3118.579.5-175.839.9000117.1
53R38.6Very low33.2Very low181 Ų181119.9 Ų119.968%0.68374%0.744SS**BIsolated β-bridge168.6149.7116.3-89.3177-179.1-146.6-6.9119.8T303R53-T303 PolarHBondContact N-O 3.34Å; R53-T303 CarbonylContact O-C 3.11Å; R53-T303 WeakPolarHBondContact O-CA 3.5Å; R53-T303 PolarHBondContact O-N 3.42Å; R53-T303 VanDerWaalsContact O-O 3.05Å; R53-T303 PolarHBondContact O-OG1 3.4Å
54S34.9Very low33.5Very low61 Ų61126 Ų12643%0.42775%0.754SS.*  trans-96.5157.3178.3-41.10000116.6N301 G302 T303S54-N301 WeakPolarHBondContact CB-O 3.47Å; S54-N301 PolarHBondContact OG-O 3.2Å; S54-G302 WeakPolarHBondContact OG-CA 3.4Å; S54-T303 WeakPolarHBondContact CA-OG1 3.42Å
55S34.2Very low33.8Very low110 Ų110124 Ų12477%0.76976%0.756SS**  trans162.9159.6142-79.90000113.1
56S35.9Very low34Very low109 Ų109121.1 Ų121.176%0.76276%0.758SS**  cis-174.4135.9-2257.50000112.8
57G29.7Very low34.7Very low81 Ų81120.3 Ų120.384%0.83576%0.756SS**  trans71.1-179.4158.300000119
58S29.5Very low34.7Very low97 Ų97121.4 Ų121.468%0.67875%0.751SS**  cis-171.9160.9-31.6-1700000110.9
59W31.3Very low34.5Very low253 Ų253126.3 Ų126.396%0.95875%0.753SS**  trans74.1145170.4-52.695.1000119.5
60G30Very low34.3Very low81 Ų81127.3 Ų127.384%0.83576%0.758SS**  trans136.6119169.700000113.5
61N31.1Very low33.9Very low174 Ų174133 Ų13393%0.9377%0.771SS**  trans-141.4138.4-179-177.424.3000112.3
62G31.7Very low33.5Very low72 Ų72129.4 Ų129.474%0.74277%0.774SS**  trans106.8137.4158.500000117.2
63G29.7Very low33.1Very low80 Ų80132.5 Ų132.583%0.82579%0.79SS**  trans121.9106.2159.500000116.5
64H39Very low32.5Very low194 Ų194126.9 Ų126.990%0.89879%0.789SS**  trans-79.1152.3156.8-52.1-91.8000108.9
65P41.7Very low32.3Very low121 Ų121130.3 Ų130.379%0.78681%0.808SS**  -149.9175.990.339.9-23.4000115.5
66S34.8Very low33Very low122 Ų122129.7 Ų129.785%0.85380%0.801SS**  trans-116.9133.9170.9-51.90000111.4
67P44.6Very low32.6Very low117 Ų117134.2 Ų134.276%0.7680%0.803SS**  trans-142.6171.1140.138.4-25000112.4
68S30.6Very low32.5Very low98 Ų98136.4 Ų136.469%0.68580%0.795SS**  cis-176.4159.8-33.4670000108.7
69R31.2Very low32.6Very low214 Ų214139 Ų13981%0.80880%0.796SS**  trans74.6129.4160-64.8-178.4171.9-138.6-3.3120.3
70N29.9Very low32.7Very low154 Ų154134.2 Ų134.282%0.82479%0.786SS**  trans-66.4158.2152.1-63.5-34.3000111.3
71Y30Very low33Very low217 Ų217136.2 Ų136.285%0.85178%0.783SS**  trans-122.9137.4134.2-95.7-83.5000108.5
72G29Very low33Very low74 Ų74132.6 Ų132.676%0.76377%0.771SS**  trans-122.6142.3162.400000107.7
73D26.9Very low33.1Very low172 Ų172139.5 Ų139.592%0.9278%0.775SS**  trans-139.4147.8168.6-168.46.4000107.2
74G27.3Very low33.1Very low64 Ų64142.4 Ų142.466%0.6677%0.771SS**  trans160.994.2-171.900000115.5
75T31.2Very low33.1Very low133 Ų133141.3 Ų141.382%0.81677%0.771SS**  trans-149.1168.2155.365.10000107.3
76P47.7Very low32.6Very low97 Ų97139.5 Ų139.563%0.6377%0.774SS**  cis-133.7173.7-2.341.7-26.4000115.6
77Y28.5Very low32.5Very low204 Ų204138.4 Ų138.480%0.877%0.767SS**  trans66153.3161.4-64.6-62.8000118.4
78D28Very low31.8Very low126 Ų126141.9 Ų141.967%0.67477%0.773SS**  cis-148.4166.1-0.5-136.7-28.6000115.7
79H31.3Very low32Very low151 Ų151143.6 Ų143.670%0.69977%0.774SS**  trans8127.8154.9-108.2-97.4000122.5
80M32.1Very low32Very low154 Ų154140.1 Ų140.176%0.75977%0.771SS**  175.3149.2106.2-92.1-65.5168.900114.2
81T37.6Very low32.1Very low123 Ų123139.6 Ų139.676%0.75577%0.768SS**  trans23115.6162.756.30000120.1
82S30.4Very low32Very low98 Ų98134.5 Ų134.569%0.68576%0.764SS**  cis88.5102.541.1-174.80000116.7
83R33.3Very low32.7Very low217 Ų217136.1 Ų136.182%0.81976%0.761SS**  trans70.1157.9142.5-71.6-175.6-172.5-179.22.4118.8
84D29.7Very low33.5Very low141 Ų141133.9 Ų133.975%0.75476%0.756SS**  cis-136.4167.914.2-120.9-37.3000115.7
85L39.1Very low33.7Very low170 Ų170138.6 Ų138.689%0.8976%0.758SS**  trans-110.4147.2167-78.3162.2000109
86G32.7Very low34.2Very low83 Ų83139.5 Ų139.586%0.85676%0.763SS**  trans-179.157.5-179.500000117.7
87S31.1Very low33.2Very low100 Ų100140.9 Ų140.970%0.69977%0.766SS**  trans-91.6132.7162.6-177.60000110.4
88H31.4Very low33.3Very low190 Ų190137 Ų13788%0.8877%0.768SS**  trans-158.1125.2156.4-93.2-60.1000111
89D34Very low33.4Very low134 Ų134141.2 Ų141.272%0.71778%0.775SS**  trans-68.9158.3172.7-51-98.8000112.8
90N30.2Very low33.9Very low140 Ų140142 Ų14275%0.74978%0.782SS**  176.1134.6113.5-98-80.2000114.6
91L32.9Very low33.9Very low144 Ų144141.8 Ų141.875%0.75478%0.78SS**  trans62.9105.4140.9-63.2165.4000123
92S28.2Very low33.5Very low110 Ų110141.8 Ų141.877%0.76979%0.785SS**  81.5148.9129.8-61.30000121.7
93P42.7Very low33.5Very low107 Ų107145.4 Ų145.470%0.69579%0.788SS**PPolyproline II helixtrans-102.5164.8-169.340.5-36.7000115.2
94P44.6Very low33.5Very low126 Ų126141 Ų14182%0.81879%0.786SS**PPolyproline II helixtrans-81.3146.4169.833.4-34.2000112.9
95F31.3Very low33.6Very low162 Ų162143.5 Ų143.571%0.71179%0.793SS**PPolyproline II helixtrans-85.4150.2167.5-76-107.1000111.2
96V41.1Very low33.2Very low152 Ų152147.3 Ų147.392%0.92180%0.795SS**  trans-129.8144.5149.7-76.10000109.6
97N27.7Very low33.1Very low126 Ų126146.4 Ų146.467%0.67479%0.786SS**  trans-139.6139.2-171-164.7-10.7000108.2
98S29.3Very low32.9Very low123 Ų123147.2 Ų147.286%0.8679%0.792SS**  trans-145.5125.8179-830000111.1
99R30.4Very low32.8Very low214 Ų214148.3 Ų148.381%0.80879%0.79SS**  trans-140.5119.1178.2171.9-171.4-87.3-149.6-5.4110.4
100I41.3Very low32.4Very low168 Ų168146.2 Ų146.286%0.86279%0.785SS**  trans-132.7100.8159.3-58.8173.8000104.4
101Q32Very low32.3Very low149 Ų149144.2 Ų144.270%0.69678%0.782SS**  53.98579.4-75.9-148.742.200115.1
102S30Very low32.2Very low123 Ų123148.4 Ų148.486%0.8679%0.79SS**  trans-122.8166.2142590000108.7
103K30.7Very low32.2Very low175 Ų175146.4 Ų146.476%0.76179%0.786SS**  trans-128.9139.8-160.4-87.5180175.2175.80113.2
104T32.7Very low31.6Very low125 Ų125151.9 Ų151.977%0.76779%0.793SS**  trans61.5127.4139.5-45.80000116.4
105E31.6Very low30.9Very low193 Ų193152 Ų15290%0.90278%0.783SS**  -144.2-17269.9-87.5-176.8171.300115.2
106R32.1Very low30.8Very low249 Ų249150.5 Ų150.594%0.9479%0.792SS**  trans-149.7124.6-159.4-175.9-168.9-171-159.74.9115
107G29.2Very low30.2Very low65 Ų65150.8 Ų150.867%0.6779%0.788SS**  trans-173.7134.5161.300000108.7
108S27.8Very low30.4Very low116 Ų116151.5 Ų151.581%0.81179%0.792SS**  65.3126.856.3-64.10000111.7
109Y28.3Very low30.5Very low214 Ų214154.8 Ų154.884%0.83979%0.793SS**  cis-162.5167.620-160.6-105.8000112.5
110S26.7Very low30.4Very low90 Ų90148.4 Ų148.463%0.62980%0.795SS**  trans58.8146173-74.70000119.6
111S27.6Very low29.9Very low98 Ų98145.6 Ų145.669%0.68579%0.788SS**  cis104.781.811.8-174.90000117.1
112Y30.8Very low29.9Very low232 Ų232146 Ų14691%0.9179%0.79SS**  trans-150.6148.4144.1-63.3-73.4000107.8
113G28.5Very low30Very low67 Ų67147.7 Ų147.769%0.69178%0.784SS**  cis10881-700000114.8
114R30.3Very low30Very low222 Ų222146.7 Ų146.784%0.83878%0.783SS**  trans-162.6134.3141.4-92.9-133.5-179.6-114.6-7.4114.2
115E29.2Very low29.8Very low130 Ų130145.2 Ų145.261%0.60778%0.777SS**  trans-61.9169.1161.661.9-67.7149.200114.9
116S29.6Very low30Very low130 Ų130142.8 Ų142.891%0.90977%0.769SS**  trans-136.4108.3156.3-1640000109.8
117N28.8Very low30.3Very low157 Ų157138.9 Ų138.984%0.8477%0.766SS**  trans-143.2139.6169.4-165.9-4.5000107.3
118L31.5Very low30.3Very low142 Ų142139.5 Ų139.574%0.74377%0.773SS**  trans-116.799.5-160.5179.976000111.1
119Q32.2Very low30.4Very low191 Ų191137.7 Ų137.789%0.89377%0.772SS**  trans-172.7144.1153.1-1248185.900110.8
120G28.9Very low30.6Very low81 Ų81134.9 Ų134.984%0.83577%0.772SS**  trans132.5126.1165.200000115.8
121C29.6Very low31Very low108 Ų108139.6 Ų139.673%0.7379%0.786SS**  trans-151.3162.8164.8-156.30000110
122H32.6Very low30.9Very low159 Ų159141.4 Ų141.474%0.73679%0.789SS**  trans70.9113.7-169.3-44.9-67.5000112.6
123Q32.1Very low31Very low158 Ų158138.8 Ų138.874%0.73879%0.786SS**  71.2140.966.1-66.4-160.963.100112.5
124Q29.6Very low31.1Very low154 Ų154139.6 Ų139.672%0.7280%0.795SS**  cis-163.7165.120.9-144171.952.100112.5
125S29.4Very low31.2Very low93 Ų93136.1 Ų136.165%0.6579%0.793SS**  trans64.9164.8150.7-69.20000120.6
126L35.7Very low31.9Very low142 Ų142135.7 Ų135.774%0.74380%0.802SS**  cis-172.1146.4-43.2-120.1162.7000109.2
127L37.3Very low32Very low167 Ų167132.6 Ų132.687%0.87479%0.791SS**  trans65.1161.3172.5-50.9170.4000116.2
128G30.3Very low32.1Very low78 Ų78131 Ų13180%0.80479%0.786SS**  cis132.1105.3-11.100000114.7
129G30.4Very low32.1Very low78 Ų78132.2 Ų132.280%0.80479%0.793SS**  trans163.3152.3172.800000115.4
130D31.7Very low32.1Very low156 Ų156128.4 Ų128.483%0.83479%0.787SS**  trans-111.6176.6-169.6-67.8-92.5000114.9
131M34.2Very low33Very low188 Ų188130 Ų13093%0.92678%0.783SS**  trans76.4153.1166-54.1-171.6-166.100118
132D26.7Very low33.1Very low137 Ų137131.6 Ų131.673%0.73379%0.79SS**  cis-166.3165.4-28.3179.935.5000108.9
133M32.1Very low33.1Very low176 Ų176133.3 Ų133.387%0.86780%0.795SS**  trans60.7134.5159.2-100.8-168.4176.500121.1
134G31.2Very low33.5Very low85 Ų85132 Ų13288%0.87680%0.8SS**  trans151.783.6158.200000118
135N32.3Very low33.6Very low148 Ų148128 Ų12879%0.79180%0.8SS**  trans-139.6134.6166171.938.7000108.8G137N135-G137 PolarHBondContact OD1-N 3.02Å
136P44.6Very low33.8Very low122 Ų122128.5 Ų128.579%0.79280%0.804SS**  -153.3117115.634.4-14.4000117.1
137G31.6Very low33.7Very low65 Ų65128.4 Ų128.467%0.6780%0.799SS**  trans69.3-171.314800000118.3N135N135-G137 PolarHBondContact OD1-N 3.02Å
138T29.6Very low33.5Very low123 Ų123131 Ų13176%0.75580%0.799SS**  cis-153.5143.4-148.70000113.1
139L32.7Very low33.5Very low168 Ų168135.5 Ų135.588%0.8879%0.793SS**  trans58.2132.3144-60.1167.8000122.8
140S31.6Very low33.4Very low111 Ų111137.6 Ų137.678%0.77678%0.782SS**  trans-91.4159.8155.3-460000110.8
141P47.9Very low33.4Very low113 Ų113138.8 Ų138.873%0.73478%0.776SS**  -162.1174.2101.139-17.7000119.8
142T32Very low33.2Very low143 Ų143135 Ų13588%0.87777%0.768SS**  trans79.4163.8145.137.10000124.4
143K33.2Very low33.4Very low195 Ų195134 Ų13485%0.84877%0.772SS**  trans-133.4158.6-169.5-90.3-168.8178-176.10113.4
144P39.5Very low33.5Very low130 Ų130132.1 Ų132.184%0.84477%0.765SS**  trans-110.3-171.6140.426-8.1000111.6
145G31.6Very low33.5Very low69 Ų69135.7 Ų135.771%0.71176%0.764SS**  cis-157.1-59.81.100000115
146S33.2Very low34Very low105 Ų105134.2 Ų134.273%0.73476%0.763SS**  trans78.2166.5-173.4-147.60000113.8
147Q34.7Very low33.4Very low139 Ų139139.6 Ų139.665%0.6577%0.767SS**  cis-153.8165.729.9-90.2-68-200113.5
148Y32.8Very low33.3Very low221 Ų221145.7 Ų145.787%0.86777%0.77SS**  trans171.193.6133.5-102.3-72.7000114.1
149Y30.8Very low33.5Very low174 Ų174149.8 Ų149.868%0.68277%0.771SS**  42.6141.6129.4-84.5-116000121.8
150Q26.9Very low33.7Very low121 Ų121147.2 Ų147.257%0.56577%0.765SS**  cis-171.2118.38.4-178.270.6-13.900115.3
151Y31.7Very low33.4Very low181 Ų181149.6 Ų149.671%0.7177%0.768SS**  trans54.9162.4148-75.6-113.6000121.9
152S30.1Very low32.4Very low110 Ų110152 Ų15277%0.76977%0.769SS**  cis-130.8173.86.3-60.90000110.5
153S31.5Very low32Very low116 Ų116149.8 Ų149.881%0.81176%0.76SS**  cis-148.2-179.52159.20000113.8
154N33.2Very low31.6Very low136 Ų136146 Ų14673%0.72776%0.758SS**  trans-104160.5-154.8-63.3-36.6000117
155N32.2Very low31.1Very low160 Ų160143.3 Ų143.386%0.85675%0.746SS**  trans-150.7119.6142.8-151.9-9.3000112.3
156P42.3Very low31.1Very low117 Ų117147.9 Ų147.976%0.7675%0.751SS**  trans-98.1-178.5-169.838-36.6000116
157R32.3Very low30.9Very low235 Ų235151.1 Ų151.189%0.88776%0.755SS**  trans-117.7138.3-172.4-61.5176.9-177.8159.5-0.5114.5
158R30.6Very low31.1Very low192 Ų192150.2 Ų150.273%0.72576%0.759SS**  trans67.9120.2150.1-67.9-175.8179-75.96.9123
159R32.7Very low30.9Very low209 Ų209146.8 Ų146.879%0.78975%0.75SS**  trans68.6172.2135.5-68.1-178.7173.9167.3-5.2118.3
160P36.8Very low31.6Very low115 Ų115143.7 Ų143.775%0.74775%0.75SS**  cis-137.1156.4-5.524.7-0.1000119.9
161L25.7Very low31.8Very low161 Ų161144.5 Ų144.584%0.84375%0.751SS**  trans73.4159.6135.1-158.561.1000124.7
162H26.5Very low31.9Very low162 Ų162144 Ų14475%0.7575%0.753SS**  trans80.6140.2170.4-102-91.7000117.5
163S22.7Very low32.5Very low97 Ų97145.6 Ų145.668%0.67876%0.758SS**  cis-142.6-174.17.3-54.80000113.3
164S26.3Very low32.8Very low116 Ų116150.9 Ų150.981%0.81176%0.76SS**  trans-55.5173166.155.20000114.1
165A28.5Very low33.2Very low73 Ų73153.3 Ų153.360%0.60376%0.764SS**  cis-160.4-158.130.700000115
166M32.6Very low33.9Very low166 Ų166151.8 Ų151.882%0.81876%0.76SS**  trans-49.3163.316660.4-94.1171.600112.6
167E28.4Very low34Very low172 Ų172151.6 Ų151.680%0.80476%0.759SS**  -171.6167.860.5-169172169.800113.6
168V37.9Very low34.4Very low120 Ų120146.9 Ų146.973%0.72776%0.759SS**  trans-57.5133.4171.3172.10000112.4
169Q29.4Very low34.7Very low149 Ų149141.5 Ų141.570%0.69676%0.763SS**  trans-154.7134.6133.2-122.9167.210100116.1
170T44.7Very low35.3Very low109 Ų109139.5 Ų139.567%0.66977%0.767SS**  trans-57.2157.8156.757.20000110.6
171K31.5Very low35.8Very low138 Ų138139.4 Ų139.460%0.677%0.767SS**  170.6151.9125.9-94.5147.5-159.7172.70116.9
172K33.2Very low36.2Very low170 Ų170136.7 Ų136.774%0.73976%0.761SS**  trans72.297.5143.2-70.6159.1-167.5174.30119.3
173V43.1Very low36.9Very low144 Ų144134 Ų13487%0.87376%0.761SS**  trans-35.5134.1130.4173.40000111.4
174R37.9Very low37.3Very low228 Ų228135.2 Ų135.286%0.8676%0.764SS**  trans-127106.2163-108.2175.3166.5133.8-5.8107.1
175K41.9Very low37.5Very low186 Ų186139.1 Ų139.181%0.80976%0.762SS**  7479.384.5-167.978.3172.8-177.20111.1
176V47.5Very low37.9Very low129 Ų129139.5 Ų139.578%0.78277%0.766SS**PPolyproline II helixtrans-68.4143.5170.6-172.80000109.6
177P43Very low37.9Very low112 Ų112137.2 Ų137.273%0.72776%0.763SS**PPolyproline II helixtrans-64149.5173.6-22.634.8000113.2
178P42.4Very low37.9Very low136 Ų136134.3 Ų134.388%0.88376%0.762SS**PPolyproline II helixtrans-84.2136.1-178.533.2-33.7000112.9
179G36.5Very low37.9Very low80 Ų80133.3 Ų133.383%0.82577%0.766SS**  trans-178.970.3-179.200000113.5
180L44.3Very low38Very low166 Ų166131.9 Ų131.987%0.86977%0.773SS**  trans-26.3161.6174.1-69.4161.2000119.3
181P47.4Very low37.7Very low113 Ų113132.2 Ų132.273%0.73477%0.774SS**  cis-134.6137.6-3.632.6-12.1000117.5
182S35.3Very low37.8Very low104 Ų104130.2 Ų130.273%0.72778%0.784SS**  trans16.2116.4130.5-179.70000121.7
183S39.8Very low38Very low107 Ų107128.9 Ų128.975%0.74879%0.785SS**  -161.1125.5115.5-104.70000108.8
184V31.8Very low37.4Very low121 Ų121133.5 Ų133.573%0.73379%0.788SS**  64.2120.279.31770000110.3
185Y31.6Very low37.2Very low198 Ų198129.5 Ų129.578%0.77678%0.784SS**  cis-144.4158.230.9-173.3-106.2000112.6P187Y185-P187 HydrophobicContact CD1-CG 4.28Å; Y185-P187 HydrophobicContact CE1-CB 4.35Å; Y185-P187 HydrophobicContact CE1-CG 4.3Å
186A35Very low36.9Very low82 Ų82130.5 Ų130.568%0.67878%0.783SS**  trans-124124.7165.700000109.2S188A186-S188 PolarHBondContact O-N 3.25Å
187P32.8Very low36.1Very low117 Ų117130 Ų13076%0.7678%0.775SS**PPolyproline II helixtrans-70.3118.7174.3-15.630.3000110.6Y185Y185-P187 HydrophobicContact CD1-CG 4.28Å; Y185-P187 HydrophobicContact CE1-CB 4.35Å; Y185-P187 HydrophobicContact CE1-CG 4.3Å
188S29.1Very low35.5Very low112 Ų112130.1 Ų130.178%0.78378%0.779SS**PPolyproline II helixtrans-83.7150167.3-172.50000110A186A186-S188 PolarHBondContact O-N 3.25Å
189A38.8Very low35.6Very low99 Ų99129.9 Ų129.982%0.81878%0.778SS**PPolyproline II helixtrans-65.9140.3176.500000111.9
190S30.6Very low35.3Very low119 Ų119129.8 Ų129.883%0.83278%0.776SS**  trans-155.4161.9162.1-161.70000111.5
191T37.8Very low34.6Very low115 Ų115132.1 Ų132.171%0.70678%0.775SS**  trans-66.5150.2-168-174.20000116.1
192A34.3Very low34.4Very low96 Ų96132.4 Ų132.479%0.79378%0.777SS**  trans-160.5114.4142.700000110.4
193D36.8Very low34.2Very low143 Ų143131.5 Ų131.577%0.76577%0.771SS**  trans-70.6134.5171.2-57.9-99.8000111.6
194Y31.4Very low33.8Very low241 Ų241132.2 Ų132.295%0.94578%0.775SS**  trans-142.6138.3149.7-104.9-78000111
195N33.7Very low34.2Very low144 Ų144136.1 Ų136.177%0.7778%0.783SS**  trans-131.3130-166.6163.813.7000109.1
196R35.9Very low34.2Very low207 Ų207132.8 Ų132.878%0.78179%0.785SS**  trans-163.5145.7145.1-114.6173.3179.4-892114.5
197D30.5Very low34.1Very low117 Ų117133.3 Ų133.363%0.62679%0.79SS**  trans69.569.8148.6-53.5-32.9000119.2
198S30.6Very low34.1Very low115 Ų115134.5 Ų134.580%0.80480%0.795SS**  5161.7127-60.90000120.9
199P43.3Very low34.1Very low132 Ų132134.8 Ų134.886%0.85780%0.797SS**  cis-141.3166.920.941.2-22.8000118.3
200G29.8Very low33.8Very low77 Ų77135.6 Ų135.679%0.79479%0.792SS**  trans141.9106.5156.400000117.7
201Y31Very low33.9Very low216 Ų216139 Ų13985%0.84779%0.792SS**  trans-140.2169.3167.5-100.6-56.2000107.7
202P41.7Very low33.9Very low119 Ų119139.1 Ų139.177%0.77380%0.795SS**  cis-107.4158.315.142.4-33.9000112.9
203S32.3Very low33.5Very low85 Ų85140 Ų14059%0.59480%0.795SS**  cis70.9114.245.4-167.20000114.7
204S31.3Very low33.3Very low121 Ų121137.1 Ų137.185%0.84679%0.786SS**  trans-159.3115.6166.2-80.60000110.7
205K38.9Very low33.3Very low204 Ų204134.1 Ų134.189%0.88778%0.778SS**PPolyproline II helixtrans-99.1146.6165.6-66.1178177.9177.70109.2
206P33.1Very low33.2Very low128 Ų128135.9 Ų135.983%0.83178%0.779SS**PPolyproline II helixtrans-100.5159143.634.1-28.8000110.9
207A31.8Very low33.1Very low93 Ų93133.7 Ų133.777%0.76978%0.78SS**PPolyproline II helixtrans-97.2169.6-178.800000112.8
208T32.9Very low33Very low141 Ų141135.2 Ų135.287%0.86578%0.783SS**PPolyproline II helixtrans-51139168.447.40000112.6
209S30.5Very low32.9Very low118 Ų118136.6 Ų136.683%0.82578%0.782SS**  trans-125.9151.5173.7-173.80000111.3
210T32Very low32.2Very low116 Ų116133.5 Ų133.571%0.71277%0.774SS**  trans-132.189.6-166.8-54.90000111.8
211F31.7Very low32.5Very low190 Ų190138 Ų13883%0.83377%0.774SS**  trans61.6179.5165-59.1-68.1000115.1
212P39.5Very low32.8Very low119 Ų119136.9 Ų136.977%0.77378%0.776SS**  -135.8171.6-105.432.5-8.8000116
213S25.9Very low32.3Very low115 Ų115135.7 Ų135.780%0.80477%0.771SS**  trans163.2137.3130.2-171.10000113.3
214S32.6Very low32.6Very low82 Ų82137 Ų13757%0.57378%0.779SS**  trans20.3127.1150-150.40000119.4
215F30.8Very low32.7Very low178 Ų178136.2 Ų136.278%0.78177%0.766SS**  -163.5139.568.1-104.8-96.2000112.6
216F31.3Very low32.7Very low181 Ų181131.4 Ų131.479%0.79476%0.755SS**  trans39.1111.5155.8-80.2-115.8000120.5
217M33Very low33.1Very low161 Ų161136 Ų13679%0.79376%0.756SS**  -179.5158.6103-95.7-174.773.900112.6
218Q28.7Very low33.1Very low148 Ų148137.1 Ų137.169%0.69276%0.759SS**  trans58.5117.5157.7-134.86921.700122
219D27.9Very low33Very low144 Ų144136.4 Ų136.477%0.7776%0.76SS**  trans58.3158149.8-91.2-62.5000122.8
220G29.8Very low33.2Very low68 Ų68135.7 Ų135.770%0.70175%0.754SS**  trans133.499.8167.600000116.2
221H35.1Very low33.4Very low172 Ų172135.8 Ų135.880%0.79676%0.76SS**  trans-69.1152.5175.6-63.7-99.1000114
222H37.4Very low33.4Very low192 Ų192130.8 Ų130.889%0.88976%0.762SS**  -160.1121.6124.238.3-76.8000111.1
223S31.6Very low33.1Very low94 Ų94133.1 Ų133.166%0.65777%0.765SS**  trans-113.1157.4175.860.50000111
224S38.1Very low33.4Very low111 Ų111133.9 Ų133.978%0.77676%0.76SS**  trans-58152.9177.751.30000114.6
225D35.2Very low33.3Very low105 Ų105137.6 Ų137.656%0.56177%0.768SS**  trans-61148.2178.2-169.971.2000113.3
226P37.9Very low34Very low103 Ų103134.3 Ų134.367%0.66977%0.765SS**SBendtrans-94.1-0.1-165.936-34000116S228P226-S228 PolarHBondContact O-N 3.1Å
227W40.8Very low33.9Very low224 Ų224129 Ų12985%0.84876%0.761SS**  trans-95.372-173.2-72.388.7000114.2
228S31.8Very low33.8Very low117 Ų117133 Ų13382%0.81877%0.769SS**  trans-153.9111.4158.5-860000113.8P226P226-S228 PolarHBondContact O-N 3.1Å
229S30.6Very low34Very low127 Ų127130.7 Ų130.789%0.88878%0.775SS**  trans-154.3147.4160.3-78.40000106.7
230S36.2Very low34.3Very low102 Ų102127.4 Ų127.471%0.71378%0.775SS**  cis-154.3178.12867.50000113.8
231S34.8Very low34.6Very low118 Ų118132.1 Ų132.183%0.82578%0.781SS**  trans75.3101.9146.3-54.10000119.5
232G31.9Very low34.7Very low86 Ų86132 Ų13289%0.88779%0.785SS**  trans-166.5120.8158.200000109.1
233M33.9Very low34.4Very low167 Ų167126.5 Ų126.582%0.82378%0.781SS**  trans-128.1135.2-167.7-173.7106.378.200111.2
234N31.9Very low34.4Very low132 Ų132130.1 Ų130.171%0.70679%0.792SS**  trans67.9143.8171.5-69.5-44.3000116.3
235Q31.6Very low34.1Very low159 Ų159129.4 Ų129.474%0.74379%0.787SS**  cis-139-142.6-14.6-89.6-81-24.100108.2
236P43.6Very low33.9Very low110 Ų110128.7 Ų128.771%0.71479%0.791SS**  -127.5157.8-115.437.3-16.6000117.8
237G30.9Very low33.6Very low69 Ų69131.9 Ų131.971%0.71180%0.796SS**  trans78113.4143.800000119.8
238Y31.2Very low33.2Very low246 Ų246128.8 Ų128.897%0.96580%0.795SS**  -174.3165.7112-112.9-86.7000109.7
239A32.6Very low33.6Very low98 Ų98129 Ų12981%0.8179%0.793SS**  trans-112147.1178.900000111.8
240G34.1Very low33.8Very low75 Ų75132 Ų13277%0.77379%0.794SS**  trans170.971.817900000117.7
241M35.2Very low33.5Very low168 Ų168132.7 Ų132.783%0.82880%0.798SS**  trans21.5139.6149.6-65.1-164.776.700123.7
242L37.3Very low33.5Very low169 Ų169132.6 Ų132.689%0.88580%0.797SS**  trans75.1147.5158.4-59.7160.5000117.9
243G31.5Very low33.4Very low77 Ų77133.8 Ų133.879%0.79479%0.792SS**  trans179.3-61.7175.600000118.3
244N30.5Very low33.1Very low169 Ų169136.5 Ų136.590%0.90480%0.795SS**  trans73.8158.7-174.3-153.632.2000117.6
245S32.7Very low33.1Very low96 Ų96135 Ų13567%0.67179%0.794SS**  trans-83.5171.9-172.4-150.80000112.4
246S31.2Very low32.9Very low90 Ų90133.3 Ų133.363%0.62980%0.8SS**  cis-163.8176.332.5-46.70000115.1
247H30.6Very low32.4Very low170 Ų170136 Ų13679%0.78781%0.807SS**  trans63.8117.2145.285.2-31.2000122.2
248I33.1Very low33Very low159 Ų159141.5 Ų141.582%0.81581%0.814SS**  trans-170.1126.4135.5-92.2145.8000107.8
249P39.2Very low33.4Very low121 Ų121135 Ų13579%0.78680%0.801SS**  trans-110.8163.3154.736.4-28.6000111.6
250Q36.4Very low33.4Very low192 Ų192137.8 Ų137.890%0.89780%0.797SS**  trans-85160.6178.8-61.2177.4-14.600112.3
251S30Very low33.2Very low115 Ų115142 Ų14280%0.80480%0.797SS**  trans-143.4155.114672.90000111.3
252S34.9Very low33.2Very low116 Ų116145.8 Ų145.881%0.81180%0.802SS**  trans-104.3159.2169.9-172.10000109
253S28.5Very low33.3Very low112 Ų112145.9 Ų145.978%0.78380%0.803SS**  trans-140.9141.9178.9-700000111.7
254Y28.7Very low33.1Very low223 Ų223147.8 Ų147.888%0.87580%0.804SS**  trans-108.4180-177.3-139.8-103.5000111.4
255C31.1Very low33.1Very low102 Ų102150.3 Ų150.369%0.68980%0.802SS**  trans-40147.8-173.9-55.90000118.5
256S27.9Very low33.9Very low123 Ų123151.2 Ų151.286%0.8681%0.806SS**  trans-157.1165.1142.1-82.90000111.5
257L33.1Very low33.7Very low166 Ų166150.7 Ų150.787%0.86980%0.802SS**  trans-95.9168.7-162.3-64.787.3000114.7
258H43.3Very low33.8Very low184 Ų184150.5 Ų150.585%0.85280%0.801SS**  trans-60.3159.1166.1-80.5-104.7000113.2
259P39.9Very low33.6Very low109 Ų109148.4 Ų148.471%0.70880%0.801SS**  -131.8139.1127.435.6-26.7000114.4
260H32.8Very low33.2Very low157 Ų157148.9 Ų148.973%0.72781%0.807SS**  trans23.5116.3153.1-55.9-67.5000119.8
261E29.7Very low33.2Very low165 Ų165143.2 Ų143.277%0.77179%0.793SS**  67.412973.6-68.9-176.8132.100115.7
262R35.1Very low33.4Very low246 Ų246144.8 Ų144.893%0.92879%0.792SS**  trans-133.9134.1154.2-82.8-172.4170.2-91.9-3108.7
263L38.9Very low33.8Very low171 Ų171146.5 Ų146.590%0.89579%0.791SS**  trans-76.4150.4-172.3-6575.6000112.3
264S26.6Very low34Very low117 Ų117149.1 Ų149.182%0.81880%0.796SS**  trans-152.4123.8153.8-162.30000110.3
265Y32Very low34.4Very low223 Ų223143.6 Ų143.688%0.87579%0.79SS**  trans-168169.8-179.5-97-59000106.9
266P49.5Very low34.6Very low114 Ų114144 Ų14474%0.7479%0.794SS**  cis-96.3-159.1641.1-33.9000111.7
267S26.3Very low35.5Very low79 Ų79145.4 Ų145.455%0.55279%0.791SS**  cis-164.1176.810.8-149.40000114.7
268H33.2Very low35.8Very low166 Ų166143.1 Ų143.177%0.76979%0.787SS**  trans59.2109153.2-57.1-48.1000122.4
269S29.1Very low36.1Very low116 Ų116140 Ų14081%0.81178%0.782SS**  56.3101.4122.9-51.10000121.2
270S29.3Very low35.8Very low130 Ų130144 Ų14491%0.90979%0.794SS**  -150.2170.8122.3-162.60000109.7
271A37.9Very low35.9Very low73 Ų73142 Ų14260%0.60380%0.797SS**  trans-91.4179-175.300000113.9
272D33.9Very low35.9Very low148 Ų148139.9 Ų139.979%0.79180%0.796SS**  trans86.6153.1156.6-55-43.4000120.8
273I43.4Very low35.8Very low152 Ų152137.2 Ų137.278%0.77979%0.792SS**  trans57.688.2170.3-27.1-179.3000116.8
274N33.1Very low35.6Very low167 Ų167137.6 Ų137.689%0.89379%0.788SS**  trans-125.2103.2153-122.3-43.7000110.2S276N274-S276 PolarHBondContact O-N 3.44Å; N274-S276 VanDerWaalsContact O-N 3.11Å
275S35.7Very low36Very low107 Ų107143.6 Ų143.675%0.74879%0.793SS**  trans-73.298.5-180-59.90000110.3
276S36.6Very low35.9Very low112 Ų112138.2 Ų138.278%0.78379%0.788SS**PPolyproline II helixtrans-57.3140.6179.4-175.10000112.3N274N274-S276 PolarHBondContact O-N 3.44Å; N274-S276 VanDerWaalsContact O-N 3.11Å
277L45.7Very low35.1Very low151 Ų151136 Ų13679%0.79179%0.786SS**PPolyproline II helixtrans-56.2146.4161.7-62.5169.2000110P279L277-P279 WeakPolarHBondContact O-CD 3.42Å
278P40.4Very low35.3Very low119 Ų119138.3 Ų138.377%0.77380%0.797SS**PPolyproline II helixtrans-77.1121.2174.130-32.5000110.9
279P48.9Very low35.3Very low118 Ų118136.5 Ų136.577%0.76679%0.793SS**PPolyproline II helixtrans-70.4150.6165.330.7-33.6000110.4L277 S281L277-P279 WeakPolarHBondContact O-CD 3.42Å; P279-S281 PolarHBondContact O-N 3.15Å
280M33Very low35.4Very low194 Ų194138.1 Ų138.196%0.95679%0.787SS**PPolyproline II helixtrans-65.1127.4178.6-67169.560.100111
281S34.8Very low35.5Very low113 Ų113142.6 Ų142.679%0.7979%0.786SS**PPolyproline II helixtrans-101.9123.5176.6-173.60000111.4P279P279-S281 PolarHBondContact O-N 3.15Å
282T29.9Very low35Very low122 Ų122144 Ų14475%0.74879%0.792SS**PPolyproline II helixtrans-95.9130.7167.8-65.10000109H284T282-H284 PolarHBondContact O-N 3.17Å
283F33.7Very low34.7Very low190 Ų190143.2 Ų143.283%0.83379%0.792SS**PPolyproline II helixtrans-70.3123.2-178.4-82.1-94.2000113.4
284H35.2Very low34Very low178 Ų178141 Ų14182%0.82479%0.79SS**  trans-140.8112.1145.5-71-61.9000111.4T282T282-H284 PolarHBondContact O-N 3.17Å
285R34.1Very low33.7Very low243 Ų243138.1 Ų138.192%0.91778%0.783SS**  trans27.7138.6141.7-163.8-178.5-160.8-87.53.9120.2
286S30.6Very low33.4Very low111 Ų111139.2 Ų139.278%0.77679%0.789SS**  cis175.1124.5-18.9175.40000108.1
287G31.5Very low33.2Very low68 Ų68140.3 Ų140.370%0.70179%0.791SS**  trans73.9164.4173.500000116.3
288T32.1Very low32.9Very low127 Ų127139 Ų13978%0.77979%0.792SS**  cis-159.1127.8-7.4-75.70000110.9
289N32.3Very low33.8Very low127 Ų127139.5 Ų139.568%0.67980%0.795SS**  trans39.5125.4153.3-65.6-3.7000124.4
290H31.6Very low32.9Very low150 Ų150139 Ų13969%0.69480%0.801SS**  trans54.9122.7145.2-41.2134.7000119.4
291Y31Very low33Very low224 Ų224136.8 Ų136.888%0.87879%0.793SS**  -166.9178.365.3-104.2-79.7000112.7
292S28.6Very low32.8Very low103 Ų103133.4 Ų133.472%0.7278%0.776SS**  trans-100.3149.6-168.8-40.30000115.1
293T27.5Very low33.1Very low132 Ų132130.9 Ų130.981%0.8176%0.761SS**  176.8129.8115.5360000114.8
294S27.6Very low33.1Very low105 Ų105128.2 Ų128.273%0.73476%0.755SS**  trans41.7116.9130.5-47.90000124.7
295S28Very low32.8Very low107 Ų107124.3 Ų124.375%0.74875%0.748SS**  88.3117.4121.3-59.80000124.3
296C28.5Very low32.7Very low129 Ų129119.2 Ų119.287%0.87274%0.737SS**  trans74.3137.2131.7-58.30000123
297T32.5Very low32.7Very low135 Ų135122.4 Ų122.483%0.82874%0.742SS**  trans-95.6158.7174.855.20000111.9
298P39.5Very low32.7Very low124 Ų124124.4 Ų124.481%0.80575%0.752SS**  -149.4178.290.436.4-16000115.4
299P59.5Low33Very low130 Ų130125.2 Ų125.284%0.84475%0.752SS**  trans-108175.7-171.841-35000115.9
300A30.3Very low33.2Very low107 Ų107130.5 Ų130.588%0.88476%0.762SS**  trans-143.8164.2168.600000111.8
301N33.6Very low33.2Very low148 Ų148127.1 Ų127.179%0.79177%0.768SS**  trans-130.8164.9-167.4-16523.7000112.5S54S54-N301 WeakPolarHBondContact CB-O 3.47Å; S54-N301 PolarHBondContact OG-O 3.2Å
302G30.6Very low33.6Very low42 Ų42122.9 Ų122.943%0.43377%0.771SS.*  trans-163.3168.4-177.100000117.1S54S54-G302 WeakPolarHBondContact OG-CA 3.4Å
303T36.7Very low33.7Very low68 Ų68121.7 Ų121.742%0.41778%0.775SS.*BIsolated β-bridgetrans-143.1-152.2-159.641.60000110.5R53 S54R53-T303 PolarHBondContact N-O 3.34Å; R53-T303 CarbonylContact O-C 3.11Å; R53-T303 WeakPolarHBondContact O-CA 3.5Å; R53-T303 PolarHBondContact O-N 3.42Å; R53-T303 VanDerWaalsContact O-O 3.05Å; R53-T303 PolarHBondContact O-OG1 3.4Å; S54-T303 WeakPolarHBondContact CA-OG1 3.42Å
304D34Very low34.1Very low134 Ų134120.5 Ų120.572%0.71778%0.779SS**  -140.3-170.1-89.7-69.5-29.8000107
305S29.3Very low34.5Very low97 Ų97120.7 Ų120.768%0.67879%0.786SS**  cis-170.2-174.713.1-150.60000112.5
306I32.2Very low34.8Very low135 Ų135119.2 Ų119.269%0.69279%0.788SS**  trans79.3129.2146.8-78.7163.8000121.3
307M30Very low35.8Very low179 Ų179119 Ų11988%0.88279%0.788SS**  trans52.3112.5156.1-77.8-174.1-8700122.2
308A31.1Very low36.4Very low110 Ų110117.2 Ų117.291%0.90978%0.781SS**  -159.6149.5105.500000111.9
309N37.7Very low37.1Very low143 Ų143120 Ų12077%0.76578%0.783SS**  trans-139.2128.6178.8167.115.4000110.1
310R37.4Very low37Very low239 Ų239118.3 Ų118.390%0.90277%0.771SS**  trans157.3147.3142.2-86153.5-168.7-1112.9110.7
311G31.6Very low38.4Very low79 Ų79115.5 Ų115.581%0.81475%0.752SS**  trans160.548.5167.600000118.6
312S38.8Very low39.8Very low134 Ų134114.2 Ų114.294%0.93775%0.745SS**  trans-72129.2168.2-58.10000111.1
313G31.5Very low41.4Very low78 Ų78115.4 Ų115.480%0.80475%0.75SS**  trans-162.3110.1175.700000111.5
314A34.9Very low42.9Very low108 Ų108117.2 Ų117.289%0.89376%0.757SS**  trans-80.2145.4-167.300000114.5
315A36.3Very low44.7Very low108 Ų108112.9 Ų112.989%0.89374%0.744SS**  172.1121.2123.400000111.3
316G35.7Very low46.7Very low76 Ų76115.8 Ų115.878%0.78474%0.744SS**  trans164.394.1175.500000112.5
317S48.1Very low48.2Very low126 Ų126112 Ų11288%0.88173%0.734SS**  trans-70.3135.4-179.9-174.30000111.5
318S46.3Very low49.9Very low96 Ų96108.7 Ų108.767%0.67172%0.719SS**  trans-155.1128.2169.3-79.20000111T320S318-T320 PolarHBondContact O-N 3.29Å
319Q54.3Low51.2Low184 Ų184106.1 Ų106.186%0.8670%0.697SS**THydrogen-bonded Turntrans-69.38.4-168.4-163.9173.9-19.700114.9
320T56.3Low52.2Low94 Ų94103.8 Ų103.858%0.57769%0.693SS**THydrogen-bonded Turntrans-90.3-24.7-172.3-35.50000113.1S318S318-T320 PolarHBondContact O-N 3.29Å
321G61Low53.5Low47 Ų4798 Ų9849%0.48568%0.678SS.*Hα-helixtrans-65.3-46.6-174.600000113.6A323 L324 G325G321-A323 VanDerWaalsContact C-N 3.29Å; G321-A323 PolarHBondContact O-N 3.07Å; G321-L324 PolarHBondContact O-N 3.04Å; G321-G325 PolarHBondContact O-N 3.36Å
322D62.5Low54.5Low122 Ų122104 Ų10465%0.65268%0.678SS**Hα-helixtrans-66.7-29.7-174.7-58.5-42.2000113.1K326D322-K326 WeakPolarHBondContact O-CB 3.31Å; D322-K326 VanDerWaalsContact O-CG 3.31Å; D322-K326 WeakPolarHBondContact O-CG 3.31Å; D322-K326 PolarHBondContact O-N 3.32Å; D322-K326 VanDerWaalsContact O-N 3.07Å
323A64.3Low54.7Low66 Ų66101.3 Ų101.355%0.54566%0.659SS.*Hα-helixtrans-68.8-45.5175.700000111.3G321 A327G321-A323 VanDerWaalsContact C-N 3.29Å; G321-A323 PolarHBondContact O-N 3.07Å; A323-A327 WeakPolarHBondContact O-CB 3.39Å; A323-A327 PolarHBondContact O-N 3Å
324L68.4Low55.6Low107 Ų107102.4 Ų102.456%0.5665%0.652SS**Hα-helixtrans-67.2-41.1175.4-77.1166.3000111.8G321 K326 A327 L328G321-L324 PolarHBondContact O-N 3.04Å; L324-K326 PolarHBondContact O-N 3.33Å; L324-A327 PolarHBondContact O-N 3.35Å; L324-L328 WeakPolarHBondContact O-CB 3.1Å; L324-L328 VanDerWaalsContact O-CG 3.29Å; L324-L328 WeakPolarHBondContact O-CG 3.39Å; L324-L328 PolarHBondContact O-N 3.33Å
325G72.1Confident56.2Low43 Ų43104.6 Ų104.644%0.44365%0.648SS.*Hα-helixtrans-58.6-44.7175.600000112.6G321 A329G321-G325 PolarHBondContact O-N 3.36Å; G325-A329 WeakPolarHBondContact O-CB 3.42Å; G325-A329 PolarHBondContact O-N 2.59Å
326K69.9Low56.7Low157 Ų157108 Ų10868%0.68365%0.645SS**Hα-helixtrans-67-45.4175.3-73.2174.3-179.1179.70112.4D322 L324 L328 A329 S330D322-K326 WeakPolarHBondContact O-CB 3.31Å; D322-K326 VanDerWaalsContact O-CG 3.31Å; D322-K326 WeakPolarHBondContact O-CG 3.31Å; D322-K326 PolarHBondContact O-N 3.32Å; D322-K326 VanDerWaalsContact O-N 3.07Å; L324-K326 PolarHBondContact O-N 3.33Å; K326-L328 VanDerWaalsContact C-N 3.31Å; K326-L328 PolarHBondContact O-N 2.86Å; K326-A329 PolarHBondContact O-N 2.92Å; K326-S330 PolarHBondContact O-N 3.34Å; K326-S330 VanDerWaalsContact O-N 3.07Å; K326-S330 PolarHBondContact O-OG 3.35Å
327A63.3Low56.9Low57 Ų57111.1 Ų111.147%0.47165%0.65SS.*Hα-helixtrans-59.5-39.9178.500000112.6A323 L324 I331A323-A327 WeakPolarHBondContact O-CB 3.39Å; A323-A327 PolarHBondContact O-N 3Å; L324-A327 PolarHBondContact O-N 3.35Å; A327-I331 VanDerWaalsContact O-CG1 3.23Å; A327-I331 WeakPolarHBondContact O-CG1 3.36Å
328L67.1Low56.3Low109 Ų109111.4 Ų111.457%0.57164%0.641SS**Hα-helixtrans-74.1-34.4177.9-67.8170.6000112.7L324 K326 S330 I331L324-L328 WeakPolarHBondContact O-CB 3.1Å; L324-L328 VanDerWaalsContact O-CG 3.29Å; L324-L328 WeakPolarHBondContact O-CG 3.39Å; L324-L328 PolarHBondContact O-N 3.33Å; K326-L328 VanDerWaalsContact C-N 3.31Å; K326-L328 PolarHBondContact O-N 2.86Å; L328-S330 VanDerWaalsContact C-N 3.31Å; L328-S330 PolarHBondContact O-N 3.36Å; L328-I331 HydrophobicContact CD2-CD1 4.04Å; L328-I331 PolarHBondContact O-N 3.18Å
329A58.2Low55.6Low55 Ų55114.2 Ų114.246%0.45565%0.649SS.*Hα-helixtrans-65.3-33.3173.400000112.6G325 K326 I331 Y332 S333G325-A329 WeakPolarHBondContact O-CB 3.42Å; G325-A329 PolarHBondContact O-N 2.59Å; K326-A329 PolarHBondContact O-N 2.92Å; A329-I331 PolarHBondContact O-N 3.25Å; A329-Y332 PolarHBondContact O-N 3.43Å; A329-S333 PolarHBondContact O-N 2.77Å; A329-S333 PolarHBondContact O-OG 3.07Å
330S58Low55Low95 Ų95110.2 Ų110.266%0.66464%0.641SS**THydrogen-bonded Turntrans-66.6-14.7176.4-62.90000114.8K326 L328K326-S330 PolarHBondContact O-N 3.34Å; K326-S330 VanDerWaalsContact O-N 3.07Å; K326-S330 PolarHBondContact O-OG 3.35Å; L328-S330 VanDerWaalsContact C-N 3.31Å; L328-S330 PolarHBondContact O-N 3.36Å
331I64.9Low53.9Low117 Ų117115.6 Ų115.660%0.666%0.657SS**THydrogen-bonded Turntrans-90.3-13.7179.9-27.8179000112.3A327 L328 A329A327-I331 VanDerWaalsContact O-CG1 3.23Å; A327-I331 WeakPolarHBondContact O-CG1 3.36Å; L328-I331 HydrophobicContact CD2-CD1 4.04Å; L328-I331 PolarHBondContact O-N 3.18Å; A329-I331 PolarHBondContact O-N 3.25Å
332Y52.9Low53Low206 Ų206119.4 Ų119.481%0.80868%0.676SS**SBendtrans-128.516.5-174.5-75.8-78.2000114A329A329-Y332 PolarHBondContact O-N 3.43Å
333S42.8Very low51.6Low77 Ų77119.2 Ų119.254%0.53868%0.684SS.*  trans-91.2123.5171.7-60.20000110.2A329A329-S333 PolarHBondContact O-N 2.77Å; A329-S333 PolarHBondContact O-OG 3.07Å
334P51.2Low50Low101 Ų101123.1 Ų123.166%0.65670%0.696SS**  trans-71.8168.2171.331.3-34.6000111.9
335D47Very low48.6Very low153 Ų153124 Ų12482%0.81871%0.708SS**  trans64.859165.9-52.3-34.6000117.8
336H45.5Very low47Very low180 Ų180127.2 Ų127.283%0.83372%0.724SS**  trans-119.7120.7160.1-77.96.5000112
337T40Very low45.6Very low142 Ų142125.2 Ų125.287%0.87173%0.725SS**  trans-84.9126.8-173.6-71.70000113
338N36.2Very low44.4Very low132 Ų132128.7 Ų128.771%0.70674%0.743SS**  trans4111.1153.3-173.114.3000118.2
339N32.5Very low42.9Very low154 Ų154129.3 Ų129.382%0.82475%0.75SS**  -155.4117126.9-124.8-34.7000111
340S40.6Very low41.8Very low100 Ų100130.1 Ų130.170%0.69977%0.765SS**  trans-144.2109.2179.5-77.20000112.2
341F34Very low40.7Very low208 Ų208130.4 Ų130.491%0.91277%0.767SS**  trans-132.6119.4151-89.5-73.5000109.1
342S40.9Very low39.7Very low126 Ų126130.2 Ų130.288%0.88177%0.773SS**PPolyproline II helixtrans-69.8130.6-173.4-52.60000112
343S33.1Very low39.5Very low118 Ų118126.2 Ų126.283%0.82577%0.772SS**PPolyproline II helixtrans-103.4151.6159.4-690000109.9
344N31.7Very low39Very low148 Ų148128 Ų12879%0.79179%0.785SS**PPolyproline II helixtrans-50.4145.4-169.2-93-21.1000114.9S346N344-S346 PolarHBondContact O-N 3.25Å
345P39.2Very low38.3Very low126 Ų126131.4 Ų131.482%0.81880%0.796SS**  trans-69.4100.3163.530.5-32.6000109.6
346S37.4Very low37.6Very low111 Ų111129.5 Ų129.578%0.77680%0.795SS**  trans-68142.7171.1-66.90000111.1N344N344-S346 PolarHBondContact O-N 3.25Å
347T40.8Very low36.9Very low114 Ų114125.8 Ų125.870%0.69980%0.796SS**  trans-65.2140.9-179.4460000112.1V349T347-V349 PolarHBondContact O-N 3.31Å
348P38Very low36.4Very low131 Ų131122.9 Ų122.985%0.85179%0.794SS**  trans-76.283.9178.431.2-35.1000111.5G350P348-G350 VanDerWaalsContact C-N 3.25Å; P348-G350 PolarHBondContact O-N 2.79Å
349V35.9Very low36.3Very low121 Ų121123.4 Ų123.473%0.73380%0.802SS**  trans-81.473.5170.8-173.40000109.5T347 S351T347-V349 PolarHBondContact O-N 3.31Å; V349-S351 PolarHBondContact O-N 2.82Å
350G35Very low36.1Very low73 Ų73120.7 Ų120.775%0.75380%0.801SS**  trans-89.372.9-18000000113.4P348P348-G350 VanDerWaalsContact C-N 3.25Å; P348-G350 PolarHBondContact O-N 2.79Å
351S35.8Very low35.8Very low101 Ų101121.6 Ų121.671%0.70680%0.802SS**PPolyproline II helixtrans-80.6135168-62.10000110.7V349V349-S351 PolarHBondContact O-N 2.82Å
352P43.6Very low35.7Very low113 Ų113122.9 Ų122.973%0.73480%0.801SS**PPolyproline II helixtrans-69.1155.1176.529.8-35.1000111.6S354P352-S354 PolarHBondContact O-N 3.41Å
353P47.7Very low35.1Very low121 Ų121122.9 Ų122.979%0.78680%0.801SS**PPolyproline II helixtrans-68.4131.4-176.227.6-34.9000112.4L355P353-L355 PolarHBondContact O-N 3.48Å
354S33.3Very low34.9Very low115 Ų115129.2 Ų129.280%0.80481%0.806SS**  trans-72109176.5-62.70000112P352P352-S354 PolarHBondContact O-N 3.41Å
355L35.3Very low34.8Very low172 Ų172130.1 Ų130.190%0.90181%0.811SS**  trans-78.3118.9161.8-63176.8000109.1P353P353-L355 PolarHBondContact O-N 3.48Å
356S32.4Very low34.4Very low114 Ų114127.9 Ų127.980%0.79781%0.811SS**  trans-83.6136.6-178-71.80000113.3
357A31.9Very low34.2Very low102 Ų102126.2 Ų126.284%0.84381%0.812SS**  trans56.492.5159.800000118.2
358G29Very low33.8Very low80 Ų80130.8 Ų130.883%0.82583%0.825SS**  trans-130.458.816600000112.7A360G358-A360 PolarHBondContact O-N 2.87Å
359T34.2Very low33.8Very low144 Ų144129.3 Ų129.388%0.88382%0.824SS**  trans-78.698.4179.948.70000111.9
360A28.7Very low33.9Very low97 Ų97128.8 Ų128.880%0.80283%0.825SS**  trans-132.695.9172.700000111.1G358 W362G358-A360 PolarHBondContact O-N 2.87Å; A360-W362 PolarHBondContact O-N 3.35Å
361V33Very low33.9Very low118 Ų118130.6 Ų130.672%0.71583%0.826SS**  trans-89.2107.3175.1175.90000109.7
362W32.7Very low33.8Very low236 Ų236131.2 Ų131.289%0.89483%0.831SS**  trans69.4148.2165.7-51.3-22.9000118.5A360A360-W362 PolarHBondContact O-N 3.35Å
363S27.4Very low34Very low125 Ų125131.7 Ų131.787%0.87483%0.834SS**  trans-154.7118156-82.90000110.1
364R30.4Very low33.2Very low252 Ų252134 Ų13495%0.95184%0.839SS**  trans-117.1103.6161.7-89.7-174.6172-112.62.6108.3
365N28.4Very low33.2Very low167 Ų167138.2 Ų138.289%0.89384%0.839SS**  trans39103.7149.1-168.385.5000119.3
366G32Very low33.4Very low79 Ų79138.3 Ų138.381%0.81484%0.835SS**  trans161.4122.8152.100000117.6
367G32.2Very low33.8Very low76 Ų76135.1 Ų135.178%0.78482%0.82SS**  trans95.678.2138.600000121.4
368Q32.1Very low34.8Very low210 Ų210134.6 Ų134.698%0.98181%0.808SS**  trans55.3174.1149.8-67.1-169.4-16.400119.3
369A39.1Very low36Very low100 Ų100137.2 Ų137.283%0.82680%0.802SS**  trans-138.3149.9-166.300000113.2
370S36.9Very low36.9Very low110 Ų110137.5 Ų137.577%0.76979%0.793SS**  trans-165.7135.8156.546.30000112.6
371S35.7Very low38.2Very low110 Ų110135.9 Ų135.977%0.76978%0.777SS**  trans39.4115.6154.357.80000121.3
372S34.8Very low39.6Very low115 Ų115134.6 Ų134.680%0.80477%0.765SS**  trans-61.5161.8152.4-38.70000111.7
373P46.8Very low41Very low123 Ų123128.1 Ų128.180%0.79975%0.745SS**  -147.6153.890.139-23.4000117
374N31.7Very low42.9Very low168 Ų168125.3 Ų125.390%0.89873%0.725SS**  trans61.9141.5156.2-131.617.4000120.3
375Y33.3Very low44.9Very low205 Ų205120 Ų12080%0.80471%0.705SS**  trans-147.2122.6-178-161.1-80.6000109.4
376E37.7Very low47.2Very low174 Ų174116.4 Ų116.481%0.81369%0.685SS**  trans-109151.1176.7-160-178.3176.700112.1
377G41.5Very low49.5Very low47 Ų47117.3 Ų117.349%0.48567%0.668SS.*  trans-50.3134.7-165.700000117.5L379G377-L379 PolarHBondContact O-N 3.34Å
378P53.5Low51.7Low90 Ų90116.7 Ų116.758%0.58465%0.647SS**THydrogen-bonded Turntrans-59.8-1.2174.3-27.236000117.7
379L52.8Low54Low135 Ų135115.3 Ų115.371%0.70763%0.632SS**Hα-helixtrans-70.9-39.3-174.3-70176.4000113.5G377 S381 L382 Q383G377-L379 PolarHBondContact O-N 3.34Å; L379-S381 PolarHBondContact O-N 3.02Å; L379-L382 PolarHBondContact O-N 3.47Å; L379-Q383 PolarHBondContact O-N 2.79Å
380H53.8Low56.1Low150 Ų150115 Ų11569%0.69462%0.616SS**Hα-helixtrans-59.2-33.5-179.6-9690.5000112.6S384H380-S384 WeakPolarHBondContact O-CB 3.39Å; H380-S384 PolarHBondContact O-N 3.4Å
381S57.1Low58.3Low64 Ų64116.1 Ų116.145%0.44861%0.61SS.*Hα-helixtrans-72-27.1177.2-173.90000113.4L379 R385L379-S381 PolarHBondContact O-N 3.02Å; S381-R385 WeakPolarHBondContact O-CB 3.43Å; S381-R385 WeakPolarHBondContact O-CG 3.42Å; S381-R385 PolarHBondContact O-N 3.14Å; S381-R385 PolarHBondContact OG-NH1 3.27Å
382L60.8Low60.6Low91 Ų91118 Ų11848%0.47660%0.6SS.*Hα-helixtrans-77.4-45173.3-85.5166000111.3L379 R385 I386L379-L382 PolarHBondContact O-N 3.47Å; L382-R385 PolarHBondContact O-N 3.29Å; L382-I386 WeakPolarHBondContact O-CG1 3.44Å; L382-I386 PolarHBondContact O-N 2.9Å; L382-I386 VanDerWaalsContact O-N 3.07Å
383Q62.5Low63.2Low100 Ų100116.5 Ų116.547%0.46758%0.582SS.*Hα-helixtrans-58-52.1176-172.961.429.200110.9L379 R385 I386 E387L379-Q383 PolarHBondContact O-N 2.79Å; Q383-R385 VanDerWaalsContact C-N 3.33Å; Q383-R385 PolarHBondContact O-N 3.39Å; Q383-I386 WeakPolarHBondContact O-CA 3.25Å; Q383-I386 WeakPolarHBondContact O-CB 3.35Å; Q383-I386 PolarHBondContact O-N 2.96Å; Q383-E387 WeakPolarHBondContact CG-OE1 3.27Å; Q383-E387 PolarHBondContact NE2-OE1 3.22Å; Q383-E387 WeakPolarHBondContact O-CG 3.27Å; Q383-E387 PolarHBondContact O-N 3.44Å
384S67.1Low65.1Low66 Ų66114.8 Ų114.846%0.46257%0.567SS.*Hα-helixtrans-58.8-38.3176.7170.80000113.2H380 I386 E387 D388H380-S384 WeakPolarHBondContact O-CB 3.39Å; H380-S384 PolarHBondContact O-N 3.4Å; S384-I386 VanDerWaalsContact C-N 3.3Å; S384-I386 PolarHBondContact O-N 3.13Å; S384-E387 PolarHBondContact O-N 3.44Å; S384-D388 WeakPolarHBondContact O-CB 3.42Å; S384-D388 PolarHBondContact O-N 2.9Å
385R72.1Confident67.7Low140 Ų140111.9 Ų111.953%0.52855%0.551SS.*Hα-helixtrans-72.6-18.3175-79.9-161.8-56.2-94-3114.3S381 L382 Q383 R389S381-R385 WeakPolarHBondContact O-CB 3.43Å; S381-R385 WeakPolarHBondContact O-CG 3.42Å; S381-R385 PolarHBondContact O-N 3.14Å; S381-R385 PolarHBondContact OG-NH1 3.27Å; L382-R385 PolarHBondContact O-N 3.29Å; Q383-R385 VanDerWaalsContact C-N 3.33Å; Q383-R385 PolarHBondContact O-N 3.39Å; R385-R389 WeakPolarHBondContact O-CB 3.45Å
386I78.2Confident70Confident92 Ų92104.3 Ų104.347%0.47253%0.531SS..Hα-helixtrans-81.4-45.5171.9-69.5162.6000108.8L382 Q383 S384 R389 L390L382-I386 WeakPolarHBondContact O-CG1 3.44Å; L382-I386 PolarHBondContact O-N 2.9Å; L382-I386 VanDerWaalsContact O-N 3.07Å; Q383-I386 WeakPolarHBondContact O-CA 3.25Å; Q383-I386 WeakPolarHBondContact O-CB 3.35Å; Q383-I386 PolarHBondContact O-N 2.96Å; S384-I386 VanDerWaalsContact C-N 3.3Å; S384-I386 PolarHBondContact O-N 3.13Å; I386-R389 CarbonylContact O-C 3.56Å; I386-R389 WeakPolarHBondContact O-CA 3.34Å; I386-R389 WeakPolarHBondContact O-CB 3.42Å; I386-R389 PolarHBondContact O-N 2.84Å; I386-R389 VanDerWaalsContact O-N 3.1Å; I386-L390 HydrophobicContact CG2-CD1 4.03Å; I386-L390 HydrophobicContact CG2-CG 4.5Å; I386-L390 WeakPolarHBondContact O-CG 3.3Å; I386-L390 PolarHBondContact O-N 3.24Å
387E79.6Confident72.3Confident97 Ų9798.8 Ų98.845%0.45351%0.506SS..Hα-helixtrans-60.9-49.7176.6-70.5158.9172.900111.8Q383 S384 R389 L390 E391Q383-E387 WeakPolarHBondContact CG-OE1 3.27Å; Q383-E387 PolarHBondContact NE2-OE1 3.22Å; Q383-E387 WeakPolarHBondContact O-CG 3.27Å; Q383-E387 PolarHBondContact O-N 3.44Å; S384-E387 PolarHBondContact O-N 3.44Å; E387-R389 PolarHBondContact O-N 3.23Å; E387-R389 VanDerWaalsContact O-N 3.1Å; E387-L390 CarbonylContact O-C 3.55Å; E387-L390 WeakPolarHBondContact O-CA 3.23Å; E387-L390 PolarHBondContact O-N 2.78Å; E387-E391 PolarHBondContact O-N 3.29Å
388D79.1Confident74.3Confident63 Ų63101 Ų10134%0.33750%0.504SS..Hα-helixtrans-61.3-17.6173.817766.4000113.4S384 R392S384-D388 WeakPolarHBondContact O-CB 3.42Å; S384-D388 PolarHBondContact O-N 2.9Å; D388-R392 VanDerWaalsContact CG-NH2 3.31Å; D388-R392 PolarHBondContact O-NH1 3.36Å; D388-R392 IonicContact OD1-CZ 3.83Å; D388-R392 IonicContact OD1-NH1 2.59Å; D388-R392 PolarHBondContact OD1-NH1 2.67Å; D388-R392 VanDerWaalsContact OD1-NH1 3.13Å; D388-R392 IonicContact OD1-NH2 3.78Å; D388-R392 PolarHBondContact OD1-NH2 3.27Å; D388-R392 IonicContact OD2-CZ 3.47Å; D388-R392 IonicContact OD2-NH1 2.79Å; D388-R392 PolarHBondContact OD2-NH1 2.68Å; D388-R392 IonicContact OD2-NH2 3.35Å; D388-R392 PolarHBondContact OD2-NH2 3.14Å
389R78.9Confident76Confident181 Ų181100.6 Ų100.668%0.68350%0.5SS*.Hα-helixtrans-93.4-26.2172.2-164.1-177.1-172.1-73.41.3112.8R385 I386 E387 L393R385-R389 WeakPolarHBondContact O-CB 3.45Å; I386-R389 CarbonylContact O-C 3.56Å; I386-R389 WeakPolarHBondContact O-CA 3.34Å; I386-R389 WeakPolarHBondContact O-CB 3.42Å; I386-R389 PolarHBondContact O-N 2.84Å; I386-R389 VanDerWaalsContact O-N 3.1Å; E387-R389 PolarHBondContact O-N 3.23Å; E387-R389 VanDerWaalsContact O-N 3.1Å; R389-L393 WeakPolarHBondContact O-CB 3.48Å; R389-L393 PolarHBondContact O-N 2.94Å
390L84.9Confident77.5Confident94 Ų94100 Ų10049%0.49250%0.496SS..Hα-helixtrans-77.3-43.1173-70.9168.9000111I386 E387 R392 L393 D394I386-L390 HydrophobicContact CG2-CD1 4.03Å; I386-L390 HydrophobicContact CG2-CG 4.5Å; I386-L390 WeakPolarHBondContact O-CG 3.3Å; I386-L390 PolarHBondContact O-N 3.24Å; E387-L390 CarbonylContact O-C 3.55Å; E387-L390 WeakPolarHBondContact O-CA 3.23Å; E387-L390 PolarHBondContact O-N 2.78Å; L390-R392 PolarHBondContact O-N 2.98Å; L390-L393 CarbonylContact O-C 3.58Å; L390-L393 WeakPolarHBondContact O-CA 3.49Å; L390-L393 VanDerWaalsContact O-CB 3.3Å; L390-L393 WeakPolarHBondContact O-CB 3.31Å; L390-L393 PolarHBondContact O-N 3.11Å; L390-D394 PolarHBondContact O-N 2.84Å
391E82.9Confident78.6Confident134 Ų13499.9 Ų99.963%0.62649%0.49SS*.Hα-helixtrans-57.8-47.4176.2-173.7173.4-158.200111.2E387 L393 D394 D395E387-E391 PolarHBondContact O-N 3.29Å; E391-L393 VanDerWaalsContact C-N 3.26Å; E391-L393 PolarHBondContact O-N 3.02Å; E391-D394 PolarHBondContact O-N 2.89Å; E391-D395 PolarHBondContact O-N 3.03Å
392R84.2Confident79.4Confident148 Ų148102.6 Ų102.656%0.55850%0.499SS*.Hα-helixtrans-68-21.4173.2-67-166.4-16188.64.4114.4D388 L390 A396D388-R392 VanDerWaalsContact CG-NH2 3.31Å; D388-R392 PolarHBondContact O-NH1 3.36Å; D388-R392 IonicContact OD1-CZ 3.83Å; D388-R392 IonicContact OD1-NH1 2.59Å; D388-R392 PolarHBondContact OD1-NH1 2.67Å; D388-R392 VanDerWaalsContact OD1-NH1 3.13Å; D388-R392 IonicContact OD1-NH2 3.78Å; D388-R392 PolarHBondContact OD1-NH2 3.27Å; D388-R392 IonicContact OD2-CZ 3.47Å; D388-R392 IonicContact OD2-NH1 2.79Å; D388-R392 PolarHBondContact OD2-NH1 2.68Å; D388-R392 IonicContact OD2-NH2 3.35Å; D388-R392 PolarHBondContact OD2-NH2 3.14Å; L390-R392 PolarHBondContact O-N 2.98Å; R392-A396 VanDerWaalsContact O-CB 3.3Å; R392-A396 WeakPolarHBondContact O-CB 3.5Å; R392-A396 PolarHBondContact O-N 2.83Å; R392-A396 VanDerWaalsContact O-N 3.14Å
393L88.8Confident79.6Confident84 Ų84105.5 Ų105.544%0.4451%0.51SS..Hα-helixtrans-75.9-43.7173.3-170.273.6000110.1R389 L390 E391 A396 I397R389-L393 WeakPolarHBondContact O-CB 3.48Å; R389-L393 PolarHBondContact O-N 2.94Å; L390-L393 CarbonylContact O-C 3.58Å; L390-L393 WeakPolarHBondContact O-CA 3.49Å; L390-L393 VanDerWaalsContact O-CB 3.3Å; L390-L393 WeakPolarHBondContact O-CB 3.31Å; L390-L393 PolarHBondContact O-N 3.11Å; E391-L393 VanDerWaalsContact C-N 3.26Å; E391-L393 PolarHBondContact O-N 3.02Å; L393-A396 PolarHBondContact O-N 2.77Å; L393-I397 HydrophobicContact CD2-CD1 4.5Å; L393-I397 HydrophobicContact CG-CD1 4.02Å; L393-I397 WeakPolarHBondContact O-CB 3.46Å; L393-I397 VanDerWaalsContact O-CG1 3.23Å; L393-I397 WeakPolarHBondContact O-CG1 3.41Å; L393-I397 PolarHBondContact O-N 3.16Å
394D85.9Confident79.6Confident88 Ų88105 Ų10547%0.47152%0.523SS..Hα-helixtrans-66-39.5175.1-86.2-32.4000111.8L390 E391 I397 H398L390-D394 PolarHBondContact O-N 2.84Å; E391-D394 PolarHBondContact O-N 2.89Å; D394-I397 CarbonylContact O-C 3.6Å; D394-I397 PolarHBondContact O-N 3.27Å; D394-H398 PolarHBondContact O-N 2.97Å; D394-H398 PolarHBondContact O-ND1 3.47Å
395D87.8Confident79.2Confident106 Ų106106.9 Ų106.957%0.56753%0.532SS*.Hα-helixtrans-58.9-46.7170.4-102.5-0.6000111.5E391 I397 H398 V399E391-D395 PolarHBondContact O-N 3.03Å; D395-I397 VanDerWaalsContact C-N 3.29Å; D395-I397 PolarHBondContact O-N 3.42Å; D395-H398 PolarHBondContact O-N 3.4Å; D395-V399 WeakPolarHBondContact O-CG2 3.29Å; D395-V399 PolarHBondContact O-N 3.01Å
396A81.1Confident78.2Confident47 Ų47102 Ų10239%0.38853%0.525SS..Hα-helixtrans-62.3-36.517600000112.1R392 L393 L400R392-A396 VanDerWaalsContact O-CB 3.3Å; R392-A396 WeakPolarHBondContact O-CB 3.5Å; R392-A396 PolarHBondContact O-N 2.83Å; R392-A396 VanDerWaalsContact O-N 3.14Å; L393-A396 PolarHBondContact O-N 2.77Å; A396-L400 WeakPolarHBondContact O-CB 3.46Å; A396-L400 WeakPolarHBondContact O-CD1 3.33Å; A396-L400 PolarHBondContact O-N 2.97Å
397I85.5Confident76.7Confident57 Ų57104.1 Ų104.129%0.29254%0.544SS..Hα-helixtrans-70.3-38.1175.3-71.7164.5000111.4L393 D394 D395 L400 R401L393-I397 HydrophobicContact CD2-CD1 4.5Å; L393-I397 HydrophobicContact CG-CD1 4.02Å; L393-I397 WeakPolarHBondContact O-CB 3.46Å; L393-I397 VanDerWaalsContact O-CG1 3.23Å; L393-I397 WeakPolarHBondContact O-CG1 3.41Å; L393-I397 PolarHBondContact O-N 3.16Å; D394-I397 CarbonylContact O-C 3.6Å; D394-I397 PolarHBondContact O-N 3.27Å; D395-I397 VanDerWaalsContact C-N 3.29Å; D395-I397 PolarHBondContact O-N 3.42Å; I397-L400 PolarHBondContact O-N 3.02Å; I397-R401 HydrophobicContact CG2-CG 4.49Å; I397-R401 WeakPolarHBondContact O-CB 3.43Å; I397-R401 VanDerWaalsContact O-CG 3.31Å; I397-R401 WeakPolarHBondContact O-CG 3.24Å; I397-R401 PolarHBondContact O-N 3.33Å
398H84.6Confident74.7Confident93 Ų93104.4 Ų104.443%0.43156%0.557SS.*Hα-helixtrans-65.4-44.5173.8-77.496.6000111.4D394 D395 R401 N402D394-H398 PolarHBondContact O-N 2.97Å; D394-H398 PolarHBondContact O-ND1 3.47Å; D395-H398 PolarHBondContact O-N 3.4Å; H398-R401 PolarHBondContact O-N 3.44Å; H398-N402 WeakPolarHBondContact O-CB 3.42Å; H398-N402 PolarHBondContact O-N 2.82Å; H398-N402 PolarHBondContact O-ND2 3.28Å
399V87.5Confident73.1Confident82 Ų82108.8 Ų108.850%0.49759%0.587SS.*Hα-helixtrans-61.3-44.8173.1173.20000110.9D395 R401 N402 H403D395-V399 WeakPolarHBondContact O-CG2 3.29Å; D395-V399 PolarHBondContact O-N 3.01Å; V399-R401 PolarHBondContact O-N 3.45Å; V399-N402 PolarHBondContact O-N 3.43Å; V399-H403 WeakPolarHBondContact O-CB 3.3Å; V399-H403 PolarHBondContact O-CD2 3.16Å; V399-H403 PolarHBondContact O-N 2.94Å
400L85.1Confident71.1Confident122 Ų122104.5 Ų104.564%0.63959%0.59SS**Hα-helixtrans-62.4-41.6175.6-104.874.8000112.4A396 I397 H403 A404A396-L400 WeakPolarHBondContact O-CB 3.46Å; A396-L400 WeakPolarHBondContact O-CD1 3.33Å; A396-L400 PolarHBondContact O-N 2.97Å; I397-L400 PolarHBondContact O-N 3.02Å; L400-H403 PolarHBondContact O-N 3.16Å; L400-A404 WeakPolarHBondContact O-CB 3.4Å; L400-A404 PolarHBondContact O-N 3.45Å
401R76.3Confident69Low148 Ų148108.5 Ų108.556%0.55861%0.608SS**Hα-helixtrans-62.5-45.4175.7-76.4175.8-173.8165.65.6111.2I397 H398 V399 H403 A404 V405I397-R401 HydrophobicContact CG2-CG 4.49Å; I397-R401 WeakPolarHBondContact O-CB 3.43Å; I397-R401 VanDerWaalsContact O-CG 3.31Å; I397-R401 WeakPolarHBondContact O-CG 3.24Å; I397-R401 PolarHBondContact O-N 3.33Å; H398-R401 PolarHBondContact O-N 3.44Å; V399-R401 PolarHBondContact O-N 3.45Å; R401-H403 VanDerWaalsContact C-N 3.26Å; R401-H403 PolarHBondContact O-N 3.35Å; R401-A404 PolarHBondContact O-N 3.39Å; R401-V405 VanDerWaalsContact O-CB 3.31Å; R401-V405 WeakPolarHBondContact O-CB 3.42Å; R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 3.32Å
402N74.5Confident67Low121 Ų121108.5 Ų108.565%0.64762%0.62SS**Hα-helixtrans-67.7-23.1179.6-67.4-17.3000113.4H398 V399H398-N402 WeakPolarHBondContact O-CB 3.42Å; H398-N402 PolarHBondContact O-N 2.82Å; H398-N402 PolarHBondContact O-ND2 3.28Å; V399-N402 PolarHBondContact O-N 3.43Å
403H65.6Low64.7Low153 Ų153104.9 Ų104.971%0.70863%0.628SS**Hα-helixtrans-94.8-30.3174.4-83.7-105.2000114.2V399 L400 R401V399-H403 WeakPolarHBondContact O-CB 3.3Å; V399-H403 PolarHBondContact O-CD2 3.16Å; V399-H403 PolarHBondContact O-N 2.94Å; L400-H403 PolarHBondContact O-N 3.16Å; R401-H403 VanDerWaalsContact C-N 3.26Å; R401-H403 PolarHBondContact O-N 3.35Å
404A61.2Low62.1Low89 Ų89104.4 Ų104.474%0.73664%0.644SS**Hα-helixtrans-81.9-35.7178.300000112L400 R401 G406L400-A404 WeakPolarHBondContact O-CB 3.4Å; L400-A404 PolarHBondContact O-N 3.45Å; R401-A404 PolarHBondContact O-N 3.39Å; A404-G406 PolarHBondContact O-N 2.94Å
405V58.8Low59.8Low106 Ų106108.4 Ų108.464%0.64266%0.659SS**SBendtrans-80.467.5161.4-170.30000107.8R401R401-V405 VanDerWaalsContact O-CB 3.31Å; R401-V405 WeakPolarHBondContact O-CB 3.42Å; R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 3.32Å
406G52Low57.3Low38 Ų38106.8 Ų106.839%0.39267%0.668SS.*PPolyproline II helixtrans-54.7151166.600000110.1A404 S408A404-G406 PolarHBondContact O-N 2.94Å; G406-S408 PolarHBondContact O-N 3.47Å
407P47Very low55.4Low135 Ų135110 Ų11088%0.87768%0.678SS**PPolyproline II helixtrans-56117-171.422.5-33.8000110.8
408S37.7Very low53.2Low103 Ų103114.2 Ų114.272%0.7270%0.699SS**PPolyproline II helixtrans-50.3146.4176.8-66.20000110.9G406 A410G406-S408 PolarHBondContact O-N 3.47Å; S408-A410 VanDerWaalsContact C-N 3.31Å; S408-A410 PolarHBondContact O-N 2.75Å
409T44.4Very low51Low156 Ų156118.5 Ų118.596%0.95772%0.719SS**SBendtrans-61.885.8-176.5510000112.3
410A38.4Very low48.3Very low90 Ų90117.7 Ų117.774%0.74473%0.727SS**  trans-122.3140.3172.900000108.9S408S408-A410 VanDerWaalsContact C-N 3.31Å; S408-A410 PolarHBondContact O-N 2.75Å
411M39.1Very low46.1Very low178 Ų178119.8 Ų119.888%0.87774%0.737SS**  trans-72.7147.9-167.7-63.7-76.7-80.800112.4G413M411-G413 VanDerWaalsContact C-N 3.29Å; M411-G413 PolarHBondContact O-N 3.29Å
412P42.6Very low44.2Very low134 Ų134120.5 Ų120.587%0.8775%0.75SS**  trans-71.484.5165.730.9-33.6000110.3
413G35.4Very low42.2Very low72 Ų72117.8 Ų117.874%0.74275%0.751SS**  trans-92.8127.9167.800000110.4M411M411-G413 VanDerWaalsContact C-N 3.29Å; M411-G413 PolarHBondContact O-N 3.29Å
414G34.6Very low41.5Very low75 Ų75116.4 Ų116.477%0.77376%0.755SS**  trans-97.6148.8-167.600000116.2
415H36.5Very low40.3Very low171 Ų171117 Ų11779%0.79275%0.754SS**  trans69119.5140.9-160.423000119.3D417H415-D417 IonicContact CE1-OD1 3.89Å; H415-D417 PolarHBondContact CE1-OD1 3.35Å; H415-D417 IonicContact CE1-OD2 2.91Å; H415-D417 PolarHBondContact CE1-OD2 3.49Å; H415-D417 IonicContact ND1-OD1 3.74Å; H415-D417 IonicContact ND1-OD2 3.74Å; H415-D417 PolarHBondContact ND1-OD2 2.89Å; H415-D417 IonicContact NE2-OD2 3.82Å
416G35.7Very low39.3Very low72 Ų72119.9 Ų119.974%0.74276%0.76SS**  trans-166.7115.2161.200000110
417D41.6Very low38.7Very low114 Ų114124.8 Ų124.861%0.6178%0.778SS**  trans-81-177-178.1-45.7-88.9000111.5H415H415-D417 IonicContact CE1-OD1 3.89Å; H415-D417 PolarHBondContact CE1-OD1 3.35Å; H415-D417 IonicContact CE1-OD2 2.91Å; H415-D417 PolarHBondContact CE1-OD2 3.49Å; H415-D417 IonicContact ND1-OD1 3.74Å; H415-D417 IonicContact ND1-OD2 3.74Å; H415-D417 PolarHBondContact ND1-OD2 2.89Å; H415-D417 IonicContact NE2-OD2 3.82Å
418M39.5Very low38.1Very low147 Ų147121.9 Ų121.972%0.72477%0.772SS**  cis-159.3-175.412-155169.9-87.700110.5
419H36.8Very low38.1Very low183 Ų183121.8 Ų121.885%0.84778%0.777SS**  trans82.6120.8171.2-52.1-83.8000116.6
420G31.5Very low37.9Very low64 Ų64123.4 Ų123.466%0.6678%0.776SS**  cis163.6157.4-13.500000114.4
421I39.2Very low37.8Very low167 Ų167122.9 Ų122.986%0.85678%0.78SS**  trans54.3120.8161.8-12-177.4000115.5
422I36.6Very low37.6Very low163 Ų163117.7 Ų117.784%0.83677%0.771SS**  -157.1159.255.8-69.9160.3000109.5
423G32.4Very low37.5Very low64 Ų64120.3 Ų120.366%0.6678%0.777SS**  trans-82.5-154.9175.700000115.3
424P51Low37.5Very low123 Ų123120.6 Ų120.680%0.79978%0.78SS**  cis-133.5168.419.141.8-25000118.2
425S35.9Very low37.7Very low103 Ų103122.9 Ų122.972%0.7278%0.784SS**  trans3.8141.8152.9-46.10000120.8
426H38Very low37.6Very low166 Ų166118.2 Ų118.277%0.76978%0.783SS**  -163.6164.973.4-118.8-95000116.3
427N39.2Very low37.6Very low141 Ų141126.2 Ų126.275%0.75479%0.792SS**  trans-26.9160.3171.2-45.9-10.3000118.7
428G34.2Very low37.2Very low73 Ų73124.4 Ų124.475%0.75380%0.801SS**  cis103.4144.15.200000114.6
429A37.9Very low36.9Very low101 Ų101124.6 Ų124.684%0.83581%0.81SS**  cis-171.8167.6-7.600000113
430M39.2Very low36.8Very low191 Ų191119.7 Ų119.794%0.94181%0.809SS**  trans82.4133.8144.7-162.9179.174.600123.4
431G36.4Very low37Very low79 Ų79124.7 Ų124.781%0.81482%0.82SS**  trans89.9154.9154.300000118
432G35.4Very low37.1Very low68 Ų68125.5 Ų125.570%0.70183%0.825SS**  cis161.2163.3-8.500000113.8
433L40.6Very low36.9Very low189 Ų189123.4 Ų123.499%0.9983%0.825SS**  trans72.1156.1173.6-44.1178000116.3
434G34.9Very low36.9Very low78 Ų78125 Ų12580%0.80483%0.832SS**  cis-167.3179.9100000113.2
435S39.2Very low36Very low124 Ų124125 Ų12587%0.86783%0.825SS**  trans-103.4160.3-168.4-178.20000115
436G34.4Very low36Very low73 Ų73130.4 Ų130.475%0.75383%0.83SS**  trans-173.612417300000116.4
437Y36.1Very low35.7Very low239 Ų239130.5 Ų130.594%0.93783%0.83SS**  trans-81162-174.4-69.7-102.9000115.9
438G32.2Very low35.2Very low77 Ų77129.8 Ų129.879%0.79484%0.836SS**  trans174.4130.5157.400000115.7
439T34.5Very low35.6Very low150 Ų150134 Ų13492%0.9284%0.84SS**  trans-133.9137-178.253.10000112.9
440G33.6Very low35.5Very low81 Ų81137.9 Ų137.984%0.83584%0.844SS**  trans-178.297.8174.300000117.6
441L36.6Very low35.1Very low168 Ų168135.5 Ų135.588%0.8884%0.839SS**  trans7.8127.7153.5-54.9172.9000121
442L41.2Very low35Very low184 Ų184134.5 Ų134.596%0.96383%0.829SS**  -178169.2114-96.4168000111.3
443S32.5Very low34.8Very low119 Ų119138 Ų13883%0.83284%0.838SS**  trans-124.9127-166.3179.20000114.5
444A32.7Very low34.2Very low98 Ų98136.1 Ų136.181%0.8182%0.823SS**  trans-157.4136.2158.600000112.2
445N31.7Very low34.1Very low124 Ų124141.6 Ų141.666%0.66382%0.819SS**  trans-70.8147167.7-137.6-30.2000108
446R36.4Very low34Very low216 Ų216141.7 Ų141.782%0.81581%0.806SS**  cis-152.4145.733.3-54.3171.5-175.1-87.2-3.2113.5
447H29.7Very low33.9Very low168 Ų168146.2 Ų146.278%0.77881%0.813SS**  trans1.7126.6158.4-63.7-108.4000121
448S30.1Very low33.7Very low125 Ų125137.3 Ų137.387%0.87479%0.794SS**  trans-141.1143.9144.4-830000108.9
449L42.4Very low33.6Very low161 Ų161141 Ų14184%0.84380%0.801SS**  trans-90.7128.6-177.9-87.865.6000111.8
450M36.2Very low33.2Very low184 Ų184137.8 Ų137.891%0.90679%0.789SS**  trans-170150.1151.7-114.5174.2-170.100113.9
451V31.1Very low33.2Very low140 Ų140141.4 Ų141.485%0.84879%0.789SS**  trans67.6113.8157.4-179.40000120.2
452G32.6Very low32.8Very low58 Ų58144 Ų14460%0.59879%0.787SS**  93.4108.1104.800000123.1
453T32Very low32.1Very low143 Ų143138.5 Ų138.588%0.87778%0.775SS**  64.9123129.655.10000124.4
454H28.2Very low31.8Very low148 Ų148138.4 Ų138.469%0.68577%0.774SS**  92.4105.6129.2-161.9-95.7000122.8E456H454-E456 IonicContact NE2-OE1 2.99Å; H454-E456 PolarHBondContact NE2-OE1 2.84Å
455R33.8Very low31.7Very low193 Ų193142.9 Ų142.973%0.72878%0.778SS**  trans57.6174139.5-78-154.9-161.6169.54.5120.8
456E35.9Very low31.3Very low126 Ų126142.2 Ų142.259%0.58978%0.783SS**  cis-163.1157.5-16.650-145117.800107.9H454H454-E456 IonicContact NE2-OE1 2.99Å; H454-E456 PolarHBondContact NE2-OE1 2.84Å
457D33.3Very low31Very low169 Ų169138.7 Ų138.790%0.90478%0.78SS**  cis-139.3-140.7-6.6-157.331.2000108.3
458G31.2Very low31.2Very low51 Ų51138.2 Ų138.253%0.52678%0.782SS.*  cis157.1124.1-2.400000113.5
459V29.4Very low32Very low156 Ų156137.6 Ų137.695%0.94578%0.775SS**  trans-145.6146.9171.9-164.10000112.2
460A27.7Very low31.2Very low82 Ų82137.4 Ų137.468%0.67878%0.775SS**  trans-76.9175-172.300000114.5
461L32.3Very low30.9Very low157 Ų157136.9 Ų136.982%0.82277%0.77SS**  -150.8127.955.2-73.9163.4000111.6
462R27.9Very low30.8Very low221 Ų221137 Ų13783%0.83477%0.771SS**  52.5109.694.2-175.8-173.7-91-87.97.7115
463G26.8Very low31.1Very low70 Ų70139.5 Ų139.572%0.72278%0.777SS**  trans-104.8178.1163.600000113.7
464S26.9Very low31Very low116 Ų116139 Ų13981%0.81177%0.773SS**  trans-152.5144170.6-74.10000110
465H29.5Very low31.4Very low192 Ų192137.9 Ų137.989%0.88978%0.779SS**  trans-109.9153.4-179.4-74.4-99000113.2
466S24Very low31.3Very low110 Ų110137.4 Ų137.477%0.76979%0.785SS**  trans-170.8153.9154-79.30000110.2
467L30.7Very low31Very low142 Ų142139.2 Ų139.274%0.74380%0.798SS**  cis-164143.9-23.2-108.2175.7000108
468L33.1Very low31.3Very low159 Ų159135.9 Ų135.983%0.83279%0.786SS**  trans67.8163.7157.7-68164.3000119.7
469P47.1Very low31.7Very low112 Ų112139.9 Ų139.973%0.72780%0.799SS**  trans-122.8-176-157.144.5-32.5000115.1
470N26.3Very low31.7Very low157 Ų157141 Ų14184%0.8479%0.794SS**  trans-150.6155.2157.8-152.27.8000113.4
471Q29.1Very low32Very low172 Ų172142.1 Ų142.180%0.80480%0.797SS**  trans-131.3141.9-179.4-63.6175.1-23.600111.2
472V29.8Very low31.7Very low144 Ų144139.3 Ų139.387%0.87380%0.797SS**  trans-165.9159.4149.9-101.10000109.7
473P38.8Very low32Very low110 Ų110134.9 Ų134.971%0.71479%0.794SS**  trans-140.1-164-134.445-26.8000117.1
474V29.5Very low32.2Very low133 Ų133136.6 Ų136.681%0.80680%0.795SS**  trans76.8149.5158.8165.40000115.8
475P36.3Very low32.7Very low124 Ų124136.5 Ų136.581%0.80579%0.792SS**  cis-116.6176.75.518.45.7000116.7
476Q32.8Very low33Very low183 Ų183134 Ų13486%0.85579%0.785SS**  trans-117.8141.1-177.7159.8-167.9-15.400110.8
477L29.6Very low33.6Very low164 Ų164136.2 Ų136.286%0.85979%0.788SS**  trans-179.7156.5157-105.6172.3000110.6
478P37.7Very low33.8Very low99 Ų99135.6 Ų135.664%0.64379%0.785SS**  -105168-67.836.2-25.8000112.7
479V40.6Very low34.2Very low134 Ų134132.4 Ų132.481%0.81277%0.774SS**  trans-71134.4168.2177.10000110.3
480Q29.3Very low33.9Very low180 Ų180133.1 Ų133.184%0.84178%0.778SS**  trans-133.1134.6154.4-69.2-164.212.700110.2
481S33.3Very low34.4Very low105 Ų105134 Ų13473%0.73478%0.778SS**  trans-77124-175-52.60000111.5T483S481-T483 PolarHBondContact O-N 2.67Å; S481-T483 VanDerWaalsContact O-N 3.1Å
482A27.1Very low34.8Very low99 Ų99131.9 Ų131.982%0.81877%0.772SS**  trans-78.586.8166.700000110.2S484A482-S484 PolarHBondContact O-N 3.2Å
483T33.9Very low35.4Very low128 Ų128130.6 Ų130.679%0.78577%0.766SS**  trans-71.1104.9158.946.50000108.3S481S481-T483 PolarHBondContact O-N 2.67Å; S481-T483 VanDerWaalsContact O-N 3.1Å
484S29.8Very low35.4Very low106 Ų106133.8 Ų133.874%0.74177%0.765SS**  trans-59.4135.6177.2-56.80000111.5A482 D486A482-S484 PolarHBondContact O-N 3.2Å; S484-D486 PolarHBondContact O-N 2.7Å
485P38.9Very low36.2Very low113 Ų113137.5 Ų137.573%0.73477%0.765SS**  trans-72.2115.4160.429.9-30.3000108.6L487P485-L487 PolarHBondContact O-N 3.13Å
486D36.3Very low36.3Very low140 Ų140140.5 Ų140.575%0.74977%0.768SS**  trans-70.9115.9168.7-18010.3000109.4S484 N488S484-D486 PolarHBondContact O-N 2.7Å; D486-N488 PolarHBondContact OD1-N 2.78Å
487L35.7Very low36.7Very low157 Ų157136 Ų13682%0.82276%0.762SS**  trans-137.763.3171.9-74.6179.8000110P485 P489P485-L487 PolarHBondContact O-N 3.13Å; L487-P489 VanDerWaalsContact O-CD 3.27Å; L487-P489 WeakPolarHBondContact O-CD 3.37Å
488N35.7Very low37.5Very low129 Ų129132 Ų13269%0.6974%0.741SS**  trans-31109.4164.9178.411.3000114.8D486D486-N488 PolarHBondContact OD1-N 2.78Å
489P40.8Very low38Very low92 Ų92131 Ų13160%0.59774%0.742SS**  trans-89.8128.5161.433.5-25.5000109.7L487 Q491L487-P489 VanDerWaalsContact O-CD 3.27Å; L487-P489 WeakPolarHBondContact O-CD 3.37Å; P489-Q491 PolarHBondContact O-N 3.28Å
490P39.9Very low38.1Very low127 Ų127133.7 Ų133.783%0.82575%0.745SS**  trans-68.896.9178.927.8-34.1000111.1D492P490-D492 PolarHBondContact O-N 3.33Å
491Q38.1Very low38.7Very low176 Ų176128.9 Ų128.982%0.82273%0.728SS**  trans-86.3105.4169.9-70.4-152.5-42.900110.2P489 P493P489-Q491 PolarHBondContact O-N 3.28Å; Q491-P493 WeakPolarHBondContact O-CD 3.49Å
492D36.4Very low39.2Very low127 Ų127128.6 Ų128.668%0.67972%0.715SS**  trans-83.5110.8173.1-168.6-17.2000109.9P490 Y494P490-D492 PolarHBondContact O-N 3.33Å; D492-Y494 PolarHBondContact O-N 2.86Å; D492-Y494 VanDerWaalsContact O-N 3.11Å
493P43.3Very low39.9Very low116 Ų116131.7 Ų131.775%0.75371%0.713SS**THydrogen-bonded Turntrans-71.6-5.6-166.8-21.235.1000116Q491 R495Q491-P493 WeakPolarHBondContact O-CD 3.49Å; P493-R495 PolarHBondContact O-N 2.83Å
494Y37.8Very low40.4Very low177 Ų177129.4 Ų129.469%0.69470%0.702SS**THydrogen-bonded Turntrans-88.71.7-165.4-85.7-85000116.4D492 E496D492-Y494 PolarHBondContact O-N 2.86Å; D492-Y494 VanDerWaalsContact O-N 3.11Å; Y494-E496 PolarHBondContact O-N 2.95Å
495R46.4Very low41Very low212 Ų212128.9 Ų128.980%0.869%0.691SS**SBendtrans-82.52-165-143.4-147.6175.1-77.7-0.6117.3P493P493-R495 PolarHBondContact O-N 2.83Å
496E39.8Very low41.2Very low186 Ų186131.7 Ų131.787%0.86969%0.687SS**SBendtrans-116.7-20.7-175.3-162.4152.3-132.400114.4Y494Y494-E496 PolarHBondContact O-N 2.95Å
497A41.2Very low41.8Very low90 Ų90127.1 Ų127.174%0.74467%0.668SS**THydrogen-bonded Turntrans-87.3-0.8-177.100000115.4
498L45.5Very low42.2Very low78 Ų78126.1 Ų126.141%0.40866%0.66SS.*THydrogen-bonded Turntrans-1065.3-168.1-76.8170.5000115.5E500 T501 Q502L498-E500 PolarHBondContact O-N 3.42Å; L498-T501 PolarHBondContact O-N 3.3Å; L498-Q502 HydrophobicContact CB-CG 4.25Å; L498-Q502 WeakPolarHBondContact O-CG 3.47Å; L498-Q502 PolarHBondContact O-N 3.49Å
499A47.2Very low42.7Very low79 Ų79126.5 Ų126.565%0.65366%0.655SS**THydrogen-bonded Turntrans-56.8-42.4-17300000113.9
500E42.8Very low43.1Very low190 Ų190124.9 Ų124.989%0.88865%0.646SS**THydrogen-bonded Turntrans-90-4.9-176.4-61.9-172.9145.700114L498L498-E500 PolarHBondContact O-N 3.42Å
501T43.4Very low43.5Very low79 Ų79124.5 Ų124.549%0.48564%0.636SS.*THydrogen-bonded Turntrans-111.5-7176.8-47.80000112.9L498 S504 N505L498-T501 PolarHBondContact O-N 3.3Å; T501-S504 PolarHBondContact O-OG 3.12Å; T501-N505 PolarHBondContact O-ND2 3.32Å
502Q43.2Very low44.1Very low100 Ų100122.2 Ų122.247%0.46763%0.63SS.*Hα-helixtrans-73-27174-85179.23.600113.7L498 S504 N505 W506L498-Q502 HydrophobicContact CB-CG 4.25Å; L498-Q502 WeakPolarHBondContact O-CG 3.47Å; L498-Q502 PolarHBondContact O-N 3.49Å; Q502-S504 VanDerWaalsContact C-N 3.26Å; Q502-S504 PolarHBondContact O-N 3.5Å; Q502-N505 PolarHBondContact O-N 3.03Å; Q502-N505 VanDerWaalsContact O-N 3.12Å; Q502-W506 PolarHBondContact O-N 2.88Å
503E42.5Very low45Very low164 Ų164119.7 Ų119.777%0.76662%0.616SS**Hα-helixtrans-69.5-14.5-176.8-86.9-161.3160.400115.3W506E503-W506 VanDerWaalsContact C-CD1 3.44Å; E503-W506 PolarHBondContact O-NE1 2.91Å
504S43.1Very low45.6Very low79 Ų79115.9 Ų115.955%0.55259%0.59SS**Hα-helixtrans-92.2-34.6166.355.50000112.8T501 Q502T501-S504 PolarHBondContact O-OG 3.12Å; Q502-S504 VanDerWaalsContact C-N 3.26Å; Q502-S504 PolarHBondContact O-N 3.5Å
505N43.1Very low46.7Very low96 Ų96115.7 Ų115.751%0.51360%0.595SS.*Hα-helixtrans-77.7-30-175.2-90.8-79.3000114.5T501 Q502 A507 Q508 K509T501-N505 PolarHBondContact O-ND2 3.32Å; Q502-N505 PolarHBondContact O-N 3.03Å; Q502-N505 VanDerWaalsContact O-N 3.12Å; N505-A507 VanDerWaalsContact C-N 3.32Å; N505-A507 PolarHBondContact O-N 3.02Å; N505-Q508 PolarHBondContact O-N 3.02Å; N505-K509 WeakPolarHBondContact O-CB 3.29Å; N505-K509 PolarHBondContact O-N 3.03Å
506W43.4Very low47.8Very low172 Ų172113.6 Ų113.665%0.65260%0.6SS**Hα-helixtrans-63.1-39.7176.777.2-71.3000112Q502 E503 Q508 K509 C510Q502-W506 PolarHBondContact O-N 2.88Å; E503-W506 VanDerWaalsContact C-CD1 3.44Å; E503-W506 PolarHBondContact O-NE1 2.91Å; W506-Q508 VanDerWaalsContact C-N 3.34Å; W506-K509 PolarHBondContact O-N 3.31Å; W506-C510 WeakPolarHBondContact O-CB 3.4Å; W506-C510 PolarHBondContact O-N 3.27Å; W506-C510 PolarHBondContact O-SG 3.35Å; W506-C510 VanDerWaalsContact O-SG 3.38Å
507A48.6Very low49.3Very low43 Ų43107.1 Ų107.136%0.35557%0.571SS.*Hα-helixtrans-67.5-33.8177.300000112.2N505 C510 N511N505-A507 VanDerWaalsContact C-N 3.32Å; N505-A507 PolarHBondContact O-N 3.02Å; A507-C510 PolarHBondContact O-SG 3.02Å; A507-C510 VanDerWaalsContact O-SG 3.38Å; A507-N511 PolarHBondContact O-ND2 2.91Å
508Q44.6Very low51.3Low137 Ų137105.9 Ų105.964%0.6455%0.554SS**Hα-helixtrans-71.2-40.9173.6-160.275.7-1.100111.5N505 W506N505-Q508 PolarHBondContact O-N 3.02Å; W506-Q508 VanDerWaalsContact C-N 3.34Å
509K46.6Very low53.1Low136 Ų136107.7 Ų107.759%0.59157%0.57SS**Hα-helixtrans-79.6-31.9-175.1-171.9147.2-172.9163.50113.8N505 W506 N511 N512 D513N505-K509 WeakPolarHBondContact O-CB 3.29Å; N505-K509 PolarHBondContact O-N 3.03Å; W506-K509 PolarHBondContact O-N 3.31Å; K509-N511 PolarHBondContact O-N 3.48Å; K509-N511 VanDerWaalsContact O-N 3.07Å; K509-N512 PolarHBondContact O-N 3.44Å; K509-D513 WeakPolarHBondContact CE-OD2 3.45Å; K509-D513 WeakPolarHBondContact CG-OD2 3.31Å; K509-D513 IonicContact NZ-OD2 2.61Å
510C47.8Very low54.9Low59 Ų59111.6 Ų111.640%0.39958%0.575SS.*THydrogen-bonded Turntrans-68.7-3.9177.8730000114.8W506 A507W506-C510 WeakPolarHBondContact O-CB 3.4Å; W506-C510 PolarHBondContact O-N 3.27Å; W506-C510 PolarHBondContact O-SG 3.35Å; W506-C510 VanDerWaalsContact O-SG 3.38Å; A507-C510 PolarHBondContact O-SG 3.02Å; A507-C510 VanDerWaalsContact O-SG 3.38Å
511N49.4Very low57.1Low118 Ų118107.3 Ų107.363%0.63156%0.555SS**THydrogen-bonded Turntrans-101.5-17.9178.3-78.4-73.3000114.5A507 K509A507-N511 PolarHBondContact O-ND2 2.91Å; K509-N511 PolarHBondContact O-N 3.48Å; K509-N511 VanDerWaalsContact O-N 3.07Å
512N49.6Very low59.2Low128 Ų128108.1 Ų108.168%0.68455%0.552SS**THydrogen-bonded Turntrans-100.5-32.3178.3-75.4-59.3000112.9K509 D514K509-N512 PolarHBondContact O-N 3.44Å; N512-D514 VanDerWaalsContact C-N 3.26Å; N512-D514 PolarHBondContact O-N 3.01Å
513D55Low61.5Low74 Ų74106.3 Ų106.340%0.39655%0.554SS.*THydrogen-bonded Turntrans-88.429.9-178.7-59.6-25.8000112.9K509 L517 R525K509-D513 WeakPolarHBondContact CE-OD2 3.45Å; K509-D513 WeakPolarHBondContact CG-OD2 3.31Å; K509-D513 IonicContact NZ-OD2 2.61Å; D513-L517 VanDerWaalsContact O-CD1 3.28Å; D513-L517 WeakPolarHBondContact O-CD1 3.22Å; D513-R525 PolarHBondContact O-NH1 3.1Å; D513-R525 PolarHBondContact O-NH2 3.1Å
514D57.5Low63.9Low37 Ų37104 Ų10420%0.19854%0.543CS..THydrogen-bonded Turntrans-134.7-5.9-169.1-138.462.8000114.8N512 K522 R525N512-D514 VanDerWaalsContact C-N 3.26Å; N512-D514 PolarHBondContact O-N 3.01Å; D514-K522 WeakPolarHBondContact OD2-CE 3.37Å; D514-K522 IonicContact OD2-NZ 2.72Å; D514-K522 PolarHBondContact OD2-NZ 3.31Å; D514-R525 IonicContact OD1-CZ 3.15Å; D514-R525 IonicContact OD1-NH1 4Å; D514-R525 PolarHBondContact OD1-NH1 2.9Å
515E60.6Low66.2Low173 Ų173105.3 Ų105.381%0.80854%0.536SS*.SBendtrans-85.4-37.2176.1-68-74.3113.900112.8
516D68.3Low68.6Low167 Ų167103.3 Ų103.389%0.89352%0.524SS*.SBendtrans-88.10.3-179.3-85.7-39.5000114.2
517L72Confident71.1Confident51 Ų51100.2 Ų100.227%0.26752%0.515SS..  trans-83.5137.8-176.6-69.4-176.8000112.8D513 Q521 R525D513-L517 VanDerWaalsContact O-CD1 3.28Å; D513-L517 WeakPolarHBondContact O-CD1 3.22Å; L517-Q521 HydrophobicContact CB-CB 4.4Å; L517-Q521 HydrophobicContact CD2-CB 4.29Å; L517-R525 VanDerWaalsContact CD1-NH1 3.32Å
518T82.6Confident73.4Confident64 Ų64104.4 Ų104.439%0.39353%0.527SS..  trans-66152.3172.874.90000110.8E520 Q521 K522T518-E520 PolarHBondContact O-N 3.4Å; T518-E520 VanDerWaalsContact O-N 3.07Å; T518-Q521 PolarHBondContact O-N 3.33Å; T518-Q521 WeakPolarHBondContact OG1-CG 3.45Å; T518-Q521 PolarHBondContact OG1-N 3.12Å; T518-Q521 PolarHBondContact OG1-OE1 2.76Å; T518-K522 PolarHBondContact O-N 3.5Å
519P83.6Confident75.9Confident115 Ų115104.7 Ų104.775%0.74752%0.522SS*.Hα-helixtrans-54.8-29.3176.3-2836000113.7A523P519-A523 WeakPolarHBondContact O-CB 3.46Å; P519-A523 PolarHBondContact O-N 3.07Å
520E84.9Confident78.3Confident162 Ų162105.7 Ų105.776%0.75752%0.523SS*.Hα-helixtrans-71.6-45.7176.3-172.6167.5-148.100112.2T518 K522 A523 E524T518-E520 PolarHBondContact O-N 3.4Å; T518-E520 VanDerWaalsContact O-N 3.07Å; E520-K522 VanDerWaalsContact C-N 3.32Å; E520-K522 PolarHBondContact O-N 2.64Å; E520-A523 WeakPolarHBondContact O-CB 3.49Å; E520-A523 PolarHBondContact O-N 2.89Å; E520-E524 PolarHBondContact O-N 3.33Å
521Q89.1Confident80.6Confident99 Ų99108.2 Ų108.246%0.46353%0.53SS..Hα-helixtrans-61.9-39.5173.6-71168.1-2900111.8L517 T518 E524 R525L517-Q521 HydrophobicContact CB-CB 4.4Å; L517-Q521 HydrophobicContact CD2-CB 4.29Å; T518-Q521 PolarHBondContact O-N 3.33Å; T518-Q521 WeakPolarHBondContact OG1-CG 3.45Å; T518-Q521 PolarHBondContact OG1-N 3.12Å; T518-Q521 PolarHBondContact OG1-OE1 2.76Å; Q521-E524 PolarHBondContact O-N 2.82Å; Q521-R525 WeakPolarHBondContact O-CB 3.2Å; Q521-R525 PolarHBondContact O-N 2.95Å
522K88.3Confident82.9Confident96 Ų96104.6 Ų104.642%0.41752%0.516SS..Hα-helixtrans-66.9-37.3176.1-166.7155178.3155.50112D514 T518 E520 E526D514-K522 WeakPolarHBondContact OD2-CE 3.37Å; D514-K522 IonicContact OD2-NZ 2.72Å; D514-K522 PolarHBondContact OD2-NZ 3.31Å; T518-K522 PolarHBondContact O-N 3.5Å; E520-K522 VanDerWaalsContact C-N 3.32Å; E520-K522 PolarHBondContact O-N 2.64Å; K522-E526 PolarHBondContact O-N 3.11Å; K522-E526 VanDerWaalsContact O-N 3.11Å
523A90.5Very high85.2Confident62 Ų62103.2 Ų103.251%0.51251%0.509SS..Hα-helixtrans-66.5-38.417200000112.6P519 E520 K527P519-A523 WeakPolarHBondContact O-CB 3.46Å; P519-A523 PolarHBondContact O-N 3.07Å; E520-A523 WeakPolarHBondContact O-CB 3.49Å; E520-A523 PolarHBondContact O-N 2.89Å; A523-K527 VanDerWaalsContact O-CB 3.28Å; A523-K527 WeakPolarHBondContact O-CB 3.46Å; A523-K527 PolarHBondContact O-N 3.02Å
524E92.6Very high87.3Confident116 Ų116103.3 Ų103.354%0.54251%0.509SS..Hα-helixtrans-69.1-42.5175.2-175.2135.3-103.500112.5E520 Q521 E526 K527 E528E520-E524 PolarHBondContact O-N 3.33Å; Q521-E524 PolarHBondContact O-N 2.82Å; E524-E526 VanDerWaalsContact C-N 3.32Å; E524-E526 PolarHBondContact O-N 3.28Å; E524-K527 WeakPolarHBondContact O-CB 3.43Å; E524-K527 PolarHBondContact O-N 2.92Å; E524-K527 VanDerWaalsContact O-N 3.17Å; E524-K527 IonicContact OE1-NZ 2.64Å; E524-K527 PolarHBondContact OE1-NZ 3.21Å; E524-E528 PolarHBondContact O-N 3.25Å
525R91.4Very high89.2Confident106 Ų106104 Ų10440%0.452%0.52SS..Hα-helixtrans-55.8-44.3172.6179.1179.9-82-175.2-4.3111.7D513 D514 L517 Q521 E528 R529D513-R525 PolarHBondContact O-NH1 3.1Å; D513-R525 PolarHBondContact O-NH2 3.1Å; D514-R525 IonicContact OD1-CZ 3.15Å; D514-R525 IonicContact OD1-NH1 4Å; D514-R525 PolarHBondContact OD1-NH1 2.9Å; L517-R525 VanDerWaalsContact CD1-NH1 3.32Å; Q521-R525 WeakPolarHBondContact O-CB 3.2Å; Q521-R525 PolarHBondContact O-N 2.95Å; R525-E528 PolarHBondContact O-N 3.43Å; R525-R529 WeakPolarHBondContact O-CB 3.27Å; R525-R529 PolarHBondContact O-N 2.96Å
526E94.6Very high91Very high54 Ų54104.7 Ų104.725%0.25252%0.516SS..Hα-helixtrans-71.3-35.1176.817559.4-174.400112.9K522 E524 R529 R530K522-E526 PolarHBondContact O-N 3.11Å; K522-E526 VanDerWaalsContact O-N 3.11Å; E524-E526 VanDerWaalsContact C-N 3.32Å; E524-E526 PolarHBondContact O-N 3.28Å; E526-R529 VanDerWaalsContact CD-NH2 3.33Å; E526-R529 PolarHBondContact O-N 3.46Å; E526-R529 IonicContact OE1-CZ 3.13Å; E526-R529 IonicContact OE1-NE 2.67Å; E526-R529 IonicContact OE1-NH2 2.76Å; E526-R529 PolarHBondContact OE1-NH2 3.12Å; E526-R529 IonicContact OE2-CZ 2.7Å; E526-R529 VanDerWaalsContact OE2-CZ 3.32Å; E526-R529 IonicContact OE2-NE 3.2Å; E526-R529 PolarHBondContact OE2-NE 3.09Å; E526-R529 IonicContact OE2-NH2 3.12Å; E526-R529 PolarHBondContact OE2-NH2 3.44Å; E526-R529 VanDerWaalsContact OE2-NH2 3.1Å; E526-R530 WeakPolarHBondContact O-CB 3.32Å; E526-R530 VanDerWaalsContact O-CG 3.31Å; E526-R530 WeakPolarHBondContact O-CG 3.37Å; E526-R530 PolarHBondContact O-N 3.28Å; E526-R530 IonicContact OE1-CZ 3.05Å; E526-R530 IonicContact OE1-NE 2.72Å; E526-R530 PolarHBondContact OE1-NE 3.34Å; E526-R530 IonicContact OE1-NH2 2.75Å; E526-R530 PolarHBondContact OE1-NH2 3.04Å
527K96.1Very high92.5Very high108 Ų108100.2 Ų100.247%0.4749%0.489SS..Hα-helixtrans-62-45.8171.9170.4-167.7164.2-157.60110.8A523 E524 R530 M531A523-K527 VanDerWaalsContact O-CB 3.28Å; A523-K527 WeakPolarHBondContact O-CB 3.46Å; A523-K527 PolarHBondContact O-N 3.02Å; E524-K527 WeakPolarHBondContact O-CB 3.43Å; E524-K527 PolarHBondContact O-N 2.92Å; E524-K527 VanDerWaalsContact O-N 3.17Å; E524-K527 IonicContact OE1-NZ 2.64Å; E524-K527 PolarHBondContact OE1-NZ 3.21Å; K527-R530 PolarHBondContact O-N 2.99Å; K527-M531 HydrophobicContact CG-CE 4.23Å; K527-M531 WeakPolarHBondContact O-CG 3.25Å; K527-M531 PolarHBondContact O-N 3.31Å
528E95.9Very high93.7Very high131 Ų131106.1 Ų106.161%0.61251%0.508SS*.Hα-helixtrans-61-48.5174.2-171.5-176.6-167.900111.4E524 R525 R530 M531 A532E524-E528 PolarHBondContact O-N 3.25Å; R525-E528 PolarHBondContact O-N 3.43Å; E528-R530 PolarHBondContact O-N 2.94Å; E528-M531 HydrophobicContact CB-CE 4.44Å; E528-M531 PolarHBondContact O-N 3.37Å; E528-A532 WeakPolarHBondContact O-CB 3.49Å; E528-A532 PolarHBondContact O-N 2.88Å
529R96.8Very high94.5Very high142 Ų142107.4 Ų107.454%0.53651%0.512SS..Hα-helixtrans-55.7-40.1176.8-164.3-168.666.783.25.5112.1R525 E526 N533R525-R529 WeakPolarHBondContact O-CB 3.27Å; R525-R529 PolarHBondContact O-N 2.96Å; E526-R529 VanDerWaalsContact CD-NH2 3.33Å; E526-R529 PolarHBondContact O-N 3.46Å; E526-R529 IonicContact OE1-CZ 3.13Å; E526-R529 IonicContact OE1-NE 2.67Å; E526-R529 IonicContact OE1-NH2 2.76Å; E526-R529 PolarHBondContact OE1-NH2 3.12Å; E526-R529 IonicContact OE2-CZ 2.7Å; E526-R529 VanDerWaalsContact OE2-CZ 3.32Å; E526-R529 IonicContact OE2-NE 3.2Å; E526-R529 PolarHBondContact OE2-NE 3.09Å; E526-R529 IonicContact OE2-NH2 3.12Å; E526-R529 PolarHBondContact OE2-NH2 3.44Å; E526-R529 VanDerWaalsContact OE2-NH2 3.1Å; R529-N533 WeakPolarHBondContact O-CB 3.49Å; R529-N533 PolarHBondContact O-N 2.7Å
530R97.3Very high95.2Very high158 Ų158108.9 Ų108.960%0.59650%0.503SS*.Hα-helixtrans-68.3-41.6174.4-73.4174.9-172.1164.17.3112.8E526 K527 E528 N533 N534E526-R530 WeakPolarHBondContact O-CB 3.32Å; E526-R530 VanDerWaalsContact O-CG 3.31Å; E526-R530 WeakPolarHBondContact O-CG 3.37Å; E526-R530 PolarHBondContact O-N 3.28Å; E526-R530 IonicContact OE1-CZ 3.05Å; E526-R530 IonicContact OE1-NE 2.72Å; E526-R530 PolarHBondContact OE1-NE 3.34Å; E526-R530 IonicContact OE1-NH2 2.75Å; E526-R530 PolarHBondContact OE1-NH2 3.04Å; K527-R530 PolarHBondContact O-N 2.99Å; E528-R530 PolarHBondContact O-N 2.94Å; R530-N533 PolarHBondContact O-N 3.32Å; R530-N534 WeakPolarHBondContact O-CB 3.47Å; R530-N534 PolarHBondContact O-N 3.46Å
531M96.9Very high95.9Very high111 Ų111104 Ų10455%0.54748%0.484SS..Hα-helixtrans-62.4-46.1175.1-70.6-172.5-59.500111.5K527 E528 N533 N534 A535K527-M531 HydrophobicContact CG-CE 4.23Å; K527-M531 WeakPolarHBondContact O-CG 3.25Å; K527-M531 PolarHBondContact O-N 3.31Å; E528-M531 HydrophobicContact CB-CE 4.44Å; E528-M531 PolarHBondContact O-N 3.37Å; M531-N533 PolarHBondContact O-N 3.15Å; M531-N534 PolarHBondContact O-N 3.17Å; M531-A535 WeakPolarHBondContact O-CB 3.36Å; M531-A535 PolarHBondContact O-N 3.44Å
532A96.9Very high96.3Very high42 Ų42105.5 Ų105.535%0.34749%0.485SS..Hα-helixtrans-62.7-40.8176.900000112.4E528 A535 R536E528-A532 WeakPolarHBondContact O-CB 3.49Å; E528-A532 PolarHBondContact O-N 2.88Å; A532-A535 PolarHBondContact O-N 3.45Å; A532-R536 WeakPolarHBondContact O-CG 3.08Å; A532-R536 PolarHBondContact O-N 3.16Å; A532-R536 VanDerWaalsContact O-N 3.15Å
533N98.2Very high96.8Very high99 Ų99104.6 Ų104.653%0.52949%0.485SS..Hα-helixtrans-64.7-45.7174.2-174.6-82.5000111.7R529 R530 M531 A535 R536 E537R529-N533 WeakPolarHBondContact O-CB 3.49Å; R529-N533 PolarHBondContact O-N 2.7Å; R530-N533 PolarHBondContact O-N 3.32Å; M531-N533 PolarHBondContact O-N 3.15Å; N533-A535 VanDerWaalsContact C-N 3.31Å; N533-A535 PolarHBondContact O-N 3.46Å; N533-R536 PolarHBondContact O-N 2.91Å; N533-E537 PolarHBondContact O-N 2.93Å
534N98.5Very high97.2Very high77 Ų77105 Ų10541%0.41248%0.478SS..Hα-helixtrans-62.9-35.9177.7-166.7-107000112.4R530 M531 R538R530-N534 WeakPolarHBondContact O-CB 3.47Å; R530-N534 PolarHBondContact O-N 3.46Å; M531-N534 PolarHBondContact O-N 3.17Å; N534-R538 VanDerWaalsContact O-CG 3.27Å; N534-R538 WeakPolarHBondContact O-CG 3.37Å; N534-R538 PolarHBondContact O-N 3.34Å; N534-R538 PolarHBondContact OD1-NE 3.12Å; N534-R538 PolarHBondContact OD1-NH2 3.32Å
535A98.6Very high97.5Very high52 Ų52102.1 Ų102.143%0.4347%0.466SS..Hα-helixtrans-64.2-44.1173.800000112.3M531 A532 N533 R538 L539M531-A535 WeakPolarHBondContact O-CB 3.36Å; M531-A535 PolarHBondContact O-N 3.44Å; A532-A535 PolarHBondContact O-N 3.45Å; N533-A535 VanDerWaalsContact C-N 3.31Å; N533-A535 PolarHBondContact O-N 3.46Å; A535-R538 PolarHBondContact O-N 2.93Å; A535-L539 PolarHBondContact O-N 3.29Å
536R98.6Very high97.8Very high187 Ų187101.3 Ų101.371%0.70647%0.467SS*.Hα-helixtrans-62.2-44.6175.4-67.7175.3-163.8-147.85.7111.8A532 N533 R538 L539 R540A532-R536 WeakPolarHBondContact O-CG 3.08Å; A532-R536 PolarHBondContact O-N 3.16Å; A532-R536 VanDerWaalsContact O-N 3.15Å; N533-R536 PolarHBondContact O-N 2.91Å; R536-R538 PolarHBondContact O-N 3.26Å; R536-L539 PolarHBondContact O-N 3.42Å; R536-R540 PolarHBondContact O-N 3.28Å
537E98.6Very high98Very high72 Ų72101.6 Ų101.634%0.33648%0.478SS..Hα-helixtrans-67-35.4178.9-172.959.1-162.100112.3N533 L539 R540 V541N533-E537 PolarHBondContact O-N 2.93Å; E537-L539 VanDerWaalsContact C-N 3.32Å; E537-L539 PolarHBondContact O-N 2.93Å; E537-R540 PolarHBondContact O-N 3.31Å; E537-R540 IonicContact OE1-CZ 3.4Å; E537-R540 IonicContact OE1-NH1 3.52Å; E537-R540 PolarHBondContact OE1-NH1 3.44Å; E537-R540 WeakPolarHBondContact OE2-CD 3.38Å; E537-R540 IonicContact OE2-CZ 2.66Å; E537-R540 IonicContact OE2-NE 3.49Å; E537-R540 IonicContact OE2-NH1 2.68Å; E537-R540 PolarHBondContact OE2-NH1 2.86Å; E537-V541 HydrophobicContact CG-CG2 4.32Å; E537-V541 WeakPolarHBondContact O-CB 3.35Å; E537-V541 VanDerWaalsContact O-CG2 3.31Å; E537-V541 WeakPolarHBondContact O-CG2 3.47Å; E537-V541 PolarHBondContact O-N 2.76Å
538R98.6Very high98.2Very high176 Ų17698.4 Ų98.466%0.66447%0.465SS*.Hα-helixtrans-59.8-40.8172-76.1172.8-166.6-119.22.6112.5N534 A535 R536 R542N534-R538 VanDerWaalsContact O-CG 3.27Å; N534-R538 WeakPolarHBondContact O-CG 3.37Å; N534-R538 PolarHBondContact O-N 3.34Å; N534-R538 PolarHBondContact OD1-NE 3.12Å; N534-R538 PolarHBondContact OD1-NH2 3.32Å; A535-R538 PolarHBondContact O-N 2.93Å; R536-R538 PolarHBondContact O-N 3.26Å; R538-R542 WeakPolarHBondContact O-CB 3.49Å; R538-R542 PolarHBondContact O-N 3.15Å
539L98.6Very high98.3Very high90 Ų9097.8 Ų97.847%0.47146%0.46SS..Hα-helixtrans-65.3-50175.5-68.1168.3000110.7A535 R536 E537 V541 R542 D543A535-L539 PolarHBondContact O-N 3.29Å; R536-L539 PolarHBondContact O-N 3.42Å; E537-L539 VanDerWaalsContact C-N 3.32Å; E537-L539 PolarHBondContact O-N 2.93Å; L539-V541 VanDerWaalsContact C-N 3.32Å; L539-V541 PolarHBondContact O-N 3.25Å; L539-R542 WeakPolarHBondContact O-CB 3.27Å; L539-R542 PolarHBondContact O-N 3.06Å; L539-R542 VanDerWaalsContact O-N 3.09Å; L539-D543 PolarHBondContact O-N 3.48Å
540R98.7Very high98.3Very high147 Ų14795.2 Ų95.256%0.55545%0.454SS*.Hα-helixtrans-54.8-44.7175.4175172.7167.5-119.61.3112.7R536 E537 D543 I544R536-R540 PolarHBondContact O-N 3.28Å; E537-R540 PolarHBondContact O-N 3.31Å; E537-R540 IonicContact OE1-CZ 3.4Å; E537-R540 IonicContact OE1-NH1 3.52Å; E537-R540 PolarHBondContact OE1-NH1 3.44Å; E537-R540 WeakPolarHBondContact OE2-CD 3.38Å; E537-R540 IonicContact OE2-CZ 2.66Å; E537-R540 IonicContact OE2-NE 3.49Å; E537-R540 IonicContact OE2-NH1 2.68Å; E537-R540 PolarHBondContact OE2-NH1 2.86Å; R540-D543 PolarHBondContact O-N 3.15Å; R540-I544 HydrophobicContact CG-CD1 4.02Å; R540-I544 WeakPolarHBondContact O-CD1 3.3Å; R540-I544 VanDerWaalsContact O-CG1 3.27Å; R540-I544 WeakPolarHBondContact O-CG1 3.36Å; R540-I544 PolarHBondContact O-N 3.43Å
541V98.8Very high98.4Very high60 Ų6090.6 Ų90.636%0.36444%0.441SS..Hα-helixtrans-67.2-39.1177.1169.60000111.8E537 L539 N545E537-V541 HydrophobicContact CG-CG2 4.32Å; E537-V541 WeakPolarHBondContact O-CB 3.35Å; E537-V541 VanDerWaalsContact O-CG2 3.31Å; E537-V541 WeakPolarHBondContact O-CG2 3.47Å; E537-V541 PolarHBondContact O-N 2.76Å; L539-V541 VanDerWaalsContact C-N 3.32Å; L539-V541 PolarHBondContact O-N 3.25Å; V541-N545 WeakPolarHBondContact O-CB 3.48Å; V541-N545 PolarHBondContact O-N 2.96Å; V541-N545 PolarHBondContact O-ND2 2.98Å; V541-N545 VanDerWaalsContact O-ND2 3.12Å; V541-N545 PolarHBondContact O-OD1 3.07Å
542R98.6Very high98.5Very high130 Ų13085.4 Ų85.449%0.49142%0.415SS..Hα-helixtrans-59-47.8172.1178.8-15968.5170.3-1.8110.8R538 L539 I544 N545 E546R538-R542 WeakPolarHBondContact O-CB 3.49Å; R538-R542 PolarHBondContact O-N 3.15Å; L539-R542 WeakPolarHBondContact O-CB 3.27Å; L539-R542 PolarHBondContact O-N 3.06Å; L539-R542 VanDerWaalsContact O-N 3.09Å; R542-I544 PolarHBondContact O-N 3.24Å; R542-N545 CarbonylContact O-C 3.57Å; R542-N545 WeakPolarHBondContact O-CA 3.35Å; R542-N545 VanDerWaalsContact O-CB 3.3Å; R542-N545 WeakPolarHBondContact O-CB 3.5Å; R542-N545 PolarHBondContact O-N 3.29Å; R542-E546 PolarHBondContact O-N 3.19Å
543D98.8Very high98.5Very high77 Ų7790 Ų9041%0.41242%0.424SS..Hα-helixtrans-68.4-38.6-173.9-59.6-12.7000111.1L539 R540 N545 E546 A547L539-D543 PolarHBondContact O-N 3.48Å; R540-D543 PolarHBondContact O-N 3.15Å; D543-N545 VanDerWaalsContact C-N 3.31Å; D543-N545 PolarHBondContact O-N 2.99Å; D543-E546 PolarHBondContact O-N 2.91Å; D543-A547 PolarHBondContact O-N 3.02Å
544I98.8Very high98.5Very high71 Ų7190.1 Ų90.136%0.36442%0.422SS..Hα-helixtrans-59.6-40.1167.6-69.2165.5000111.3R540 R542 F548R540-I544 HydrophobicContact CG-CD1 4.02Å; R540-I544 WeakPolarHBondContact O-CD1 3.3Å; R540-I544 VanDerWaalsContact O-CG1 3.27Å; R540-I544 WeakPolarHBondContact O-CG1 3.36Å; R540-I544 PolarHBondContact O-N 3.43Å; R542-I544 PolarHBondContact O-N 3.24Å; I544-F548 HydrophobicContact CG2-CD2 3.94Å; I544-F548 HydrophobicContact CG2-CE2 4.11Å; I544-F548 WeakPolarHBondContact O-CD2 3.19Å; I544-F548 PolarHBondContact O-N 3.21Å
545N98.6Very high98.5Very high54 Ų5486.6 Ų86.629%0.28940%0.404SS..Hα-helixtrans-67.2-39.7177.8-67.1-27.3000112.5V541 R542 D543 F548 K549 K567V541-N545 WeakPolarHBondContact O-CB 3.48Å; V541-N545 PolarHBondContact O-N 2.96Å; V541-N545 PolarHBondContact O-ND2 2.98Å; V541-N545 VanDerWaalsContact O-ND2 3.12Å; V541-N545 PolarHBondContact O-OD1 3.07Å; R542-N545 CarbonylContact O-C 3.57Å; R542-N545 WeakPolarHBondContact O-CA 3.35Å; R542-N545 VanDerWaalsContact O-CB 3.3Å; R542-N545 WeakPolarHBondContact O-CB 3.5Å; R542-N545 PolarHBondContact O-N 3.29Å; D543-N545 VanDerWaalsContact C-N 3.31Å; D543-N545 PolarHBondContact O-N 2.99Å; N545-F548 WeakPolarHBondContact O-CB 3.42Å; N545-F548 PolarHBondContact O-N 3.05Å; N545-K549 WeakPolarHBondContact O-CG 3.35Å; N545-K549 PolarHBondContact O-N 3.48Å; N545-K567 WeakPolarHBondContact OD1-CE 3.31Å; N545-K567 PolarHBondContact OD1-NZ 3.23Å
546E98.6Very high98.4Very high90 Ų9087 Ų8742%0.42140%0.397SS..Hα-helixtrans-66.2-42.7175.6-59.7-45.6128.300111.6R542 D543 F548 K549 E550R542-E546 PolarHBondContact O-N 3.19Å; D543-E546 PolarHBondContact O-N 2.91Å; E546-F548 VanDerWaalsContact C-N 3.26Å; E546-F548 PolarHBondContact O-N 3.38Å; E546-K549 WeakPolarHBondContact O-CB 3.49Å; E546-K549 PolarHBondContact O-N 3Å; E546-K549 WeakPolarHBondContact OE1-CE 3.48Å; E546-K549 IonicContact OE1-NZ 2.67Å; E546-K549 PolarHBondContact OE1-NZ 3.49Å; E546-K549 WeakPolarHBondContact OE2-CD 3.47Å; E546-K549 WeakPolarHBondContact OE2-CE 3.4Å; E546-K549 IonicContact OE2-NZ 3.36Å; E546-K549 PolarHBondContact OE2-NZ 3.12Å; E546-E550 PolarHBondContact O-N 2.85Å
547A98.6Very high98.3Very high60 Ų6084.5 Ų84.550%0.49640%0.397SS..Hα-helixtrans-58.3-38.417300000112.2D543 E550 L551D543-A547 PolarHBondContact O-N 3.02Å; A547-E550 PolarHBondContact O-N 2.99Å; A547-L551 WeakPolarHBondContact O-CB 3.2Å; A547-L551 PolarHBondContact O-N 2.84Å
548F98.7Very high98.2Very high41 Ų4185.7 Ų85.718%0.1840%0.402CS..Hα-helixtrans-64.8-36.5172.5-97.9-70.7000113.4I544 N545 E546 G552 K567 I570 L571I544-F548 HydrophobicContact CG2-CD2 3.94Å; I544-F548 HydrophobicContact CG2-CE2 4.11Å; I544-F548 WeakPolarHBondContact O-CD2 3.19Å; I544-F548 PolarHBondContact O-N 3.21Å; N545-F548 WeakPolarHBondContact O-CB 3.42Å; N545-F548 PolarHBondContact O-N 3.05Å; E546-F548 VanDerWaalsContact C-N 3.26Å; E546-F548 PolarHBondContact O-N 3.38Å; F548-G552 PolarHBondContact O-N 2.99Å; F548-K567 HydrophobicContact CD1-CB 4.03Å; F548-K567 HydrophobicContact CD1-CG 3.91Å; F548-K567 HydrophobicContact CD2-CD 3.88Å; F548-K567 HydrophobicContact CD2-CG 4.11Å; F548-K567 HydrophobicContact CE1-CB 3.73Å; F548-K567 HydrophobicContact CE1-CG 4.06Å; F548-K567 WeakPolarHBondContact CE1-O 3.34Å; F548-K567 HydrophobicContact CE2-CB 4.46Å; F548-K567 HydrophobicContact CE2-CD 3.89Å; F548-K567 HydrophobicContact CE2-CG 4.26Å; F548-K567 HydrophobicContact CG-CD 4.22Å; F548-K567 HydrophobicContact CG-CG 3.94Å; F548-K567 HydrophobicContact CZ-CB 3.97Å; F548-K567 HydrophobicContact CZ-CD 4.23Å; F548-K567 HydrophobicContact CZ-CG 4.23Å; F548-I570 HydrophobicContact CD1-CB 4.26Å; F548-I570 HydrophobicContact CD1-CD1 4.1Å; F548-I570 HydrophobicContact CD1-CG2 4.2Å; F548-I570 HydrophobicContact CE1-CB 4.43Å; F548-I570 WeakPolarHBondContact O-CD1 3.35Å; F548-L571 HydrophobicContact CE1-CD2 3.91Å; F548-L571 HydrophobicContact CE1-CG 3.94Å; F548-L571 HydrophobicContact CZ-CD1 4.26Å; F548-L571 HydrophobicContact CZ-CD2 4.03Å; F548-L571 HydrophobicContact CZ-CG 4.14Å
549K98.1Very high98.1Very high118 Ų11880.6 Ų80.651%0.51339%0.388SS..Hα-helixtrans-67.9-41.1175.8-66.5175.9-160.8165.10112.2N545 E546 G552 R553N545-K549 WeakPolarHBondContact O-CG 3.35Å; N545-K549 PolarHBondContact O-N 3.48Å; E546-K549 WeakPolarHBondContact O-CB 3.49Å; E546-K549 PolarHBondContact O-N 3Å; E546-K549 WeakPolarHBondContact OE1-CE 3.48Å; E546-K549 IonicContact OE1-NZ 2.67Å; E546-K549 PolarHBondContact OE1-NZ 3.49Å; E546-K549 WeakPolarHBondContact OE2-CD 3.47Å; E546-K549 WeakPolarHBondContact OE2-CE 3.4Å; E546-K549 IonicContact OE2-NZ 3.36Å; E546-K549 PolarHBondContact OE2-NZ 3.12Å; K549-G552 PolarHBondContact O-N 3.13Å; K549-R553 PolarHBondContact O-N 3.37Å
550E98.4Very high97.9Very high88 Ų8885.3 Ų85.341%0.41140%0.404SS..Hα-helixtrans-62.3-52.8176.2-173.460.2-111.500110.5E546 A547 G552 R553 M554E546-E550 PolarHBondContact O-N 2.85Å; A547-E550 PolarHBondContact O-N 2.99Å; E550-G552 VanDerWaalsContact C-N 3.29Å; E550-G552 PolarHBondContact O-N 3.29Å; E550-R553 VanDerWaalsContact CD-NH1 3.34Å; E550-R553 PolarHBondContact O-N 2.75Å; E550-R553 VanDerWaalsContact O-N 3.16Å; E550-R553 IonicContact OE1-CZ 3.1Å; E550-R553 IonicContact OE1-NH1 2.74Å; E550-R553 PolarHBondContact OE1-NH1 3.01Å; E550-R553 IonicContact OE1-NH2 2.83Å; E550-R553 IonicContact OE2-CZ 3.84Å; E550-R553 IonicContact OE2-NH1 3.32Å; E550-R553 PolarHBondContact OE2-NH1 3.24Å; E550-R553 IonicContact OE2-NH2 3.71Å; E550-R553 PolarHBondContact OE2-NH2 3.05Å; E550-M554 WeakPolarHBondContact O-CG 3.45Å; E550-M554 PolarHBondContact O-N 3.24Å
551L98.6Very high97.6Very high60 Ų6079.3 Ų79.331%0.31439%0.385SS..Hα-helixtrans-58.2-41.6176.6-177.262.2000111.8A547 M554 V555 I570 A574A547-L551 WeakPolarHBondContact O-CB 3.2Å; A547-L551 PolarHBondContact O-N 2.84Å; L551-M554 PolarHBondContact O-N 2.91Å; L551-V555 HydrophobicContact CD1-CG2 4.14Å; L551-V555 HydrophobicContact CG-CG2 4.38Å; L551-V555 VanDerWaalsContact O-CB 3.32Å; L551-V555 WeakPolarHBondContact O-CB 3.5Å; L551-V555 WeakPolarHBondContact O-CG2 3.37Å; L551-V555 PolarHBondContact O-N 2.81Å; L551-I570 HydrophobicContact CB-CG2 4.1Å; L551-I570 HydrophobicContact CD2-CG2 3.76Å; L551-I570 HydrophobicContact CG-CG2 3.63Å; L551-A574 HydrophobicContact CD1-CB 4.16Å; L551-A574 HydrophobicContact CD2-CB 4.38Å; L551-A574 HydrophobicContact CG-CB 4.46Å
552G98.2Very high97.3Very high2 Ų283 Ų832%0.02140%0.403CS..Hα-helixtrans-55.8-51.1174.500000112.5F548 K549 E550 V555 Q556 Q565F548-G552 PolarHBondContact O-N 2.99Å; K549-G552 PolarHBondContact O-N 3.13Å; E550-G552 VanDerWaalsContact C-N 3.29Å; E550-G552 PolarHBondContact O-N 3.29Å; G552-V555 PolarHBondContact O-N 3.3Å; G552-Q556 VanDerWaalsContact O-CB 3.29Å; G552-Q556 WeakPolarHBondContact O-CB 3.5Å; G552-Q556 PolarHBondContact O-N 2.9Å; G552-Q565 VanDerWaalsContact C-OE1 3.29Å; G552-Q565 PolarHBondContact O-NE2 3.48Å; G552-Q565 PolarHBondContact O-OE1 3.43Å
553R97.9Very high97Very high138 Ų13883.6 Ų83.652%0.52141%0.409SS..Hα-helixtrans-59.8-45.7175.9-81.9-163.3-7886.30.3113K549 E550 V555 Q556 L557K549-R553 PolarHBondContact O-N 3.37Å; E550-R553 VanDerWaalsContact CD-NH1 3.34Å; E550-R553 PolarHBondContact O-N 2.75Å; E550-R553 VanDerWaalsContact O-N 3.16Å; E550-R553 IonicContact OE1-CZ 3.1Å; E550-R553 IonicContact OE1-NH1 2.74Å; E550-R553 PolarHBondContact OE1-NH1 3.01Å; E550-R553 IonicContact OE1-NH2 2.83Å; E550-R553 IonicContact OE2-CZ 3.84Å; E550-R553 IonicContact OE2-NH1 3.32Å; E550-R553 PolarHBondContact OE2-NH1 3.24Å; E550-R553 IonicContact OE2-NH2 3.71Å; E550-R553 PolarHBondContact OE2-NH2 3.05Å; R553-V555 VanDerWaalsContact C-N 3.31Å; R553-V555 PolarHBondContact O-N 2.91Å; R553-Q556 PolarHBondContact O-N 3.17Å; R553-L557 WeakPolarHBondContact O-CB 3.43Å; R553-L557 PolarHBondContact O-N 3.21Å
554M97.9Very high96.8Very high102 Ų10286 Ų8650%0.50243%0.429SS..Hα-helixtrans-59.6-43.4177.3-68.9-175.77200111.6E550 L551 L557 H558E550-M554 WeakPolarHBondContact O-CG 3.45Å; E550-M554 PolarHBondContact O-N 3.24Å; L551-M554 PolarHBondContact O-N 2.91Å; M554-L557 PolarHBondContact O-N 2.9Å; M554-H558 PolarHBondContact O-CD2 3.33Å; M554-H558 VanDerWaalsContact O-CD2 3.27Å; M554-H558 PolarHBondContact O-N 2.99Å; M554-H558 VanDerWaalsContact O-N 3.16Å
555V98.1Very high96.6Very high4 Ų484.8 Ų84.82%0.02442%0.421CS..Hα-helixtrans-68.7-42.8179.1168.20000111.9L551 G552 R553 L557 H558 L559 Q573 A574 V577L551-V555 HydrophobicContact CD1-CG2 4.14Å; L551-V555 HydrophobicContact CG-CG2 4.38Å; L551-V555 VanDerWaalsContact O-CB 3.32Å; L551-V555 WeakPolarHBondContact O-CB 3.5Å; L551-V555 WeakPolarHBondContact O-CG2 3.37Å; L551-V555 PolarHBondContact O-N 2.81Å; G552-V555 PolarHBondContact O-N 3.3Å; R553-V555 VanDerWaalsContact C-N 3.31Å; R553-V555 PolarHBondContact O-N 2.91Å; V555-L557 VanDerWaalsContact C-N 3.32Å; V555-L557 PolarHBondContact O-N 3.07Å; V555-H558 PolarHBondContact O-N 3.37Å; V555-L559 HydrophobicContact CG1-CD1 3.95Å; V555-L559 HydrophobicContact CG1-CG 4.5Å; V555-L559 WeakPolarHBondContact O-CB 3.36Å; V555-L559 WeakPolarHBondContact O-CG 3.38Å; V555-L559 PolarHBondContact O-N 2.92Å; V555-Q573 HydrophobicContact CG1-CB 3.32Å; V555-Q573 HydrophobicContact CG1-CG 4.42Å; V555-A574 HydrophobicContact CG2-CB 3.78Å; V555-V577 HydrophobicContact CG1-CG2 4.35Å
556Q97.3Very high96.6Very high60 Ų6086.5 Ų86.528%0.2843%0.434SS..Hα-helixtrans-59.7-41.5175.4176.1174.2-4.700111.6G552 R553 L559 K560 S561 D562G552-Q556 VanDerWaalsContact O-CB 3.29Å; G552-Q556 WeakPolarHBondContact O-CB 3.5Å; G552-Q556 PolarHBondContact O-N 2.9Å; R553-Q556 PolarHBondContact O-N 3.17Å; Q556-L559 PolarHBondContact O-N 2.91Å; Q556-K560 WeakPolarHBondContact O-CA 3.46Å; Q556-K560 PolarHBondContact O-N 3.38Å; Q556-S561 PolarHBondContact O-N 3.28Å; Q556-D562 PolarHBondContact NE2-OD1 3.31Å
557L96.7Very high96.6Very high134 Ų13486.7 Ų86.770%0.70243%0.433SS*.Hα-helixtrans-61.8-47.6175.9-179.465.6000111.9R553 M554 V555R553-L557 WeakPolarHBondContact O-CB 3.43Å; R553-L557 PolarHBondContact O-N 3.21Å; M554-L557 PolarHBondContact O-N 2.9Å; V555-L557 VanDerWaalsContact C-N 3.32Å; V555-L557 PolarHBondContact O-N 3.07Å
558H96.8Very high96.6Very high97 Ų9789.1 Ų89.145%0.44944%0.437SS..Hα-helixtrans-69.2-34.6179.2-81.2-66.9000113.5M554 V555 V577M554-H558 PolarHBondContact O-CD2 3.33Å; M554-H558 VanDerWaalsContact O-CD2 3.27Å; M554-H558 PolarHBondContact O-N 2.99Å; M554-H558 VanDerWaalsContact O-N 3.16Å; V555-H558 PolarHBondContact O-N 3.37Å; H558-V577 HydrophobicContact CB-CB 4.44Å; H558-V577 HydrophobicContact CB-CG1 3.63Å; H558-V577 HydrophobicContact CB-CG2 3.85Å
559L95.8Very high96.5Very high70 Ų7090 Ų9037%0.36644%0.444SS..Hα-helixtrans-88.9-6.7179.1-64.9-178000114.4V555 Q556 S561 Q573 V577V555-L559 HydrophobicContact CG1-CD1 3.95Å; V555-L559 HydrophobicContact CG1-CG 4.5Å; V555-L559 WeakPolarHBondContact O-CB 3.36Å; V555-L559 WeakPolarHBondContact O-CG 3.38Å; V555-L559 PolarHBondContact O-N 2.92Å; Q556-L559 PolarHBondContact O-N 2.91Å; L559-S561 VanDerWaalsContact C-N 3.26Å; L559-S561 PolarHBondContact O-N 3.45Å; L559-Q573 HydrophobicContact CD1-CB 3.67Å; L559-Q573 HydrophobicContact CD1-CG 3.72Å; L559-V577 HydrophobicContact CD1-CG2 4.14Å; L559-V577 HydrophobicContact CD2-CG2 3.67Å; L559-V577 HydrophobicContact CG-CG2 3.6Å
560K95.1Very high96.5Very high188 Ų18885 Ų8582%0.81742%0.423SS*.THydrogen-bonded Turntrans49.745.6-177.4-55.5180-178.8-178.80112.2Q556Q556-K560 WeakPolarHBondContact O-CA 3.46Å; Q556-K560 PolarHBondContact O-N 3.38Å
561S92.1Very high96.5Very high22 Ų2285 Ų8515%0.15443%0.425CS..  trans-136.992.5-163.1164.50000112.3Q556 L559 K563Q556-S561 PolarHBondContact O-N 3.28Å; L559-S561 VanDerWaalsContact C-N 3.26Å; L559-S561 PolarHBondContact O-N 3.45Å; S561-K563 PolarHBondContact O-N 2.88Å
562D92.8Very high96.5Very high137 Ų13788 Ų8873%0.73344%0.437SS*.  trans-74.534.5-179.8-50.9-55.4000114.5Q556Q556-D562 PolarHBondContact NE2-OD1 3.31Å
563K92.3Very high96.5Very high142 Ų14289.2 Ų89.262%0.61744%0.442SS*.PPolyproline II helixtrans-79.3137.6175.3-66.1176.2-177.6173.10109.1S561 Q565S561-K563 PolarHBondContact O-N 2.88Å; K563-Q565 WeakPolarHBondContact O-CG 3.27Å; K563-Q565 PolarHBondContact O-N 3.43Å
564P93.4Very high96.5Very high127 Ų12783.1 Ų83.183%0.82542%0.421SS*.PPolyproline II helixtrans-61.1125.4176.925.7-34.1000110.4
565Q95.1Very high96.5Very high46 Ų4682.3 Ų82.322%0.21542%0.422CS..PPolyproline II helixtrans-99.9130.4-175.1-58.6173.6-46.800111.9G552 K563 I570G552-Q565 VanDerWaalsContact C-OE1 3.29Å; G552-Q565 PolarHBondContact O-NE2 3.48Å; G552-Q565 PolarHBondContact O-OE1 3.43Å; K563-Q565 WeakPolarHBondContact O-CG 3.27Å; K563-Q565 PolarHBondContact O-N 3.43Å; Q565-I570 HydrophobicContact CB-CD1 4.05Å; Q565-I570 HydrophobicContact CB-CG1 3.57Å; Q565-I570 HydrophobicContact CG-CG1 4.27Å
566T98.2Very high96.5Very high90 Ų9084.7 Ų84.755%0.55244%0.442SS*.PPolyproline II helixtrans-87.6157.8162.867.40000109.6L568 L569 I570T566-L568 PolarHBondContact O-N 2.69Å; T566-L568 VanDerWaalsContact O-N 3.15Å; T566-L569 WeakPolarHBondContact O-CA 3.47Å; T566-L569 WeakPolarHBondContact O-CB 3.46Å; T566-L569 PolarHBondContact O-N 3.38Å; T566-L569 PolarHBondContact OG1-N 3.44Å; T566-I570 WeakPolarHBondContact O-CG1 3.33Å; T566-I570 PolarHBondContact O-N 2.98Å
567K98.5Very high96.5Very high94 Ų9482.4 Ų82.441%0.40943%0.432SS..Hα-helixtrans-48.9-44.1177.4-70.1-172.7175.3-174.60113.1N545 F548 I570 L571N545-K567 WeakPolarHBondContact OD1-CE 3.31Å; N545-K567 PolarHBondContact OD1-NZ 3.23Å; F548-K567 HydrophobicContact CD1-CB 4.03Å; F548-K567 HydrophobicContact CD1-CG 3.91Å; F548-K567 HydrophobicContact CD2-CD 3.88Å; F548-K567 HydrophobicContact CD2-CG 4.11Å; F548-K567 HydrophobicContact CE1-CB 3.73Å; F548-K567 HydrophobicContact CE1-CG 4.06Å; F548-K567 WeakPolarHBondContact CE1-O 3.34Å; F548-K567 HydrophobicContact CE2-CB 4.46Å; F548-K567 HydrophobicContact CE2-CD 3.89Å; F548-K567 HydrophobicContact CE2-CG 4.26Å; F548-K567 HydrophobicContact CG-CD 4.22Å; F548-K567 HydrophobicContact CG-CG 3.94Å; F548-K567 HydrophobicContact CZ-CB 3.97Å; F548-K567 HydrophobicContact CZ-CD 4.23Å; F548-K567 HydrophobicContact CZ-CG 4.23Å; K567-I570 PolarHBondContact O-N 2.89Å; K567-L571 WeakPolarHBondContact O-CG 3.36Å; K567-L571 PolarHBondContact O-N 2.94Å; K567-L571 VanDerWaalsContact O-N 3.15Å
568L98.1Very high96.6Very high111 Ų11180.4 Ų80.458%0.58142%0.421SS*.Hα-helixtrans-63.5-41.8177.8-177.961.1000112T566 L571 H572T566-L568 PolarHBondContact O-N 2.69Å; T566-L568 VanDerWaalsContact O-N 3.15Å; L568-L571 PolarHBondContact O-N 2.96Å; L568-H572 WeakPolarHBondContact CD1-NE2 3.4Å; L568-H572 PolarHBondContact O-CD2 3.17Å; L568-H572 PolarHBondContact O-N 2.83Å; L568-H572 VanDerWaalsContact O-N 3.12Å
569L97.6Very high96.7Very high61 Ų6180.3 Ų80.332%0.31942%0.424SS..Hα-helixtrans-66-38.1176.6-173.359.1000111.9T566 L571 H572 Q573T566-L569 WeakPolarHBondContact O-CA 3.47Å; T566-L569 WeakPolarHBondContact O-CB 3.46Å; T566-L569 PolarHBondContact O-N 3.38Å; T566-L569 PolarHBondContact OG1-N 3.44Å; L569-L571 VanDerWaalsContact C-N 3.34Å; L569-L571 PolarHBondContact O-N 3.11Å; L569-H572 PolarHBondContact O-N 3.32Å; L569-Q573 HydrophobicContact CD1-CG 3.97Å; L569-Q573 HydrophobicContact CG-CG 4.19Å; L569-Q573 VanDerWaalsContact O-CB 3.25Å; L569-Q573 WeakPolarHBondContact O-CB 2.8Å; L569-Q573 VanDerWaalsContact O-CG 3.27Å; L569-Q573 WeakPolarHBondContact O-CG 3.36Å; L569-Q573 PolarHBondContact O-N 2.74Å
570I98.3Very high96.7Very high12 Ų1279.7 Ų79.76%0.06243%0.425CS..Hα-helixtrans-58.5-45.6174.1-61.9173.6000110.3F548 L551 Q565 T566 K567 Q573 A574F548-I570 HydrophobicContact CD1-CB 4.26Å; F548-I570 HydrophobicContact CD1-CD1 4.1Å; F548-I570 HydrophobicContact CD1-CG2 4.2Å; F548-I570 HydrophobicContact CE1-CB 4.43Å; F548-I570 WeakPolarHBondContact O-CD1 3.35Å; L551-I570 HydrophobicContact CB-CG2 4.1Å; L551-I570 HydrophobicContact CD2-CG2 3.76Å; L551-I570 HydrophobicContact CG-CG2 3.63Å; Q565-I570 HydrophobicContact CB-CD1 4.05Å; Q565-I570 HydrophobicContact CB-CG1 3.57Å; Q565-I570 HydrophobicContact CG-CG1 4.27Å; T566-I570 WeakPolarHBondContact O-CG1 3.33Å; T566-I570 PolarHBondContact O-N 2.98Å; K567-I570 PolarHBondContact O-N 2.89Å; I570-Q573 PolarHBondContact O-N 3.48Å; I570-A574 VanDerWaalsContact O-CB 3.22Å; I570-A574 WeakPolarHBondContact O-CB 3.4Å; I570-A574 PolarHBondContact O-N 3.2Å
571L98.5Very high96.8Very high87 Ų8773.5 Ų73.546%0.45540%0.401SS..Hα-helixtrans-63.1-49178.5-64.6178.1000112.4F548 K567 L568 L569 Q573 A574 V575F548-L571 HydrophobicContact CE1-CD2 3.91Å; F548-L571 HydrophobicContact CE1-CG 3.94Å; F548-L571 HydrophobicContact CZ-CD1 4.26Å; F548-L571 HydrophobicContact CZ-CD2 4.03Å; F548-L571 HydrophobicContact CZ-CG 4.14Å; K567-L571 WeakPolarHBondContact O-CG 3.36Å; K567-L571 PolarHBondContact O-N 2.94Å; K567-L571 VanDerWaalsContact O-N 3.15Å; L568-L571 PolarHBondContact O-N 2.96Å; L569-L571 VanDerWaalsContact C-N 3.34Å; L569-L571 PolarHBondContact O-N 3.11Å; L571-Q573 VanDerWaalsContact C-N 3.34Å; L571-Q573 PolarHBondContact O-N 2.83Å; L571-A574 PolarHBondContact O-N 3.49Å; L571-V575 WeakPolarHBondContact O-CG2 3.44Å; L571-V575 PolarHBondContact O-N 3.3Å; L571-V575 VanDerWaalsContact O-N 3.16Å
572H97.8Very high97Very high125 Ų12576.8 Ų76.858%0.57941%0.414SS*.Hα-helixtrans-62-41.4178.1-72.3-60.9000112.5L568 L569 A576L568-H572 WeakPolarHBondContact CD1-NE2 3.4Å; L568-H572 PolarHBondContact O-CD2 3.17Å; L568-H572 PolarHBondContact O-N 2.83Å; L568-H572 VanDerWaalsContact O-N 3.12Å; L569-H572 PolarHBondContact O-N 3.32Å; H572-A576 PolarHBondContact O-N 3.1Å
573Q97.7Very high97.1Very high26 Ų2675.3 Ų75.312%0.12140%0.403CS..Hα-helixtrans-70.7-35.6178.1-73.5-178.8-12.600112.3V555 L559 L569 I570 L571 A576 V577V555-Q573 HydrophobicContact CG1-CB 3.32Å; V555-Q573 HydrophobicContact CG1-CG 4.42Å; L559-Q573 HydrophobicContact CD1-CB 3.67Å; L559-Q573 HydrophobicContact CD1-CG 3.72Å; L569-Q573 HydrophobicContact CD1-CG 3.97Å; L569-Q573 HydrophobicContact CG-CG 4.19Å; L569-Q573 VanDerWaalsContact O-CB 3.25Å; L569-Q573 WeakPolarHBondContact O-CB 2.8Å; L569-Q573 VanDerWaalsContact O-CG 3.27Å; L569-Q573 WeakPolarHBondContact O-CG 3.36Å; L569-Q573 PolarHBondContact O-N 2.74Å; I570-Q573 PolarHBondContact O-N 3.48Å; L571-Q573 VanDerWaalsContact C-N 3.34Å; L571-Q573 PolarHBondContact O-N 2.83Å; Q573-A576 PolarHBondContact O-N 3.44Å; Q573-V577 WeakPolarHBondContact O-CG2 3.41Å; Q573-V577 PolarHBondContact O-N 3.4Å
574A98.5Very high97.2Very high10 Ų1071.4 Ų71.48%0.08339%0.387CS..Hα-helixtrans-60.3-45.7174.400000111.9L551 V555 I570 L571 A576 V577 I578L551-A574 HydrophobicContact CD1-CB 4.16Å; L551-A574 HydrophobicContact CD2-CB 4.38Å; L551-A574 HydrophobicContact CG-CB 4.46Å; V555-A574 HydrophobicContact CG2-CB 3.78Å; I570-A574 VanDerWaalsContact O-CB 3.22Å; I570-A574 WeakPolarHBondContact O-CB 3.4Å; I570-A574 PolarHBondContact O-N 3.2Å; L571-A574 PolarHBondContact O-N 3.49Å; A574-A576 VanDerWaalsContact C-N 3.34Å; A574-A576 PolarHBondContact O-N 3.46Å; A574-V577 PolarHBondContact O-N 2.73Å; A574-I578 VanDerWaalsContact O-CG1 3.29Å; A574-I578 WeakPolarHBondContact O-CG1 3.47Å; A574-I578 PolarHBondContact O-N 3.41Å
575V98.4Very high97.3Very high85 Ų8569 Ų6952%0.51537%0.369SS..Hα-helixtrans-59.8-43.9175.6174.20000111.2L571 V577 I578 L579L571-V575 WeakPolarHBondContact O-CG2 3.44Å; L571-V575 PolarHBondContact O-N 3.3Å; L571-V575 VanDerWaalsContact O-N 3.16Å; V575-V577 PolarHBondContact O-N 3.03Å; V575-I578 PolarHBondContact O-N 3.45Å; V575-L579 HydrophobicContact CG1-CD1 3.84Å; V575-L579 HydrophobicContact CG1-CG 4.4Å; V575-L579 VanDerWaalsContact O-CG 3.31Å; V575-L579 WeakPolarHBondContact O-CG 3.36Å; V575-L579 PolarHBondContact O-N 3.19Å
576A97.4Very high97.1Very high55 Ų5574.1 Ų74.146%0.45539%0.387SS..Hα-helixtrans-63.7-40177.100000113.1H572 Q573 A574 S580H572-A576 PolarHBondContact O-N 3.1Å; Q573-A576 PolarHBondContact O-N 3.44Å; A574-A576 VanDerWaalsContact C-N 3.34Å; A574-A576 PolarHBondContact O-N 3.46Å; A576-S580 WeakPolarHBondContact O-CB 3.47Å; A576-S580 PolarHBondContact O-N 2.56Å; A576-S580 VanDerWaalsContact O-N 3.12Å
577V98.3Very high96.7Very high12 Ų1274.8 Ų74.87%0.07338%0.384CS..Hα-helixtrans-63.5-48.5174.7167.90000111V555 H558 L559 Q573 A574 V575 S580 L581V555-V577 HydrophobicContact CG1-CG2 4.35Å; H558-V577 HydrophobicContact CB-CB 4.44Å; H558-V577 HydrophobicContact CB-CG1 3.63Å; H558-V577 HydrophobicContact CB-CG2 3.85Å; L559-V577 HydrophobicContact CD1-CG2 4.14Å; L559-V577 HydrophobicContact CD2-CG2 3.67Å; L559-V577 HydrophobicContact CG-CG2 3.6Å; Q573-V577 WeakPolarHBondContact O-CG2 3.41Å; Q573-V577 PolarHBondContact O-N 3.4Å; A574-V577 PolarHBondContact O-N 2.73Å; V575-V577 PolarHBondContact O-N 3.03Å; V577-S580 PolarHBondContact O-N 3.39Å; V577-L581 HydrophobicContact CG1-CD1 3.71Å; V577-L581 HydrophobicContact CG1-CG 4.33Å; V577-L581 WeakPolarHBondContact O-CB 3.31Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.04Å; V577-L581 PolarHBondContact O-N 3.02Å
578I98.3Very high96.1Very high91 Ų9177 Ų7747%0.46739%0.389SS..Hα-helixtrans-58.9-52.4179.9-69.4164.5000110.3A574 V575 S580 L581 E582A574-I578 VanDerWaalsContact O-CG1 3.29Å; A574-I578 WeakPolarHBondContact O-CG1 3.47Å; A574-I578 PolarHBondContact O-N 3.41Å; V575-I578 PolarHBondContact O-N 3.45Å; I578-S580 VanDerWaalsContact C-N 3.31Å; I578-S580 PolarHBondContact O-N 3.35Å; I578-L581 PolarHBondContact O-N 3.25Å; I578-L581 VanDerWaalsContact O-N 3.14Å; I578-E582 HydrophobicContact CG2-CG 4.19Å; I578-E582 WeakPolarHBondContact O-CB 3.28Å; I578-E582 WeakPolarHBondContact O-CG 3.28Å; I578-E582 PolarHBondContact O-N 2.81Å
579L97.8Very high95.2Very high95 Ų9577.6 Ų77.650%0.49739%0.393SS..Hα-helixtrans-59.4-39.9-179.6-68.9171.2000112.5V575 Q583V575-L579 HydrophobicContact CG1-CD1 3.84Å; V575-L579 HydrophobicContact CG1-CG 4.4Å; V575-L579 VanDerWaalsContact O-CG 3.31Å; V575-L579 WeakPolarHBondContact O-CG 3.36Å; V575-L579 PolarHBondContact O-N 3.19Å; L579-Q583 WeakPolarHBondContact O-CB 3.5Å; L579-Q583 PolarHBondContact O-N 3.05Å
580S96.9Very high94.3Very high58 Ų5882.1 Ų82.141%0.40642%0.417SS..Hα-helixtrans-66-42.8175.7-174.40000112.5A576 V577 I578 Q583 Q584A576-S580 WeakPolarHBondContact O-CB 3.47Å; A576-S580 PolarHBondContact O-N 2.56Å; A576-S580 VanDerWaalsContact O-N 3.12Å; V577-S580 PolarHBondContact O-N 3.39Å; I578-S580 VanDerWaalsContact C-N 3.31Å; I578-S580 PolarHBondContact O-N 3.35Å; S580-Q583 PolarHBondContact O-N 3.16Å; S580-Q584 WeakPolarHBondContact O-CG 3.37Å; S580-Q584 PolarHBondContact O-N 2.84Å; S580-Q584 PolarHBondContact OG-NE2 3.07Å
581L96.7Very high92.7Very high57 Ų5785.7 Ų85.730%0.29844%0.436SS..Hα-helixtrans-67.9-42.3177.9-69.1173.5000111.5V577 I578 Q583 Q584 V585V577-L581 HydrophobicContact CG1-CD1 3.71Å; V577-L581 HydrophobicContact CG1-CG 4.33Å; V577-L581 WeakPolarHBondContact O-CB 3.31Å; V577-L581 VanDerWaalsContact O-CG 3.31Å; V577-L581 WeakPolarHBondContact O-CG 3.04Å; V577-L581 PolarHBondContact O-N 3.02Å; I578-L581 PolarHBondContact O-N 3.25Å; I578-L581 VanDerWaalsContact O-N 3.14Å; L581-Q583 VanDerWaalsContact C-N 3.31Å; L581-Q583 PolarHBondContact O-N 2.66Å; L581-Q584 PolarHBondContact O-N 2.61Å; L581-V585 WeakPolarHBondContact O-CB 3.38Å; L581-V585 VanDerWaalsContact O-CG2 3.27Å; L581-V585 WeakPolarHBondContact O-CG2 3.35Å; L581-V585 PolarHBondContact O-N 3.06Å
582E96.4Very high91Very high92 Ų9285.7 Ų85.743%0.4344%0.441SS..Hα-helixtrans-61.1-37.7174-73-179.717700112.7I578 R586I578-E582 HydrophobicContact CG2-CG 4.19Å; I578-E582 WeakPolarHBondContact O-CB 3.28Å; I578-E582 WeakPolarHBondContact O-CG 3.28Å; I578-E582 PolarHBondContact O-N 2.81Å; E582-R586 VanDerWaalsContact CB-NH2 3.34Å; E582-R586 WeakPolarHBondContact O-CB 3.1Å; E582-R586 WeakPolarHBondContact O-CG 3.39Å; E582-R586 PolarHBondContact O-N 3.24Å; E582-R586 PolarHBondContact O-NE 3.38Å; E582-R586 IonicContact OE2-NH2 3.45Å; E582-R586 PolarHBondContact OE2-NH2 2.91Å; E582-R586 VanDerWaalsContact OE2-NH2 3.12Å
583Q95.5Very high89.2Confident106 Ų10688 Ų8850%0.49545%0.449SS..Hα-helixtrans-64.4-50.8174.1177.7173.3-900110.3L579 S580 L581 V585 R586 E587L579-Q583 WeakPolarHBondContact O-CB 3.5Å; L579-Q583 PolarHBondContact O-N 3.05Å; S580-Q583 PolarHBondContact O-N 3.16Å; L581-Q583 VanDerWaalsContact C-N 3.31Å; L581-Q583 PolarHBondContact O-N 2.66Å; Q583-V585 VanDerWaalsContact C-N 3.27Å; Q583-V585 PolarHBondContact O-N 2.98Å; Q583-R586 WeakPolarHBondContact O-CB 3.23Å; Q583-R586 PolarHBondContact O-N 3.3Å; Q583-R586 VanDerWaalsContact O-N 3.11Å; Q583-E587 HydrophobicContact CG-CG 4.4Å; Q583-E587 VanDerWaalsContact CG-OE1 3.24Å; Q583-E587 WeakPolarHBondContact CG-OE1 3.41Å; Q583-E587 PolarHBondContact NE2-OE1 3.43Å; Q583-E587 WeakPolarHBondContact O-CG 3.44Å; Q583-E587 PolarHBondContact O-N 3.23Å
584Q93.6Very high87.4Confident60 Ų6088.9 Ų88.928%0.2846%0.461SS..Hα-helixtrans-60.5-35.1177.7-67.3173.848.300112.8S580 L581 R588S580-Q584 WeakPolarHBondContact O-CG 3.37Å; S580-Q584 PolarHBondContact O-N 2.84Å; S580-Q584 PolarHBondContact OG-NE2 3.07Å; L581-Q584 PolarHBondContact O-N 2.61Å; Q584-R588 WeakPolarHBondContact O-CB 3.36Å; Q584-R588 VanDerWaalsContact O-CG 3.25Å; Q584-R588 WeakPolarHBondContact O-CG 3.29Å; Q584-R588 PolarHBondContact O-N 3.49Å
585V95Very high85.5Confident77 Ų7789.8 Ų89.847%0.46747%0.469SS..Hα-helixtrans-68-42.7175.1167.60000110.7L581 Q583 N589L581-V585 WeakPolarHBondContact O-CB 3.38Å; L581-V585 VanDerWaalsContact O-CG2 3.27Å; L581-V585 WeakPolarHBondContact O-CG2 3.35Å; L581-V585 PolarHBondContact O-N 3.06Å; Q583-V585 VanDerWaalsContact C-N 3.27Å; Q583-V585 PolarHBondContact O-N 2.98Å; V585-N589 WeakPolarHBondContact O-CB 3.42Å; V585-N589 PolarHBondContact O-N 2.72Å; V585-N589 VanDerWaalsContact O-N 3.13Å; V585-N589 PolarHBondContact O-ND2 3.48Å
586R92.3Very high83.6Confident152 Ų15289.3 Ų89.357%0.57447%0.468SS*.Hα-helixtrans-60.5-48.3173.5-78.3174.6-85.2-165.2-10.7111.6E582 Q583 N589 L590E582-R586 VanDerWaalsContact CB-NH2 3.34Å; E582-R586 WeakPolarHBondContact O-CB 3.1Å; E582-R586 WeakPolarHBondContact O-CG 3.39Å; E582-R586 PolarHBondContact O-N 3.24Å; E582-R586 PolarHBondContact O-NE 3.38Å; E582-R586 IonicContact OE2-NH2 3.45Å; E582-R586 PolarHBondContact OE2-NH2 2.91Å; E582-R586 VanDerWaalsContact OE2-NH2 3.12Å; Q583-R586 WeakPolarHBondContact O-CB 3.23Å; Q583-R586 PolarHBondContact O-N 3.3Å; Q583-R586 VanDerWaalsContact O-N 3.11Å; R586-N589 PolarHBondContact O-N 2.72Å; R586-L590 WeakPolarHBondContact O-CB 3.31Å; R586-L590 PolarHBondContact O-N 3.34Å
587E89.9Confident81.7Confident105 Ų10592.6 Ų92.649%0.49148%0.478SS..Hα-helixtrans-63.4-45.8-179.7-71.4170.5-177.300112.8Q583 N589 L590 N591Q583-E587 HydrophobicContact CG-CG 4.4Å; Q583-E587 VanDerWaalsContact CG-OE1 3.24Å; Q583-E587 WeakPolarHBondContact CG-OE1 3.41Å; Q583-E587 PolarHBondContact NE2-OE1 3.43Å; Q583-E587 WeakPolarHBondContact O-CG 3.44Å; Q583-E587 PolarHBondContact O-N 3.23Å; E587-N589 VanDerWaalsContact C-N 3.34Å; E587-N589 PolarHBondContact O-N 3.11Å; E587-L590 PolarHBondContact O-N 3.31Å; E587-N591 PolarHBondContact O-N 2.99Å
588R85.4Confident79.7Confident141 Ų14197 Ų9753%0.53250%0.496SS..Hα-helixtrans-64.3-36.7178-73.4179-169.41158.2112.7Q584Q584-R588 WeakPolarHBondContact O-CB 3.36Å; Q584-R588 VanDerWaalsContact O-CG 3.25Å; Q584-R588 WeakPolarHBondContact O-CG 3.29Å; Q584-R588 PolarHBondContact O-N 3.49Å
589N79.7Confident77.7Confident123 Ų123100.6 Ų100.666%0.65850%0.504SS*.Hα-helixtrans-74.2-28.5176.8-77.7-63.6000112.9V585 R586 E587 N591V585-N589 WeakPolarHBondContact O-CB 3.42Å; V585-N589 PolarHBondContact O-N 2.72Å; V585-N589 VanDerWaalsContact O-N 3.13Å; V585-N589 PolarHBondContact O-ND2 3.48Å; R586-N589 PolarHBondContact O-N 2.72Å; E587-N589 VanDerWaalsContact C-N 3.34Å; E587-N589 PolarHBondContact O-N 3.11Å; N589-N591 VanDerWaalsContact C-N 3.33Å; N589-N591 PolarHBondContact O-N 3.23Å
590L77.9Confident75.7Confident156 Ų156105.2 Ų105.282%0.81751%0.514SS*.Hα-helixtrans-72.1-23.8179.4-169.261.1000113.1R586 E587R586-L590 WeakPolarHBondContact O-CB 3.31Å; R586-L590 PolarHBondContact O-N 3.34Å; E587-L590 PolarHBondContact O-N 3.31Å
591N64.4Low73.5Confident86 Ų86107.8 Ų107.846%0.4652%0.52SS..  trans-138.980.2175.5-167.7-16000113.3E587 N589 K593 A594 A595E587-N591 PolarHBondContact O-N 2.99Å; N589-N591 VanDerWaalsContact C-N 3.33Å; N589-N591 PolarHBondContact O-N 3.23Å; N591-K593 PolarHBondContact O-N 3.04Å; N591-K593 PolarHBondContact OD1-N 2.92Å; N591-A594 HydrophobicContact CB-CB 4.17Å; N591-A594 PolarHBondContact O-N 3.04Å; N591-A594 PolarHBondContact OD1-N 3.22Å; N591-A595 PolarHBondContact O-N 3.18Å
592P64.1Low71.4Confident88 Ų88110 Ų11057%0.57153%0.529SS*.Hα-helixtrans-64.1-22.2-179.224.7-34.4000113.8C596P592-C596 PolarHBondContact O-N 3.08Å
593K58.2Low69.1Low172 Ų172112.5 Ų112.575%0.74854%0.541SS*.Hα-helixtrans-73.4-42176.8-70.3-174.7177.7-1800111.7N591 C596 L597N591-K593 PolarHBondContact O-N 3.04Å; N591-K593 PolarHBondContact OD1-N 2.92Å; K593-C596 PolarHBondContact O-N 2.83Å; K593-L597 PolarHBondContact O-N 3.24Å
594A60.8Low66.8Low45 Ų45115.7 Ų115.737%0.37255%0.553SS.*Hα-helixtrans-63.9-39.7173.700000112N591 C596 L597 K598N591-A594 HydrophobicContact CB-CB 4.17Å; N591-A594 PolarHBondContact O-N 3.04Å; N591-A594 PolarHBondContact OD1-N 3.22Å; A594-C596 VanDerWaalsContact C-N 3.26Å; A594-C596 PolarHBondContact O-N 2.91Å; A594-L597 PolarHBondContact O-N 2.96Å; A594-L597 VanDerWaalsContact O-N 3.17Å; A594-K598 PolarHBondContact O-N 3.33Å
595A57.9Low64.6Low30 Ų30118.1 Ų118.125%0.24857%0.571CS.*Hα-helixtrans-65.3-23.3178.200000114.4N591 R599N591-A595 PolarHBondContact O-N 3.18Å; A595-R599 PolarHBondContact O-NE 3.36Å; A595-R599 VanDerWaalsContact O-NE 3.15Å
596C59.7Low61.8Low74 Ų74119.7 Ų119.750%0.559%0.586SS.*Hα-helixtrans-83.8-35.8170-84.20000113.1P592 K593 A594 R599 R600P592-C596 PolarHBondContact O-N 3.08Å; K593-C596 PolarHBondContact O-N 2.83Å; A594-C596 VanDerWaalsContact C-N 3.26Å; A594-C596 PolarHBondContact O-N 2.91Å; C596-R599 PolarHBondContact SG-NH2 2.94Å; C596-R599 VanDerWaalsContact SG-NH2 3.44Å; C596-R600 PolarHBondContact O-N 3.31Å
597L55.9Low59.4Low124 Ų124116.7 Ų116.765%0.64959%0.588SS**Hα-helixtrans-62.6-47.5175.7-83.6160.4000111.7K593 A594 R599 R600 E601K593-L597 PolarHBondContact O-N 3.24Å; A594-L597 PolarHBondContact O-N 2.96Å; A594-L597 VanDerWaalsContact O-N 3.17Å; L597-R599 VanDerWaalsContact C-N 3.32Å; L597-R599 PolarHBondContact O-N 3.07Å; L597-R600 WeakPolarHBondContact O-CB 3.45Å; L597-R600 PolarHBondContact O-N 3.07Å; L597-E601 PolarHBondContact O-N 3.18Å
598K56.6Low56.9Low106 Ų106119.6 Ų119.646%0.46160%0.602SS.*Hα-helixtrans-64.1-32.7-178.1-161.2174-163.4-67.60113.8A594 R600 E601 E602A594-K598 PolarHBondContact O-N 3.33Å; K598-R600 VanDerWaalsContact C-N 3.31Å; K598-R600 PolarHBondContact O-N 3.25Å; K598-E601 WeakPolarHBondContact O-CB 3.06Å; K598-E601 PolarHBondContact O-N 3.45Å; K598-E602 IonicContact NZ-OE1 2.69Å; K598-E602 PolarHBondContact NZ-OE1 2.88Å; K598-E602 WeakPolarHBondContact O-CG 3.15Å; K598-E602 PolarHBondContact O-N 3.32Å
599R57.9Low55.1Low165 Ų165117.5 Ų117.562%0.62361%0.607SS**Hα-helixtrans-68.2-29.3173.7-76.3-174.7-711743.2113.1A595 C596 L597 E603A595-R599 PolarHBondContact O-NE 3.36Å; A595-R599 VanDerWaalsContact O-NE 3.15Å; C596-R599 PolarHBondContact SG-NH2 2.94Å; C596-R599 VanDerWaalsContact SG-NH2 3.44Å; L597-R599 VanDerWaalsContact C-N 3.32Å; L597-R599 PolarHBondContact O-N 3.07Å; R599-E603 PolarHBondContact O-N 2.89Å
600R54.4Low53.3Low192 Ų192116.8 Ų116.873%0.72561%0.609SS**Hα-helixtrans-81.5-22.1176.1-157.7179.5-166.2-165.33.9113.3C596 L597 K598C596-R600 PolarHBondContact O-N 3.31Å; L597-R600 WeakPolarHBondContact O-CB 3.45Å; L597-R600 PolarHBondContact O-N 3.07Å; K598-R600 VanDerWaalsContact C-N 3.31Å; K598-R600 PolarHBondContact O-N 3.25Å
601E51.7Low51.7Low112 Ų112115.3 Ų115.352%0.52361%0.609SS.*Hα-helixtrans-71.8-51.6170.2169.7-163.6135.700110.5L597 K598 E603 K604 V605L597-E601 PolarHBondContact O-N 3.18Å; K598-E601 WeakPolarHBondContact O-CB 3.06Å; K598-E601 PolarHBondContact O-N 3.45Å; E601-E603 VanDerWaalsContact C-N 3.35Å; E601-E603 PolarHBondContact O-N 3.24Å; E601-K604 PolarHBondContact O-N 3.32Å; E601-K604 VanDerWaalsContact O-N 3.08Å; E601-V605 PolarHBondContact O-N 3.33Å
602E51.8Low50.5Low103 Ų103119.4 Ų119.448%0.48163%0.63SS.*Hα-helixtrans-63.8-35.9-178.6-71.1172-155.800113K598 K604 V605 S606K598-E602 IonicContact NZ-OE1 2.69Å; K598-E602 PolarHBondContact NZ-OE1 2.88Å; K598-E602 WeakPolarHBondContact O-CG 3.15Å; K598-E602 PolarHBondContact O-N 3.32Å; E602-K604 PolarHBondContact O-N 3.48Å; E602-V605 PolarHBondContact O-N 3.38Å; E602-S606 PolarHBondContact O-N 3.07Å
603E48.2Very low49.2Very low146 Ų146120.7 Ų120.768%0.68264%0.64SS**Hα-helixtrans-58.8-33.4173.3-171.6179.9-172.200112.8R599 E601R599-E603 PolarHBondContact O-N 2.89Å; E601-E603 VanDerWaalsContact C-N 3.35Å; E601-E603 PolarHBondContact O-N 3.24Å
604K46.5Very low48.5Very low172 Ų172121.2 Ų121.275%0.74865%0.65SS**Hα-helixtrans-80.6-17.2-179.7-98.7-164.4168.8-160.60114.8E601 E602 S607E601-K604 PolarHBondContact O-N 3.32Å; E601-K604 VanDerWaalsContact O-N 3.08Å; E602-K604 PolarHBondContact O-N 3.48Å; K604-S607 PolarHBondContact O-OG 2.7Å
605V48.1Very low47.3Very low111 Ų111123.9 Ų123.967%0.67367%0.672SS**Hα-helixtrans-91.5-22.4179.3179.10000111.2E601 E602 S607E601-V605 PolarHBondContact O-N 3.33Å; E602-V605 PolarHBondContact O-N 3.38Å; V605-S607 VanDerWaalsContact C-N 3.25Å; V605-S607 PolarHBondContact O-N 3.27Å
606S36.5Very low46.2Very low111 Ų111125.4 Ų125.478%0.77669%0.691SS**THydrogen-bonded Turntrans-79.72177.2-166.80000114.7E602E602-S606 PolarHBondContact O-N 3.07Å
607S42.2Very low46Very low88 Ų88128 Ų12862%0.61571%0.707SS**THydrogen-bonded Turntrans-112.819.5-17571.30000114.4K604 V605 P609K604-S607 PolarHBondContact O-OG 2.7Å; V605-S607 VanDerWaalsContact C-N 3.25Å; V605-S607 PolarHBondContact O-N 3.27Å; S607-P609 WeakPolarHBondContact O-CD 3.49Å
608E37.4Very low45.1Very low166 Ų166131.1 Ų131.178%0.77672%0.718SS**  trans-89.8114.8173.5-169.5172.7165.200110.2
609P48.3Very low44.8Very low98 Ų98132 Ų13264%0.63673%0.734SS**  trans-73.1151.1174.531.3-34.3000110.8S607S607-P609 WeakPolarHBondContact O-CD 3.49Å
610P41.2Very low43.8Very low107 Ų107127.4 Ų127.470%0.69574%0.738SS**  trans-63.1142.5-177.726.6-35000111.9L612P610-L612 PolarHBondContact O-N 3.27Å
611P43.4Very low43.3Very low126 Ų126127.8 Ų127.882%0.81875%0.751SS**  trans-70.9106-174.527.9-34.9000111.4
612L39Very low42.6Very low172 Ų172125.8 Ų125.890%0.90176%0.76SS**  trans-72.5137.2170.1-71.9178.2000110.9P610P610-L612 PolarHBondContact O-N 3.27Å
613S38.3Very low41.8Very low114 Ų114128.9 Ų128.980%0.79778%0.78SS**  trans-76138.6-170.252.30000114.2A615S613-A615 PolarHBondContact O-N 2.68Å
614L42.8Very low41.6Very low183 Ų183126.4 Ų126.496%0.95879%0.785SS**  trans-33106.1171.5-18070000116.9
615A36Very low41.5Very low101 Ų101123.6 Ų123.684%0.83579%0.786SS**  trans-172.4141.5149.600000107.9S613S613-A615 PolarHBondContact O-N 2.68Å
616G33.8Very low41.2Very low62 Ų62126.3 Ų126.364%0.63980%0.797SS**  cis-162.9179.3-5.900000108.5
617P55.1Low41.6Very low128 Ų128129 Ų12983%0.83180%0.797SS**  trans-82.9134.8-169.632.1-34.5000113.6
618H37.2Very low41.8Very low190 Ų190133.9 Ų133.988%0.8881%0.812SS**  trans-135.8139.6163.5-95.2-88.2000111.3
619P51.3Low42.3Very low124 Ų124128.1 Ų128.181%0.80580%0.798SS**  trans-106.2164.3-172.939.9-35.5000114.4
620G35.8Very low42.2Very low69 Ų69132.3 Ų132.371%0.71181%0.809SS**  trans110.4151.5148.700000116.7
621M44.2Very low42.1Very low201 Ų201139.4 Ų139.499%0.9984%0.836SS**  trans65.9136.1177.3-55.8165.364.100114.6
622G36.7Very low42Very low69 Ų69140.1 Ų140.171%0.71184%0.836SS**  cis-179.6168.1-300000110
623D36.6Very low42.2Very low169 Ų169138.4 Ų138.490%0.90483%0.833SS**  trans-42135.5-173.3-66.4-81.1000117.3
624A42.4Very low42.4Very low94 Ų94139.7 Ų139.778%0.77784%0.835SS**  -167.9110.4116.600000113.2
625S45.3Very low42.4Very low112 Ų112137.2 Ų137.278%0.78383%0.828SS**  trans28.1109.9135.8-52.90000120.3
626N42.7Very low42.8Very low169 Ų169139.4 Ų139.490%0.90483%0.827SS**  -151.5123.9122.5-111-44.4000111.4
627H44Very low43.4Very low167 Ų167144.6 Ų144.677%0.77384%0.84SS**  trans-116.4103.5-176.4178.389000109.2
628M46.2Very low42.5Very low190 Ų190145.8 Ų145.894%0.93684%0.841SS**  trans-128.999.7167.5-77-175.967.500108.5
629G48.4Very low42.9Very low45 Ų45142.4 Ų142.446%0.46484%0.838SS.*  trans-166.2104.8179.200000111.5
630Q45.5Very low42.2Very low187 Ų187143.9 Ų143.987%0.87484%0.84SS**  trans71.8145.7178.5-48.3170.629.200112.8
631M39.1Very low42.8Very low255 Ų255150.7 Ų150.7100%1.25685%0.852SS**  cis-118.208.6-62.4177.3-178.500112.2

Retrieved 631 of 631 residues in 139.8 ms (Link to these results)