A0A096NAD7_PAPAN Loading...

Neurogenic differentiation factor

AlphaFold DB , UniProt , Accession A0A096NAD7, Species PAPAN (Papio anubis, Olive baboon), Gene NEUROD4, Length 337 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 low41.3Very low241 Ų241169.3 Ų169.3100%1.18783%0.83SS**  0119.30-75.7169.6178.100106.2
2T38.4Very low40.7Very low110 Ų110165 Ų16568%0.67582%0.821SS**  cis-157.5138.24.2-43.30000110.6
3E41Very low40.2Very low139 Ų139167.5 Ų167.565%0.6582%0.823SS**  trans59.3131.4153.5-72.7-176.1125.400120.6
4R47.3Very low40.1Very low207 Ų207163.3 Ų163.378%0.78182%0.819SS**  67.4147.878.5-63179176.3166.2-12.9112.9
5L44.8Very low39.7Very low129 Ų129166.2 Ų166.268%0.67583%0.825SS**  cis-150.1158.821.4-163.869.2000112.8
6E40.7Very low39.7Very low165 Ų165166.3 Ų166.377%0.77182%0.822SS**  trans31.6123.6155.2-74.7163.5-174.600122.9
7M41.1Very low39.5Very low187 Ų187167.4 Ų167.492%0.92183%0.827SS**  trans-91124.9141.7-69.3176.366.900109.1
8S48Very low39.4Very low125 Ų125161.5 Ų161.587%0.87482%0.817SS**  trans-73.814717551.60000111.7
9K45.3Very low39.1Very low202 Ų202162.9 Ų162.988%0.87882%0.82SS**  trans-131.5112.1-166.6-174.8179.7-176.1177.60111.1
10T37.1Very low39Very low145 Ų145163.7 Ų163.789%0.8983%0.826SS**  trans-127.3153.5168.547.70000110.5
11Y33.5Very low38.8Very low212 Ų212161.6 Ų161.683%0.83182%0.821SS**  trans-150-174.8-171-164.2-102.2000108.1
12V34.9Very low38.5Very low118 Ų118157.5 Ų157.572%0.71580%0.804SS**  trans78.4134.2179.1-171.80000111.6
13K34.1Very low38.7Very low197 Ų197157.8 Ų157.886%0.85781%0.806SS**  cis-141.2148.515.1-152.5160.3-175.8173.90113
14S37.8Very low38.7Very low109 Ų109156.9 Ų156.976%0.76281%0.812SS**  trans-80.9152.1168-35.70000112.1
15K35.3Very low38.2Very low207 Ų207152.2 Ų152.290%0.981%0.811SS**  trans-141.8133.7140.3-167171.1-179.3-175.90111.2
16E39.9Very low37.8Very low168 Ų168158.1 Ų158.179%0.78582%0.824SS**  trans-93.9149-177.2167.3-176.5-125.500111.1
17M36.3Very low37.7Very low184 Ų184159.3 Ų159.391%0.90683%0.832SS**  trans-171.3129.2136.1-98-55.3179.500108.3
18G36.7Very low37.4Very low62 Ų62156.6 Ų156.664%0.63982%0.822SS**  trans-107.7-178.1178.300000113.1
19E34.4Very low36.9Very low189 Ų189160.4 Ų160.488%0.88382%0.822SS**  trans58.6112.1166.2-56.3-167.5158.400118.5
20L36Very low36.3Very low178 Ų178153.8 Ų153.893%0.93281%0.812SS**  -147144109.4-108.4175000110.2
21V36.3Very low36.4Very low120 Ų120155.7 Ų155.773%0.72782%0.816SS**  trans-89.9129-172.7172.10000111.2
22N30.3Very low36.1Very low155 Ų155149.4 Ų149.483%0.82982%0.815SS**  trans-163.2118.7138.3-121.1-12.1000112.4
23T40.9Very low35.8Very low116 Ų116149.9 Ų149.971%0.71282%0.823SS**  trans-107.9146.4162.8420000109.3
24P40.8Very low35.7Very low120 Ų120148.3 Ų148.378%0.77982%0.819SS**  -116.1128.9105.3-8.527.4000110.4
25S37.4Very low35.3Very low109 Ų109148.6 Ų148.676%0.76281%0.812SS**  69.754.756.9-159.90000114.1
26W36.4Very low35.4Very low252 Ų252145.7 Ų145.796%0.95580%0.802SS**  trans-159.483.8136.368.1-51000110.2
27M38Very low35Very low190 Ų190143.4 Ų143.494%0.93680%0.799SS**  trans-102.5152.7173-95.2-174.7167.500111.4
28D35.8Very low34.8Very low131 Ų131141.4 Ų141.470%0.70179%0.785SS**  trans67.7120.8154-168.153000120.9
29K37.1Very low34.6Very low204 Ų204145.4 Ų145.489%0.88779%0.787SS**  176.8130.8125.5-95.4162.6-173.8177.60108.6
30G34.2Very low34.6Very low64 Ų64144.3 Ų144.366%0.6678%0.782SS**  cis-167.5170.1-6.700000110.3
31L37.3Very low34.4Very low185 Ų185143.6 Ų143.697%0.96977%0.774SS**  trans-82.8156.1-173.7-65.9167.8000113.8
32G28.1Very low34.1Very low79 Ų79142.7 Ų142.781%0.81477%0.773SS**  trans126.8103.5143.900000117.4
33S28.8Very low34.3Very low128 Ų128146.7 Ų146.790%0.89578%0.776SS**  trans-162.2131145.1-171.10000110.2
34Q31Very low34.4Very low165 Ų165147.2 Ų147.277%0.77178%0.782SS**  trans-156.8152.6170.9-147.8-163.5-53.100109.1
35N30.5Very low33.9Very low114 Ų114145.1 Ų145.161%0.6178%0.782SS**  trans71.8137165.7-69.712.3000117.2
36E36.5Very low34Very low146 Ų146146.2 Ų146.268%0.68278%0.784SS**  cis-168.9154.5-11.6-137.4176.9144.200113.3
37V31.6Very low34.1Very low120 Ų120144.9 Ų144.973%0.72778%0.781SS**  trans53.4162.7159.3-83.20000120.3
38K32.1Very low34Very low143 Ų143138.7 Ų138.762%0.62277%0.765SS**  cis-155148.415.6-140.2165.3-173.2-71.20112.5
39E33.6Very low34.5Very low145 Ų145141.7 Ų141.768%0.67878%0.777SS**  trans39.8151.1144.5-68.6161.1-16900121.6
40E34.6Very low34.9Very low166 Ų166139.7 Ų139.778%0.77678%0.775SS**  cis-154.7173-9-100-92.1143.900104.9
41E31.6Very low35Very low163 Ų163142.6 Ų142.676%0.76279%0.786SS**  cis-165.6164.746.4-162.3-165.2132.900111.4
42S30Very low35Very low101 Ų101139 Ų13971%0.70678%0.776SS**  trans79.8127.2158.5-88.90000120.3
43R33.6Very low35.6Very low239 Ų239143 Ų14390%0.90278%0.778SS**  trans-114.9-180178.2-79.2179.6170.5-163.6-0.5109.4
44P43.6Very low36Very low127 Ų127142.7 Ų142.783%0.82577%0.771SS**  cis-127.5160.7-34.731.3-15000112.8
45G29.6Very low36.6Very low76 Ų76142.8 Ų142.878%0.78477%0.771SS**  trans-121137.1166.800000111.6
46T40.9Very low36.9Very low132 Ų132146.1 Ų146.181%0.8178%0.783SS**  trans-85.1168.9176.5-171.30000112
47Y37.7Very low37.2Very low225 Ų225146.2 Ų146.288%0.88278%0.783SS**  trans63151.4-174.497.3-97.1000115.6
48G35.1Very low37.6Very low59 Ų59145.9 Ų145.961%0.60878%0.778SS**  cis17366.2-2.200000114.9
49M47.5Very low38.2Very low194 Ų194142.8 Ų142.896%0.95677%0.774SS**  trans40.477.2155.6-163.5168.479.700118.5
50L44.3Very low38.6Very low162 Ų162142 Ų14285%0.84877%0.773SS**  trans-154.2113.2155.9-174.462.9000113.4
51S36.3Very low39.1Very low125 Ų125142.5 Ų142.587%0.87478%0.775SS**  trans175.961.6148-79.70000110.1
52S38.3Very low39.7Very low109 Ų109140.9 Ų140.976%0.76277%0.767SS**  trans-86.3146.5159.4-169.60000108.4T54S52-T54 PolarHBondContact O-N 3.11Å
53L40.9Very low40.3Very low165 Ų165144.4 Ų144.486%0.86477%0.773SS**  trans-61.8117.4177.9-65.4163.4000110
54T37.3Very low40.9Very low120 Ų120142 Ų14274%0.73677%0.772SS**  trans-93.4110.6159.447.40000108.2S52 E56S52-T54 PolarHBondContact O-N 3.11Å; T54-E56 PolarHBondContact O-N 3.14Å
55E43Very low40.7Very low167 Ų167144 Ų14478%0.7877%0.77SS**  trans-63.1128.6165.4-60.2-174.1140.700108.2H57E55-H57 PolarHBondContact O-N 3.33Å
56E36.6Very low41.6Very low184 Ų184149.9 Ų149.986%0.8678%0.777SS**  trans-71.272.5-179.4-66.1-82.3146.600110.2T54 D58T54-E56 PolarHBondContact O-N 3.14Å; E56-D58 PolarHBondContact O-N 3.41Å; E56-D58 VanDerWaalsContact O-N 3.09Å
57H43.2Very low41.7Very low149 Ų149152 Ų15269%0.6978%0.778SS**  trans-74.698.2179.8-142-86.6000108.2E55 S59E55-H57 PolarHBondContact O-N 3.33Å; H57-S59 PolarHBondContact ND1-OG 3.09Å; H57-S59 PolarHBondContact O-N 3.16Å
58D40.5Very low42.3Very low113 Ų113150.3 Ų150.360%0.60478%0.778SS**  trans-68.955.9176.3-171.132.7000110.8E56 I60 R92E56-D58 PolarHBondContact O-N 3.41Å; E56-D58 VanDerWaalsContact O-N 3.09Å; D58-I60 VanDerWaalsContact C-N 3.28Å; D58-I60 PolarHBondContact O-N 3.13Å; D58-R92 IonicContact OD2-CZ 2.78Å; D58-R92 IonicContact OD2-NH1 3.51Å; D58-R92 PolarHBondContact OD2-NH1 2.93Å; D58-R92 IonicContact OD2-NH2 2.74Å; D58-R92 PolarHBondContact OD2-NH2 2.97Å
59S43.2Very low42.8Very low77 Ų77154.7 Ų154.754%0.53879%0.788SS.*  trans-73.278.1178.8-66.20000109.4H57 E61H57-S59 PolarHBondContact ND1-OG 3.09Å; H57-S59 PolarHBondContact O-N 3.16Å; S59-E61 PolarHBondContact O-N 3.25Å
60I43.3Very low42.6Very low130 Ų130147.6 Ų147.667%0.66777%0.765SS**  trans-69.8100.8168.8-170.9164.3000109.2D58 E62D58-I60 VanDerWaalsContact C-N 3.28Å; D58-I60 PolarHBondContact O-N 3.13Å; I60-E62 PolarHBondContact O-N 3.16Å
61E45.6Very low43Very low175 Ų175148.2 Ų148.282%0.81876%0.763SS**  trans-68.898170.3-67.2177.7158.500107.7S59 E63S59-E61 PolarHBondContact O-N 3.25Å; E61-E63 PolarHBondContact O-N 2.86Å
62E44.3Very low44.1Very low129 Ų129151 Ų15160%0.60376%0.759SS**  trans-78.389.4170.9-69.2-178.6132.800107.8I60 E64 K85I60-E62 PolarHBondContact O-N 3.16Å; E62-E64 PolarHBondContact O-N 3.36Å; E62-K85 IonicContact OE2-NZ 2.66Å; E62-K85 PolarHBondContact OE2-NZ 3.24Å
63E41Very low44.7Very low176 Ų176151.5 Ų151.582%0.82276%0.76SS**  trans-59.8123171.4-67.9-178126.900110.1E61 E65E61-E63 PolarHBondContact O-N 2.86Å; E63-E65 PolarHBondContact O-N 3Å; E63-E65 VanDerWaalsContact O-N 3.16Å
64E47.3Very low45.6Very low189 Ų189152.5 Ų152.588%0.88376%0.758SS**  trans-86.178.5-179.4-67.1-168.514000111.1E62 E66E62-E64 PolarHBondContact O-N 3.36Å; E64-E66 PolarHBondContact O-N 3.24Å
65E39.8Very low46.8Very low169 Ų169158.1 Ų158.179%0.7977%0.765SS**  trans-72.498.9166.5-71-170.4144.200110.9E63 E67E63-E65 PolarHBondContact O-N 3Å; E63-E65 VanDerWaalsContact O-N 3.16Å; E65-E67 VanDerWaalsContact C-N 3.32Å; E65-E67 PolarHBondContact O-N 2.88Å; E65-E67 VanDerWaalsContact O-N 3.07Å
66E47.2Very low47.7Very low198 Ų198162.5 Ų162.593%0.92578%0.775SS**  trans-7579.5164.7-70.2-157.1138.300111E64E64-E66 PolarHBondContact O-N 3.24Å
67E44.5Very low49.6Very low176 Ų176156.1 Ų156.182%0.82276%0.759SS**PPolyproline II helixtrans-75.6142.4171.5-89.6-86.9118.200112.7E65E65-E67 VanDerWaalsContact C-N 3.32Å; E65-E67 PolarHBondContact O-N 2.88Å; E65-E67 VanDerWaalsContact O-N 3.07Å
68E48.9Very low51Low190 Ų190155.4 Ų155.489%0.88877%0.767SS**PPolyproline II helixtrans-74.5169.3-161.9-152.7177.4145.200115.3
69D45.9Very low52.4Low151 Ų151159.4 Ų159.481%0.80778%0.779SS**PPolyproline II helixtrans-63.9144.1-178.2-168.820.9000113.1
70G43.8Very low53.8Low46 Ų46165.6 Ų165.647%0.47480%0.796SS.*  trans-159.984.2-17300000111.5K72G70-K72 PolarHBondContact O-N 3.08Å; G70-K72 VanDerWaalsContact O-N 3.07Å
71E53.2Low55.5Low174 Ų174168.7 Ų168.781%0.81381%0.805SS**  trans-51.3112.5-175.7-73.8-144.3112.600113.1
72K57.7Low57.2Low183 Ų183170.4 Ų170.480%0.79681%0.81SS**  trans-122.3136.4173.3-73.2166.2-171.8163.10110.1G70 K74G70-K72 PolarHBondContact O-N 3.08Å; G70-K72 VanDerWaalsContact O-N 3.07Å; K72-K74 PolarHBondContact O-N 3.35Å
73P52.2Low59.1Low120 Ų120168.3 Ų168.378%0.77980%0.801SS**  trans-62.3132-163.720.8-32.6000113.2R75P73-R75 VanDerWaalsContact C-N 3.34Å; P73-R75 PolarHBondContact O-N 3.11Å
74K60.3Low61.6Low187 Ų187165 Ų16581%0.81379%0.793SS**  trans-69.379.7-172.1-68.2160.3-177.1155.70111.8K72 R76K72-K74 PolarHBondContact O-N 3.35Å; K74-R76 PolarHBondContact O-N 3.38Å; K74-R76 VanDerWaalsContact O-N 3.13Å
75R61.7Low63.8Low238 Ų238163.2 Ų163.290%0.89878%0.782SS**  trans-53.2117174.7-66.2-173.375175.44.5110P73 G77P73-R75 VanDerWaalsContact C-N 3.34Å; P73-R75 PolarHBondContact O-N 3.11Å; R75-G77 PolarHBondContact O-N 3.4Å
76R62Low66.4Low258 Ų258158.1 Ų158.197%0.97477%0.769SS**  trans-73.2106.2-177.6-68.6-177.5177.3-175.8-1110.7K74K74-R76 PolarHBondContact O-N 3.38Å; K74-R76 VanDerWaalsContact O-N 3.13Å
77G75.9Confident68.7Low51 Ų51156.7 Ų156.753%0.52676%0.755SS.*SBendtrans-171162.8171.300000110R75 K79R75-G77 PolarHBondContact O-N 3.4Å; G77-K79 PolarHBondContact O-N 3.25Å
78P73.9Confident71.1Confident133 Ų133153 Ų15386%0.86474%0.741SS**  trans-59.7109179.9-24.335000111.3K80P78-K80 PolarHBondContact O-N 2.69Å; P78-K80 VanDerWaalsContact O-N 3.08Å
79K70Confident73.3Confident198 Ų198150.2 Ų150.286%0.86173%0.728SS**  trans-56.7117.2175.6-81.9-169174.5-173.10108.9G77 K81G77-K79 PolarHBondContact O-N 3.25Å; K79-K81 PolarHBondContact O-N 2.91Å
80K70.9Confident75.7Confident207 Ų207151.1 Ų151.190%0.972%0.72SS**  trans-59.6101.1169.3-66.5-177-179.21790108P78 K82P78-K80 PolarHBondContact O-N 2.69Å; P78-K80 VanDerWaalsContact O-N 3.08Å; K80-K82 PolarHBondContact O-N 3.3Å
81K79.2Confident78.2Confident195 Ų195154.8 Ų154.885%0.84872%0.723SS**PPolyproline II helixtrans-59.2123.2176.8-69.3-172.9176.2-175.20108.5K79 M83K79-K81 PolarHBondContact O-N 2.91Å; K81-M83 PolarHBondContact O-N 3.08Å
82K81.7Confident80.3Confident211 Ų211153.1 Ų153.192%0.91771%0.709SS**PPolyproline II helixtrans-52138.1169.4-68.7-173.3177.8-175.70108K80K80-K82 PolarHBondContact O-N 3.3Å
83M85Confident82.3Confident85 Ų85147.3 Ų147.342%0.41970%0.695SS.*PPolyproline II helixtrans-77.7136.3176.7-64.6-150.3-54.500110.2K81 R87 L88K81-M83 PolarHBondContact O-N 3.08Å; M83-R87 HydrophobicContact CB-CB 4.5Å; M83-R87 HydrophobicContact CB-CG 4.49Å; M83-R87 HydrophobicContact CE-CG 4.4Å; M83-R87 HydrophobicContact SD-CG 3.85Å; M83-R87 PolarHBondContact SD-NE 3.2Å; M83-L88 HydrophobicContact CE-CD1 4.3Å
84T93.4Very high84.4Confident106 Ų106149.1 Ų149.165%0.6569%0.686SS**PPolyproline II helixtrans-56.6145.5172.7-38.10000111.4A86 R87 L88T84-A86 VanDerWaalsContact C-N 3.34Å; T84-A86 PolarHBondContact O-N 2.94Å; T84-R87 WeakPolarHBondContact O-CA 3.44Å; T84-R87 WeakPolarHBondContact O-CB 3.32Å; T84-R87 PolarHBondContact O-N 3.31Å; T84-L88 PolarHBondContact O-N 2.8Å
85K93.6Very high86.3Confident151 Ų151147.1 Ų147.166%0.65767%0.674SS**Hα-helixtrans-47.7-51.1-179.3-162.3155.51801610112.1E62 R87 L88 E89E62-K85 IonicContact OE2-NZ 2.66Å; E62-K85 PolarHBondContact OE2-NZ 3.24Å; K85-R87 VanDerWaalsContact C-N 3.3Å; K85-R87 PolarHBondContact O-N 2.97Å; K85-L88 WeakPolarHBondContact O-CB 3.47Å; K85-L88 PolarHBondContact O-N 3.28Å; K85-L88 VanDerWaalsContact O-N 3.09Å; K85-E89 WeakPolarHBondContact O-CB 3.33Å; K85-E89 PolarHBondContact O-N 3.01Å
86A94.1Very high88Confident63 Ų63140 Ų14052%0.52166%0.656SS.*Hα-helixtrans-60.5-28.4175.300000115.2T84 R90T84-A86 VanDerWaalsContact C-N 3.34Å; T84-A86 PolarHBondContact O-N 2.94Å; A86-R90 WeakPolarHBondContact O-CB 3.45Å; A86-R90 PolarHBondContact O-N 3.04Å
87R94.1Very high89.8Confident168 Ų168134.4 Ų134.463%0.63464%0.639SS**Hα-helixtrans-77.6-36.1175.3-176.7176.9173.4178.2-3.1111.4M83 T84 K85 F91M83-R87 HydrophobicContact CB-CB 4.5Å; M83-R87 HydrophobicContact CB-CG 4.49Å; M83-R87 HydrophobicContact CE-CG 4.4Å; M83-R87 HydrophobicContact SD-CG 3.85Å; M83-R87 PolarHBondContact SD-NE 3.2Å; T84-R87 WeakPolarHBondContact O-CA 3.44Å; T84-R87 WeakPolarHBondContact O-CB 3.32Å; T84-R87 PolarHBondContact O-N 3.31Å; K85-R87 VanDerWaalsContact C-N 3.3Å; K85-R87 PolarHBondContact O-N 2.97Å; R87-F91 PolarHBondContact O-N 3.43Å
88L95Very high90.8Very high98 Ų98134.5 Ų134.551%0.51364%0.635SS.*Hα-helixtrans-67.3-43.6172.9-179.761.8000111M83 T84 K85 F91 R92M83-L88 HydrophobicContact CE-CD1 4.3Å; T84-L88 PolarHBondContact O-N 2.8Å; K85-L88 WeakPolarHBondContact O-CB 3.47Å; K85-L88 PolarHBondContact O-N 3.28Å; K85-L88 VanDerWaalsContact O-N 3.09Å; L88-F91 CarbonylContact O-C 3.57Å; L88-F91 WeakPolarHBondContact O-CA 3.36Å; L88-F91 WeakPolarHBondContact O-CB 3.31Å; L88-F91 PolarHBondContact O-N 3.1Å; L88-F91 VanDerWaalsContact O-N 3.12Å; L88-R92 PolarHBondContact O-N 3.03Å
89E96.3Very high92Very high132 Ų132132.3 Ų132.362%0.61762%0.616SS**Hα-helixtrans-59.6-50.4174.5-171.6-166.8168.700111.9K85 F91 R92 A93K85-E89 WeakPolarHBondContact O-CB 3.33Å; K85-E89 PolarHBondContact O-N 3.01Å; E89-F91 PolarHBondContact O-N 3.37Å; E89-F91 VanDerWaalsContact O-N 3.11Å; E89-R92 PolarHBondContact O-N 2.96Å; E89-A93 WeakPolarHBondContact O-CB 3.43Å; E89-A93 PolarHBondContact O-N 3.33Å
90R96.4Very high93.4Very high169 Ų169125.2 Ų125.264%0.63860%0.595SS**Hα-helixtrans-57.4-28.8174.6-167.1179.5-169.6-160.15.1112.4A86 R94A86-R90 WeakPolarHBondContact O-CB 3.45Å; A86-R90 PolarHBondContact O-N 3.04Å; R90-R94 WeakPolarHBondContact O-CB 3.27Å; R90-R94 WeakPolarHBondContact O-CD 3.44Å; R90-R94 WeakPolarHBondContact O-CG 3.17Å; R90-R94 PolarHBondContact O-N 2.88Å
91F96.7Very high94.7Very high123 Ų123123.8 Ų123.854%0.53958%0.583SS.*Hα-helixtrans-76.4-44.8172.2179.6-96.1000112.3R87 L88 E89 A93 R94 R95R87-F91 PolarHBondContact O-N 3.43Å; L88-F91 CarbonylContact O-C 3.57Å; L88-F91 WeakPolarHBondContact O-CA 3.36Å; L88-F91 WeakPolarHBondContact O-CB 3.31Å; L88-F91 PolarHBondContact O-N 3.1Å; L88-F91 VanDerWaalsContact O-N 3.12Å; E89-F91 PolarHBondContact O-N 3.37Å; E89-F91 VanDerWaalsContact O-N 3.11Å; F91-A93 PolarHBondContact O-N 2.74Å; F91-R94 PolarHBondContact O-N 3.23Å; F91-R95 PolarHBondContact O-N 3.19Å
92R97.4Very high95.6Very high140 Ų140118.5 Ų118.553%0.52856%0.562SS.*Hα-helixtrans-56.9-47.7174.1-173.5169.6172.7157-3.9110.6D58 L88 E89 R94 R95 V96D58-R92 IonicContact OD2-CZ 2.78Å; D58-R92 IonicContact OD2-NH1 3.51Å; D58-R92 PolarHBondContact OD2-NH1 2.93Å; D58-R92 IonicContact OD2-NH2 2.74Å; D58-R92 PolarHBondContact OD2-NH2 2.97Å; L88-R92 PolarHBondContact O-N 3.03Å; E89-R92 PolarHBondContact O-N 2.96Å; R92-R94 PolarHBondContact O-N 3.23Å; R92-R95 PolarHBondContact O-N 3.4Å; R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 2.92Å
93A97.8Very high96.5Very high61 Ų61117 Ų11750%0.50455%0.55SS.*Hα-helixtrans-60.9-43.3176.300000113.3E89 F91 V96 K97E89-A93 WeakPolarHBondContact O-CB 3.43Å; E89-A93 PolarHBondContact O-N 3.33Å; F91-A93 PolarHBondContact O-N 2.74Å; A93-V96 PolarHBondContact O-N 3.42Å; A93-K97 WeakPolarHBondContact O-CB 3.28Å; A93-K97 PolarHBondContact O-N 2.93Å
94R98.4Very high97.1Very high158 Ų158117.8 Ų117.860%0.59656%0.56SS**Hα-helixtrans-60.9-43.5173.5-79.1170.9173-164.8-4.1111.9R90 F91 R92 K97 A98R90-R94 WeakPolarHBondContact O-CB 3.27Å; R90-R94 WeakPolarHBondContact O-CD 3.44Å; R90-R94 WeakPolarHBondContact O-CG 3.17Å; R90-R94 PolarHBondContact O-N 2.88Å; F91-R94 PolarHBondContact O-N 3.23Å; R92-R94 PolarHBondContact O-N 3.23Å; R94-K97 PolarHBondContact O-N 2.89Å; R94-A98 WeakPolarHBondContact O-CB 3.42Å; R94-A98 PolarHBondContact O-N 2.92Å
95R98.6Very high97.4Very high145 Ų145119.9 Ų119.955%0.54756%0.556SS.*Hα-helixtrans-63.4-44.4177.3-170.2177.171.5157.41.2111.6F91 R92 A98 N99F91-R95 PolarHBondContact O-N 3.19Å; R92-R95 PolarHBondContact O-N 3.4Å; R95-A98 PolarHBondContact O-N 3.15Å; R95-N99 WeakPolarHBondContact O-CB 3.49Å; R95-N99 PolarHBondContact O-N 3.47Å; R95-N99 PolarHBondContact O-OD1 3.29Å
96V98.4Very high97.6Very high88 Ų88115.6 Ų115.653%0.53354%0.539SS..Hα-helixtrans-60.1-46.9175.2171.80000111.1R92 A93 A98 N99 A100R92-V96 WeakPolarHBondContact O-CG2 3.31Å; R92-V96 PolarHBondContact O-N 2.92Å; A93-V96 PolarHBondContact O-N 3.42Å; V96-A98 VanDerWaalsContact C-N 3.31Å; V96-A98 PolarHBondContact O-N 3.04Å; V96-N99 PolarHBondContact O-N 3.08Å; V96-A100 WeakPolarHBondContact O-CB 3.25Å; V96-A100 PolarHBondContact O-N 2.81Å
97K98.5Very high97.8Very high140 Ų140118 Ų11861%0.60954%0.54SS*.Hα-helixtrans-63.5-33177.8-172167.4-176.4167.50113.3A93 R94 R101A93-K97 WeakPolarHBondContact O-CB 3.28Å; A93-K97 PolarHBondContact O-N 2.93Å; R94-K97 PolarHBondContact O-N 2.89Å; K97-R101 WeakPolarHBondContact O-CG 3.48Å; K97-R101 PolarHBondContact O-N 3.18Å
98A98.6Very high98Very high54 Ų54112 Ų11245%0.44653%0.529SS..Hα-helixtrans-71.2-48.2173.100000111.7R94 R95 V96 A100 R101 E102R94-A98 WeakPolarHBondContact O-CB 3.42Å; R94-A98 PolarHBondContact O-N 2.92Å; R95-A98 PolarHBondContact O-N 3.15Å; V96-A98 VanDerWaalsContact C-N 3.31Å; V96-A98 PolarHBondContact O-N 3.04Å; A98-A100 VanDerWaalsContact C-N 3.3Å; A98-A100 PolarHBondContact O-N 2.99Å; A98-R101 WeakPolarHBondContact O-CB 3.4Å; A98-R101 PolarHBondContact O-N 2.99Å; A98-R101 VanDerWaalsContact O-N 3.11Å; A98-E102 PolarHBondContact O-N 3.16Å
99N98.8Very high98.2Very high87 Ų87111.7 Ų111.747%0.46553%0.528SS..Hα-helixtrans-60.5-38.7178.8-708.1000112.2R95 V96 E102 R103R95-N99 WeakPolarHBondContact O-CB 3.49Å; R95-N99 PolarHBondContact O-N 3.47Å; R95-N99 PolarHBondContact O-OD1 3.29Å; V96-N99 PolarHBondContact O-N 3.08Å; N99-E102 PolarHBondContact O-N 3.48Å; N99-R103 WeakPolarHBondContact O-CG 3.22Å; N99-R103 PolarHBondContact O-N 3.14Å
100A98.7Very high98.3Very high49 Ų49108 Ų10841%0.40551%0.512SS..Hα-helixtrans-60.5-44.4174.100000112.1V96 A98 R103 T104V96-A100 WeakPolarHBondContact O-CB 3.25Å; V96-A100 PolarHBondContact O-N 2.81Å; A98-A100 VanDerWaalsContact C-N 3.3Å; A98-A100 PolarHBondContact O-N 2.99Å; A100-R103 WeakPolarHBondContact O-CB 3.36Å; A100-R103 PolarHBondContact O-N 3.16Å; A100-T104 PolarHBondContact O-N 3.32Å; A100-T104 PolarHBondContact O-OG1 3.42Å; A100-T104 VanDerWaalsContact O-OG1 3.14Å
101R98.8Very high98.4Very high176 Ų176104 Ų10466%0.66450%0.504SS*.Hα-helixtrans-65-40.8177.7-73.5174.2168.8-137-11.1112.8K97 A98 T104 R105K97-R101 WeakPolarHBondContact O-CG 3.48Å; K97-R101 PolarHBondContact O-N 3.18Å; A98-R101 WeakPolarHBondContact O-CB 3.4Å; A98-R101 PolarHBondContact O-N 2.99Å; A98-R101 VanDerWaalsContact O-N 3.11Å; R101-T104 PolarHBondContact O-N 3.41Å; R101-R105 PolarHBondContact O-N 3.19Å
102E98.7Very high98.5Very high85 Ų85100.8 Ų100.840%0.39750%0.499SS..Hα-helixtrans-68-35.8176.9178.257.8-173.200111.8A98 N99 R105 M106A98-E102 PolarHBondContact O-N 3.16Å; N99-E102 PolarHBondContact O-N 3.48Å; E102-R105 PolarHBondContact O-N 2.83Å; E102-R105 IonicContact OE1-NH1 3.91Å; E102-R105 PolarHBondContact OE1-NH1 2.96Å; E102-R105 WeakPolarHBondContact OE2-CD 3.48Å; E102-R105 IonicContact OE2-CZ 3.94Å; E102-R105 IonicContact OE2-NH1 3.83Å; E102-R105 PolarHBondContact OE2-NH1 3.49Å; E102-M106 HydrophobicContact CG-CG 4.46Å; E102-M106 WeakPolarHBondContact O-CB 3.44Å; E102-M106 VanDerWaalsContact O-CG 3.31Å; E102-M106 WeakPolarHBondContact O-CG 3.44Å; E102-M106 PolarHBondContact O-N 3.43Å; E102-M106 WeakPolarHBondContact OE1-CG 3.45Å
103R98.8Very high98.6Very high178 Ų17895 Ų9567%0.67248%0.479SS*.Hα-helixtrans-57.4-51.8168.5-73.2173.6179.2176.2-2.4110.9N99 A100 R105 M106 H107N99-R103 WeakPolarHBondContact O-CG 3.22Å; N99-R103 PolarHBondContact O-N 3.14Å; A100-R103 WeakPolarHBondContact O-CB 3.36Å; A100-R103 PolarHBondContact O-N 3.16Å; R103-R105 VanDerWaalsContact C-N 3.33Å; R103-R105 PolarHBondContact O-N 3.3Å; R103-M106 CarbonylContact O-C 3.55Å; R103-M106 PolarHBondContact O-N 3.32Å; R103-M106 VanDerWaalsContact O-N 3.08Å; R103-H107 PolarHBondContact O-CD2 3.47Å; R103-H107 PolarHBondContact O-N 3.44Å
104T98.7Very high98.5Very high102 Ų10294 Ų9463%0.62647%0.465SS*.Hα-helixtrans-56.5-43.8177.6-51.50000112.5A100 R101 M106 H107 G108A100-T104 PolarHBondContact O-N 3.32Å; A100-T104 PolarHBondContact O-OG1 3.42Å; A100-T104 VanDerWaalsContact O-OG1 3.14Å; R101-T104 PolarHBondContact O-N 3.41Å; T104-M106 PolarHBondContact O-N 3.13Å; T104-H107 PolarHBondContact O-N 2.98Å; T104-G108 PolarHBondContact O-N 3.37Å
105R98.8Very high98.5Very high151 Ų15190.2 Ų90.257%0.5746%0.457SS*.Hα-helixtrans-61.1-42.6174.8174.6174.3161.3-81.7-9.9112.1R101 E102 R103 L109R101-R105 PolarHBondContact O-N 3.19Å; E102-R105 PolarHBondContact O-N 2.83Å; E102-R105 IonicContact OE1-NH1 3.91Å; E102-R105 PolarHBondContact OE1-NH1 2.96Å; E102-R105 WeakPolarHBondContact OE2-CD 3.48Å; E102-R105 IonicContact OE2-CZ 3.94Å; E102-R105 IonicContact OE2-NH1 3.83Å; E102-R105 PolarHBondContact OE2-NH1 3.49Å; R103-R105 VanDerWaalsContact C-N 3.33Å; R103-R105 PolarHBondContact O-N 3.3Å; R105-L109 PolarHBondContact O-N 3.32Å; R105-L109 VanDerWaalsContact O-N 3.15Å
106M98.8Very high98.5Very high61 Ų6186 Ų8630%0.344%0.444SS..Hα-helixtrans-72.2-28.6178.9-73.1-61.1-57.500113.5E102 R103 T104 L109 N110E102-M106 HydrophobicContact CG-CG 4.46Å; E102-M106 WeakPolarHBondContact O-CB 3.44Å; E102-M106 VanDerWaalsContact O-CG 3.31Å; E102-M106 WeakPolarHBondContact O-CG 3.44Å; E102-M106 PolarHBondContact O-N 3.43Å; E102-M106 WeakPolarHBondContact OE1-CG 3.45Å; R103-M106 CarbonylContact O-C 3.55Å; R103-M106 PolarHBondContact O-N 3.32Å; R103-M106 VanDerWaalsContact O-N 3.08Å; T104-M106 PolarHBondContact O-N 3.13Å; M106-L109 HydrophobicContact CE-CD2 4.18Å; M106-L109 HydrophobicContact SD-CD2 3.99Å; M106-N110 PolarHBondContact O-N 3.24Å; M106-N110 PolarHBondContact O-ND2 3.47Å
107H98.6Very high98.5Very high114 Ų11483.1 Ų83.153%0.52842%0.424SS..Hα-helixtrans-60.9-57.8168.4-73.1-68.5000110.2R103 T104 L109 N110 D111R103-H107 PolarHBondContact O-CD2 3.47Å; R103-H107 PolarHBondContact O-N 3.44Å; T104-H107 PolarHBondContact O-N 2.98Å; H107-L109 PolarHBondContact O-N 3.45Å; H107-L109 VanDerWaalsContact O-N 3.1Å; H107-N110 CarbonylContact O-C 3.58Å; H107-N110 WeakPolarHBondContact O-CA 3.48Å; H107-N110 WeakPolarHBondContact O-CB 3.46Å; H107-N110 PolarHBondContact O-N 3.4Å; H107-D111 VanDerWaalsContact C-OD2 3.3Å; H107-D111 PolarHBondContact O-N 2.85Å; H107-D111 VanDerWaalsContact O-OD2 3.12Å
108G98.5Very high98.4Very high40 Ų4083.8 Ų83.841%0.41242%0.423SS..Hα-helixtrans-56.5-32.8179.400000114.5T104 A112T104-G108 PolarHBondContact O-N 3.37Å; G108-A112 WeakPolarHBondContact O-CB 3.37Å; G108-A112 PolarHBondContact O-N 3.14Å
109L98.6Very high98.2Very high92 Ų9285.7 Ų85.748%0.48243%0.429SS..Hα-helixtrans-69.6-38.2172.3179.261.1000113.2R105 M106 H107 L113R105-L109 PolarHBondContact O-N 3.32Å; R105-L109 VanDerWaalsContact O-N 3.15Å; M106-L109 HydrophobicContact CE-CD2 4.18Å; M106-L109 HydrophobicContact SD-CD2 3.99Å; H107-L109 PolarHBondContact O-N 3.45Å; H107-L109 VanDerWaalsContact O-N 3.1Å; L109-L113 WeakPolarHBondContact O-CB 3.29Å; L109-L113 PolarHBondContact O-N 3.32Å; L109-L113 VanDerWaalsContact O-N 3.13Å
110N98.4Very high98.1Very high54 Ų5482.3 Ų82.329%0.28941%0.41SS..Hα-helixtrans-69.9-38.1174.5-69.2-36000111.2M106 H107 L113 D114 K131M106-N110 PolarHBondContact O-N 3.24Å; M106-N110 PolarHBondContact O-ND2 3.47Å; H107-N110 CarbonylContact O-C 3.58Å; H107-N110 WeakPolarHBondContact O-CA 3.48Å; H107-N110 WeakPolarHBondContact O-CB 3.46Å; H107-N110 PolarHBondContact O-N 3.4Å; N110-L113 WeakPolarHBondContact O-CB 3.5Å; N110-L113 PolarHBondContact O-N 2.96Å; N110-D114 PolarHBondContact O-N 3.22Å; N110-K131 PolarHBondContact OD1-NZ 3.32Å
111D98.4Very high97.7Very high87 Ų8781.3 Ų81.347%0.46540%0.4SS..Hα-helixtrans-64.5-44177.1-55.6-31.6000110.6H107 L113 D114 N115H107-D111 VanDerWaalsContact C-OD2 3.3Å; H107-D111 PolarHBondContact O-N 2.85Å; H107-D111 VanDerWaalsContact O-OD2 3.12Å; D111-L113 VanDerWaalsContact C-N 3.3Å; D111-L113 PolarHBondContact O-N 3.34Å; D111-D114 PolarHBondContact O-N 3.24Å; D111-N115 PolarHBondContact O-N 3.5Å; D111-N115 PolarHBondContact O-ND2 2.96Å; D111-N115 PolarHBondContact O-OD1 3.07Å
112A98.6Very high97.2Very high54 Ų5473.1 Ų73.145%0.44637%0.369SS..Hα-helixtrans-60.7-37.1172.100000112.7G108 N115 L116G108-A112 WeakPolarHBondContact O-CB 3.37Å; G108-A112 PolarHBondContact O-N 3.14Å; A112-N115 WeakPolarHBondContact O-CB 3.48Å; A112-N115 PolarHBondContact O-N 3.26Å; A112-L116 PolarHBondContact O-N 3.35Å
113L98.6Very high96.8Very high19 Ų1973.8 Ų73.810%0.09937%0.369CS..Hα-helixtrans-71-36.3175.4-176.165.4000112.5L109 N110 D111 L116 R117 K131 T134L109-L113 WeakPolarHBondContact O-CB 3.29Å; L109-L113 PolarHBondContact O-N 3.32Å; L109-L113 VanDerWaalsContact O-N 3.13Å; N110-L113 WeakPolarHBondContact O-CB 3.5Å; N110-L113 PolarHBondContact O-N 2.96Å; D111-L113 VanDerWaalsContact C-N 3.3Å; D111-L113 PolarHBondContact O-N 3.34Å; L113-L116 HydrophobicContact CD1-CD2 4.34Å; L113-L116 WeakPolarHBondContact O-CB 3.49Å; L113-L116 PolarHBondContact O-N 3.48Å; L113-R117 WeakPolarHBondContact O-CG 3.24Å; L113-R117 PolarHBondContact O-N 3.34Å; L113-K131 HydrophobicContact CD2-CB 4.14Å; L113-K131 HydrophobicContact CD2-CD 3.85Å; L113-K131 HydrophobicContact CD2-CG 3.66Å; L113-T134 HydrophobicContact CD1-CG2 3.8Å
114D97.4Very high96.3Very high41 Ų4166.7 Ų66.722%0.21935%0.346CS..Hα-helixtrans-69.1-33.5171.9-86.1-28.7000112N110 D111 R117 R118 K128N110-D114 PolarHBondContact O-N 3.22Å; D111-D114 PolarHBondContact O-N 3.24Å; D114-R117 WeakPolarHBondContact O-CB 3.47Å; D114-R117 PolarHBondContact O-N 2.9Å; D114-R117 WeakPolarHBondContact OD1-CD 3.45Å; D114-R117 IonicContact OD1-CZ 3.66Å; D114-R117 IonicContact OD1-NE 2.63Å; D114-R117 IonicContact OD1-NH1 2.7Å; D114-R117 PolarHBondContact OD1-NH1 3.27Å; D114-R118 WeakPolarHBondContact O-CG 3.33Å; D114-R118 PolarHBondContact O-N 3.24Å; D114-K128 WeakPolarHBondContact OD1-CD 3.3Å; D114-K128 WeakPolarHBondContact OD1-CE 3.43Å; D114-K128 IonicContact OD1-NZ 3.17Å; D114-K128 PolarHBondContact OD1-NZ 3.13Å; D114-K128 IonicContact OD2-NZ 2.66Å; D114-K128 PolarHBondContact OD2-NZ 2.93Å
115N97.8Very high95.7Very high78 Ų7870.4 Ų70.442%0.41735%0.354SS..Hα-helixtrans-62.2-42.7169.5-66.1-22.5000111.5D111 A112 R117 R118D111-N115 PolarHBondContact O-N 3.5Å; D111-N115 PolarHBondContact O-ND2 2.96Å; D111-N115 PolarHBondContact O-OD1 3.07Å; A112-N115 WeakPolarHBondContact O-CB 3.48Å; A112-N115 PolarHBondContact O-N 3.26Å; N115-R117 PolarHBondContact O-N 2.91Å; N115-R118 PolarHBondContact O-N 3.38Å; N115-R118 PolarHBondContact OD1-NH2 3.34Å
116L98.4Very high95.2Very high55 Ų5569.8 Ų69.829%0.28837%0.367SS..Hα-helixtrans-61.6-41.8172.8-177.462.4000111.7A112 L113 R118 V119 M120 T134 L135 A138A112-L116 PolarHBondContact O-N 3.35Å; L113-L116 HydrophobicContact CD1-CD2 4.34Å; L113-L116 WeakPolarHBondContact O-CB 3.49Å; L113-L116 PolarHBondContact O-N 3.48Å; L116-R118 VanDerWaalsContact C-N 3.29Å; L116-R118 PolarHBondContact O-N 3.17Å; L116-V119 HydrophobicContact CD1-CG2 4.29Å; L116-V119 VanDerWaalsContact O-CG2 3.22Å; L116-V119 WeakPolarHBondContact O-CG2 3.32Å; L116-V119 PolarHBondContact O-N 2.89Å; L116-M120 HydrophobicContact CD1-CE 3.8Å; L116-M120 HydrophobicContact CG-CE 4.25Å; L116-M120 WeakPolarHBondContact O-CG 3.24Å; L116-T134 HydrophobicContact CD2-CG2 4.07Å; L116-T134 HydrophobicContact CG-CG2 4.17Å; L116-L135 HydrophobicContact CD2-CD2 4.31Å; L116-A138 HydrophobicContact CD1-CB 4.09Å; L116-A138 HydrophobicContact CD2-CB 4.04Å; L116-A138 HydrophobicContact CG-CB 4.34Å
117R97.5Very high94.8Very high29 Ų2972.1 Ų72.111%0.10938%0.377CS..Hα-helixtrans-59.1-37.6175.2-72.2178-176.5112.10.6112.8L113 D114 N115 V119 M120 Y123 L129 T134L113-R117 WeakPolarHBondContact O-CG 3.24Å; L113-R117 PolarHBondContact O-N 3.34Å; D114-R117 WeakPolarHBondContact O-CB 3.47Å; D114-R117 PolarHBondContact O-N 2.9Å; D114-R117 WeakPolarHBondContact OD1-CD 3.45Å; D114-R117 IonicContact OD1-CZ 3.66Å; D114-R117 IonicContact OD1-NE 2.63Å; D114-R117 IonicContact OD1-NH1 2.7Å; D114-R117 PolarHBondContact OD1-NH1 3.27Å; N115-R117 PolarHBondContact O-N 2.91Å; R117-V119 PolarHBondContact O-N 3.31Å; R117-M120 PolarHBondContact O-N 2.94Å; R117-Y123 HydrophobicContact CB-CD2 4.35Å; R117-Y123 WeakPolarHBondContact O-CB 3.49Å; R117-Y123 VanDerWaalsContact O-CD2 3.24Å; R117-Y123 WeakPolarHBondContact O-CD2 3.49Å; R117-L129 VanDerWaalsContact CZ-O 3.28Å; R117-L129 PolarHBondContact NE-O 3.42Å; R117-L129 PolarHBondContact NH2-O 3.09Å; R117-T134 HydrophobicContact CG-CG2 3.64Å; R117-T134 PolarHBondContact NE-OG1 3.5Å
118R96.3Very high94.6Very high154 Ų15472.4 Ų72.458%0.58138%0.377SS*.Hα-helixtrans-63.8-19.7-179.8-73.2-167.4-68.2143.8-8114.1D114 N115 L116 Y123D114-R118 WeakPolarHBondContact O-CG 3.33Å; D114-R118 PolarHBondContact O-N 3.24Å; N115-R118 PolarHBondContact O-N 3.38Å; N115-R118 PolarHBondContact OD1-NH2 3.34Å; L116-R118 VanDerWaalsContact C-N 3.29Å; L116-R118 PolarHBondContact O-N 3.17Å; R118-Y123 HydrophobicContact CG-CD2 4.42Å; R118-Y123 HydrophobicContact CG-CE1 4.33Å; R118-Y123 HydrophobicContact CG-CE2 3.9Å
119V96.1Very high94.4Very high93 Ų9371.3 Ų71.356%0.56436%0.362SS*.THydrogen-bonded Turntrans-106.512.1177.7-59.40000113.4L116 R117 Y141L116-V119 HydrophobicContact CD1-CG2 4.29Å; L116-V119 VanDerWaalsContact O-CG2 3.22Å; L116-V119 WeakPolarHBondContact O-CG2 3.32Å; L116-V119 PolarHBondContact O-N 2.89Å; R117-V119 PolarHBondContact O-N 3.31Å; V119-Y141 WeakPolarHBondContact O-CE1 3.37Å
120M95.4Very high94.4Very high16 Ų1669.8 Ų69.88%0.07936%0.359CS..SBendtrans-83.1146.2174-65-64.894.100111.6L116 R117 C122 Y123 L137 A138 Y141L116-M120 HydrophobicContact CD1-CE 3.8Å; L116-M120 HydrophobicContact CG-CE 4.25Å; L116-M120 WeakPolarHBondContact O-CG 3.24Å; R117-M120 PolarHBondContact O-N 2.94Å; M120-C122 PolarHBondContact O-N 3.34Å; M120-Y123 PolarHBondContact O-N 3.36Å; M120-L137 HydrophobicContact CB-CD2 3.97Å; M120-L137 HydrophobicContact CG-CD2 4.18Å; M120-L137 HydrophobicContact SD-CB 4.23Å; M120-L137 HydrophobicContact SD-CD2 4.06Å; M120-L137 HydrophobicContact SD-CG 3.9Å; M120-A138 HydrophobicContact CE-CB 3.87Å; M120-A138 HydrophobicContact SD-CB 3.93Å; M120-Y141 HydrophobicContact CE-CD1 4.25Å
121P90.3Very high94.4Very high28 Ų2872 Ų7218%0.18237%0.365CS..THydrogen-bonded Turntrans-67.93.2-177.627.8-35.9000115.1L137 Y141 L164 L180P121-L137 HydrophobicContact CG-CD1 4.34Å; P121-Y141 HydrophobicContact CG-CD1 4.45Å; P121-Y141 HydrophobicContact CG-CD2 4.32Å; P121-Y141 HydrophobicContact CG-CE2 4.48Å; P121-Y141 HydrophobicContact CG-CG 4.3Å; P121-L164 HydrophobicContact CB-CD1 4.39Å; P121-L164 HydrophobicContact CG-CD1 3.87Å; P121-L164 HydrophobicContact CG-CD2 4.24Å; P121-L180 HydrophobicContact CB-CD1 4.39Å; P121-L180 HydrophobicContact CB-CD2 4.25Å
122C87.8Confident94.4Very high4 Ų472.2 Ų72.23%0.02737%0.366CS..THydrogen-bonded Turntrans-136.436175.871.70000112.2M120 S124 L137 L175 V176 C179M120-C122 PolarHBondContact O-N 3.34Å; C122-S124 PolarHBondContact O-N 3.47Å; C122-L137 VanDerWaalsContact SG-CD2 3.53Å; C122-L175 HydrophobicContact CB-CG 4.36Å; C122-V176 HydrophobicContact CB-CG2 4.07Å; C122-C179 HydrophobicContact CB-CB 3.82Å
123Y90.7Very high94.4Very high99 Ų9970 Ų7039%0.38835%0.347SS..  trans-61.9121-178.8174.9-113.8000112.4R117 R118 M120 K125R117-Y123 HydrophobicContact CB-CD2 4.35Å; R117-Y123 WeakPolarHBondContact O-CB 3.49Å; R117-Y123 VanDerWaalsContact O-CD2 3.24Å; R117-Y123 WeakPolarHBondContact O-CD2 3.49Å; R118-Y123 HydrophobicContact CG-CD2 4.42Å; R118-Y123 HydrophobicContact CG-CE1 4.33Å; R118-Y123 HydrophobicContact CG-CE2 3.9Å; M120-Y123 PolarHBondContact O-N 3.36Å; Y123-K125 HydrophobicContact CE1-CG 3.95Å
124S88.1Confident94.3Very high29 Ų2969.1 Ų69.120%0.20334%0.342CS..  trans-115.2137.5170.1174.10000111.1C122 T126 Q127C122-S124 PolarHBondContact O-N 3.47Å; S124-T126 PolarHBondContact OG-N 2.99Å; S124-T126 PolarHBondContact OG-OG1 3.1Å; S124-Q127 PolarHBondContact OG-N 3.15Å; S124-Q127 VanDerWaalsContact OG-N 3.09Å
125K86Confident94.4Very high181 Ų18172 Ų7279%0.78736%0.356SS*.SBendtrans-71.3-31.2174-67.2179.1-179.9176.20112.2Y123Y123-K125 HydrophobicContact CE1-CG 3.95Å
126T87.9Confident94.4Very high137 Ų13773.3 Ų73.384%0.8436%0.356SS*.SBendtrans-94.9-32.1-175.951.90000112.8S124S124-T126 PolarHBondContact OG-N 2.99Å; S124-T126 PolarHBondContact OG-OG1 3.1Å
127Q90.3Very high94.4Very high111 Ų11170.7 Ų70.752%0.51934%0.342SS..  trans-117.397.8-177-170.5178.97.800111.2S124S124-Q127 PolarHBondContact OG-N 3.15Å; S124-Q127 VanDerWaalsContact OG-N 3.09Å
128K94.5Very high94.5Very high120 Ų12069.8 Ų69.852%0.52234%0.341SS..PPolyproline II helixtrans-79.7129.4174.8-68.3-175.4176.6-174.40111D114D114-K128 WeakPolarHBondContact OD1-CD 3.3Å; D114-K128 WeakPolarHBondContact OD1-CE 3.43Å; D114-K128 IonicContact OD1-NZ 3.17Å; D114-K128 PolarHBondContact OD1-NZ 3.13Å; D114-K128 IonicContact OD2-NZ 2.66Å; D114-K128 PolarHBondContact OD2-NZ 2.93Å
129L96Very high94.6Very high17 Ų1771.4 Ų71.49%0.08935%0.347CS..PPolyproline II helixtrans-59.7148.1169-64.3-174.3000111.5R117 E133 T134 L137 T172 L175R117-L129 VanDerWaalsContact CZ-O 3.28Å; R117-L129 PolarHBondContact NE-O 3.42Å; R117-L129 PolarHBondContact NH2-O 3.09Å; L129-E133 HydrophobicContact CB-CB 4.4Å; L129-T134 WeakPolarHBondContact CB-OG1 3.43Å; L129-T134 PolarHBondContact O-OG1 3.34Å; L129-L137 HydrophobicContact CD1-CD2 3.69Å; L129-T172 HydrophobicContact CD1-CG2 4.35Å; L129-T172 HydrophobicContact CD2-CG2 3.7Å; L129-L175 HydrophobicContact CD2-CD2 4.09Å
130S97.5Very high94.6Very high60 Ų6067.7 Ų67.742%0.4232%0.324SS..PPolyproline II helixtrans-63.3165.4175.388.90000111.5I132 E133 T134S130-I132 VanDerWaalsContact C-N 3.33Å; S130-I132 PolarHBondContact O-N 3.24Å; S130-I132 WeakPolarHBondContact OG-CG2 3.48Å; S130-E133 PolarHBondContact O-N 3.48Å; S130-E133 VanDerWaalsContact OG-CG 3.29Å; S130-E133 WeakPolarHBondContact OG-CG 3.49Å; S130-E133 PolarHBondContact OG-N 2.88Å; S130-T134 WeakPolarHBondContact O-CB 3.41Å; S130-T134 PolarHBondContact O-N 3.06Å; S130-T134 PolarHBondContact O-OG1 2.85Å
131K98.3Very high94.7Very high99 Ų9970 Ų7043%0.4333%0.332SS..Hα-helixtrans-59.3-42.6-178.5-60.3-154.1170-1680112.4N110 L113 L135N110-K131 PolarHBondContact OD1-NZ 3.32Å; L113-K131 HydrophobicContact CD2-CB 4.14Å; L113-K131 HydrophobicContact CD2-CD 3.85Å; L113-K131 HydrophobicContact CD2-CG 3.66Å; K131-L135 WeakPolarHBondContact O-CG 3.44Å; K131-L135 PolarHBondContact O-N 2.85Å
132I98.3Very high95.1Very high93 Ų9374.1 Ų74.148%0.47735%0.351SS..Hα-helixtrans-71.9-41179.7-177.258.9000112.1S130 T134 L135 R136S130-I132 VanDerWaalsContact C-N 3.33Å; S130-I132 PolarHBondContact O-N 3.24Å; S130-I132 WeakPolarHBondContact OG-CG2 3.48Å; I132-T134 PolarHBondContact O-N 3.34Å; I132-L135 PolarHBondContact O-N 3.07Å; I132-R136 HydrophobicContact CD1-CG 4.27Å; I132-R136 HydrophobicContact CG1-CG 4.41Å; I132-R136 WeakPolarHBondContact O-CG 3.43Å; I132-R136 PolarHBondContact O-N 2.86Å
133E98.1Very high95.5Very high8 Ų879.8 Ų79.84%0.03737%0.372CS..Hα-helixtrans-67.4-37.3179.9-62.2-62.988.300111.6L129 S130 L135 R136 L137 S169 T172L129-E133 HydrophobicContact CB-CB 4.4Å; S130-E133 PolarHBondContact O-N 3.48Å; S130-E133 VanDerWaalsContact OG-CG 3.29Å; S130-E133 WeakPolarHBondContact OG-CG 3.49Å; S130-E133 PolarHBondContact OG-N 2.88Å; E133-L135 PolarHBondContact O-N 2.7Å; E133-R136 PolarHBondContact O-N 3.19Å; E133-R136 VanDerWaalsContact OE1-CD 3.31Å; E133-R136 WeakPolarHBondContact OE1-CD 3.48Å; E133-R136 IonicContact OE1-CZ 3.78Å; E133-R136 IonicContact OE1-NE 2.72Å; E133-R136 IonicContact OE1-NH1 3.7Å; E133-R136 PolarHBondContact OE1-NH1 2.72Å; E133-L137 WeakPolarHBondContact O-CB 3.48Å; E133-L137 PolarHBondContact O-N 3.41Å; E133-S169 VanDerWaalsContact OE2-CB 3.25Å; E133-S169 WeakPolarHBondContact OE2-CB 3.34Å; E133-S169 PolarHBondContact OE2-N 2.93Å; E133-S169 PolarHBondContact OE2-OG 2.84Å; E133-T172 HydrophobicContact CB-CG2 4.47Å; E133-T172 PolarHBondContact OE2-OG1 2.91Å
134T98.3Very high95.7Very high0 Ų075.1 Ų75.10%035%0.354CS..Hα-helixtrans-60.4-44.3173.4-49.90000111.2L113 L116 R117 L129 S130 I132 A138L113-T134 HydrophobicContact CD1-CG2 3.8Å; L116-T134 HydrophobicContact CD2-CG2 4.07Å; L116-T134 HydrophobicContact CG-CG2 4.17Å; R117-T134 HydrophobicContact CG-CG2 3.64Å; R117-T134 PolarHBondContact NE-OG1 3.5Å; L129-T134 WeakPolarHBondContact CB-OG1 3.43Å; L129-T134 PolarHBondContact O-OG1 3.34Å; S130-T134 WeakPolarHBondContact O-CB 3.41Å; S130-T134 PolarHBondContact O-N 3.06Å; S130-T134 PolarHBondContact O-OG1 2.85Å; I132-T134 PolarHBondContact O-N 3.34Å; T134-A138 VanDerWaalsContact O-CB 3.24Å; T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 3.42Å
135L98.6Very high96.1Very high100 Ų10077.1 Ų77.152%0.52436%0.362SS..Hα-helixtrans-72.1-33.7-179.5-68.6171.3000113.1L116 K131 I132 E133 R139L116-L135 HydrophobicContact CD2-CD2 4.31Å; K131-L135 WeakPolarHBondContact O-CG 3.44Å; K131-L135 PolarHBondContact O-N 2.85Å; I132-L135 PolarHBondContact O-N 3.07Å; E133-L135 PolarHBondContact O-N 2.7Å; L135-R139 PolarHBondContact O-N 3.33Å
136R98.5Very high96.6Very high106 Ų10670.8 Ų70.840%0.434%0.34SS..Hα-helixtrans-66.7-52.7172.9-75.1168.5166.7174.5-11.7111.2I132 E133 A138 R139 N140 G167 L168I132-R136 HydrophobicContact CD1-CG 4.27Å; I132-R136 HydrophobicContact CG1-CG 4.41Å; I132-R136 WeakPolarHBondContact O-CG 3.43Å; I132-R136 PolarHBondContact O-N 2.86Å; E133-R136 PolarHBondContact O-N 3.19Å; E133-R136 VanDerWaalsContact OE1-CD 3.31Å; E133-R136 WeakPolarHBondContact OE1-CD 3.48Å; E133-R136 IonicContact OE1-CZ 3.78Å; E133-R136 IonicContact OE1-NE 2.72Å; E133-R136 IonicContact OE1-NH1 3.7Å; E133-R136 PolarHBondContact OE1-NH1 2.72Å; R136-A138 VanDerWaalsContact C-N 3.3Å; R136-A138 PolarHBondContact O-N 2.78Å; R136-R139 WeakPolarHBondContact O-CB 3.43Å; R136-R139 PolarHBondContact O-N 3.01Å; R136-R139 VanDerWaalsContact O-N 3.16Å; R136-N140 VanDerWaalsContact O-CG 3.28Å; R136-N140 PolarHBondContact O-N 2.95Å; R136-N140 PolarHBondContact O-OD1 3.34Å; R136-G167 PolarHBondContact NH1-O 3.21Å; R136-L168 HydrophobicContact CB-CD2 3.4Å; R136-L168 VanDerWaalsContact CB-CD2 3.4Å; R136-L168 HydrophobicContact CG-CD2 4.4Å
137L98Very high96.8Very high0 Ų067.8 Ų67.80%032%0.317CS..Hα-helixtrans-60.8-40.1179.2-179.561.9000111.4M120 P121 C122 L129 E133 R139 N140 Y141 L164 L168 V176M120-L137 HydrophobicContact CB-CD2 3.97Å; M120-L137 HydrophobicContact CG-CD2 4.18Å; M120-L137 HydrophobicContact SD-CB 4.23Å; M120-L137 HydrophobicContact SD-CD2 4.06Å; M120-L137 HydrophobicContact SD-CG 3.9Å; P121-L137 HydrophobicContact CG-CD1 4.34Å; C122-L137 VanDerWaalsContact SG-CD2 3.53Å; L129-L137 HydrophobicContact CD1-CD2 3.69Å; E133-L137 WeakPolarHBondContact O-CB 3.48Å; E133-L137 PolarHBondContact O-N 3.41Å; L137-R139 PolarHBondContact O-N 2.66Å; L137-N140 PolarHBondContact O-N 3.14Å; L137-Y141 VanDerWaalsContact O-CB 3.25Å; L137-Y141 WeakPolarHBondContact O-CB 3.47Å; L137-Y141 PolarHBondContact O-N 2.93Å; L137-L164 HydrophobicContact CD1-CB 4.1Å; L137-L164 HydrophobicContact CD1-CD2 4Å; L137-L168 HydrophobicContact CB-CD1 4.2Å; L137-L168 HydrophobicContact CB-CD2 4.41Å; L137-L168 HydrophobicContact CD1-CD1 4.04Å; L137-V176 HydrophobicContact CD1-CG2 4.17Å; L137-V176 HydrophobicContact CD2-CG2 4.27Å
138A98.6Very high97Very high10 Ų1064 Ų648%0.08330%0.302CS..Hα-helixtrans-61.4-42.8175.600000112.6L116 M120 T134 R136 Y141 I142L116-A138 HydrophobicContact CD1-CB 4.09Å; L116-A138 HydrophobicContact CD2-CB 4.04Å; L116-A138 HydrophobicContact CG-CB 4.34Å; M120-A138 HydrophobicContact CE-CB 3.87Å; M120-A138 HydrophobicContact SD-CB 3.93Å; T134-A138 VanDerWaalsContact O-CB 3.24Å; T134-A138 WeakPolarHBondContact O-CB 3.49Å; T134-A138 PolarHBondContact O-N 3.42Å; R136-A138 VanDerWaalsContact C-N 3.3Å; R136-A138 PolarHBondContact O-N 2.78Å; A138-Y141 PolarHBondContact O-N 2.96Å; A138-I142 WeakPolarHBondContact O-CD1 3.46Å; A138-I142 VanDerWaalsContact O-CG1 3.27Å; A138-I142 WeakPolarHBondContact O-CG1 3.44Å; A138-I142 PolarHBondContact O-N 3.14Å
139R98.4Very high97Very high189 Ų18965.3 Ų65.371%0.71331%0.313SS*.Hα-helixtrans-61.2-49173.7-180-170.5-64.2-157.6-2.4111.3L135 R136 L137 Y141 I142 W143L135-R139 PolarHBondContact O-N 3.33Å; R136-R139 WeakPolarHBondContact O-CB 3.43Å; R136-R139 PolarHBondContact O-N 3.01Å; R136-R139 VanDerWaalsContact O-N 3.16Å; L137-R139 PolarHBondContact O-N 2.66Å; R139-Y141 VanDerWaalsContact C-N 3.29Å; R139-Y141 PolarHBondContact O-N 3.17Å; R139-I142 PolarHBondContact O-N 3.28Å; R139-W143 PolarHBondContact O-N 2.94Å; R139-W143 VanDerWaalsContact O-N 3.1Å
140N97.9Very high96.9Very high15 Ų1572.1 Ų72.18%0.0835%0.345CS..Hα-helixtrans-63.3-37.8-177.9-65.9-2.2000111.3R136 L137 A144 M163 L164 K166R136-N140 VanDerWaalsContact O-CG 3.28Å; R136-N140 PolarHBondContact O-N 2.95Å; R136-N140 PolarHBondContact O-OD1 3.34Å; L137-N140 PolarHBondContact O-N 3.14Å; N140-A144 VanDerWaalsContact O-CB 3.28Å; N140-A144 WeakPolarHBondContact O-CB 3.46Å; N140-A144 PolarHBondContact O-N 3.14Å; N140-M163 WeakPolarHBondContact CB-O 3.35Å; N140-M163 PolarHBondContact ND2-O 3.45Å; N140-L164 PolarHBondContact ND2-O 3.43Å; N140-K166 PolarHBondContact ND2-O 2.92Å
141Y97.6Very high96.6Very high65 Ų6572.3 Ų72.326%0.25534%0.343SS..Hα-helixtrans-71-39.5178.5-173.5-146.5000112.6V119 M120 P121 L137 A138 R139 A144 L145 F160 L164V119-Y141 WeakPolarHBondContact O-CE1 3.37Å; M120-Y141 HydrophobicContact CE-CD1 4.25Å; P121-Y141 HydrophobicContact CG-CD1 4.45Å; P121-Y141 HydrophobicContact CG-CD2 4.32Å; P121-Y141 HydrophobicContact CG-CE2 4.48Å; P121-Y141 HydrophobicContact CG-CG 4.3Å; L137-Y141 VanDerWaalsContact O-CB 3.25Å; L137-Y141 WeakPolarHBondContact O-CB 3.47Å; L137-Y141 PolarHBondContact O-N 2.93Å; A138-Y141 PolarHBondContact O-N 2.96Å; R139-Y141 VanDerWaalsContact C-N 3.29Å; R139-Y141 PolarHBondContact O-N 3.17Å; Y141-A144 PolarHBondContact O-N 3.34Å; Y141-L145 HydrophobicContact CD1-CD1 4.5Å; Y141-L145 HydrophobicContact CD2-CD1 3.98Å; Y141-L145 HydrophobicContact CD2-CG 3.9Å; Y141-L145 HydrophobicContact CE1-CD1 4.2Å; Y141-L145 HydrophobicContact CE2-CD1 3.64Å; Y141-L145 HydrophobicContact CE2-CD2 3.91Å; Y141-L145 HydrophobicContact CE2-CG 3.7Å; Y141-L145 HydrophobicContact CG-CD1 4.4Å; Y141-L145 WeakPolarHBondContact O-CB 3.36Å; Y141-L145 VanDerWaalsContact O-CG 3.31Å; Y141-L145 WeakPolarHBondContact O-CG 3.4Å; Y141-L145 PolarHBondContact O-N 3.06Å; Y141-F160 HydrophobicContact CD2-CZ 4.35Å; Y141-F160 HydrophobicContact CE2-CZ 4.18Å; Y141-L164 HydrophobicContact CD2-CD2 3.93Å; Y141-L164 HydrophobicContact CG-CD2 4.17Å
142I97.9Very high96.1Very high114 Ų11470.9 Ų70.959%0.58536%0.357SS*.Hα-helixtrans-58.8-49.7172.2-70164000110.3A138 R139 L145 S146A138-I142 WeakPolarHBondContact O-CD1 3.46Å; A138-I142 VanDerWaalsContact O-CG1 3.27Å; A138-I142 WeakPolarHBondContact O-CG1 3.44Å; A138-I142 PolarHBondContact O-N 3.14Å; R139-I142 PolarHBondContact O-N 3.28Å; I142-L145 PolarHBondContact O-N 3.49Å; I142-S146 PolarHBondContact O-N 3.35Å; I142-S146 PolarHBondContact O-OG 3.43Å
143W96.6Very high95.4Very high123 Ų12373 Ų7347%0.46637%0.365SS..Hα-helixtrans-61.4-48.8177.2178.211.9000111.8R139 L145 S146 E147R139-W143 PolarHBondContact O-N 2.94Å; R139-W143 VanDerWaalsContact O-N 3.1Å; W143-L145 PolarHBondContact O-N 2.89Å; W143-S146 WeakPolarHBondContact O-CB 3.48Å; W143-S146 PolarHBondContact O-N 3.35Å; W143-E147 PolarHBondContact NE1-OE2 2.86Å; W143-E147 PolarHBondContact O-N 2.72Å
144A94.9Very high94.4Very high0 Ų078.2 Ų78.20%040%0.397CS..Hα-helixtrans-59.9-31.1179.500000113.1N140 Y141 V148 F160 M163 L164N140-A144 VanDerWaalsContact O-CB 3.28Å; N140-A144 WeakPolarHBondContact O-CB 3.46Å; N140-A144 PolarHBondContact O-N 3.14Å; Y141-A144 PolarHBondContact O-N 3.34Å; A144-V148 WeakPolarHBondContact O-CG2 3.47Å; A144-V148 PolarHBondContact O-N 3.03Å; A144-F160 HydrophobicContact CB-CD2 4.11Å; A144-F160 HydrophobicContact CB-CE2 3.73Å; A144-M163 HydrophobicContact CB-CB 4.3Å; A144-M163 HydrophobicContact CB-CE 3.84Å; A144-M163 HydrophobicContact CB-SD 4.43Å; A144-L164 HydrophobicContact CB-CD2 4.46Å
145L95.3Very high93.4Very high71 Ų7180 Ų8037%0.37241%0.409SS..Hα-helixtrans-77.5-36.5172.5-70.3176.5000113Y141 I142 W143 E147 V148 L149Y141-L145 HydrophobicContact CD1-CD1 4.5Å; Y141-L145 HydrophobicContact CD2-CD1 3.98Å; Y141-L145 HydrophobicContact CD2-CG 3.9Å; Y141-L145 HydrophobicContact CE1-CD1 4.2Å; Y141-L145 HydrophobicContact CE2-CD1 3.64Å; Y141-L145 HydrophobicContact CE2-CD2 3.91Å; Y141-L145 HydrophobicContact CE2-CG 3.7Å; Y141-L145 HydrophobicContact CG-CD1 4.4Å; Y141-L145 WeakPolarHBondContact O-CB 3.36Å; Y141-L145 VanDerWaalsContact O-CG 3.31Å; Y141-L145 WeakPolarHBondContact O-CG 3.4Å; Y141-L145 PolarHBondContact O-N 3.06Å; I142-L145 PolarHBondContact O-N 3.49Å; W143-L145 PolarHBondContact O-N 2.89Å; L145-E147 VanDerWaalsContact C-N 3.35Å; L145-V148 PolarHBondContact O-N 3.08Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.37Å; L145-L149 VanDerWaalsContact O-N 3.11Å
146S96.2Very high92.4Very high48 Ų4882.9 Ų82.934%0.33642%0.42SS..Hα-helixtrans-58.8-46.6171.5-67.20000111.4I142 W143 V148 L149 E150I142-S146 PolarHBondContact O-N 3.35Å; I142-S146 PolarHBondContact O-OG 3.43Å; W143-S146 WeakPolarHBondContact O-CB 3.48Å; W143-S146 PolarHBondContact O-N 3.35Å; S146-V148 VanDerWaalsContact C-N 3.32Å; S146-V148 PolarHBondContact O-N 3.21Å; S146-L149 PolarHBondContact O-N 3.47Å; S146-L149 VanDerWaalsContact O-N 3.08Å; S146-E150 WeakPolarHBondContact O-CG 3.38Å; S146-E150 PolarHBondContact O-N 2.73Å
147E93.4Very high91.6Very high74 Ų7479.5 Ų79.535%0.34642%0.418SS..Hα-helixtrans-59.1-40.8178.8-157.681.9-146.800111.9W143 L145 T151W143-E147 PolarHBondContact NE1-OE2 2.86Å; W143-E147 PolarHBondContact O-N 2.72Å; L145-E147 VanDerWaalsContact C-N 3.35Å; E147-T151 WeakPolarHBondContact O-CB 3.38Å; E147-T151 VanDerWaalsContact O-CG2 3.32Å; E147-T151 WeakPolarHBondContact O-CG2 3.37Å; E147-T151 PolarHBondContact O-N 3.38Å; E147-T151 PolarHBondContact O-OG1 2.99Å
148V93.8Very high91Very high33 Ų3386.8 Ų86.820%0.245%0.449CS..Hα-helixtrans-62.3-42.4174.5172.80000111.7A144 L145 S146 G152 T154 P155A144-V148 WeakPolarHBondContact O-CG2 3.47Å; A144-V148 PolarHBondContact O-N 3.03Å; L145-V148 PolarHBondContact O-N 3.08Å; S146-V148 VanDerWaalsContact C-N 3.32Å; S146-V148 PolarHBondContact O-N 3.21Å; V148-G152 WeakPolarHBondContact O-CA 3.31Å; V148-G152 PolarHBondContact O-N 3.37Å; V148-G152 VanDerWaalsContact O-N 3.13Å; V148-T154 HydrophobicContact CG1-CG2 4.32Å; V148-P155 VanDerWaalsContact CG2-CD 3.45Å; V148-P155 HydrophobicContact CG2-CG 4.31Å
149L94.7Very high90.6Very high146 Ų14687.6 Ų87.676%0.76446%0.459SS*.Hα-helixtrans-73.2-35.2-178.5-69.6170.6000112.6L145 S146L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.37Å; L145-L149 VanDerWaalsContact O-N 3.11Å; S146-L149 PolarHBondContact O-N 3.47Å; S146-L149 VanDerWaalsContact O-N 3.08Å
150E94.3Very high90.2Very high161 Ų16180.5 Ų80.575%0.75243%0.433SS*.Hα-helixtrans-77.7-39.1179.6-72176.3-141.700112.5S146S146-E150 WeakPolarHBondContact O-CG 3.38Å; S146-E150 PolarHBondContact O-N 2.73Å
151T91Very high90Very high64 Ų6480.4 Ų80.439%0.39343%0.433SS..Hα-helixtrans-86.1-13.4-179.661.70000114.2E147 Q153E147-T151 WeakPolarHBondContact O-CB 3.38Å; E147-T151 VanDerWaalsContact O-CG2 3.32Å; E147-T151 WeakPolarHBondContact O-CG2 3.37Å; E147-T151 PolarHBondContact O-N 3.38Å; E147-T151 PolarHBondContact O-OG1 2.99Å; T151-Q153 PolarHBondContact O-N 3.31Å; T151-Q153 VanDerWaalsContact O-N 3.16Å; T151-Q153 PolarHBondContact O-NE2 2.58Å; T151-Q153 PolarHBondContact OG1-N 2.74Å; T151-Q153 PolarHBondContact OG1-O 3.37Å
152G87.7Confident89.8Confident69 Ų6984.4 Ų84.471%0.71145%0.454SS*.SBendtrans64.68.5-17200000114.3V148V148-G152 WeakPolarHBondContact O-CA 3.31Å; V148-G152 PolarHBondContact O-N 3.37Å; V148-G152 VanDerWaalsContact O-N 3.13Å
153Q82.8Confident89.6Confident138 Ų13881 Ų8165%0.64544%0.436SS*.SBendtrans-125.2131.5-172.8-73.2165.892.200109.3T151 P155T151-Q153 PolarHBondContact O-N 3.31Å; T151-Q153 VanDerWaalsContact O-N 3.16Å; T151-Q153 PolarHBondContact O-NE2 2.58Å; T151-Q153 PolarHBondContact OG1-N 2.74Å; T151-Q153 PolarHBondContact OG1-O 3.37Å; Q153-P155 VanDerWaalsContact O-CD 3.31Å; Q153-P155 WeakPolarHBondContact O-CD 3.29Å
154T78.6Confident89.5Confident117 Ų11775.1 Ų75.172%0.71841%0.414SS*.PPolyproline II helixtrans-69.8121.4164.951.50000108.5V148V148-T154 HydrophobicContact CG1-CG2 4.32Å
155P76.1Confident89.6Confident37 Ų3776.3 Ų76.324%0.2442%0.422CS..PPolyproline II helixtrans-54.2145.4172.3-24.533.2000110V148 Q153 G157 F160 M163V148-P155 VanDerWaalsContact CG2-CD 3.45Å; V148-P155 HydrophobicContact CG2-CG 4.31Å; Q153-P155 VanDerWaalsContact O-CD 3.31Å; Q153-P155 WeakPolarHBondContact O-CD 3.29Å; P155-G157 PolarHBondContact O-N 2.91Å; P155-F160 HydrophobicContact CB-CB 4.36Å; P155-M163 HydrophobicContact CB-CE 4.28Å; P155-M163 HydrophobicContact CG-CE 3.76Å
156E78.2Confident89.6Confident161 Ų16179 Ų7975%0.75243%0.43SS*.PPolyproline II helixtrans-48.4136.8169.5-72.5-169.9-165.600109.5K158 G159 F160E156-K158 CarbonylContact O-C 3.57Å; E156-K158 PolarHBondContact O-N 3.35Å; E156-G159 WeakPolarHBondContact O-CA 3.44Å; E156-G159 PolarHBondContact O-N 3.12Å; E156-F160 PolarHBondContact O-N 2.74Å; E156-F160 VanDerWaalsContact O-N 3.08Å
157G82.5Confident89.6Confident35 Ų3579.3 Ų79.336%0.36144%0.441SS..Hα-helixtrans-54-29.1-168.800000114P155 F160 V161 L182P155-G157 PolarHBondContact O-N 2.91Å; G157-F160 PolarHBondContact O-N 3.37Å; G157-V161 WeakPolarHBondContact O-CB 3.38Å; G157-V161 WeakPolarHBondContact O-CG2 3.31Å; G157-V161 PolarHBondContact O-N 2.98Å; G157-L182 WeakPolarHBondContact O-CD1 3.25Å; G157-L182 WeakPolarHBondContact O-CD2 3.43Å
158K85.4Confident89.8Confident152 Ų15276.7 Ų76.766%0.66143%0.43SS*.Hα-helixtrans-57.1-53.8170.5-68.5176.6-178.1-68.20112.5E156 V161 E162 L182E156-K158 CarbonylContact O-C 3.57Å; E156-K158 PolarHBondContact O-N 3.35Å; K158-V161 PolarHBondContact O-N 3.29Å; K158-E162 WeakPolarHBondContact O-CB 3.46Å; K158-E162 PolarHBondContact O-N 2.86Å; K158-L182 HydrophobicContact CB-CD1 4.37Å; K158-L182 HydrophobicContact CG-CD1 4.01Å
159G89.1Confident90Very high28 Ų2877.5 Ų77.529%0.28944%0.437SS..Hα-helixtrans-65.6-36.4176.800000112.8E156 E162 M163E156-G159 WeakPolarHBondContact O-CA 3.44Å; E156-G159 PolarHBondContact O-N 3.12Å; G159-E162 PolarHBondContact O-N 2.84Å; G159-M163 WeakPolarHBondContact O-CG 3.5Å; G159-M163 PolarHBondContact O-N 2.78Å
160F91.3Very high90Very high40 Ų4076.9 Ų76.918%0.17543%0.43CS..Hα-helixtrans-62.9-45.8174.9-171.8-104.8000112.2Y141 A144 P155 E156 G157 M163 L164 L180Y141-F160 HydrophobicContact CD2-CZ 4.35Å; Y141-F160 HydrophobicContact CE2-CZ 4.18Å; A144-F160 HydrophobicContact CB-CD2 4.11Å; A144-F160 HydrophobicContact CB-CE2 3.73Å; P155-F160 HydrophobicContact CB-CB 4.36Å; E156-F160 PolarHBondContact O-N 2.74Å; E156-F160 VanDerWaalsContact O-N 3.08Å; G157-F160 PolarHBondContact O-N 3.37Å; F160-M163 HydrophobicContact CD2-CE 4.3Å; F160-M163 PolarHBondContact O-N 2.92Å; F160-L164 HydrophobicContact CD1-CD1 3.91Å; F160-L164 HydrophobicContact CE1-CD1 3.54Å; F160-L164 HydrophobicContact CE1-CG 4.38Å; F160-L164 HydrophobicContact CZ-CD1 4.11Å; F160-L164 WeakPolarHBondContact O-CG 3.39Å; F160-L164 PolarHBondContact O-N 3.11Å; F160-L164 VanDerWaalsContact O-N 3.13Å; F160-L180 HydrophobicContact CD1-CD1 4.44Å; F160-L180 HydrophobicContact CE1-CD1 4.37Å
161V92.6Very high90.1Very high13 Ų1373.5 Ų73.58%0.07942%0.422CS..Hα-helixtrans-66-37.6174.8170.80000111.6G157 K158 L164 C165 A177 L180 L182G157-V161 WeakPolarHBondContact O-CB 3.38Å; G157-V161 WeakPolarHBondContact O-CG2 3.31Å; G157-V161 PolarHBondContact O-N 2.98Å; K158-V161 PolarHBondContact O-N 3.29Å; V161-L164 PolarHBondContact O-N 3.35Å; V161-C165 VanDerWaalsContact O-CB 3.3Å; V161-C165 WeakPolarHBondContact O-CB 3.48Å; V161-C165 PolarHBondContact O-N 3.49Å; V161-C165 PolarHBondContact O-SG 3.39Å; V161-A177 HydrophobicContact CG1-CB 4.11Å; V161-L180 HydrophobicContact CG2-CB 3.85Å; V161-L180 HydrophobicContact CG2-CD1 3.84Å; V161-L182 HydrophobicContact CB-CD1 3.91Å; V161-L182 HydrophobicContact CG1-CD1 4.44Å; V161-L182 HydrophobicContact CG2-CD1 3.72Å; V161-L182 HydrophobicContact CG2-CD2 4.12Å; V161-L182 HydrophobicContact CG2-CG 3.92Å
162E92.7Very high90.3Very high149 Ų14971.1 Ų71.170%0.69641%0.408SS*.Hα-helixtrans-61.1-46.8175.6-173.5177.4171.700111.9K158 G159 L164 C165 K166K158-E162 WeakPolarHBondContact O-CB 3.46Å; K158-E162 PolarHBondContact O-N 2.86Å; G159-E162 PolarHBondContact O-N 2.84Å; E162-L164 VanDerWaalsContact C-N 3.34Å; E162-L164 PolarHBondContact O-N 3Å; E162-C165 PolarHBondContact O-N 3.43Å; E162-K166 PolarHBondContact O-N 3.29Å; E162-K166 VanDerWaalsContact O-N 3.14Å
163M93.9Very high90.6Very high42 Ų4268.6 Ų68.621%0.20738%0.379CS..Hα-helixtrans-57.7-45.5174.7-72.5-165.5-67.500111.9N140 A144 P155 G159 F160 K166N140-M163 WeakPolarHBondContact CB-O 3.35Å; N140-M163 PolarHBondContact ND2-O 3.45Å; A144-M163 HydrophobicContact CB-CB 4.3Å; A144-M163 HydrophobicContact CB-CE 3.84Å; A144-M163 HydrophobicContact CB-SD 4.43Å; P155-M163 HydrophobicContact CB-CE 4.28Å; P155-M163 HydrophobicContact CG-CE 3.76Å; G159-M163 WeakPolarHBondContact O-CG 3.5Å; G159-M163 PolarHBondContact O-N 2.78Å; F160-M163 HydrophobicContact CD2-CE 4.3Å; F160-M163 PolarHBondContact O-N 2.92Å; M163-K166 WeakPolarHBondContact O-CB 3.4Å; M163-K166 PolarHBondContact O-N 3.02Å
164L95.7Very high91.1Very high0 Ų066.7 Ų66.70%037%0.373CS..Hα-helixtrans-63.9-43.5178.1-70.5177000112.8P121 L137 N140 Y141 A144 F160 V161 E162 K166 L168 V176 L180P121-L164 HydrophobicContact CB-CD1 4.39Å; P121-L164 HydrophobicContact CG-CD1 3.87Å; P121-L164 HydrophobicContact CG-CD2 4.24Å; L137-L164 HydrophobicContact CD1-CB 4.1Å; L137-L164 HydrophobicContact CD1-CD2 4Å; N140-L164 PolarHBondContact ND2-O 3.43Å; Y141-L164 HydrophobicContact CD2-CD2 3.93Å; Y141-L164 HydrophobicContact CG-CD2 4.17Å; A144-L164 HydrophobicContact CB-CD2 4.46Å; F160-L164 HydrophobicContact CD1-CD1 3.91Å; F160-L164 HydrophobicContact CE1-CD1 3.54Å; F160-L164 HydrophobicContact CE1-CG 4.38Å; F160-L164 HydrophobicContact CZ-CD1 4.11Å; F160-L164 WeakPolarHBondContact O-CG 3.39Å; F160-L164 PolarHBondContact O-N 3.11Å; F160-L164 VanDerWaalsContact O-N 3.13Å; V161-L164 PolarHBondContact O-N 3.35Å; E162-L164 VanDerWaalsContact C-N 3.34Å; E162-L164 PolarHBondContact O-N 3Å; L164-K166 VanDerWaalsContact C-N 3.26Å; L164-K166 PolarHBondContact O-N 2.98Å; L164-L168 WeakPolarHBondContact O-CD1 3.21Å; L164-V176 HydrophobicContact CB-CG1 3.98Å; L164-V176 HydrophobicContact CD1-CG1 4.24Å; L164-L180 HydrophobicContact CD1-CD1 3.4Å
165C96.1Very high91.7Very high24 Ų2462.8 Ų62.816%0.16235%0.348CS..Hα-helixtrans-72.8-12.6-178.3-70.50000114.3V161 E162 G167 L168V161-C165 VanDerWaalsContact O-CB 3.3Å; V161-C165 WeakPolarHBondContact O-CB 3.48Å; V161-C165 PolarHBondContact O-N 3.49Å; V161-C165 PolarHBondContact O-SG 3.39Å; E162-C165 PolarHBondContact O-N 3.43Å; C165-G167 PolarHBondContact O-N 2.91Å; C165-L168 WeakPolarHBondContact O-CB 3.46Å; C165-L168 PolarHBondContact O-N 3.26Å
166K96Very high92.5Very high127 Ų12761 Ų6155%0.55234%0.336SS*.THydrogen-bonded Turntrans-56.3110.1-173.5-170.8169.9-177.6169.70113N140 E162 M163 L164 L168N140-K166 PolarHBondContact ND2-O 2.92Å; E162-K166 PolarHBondContact O-N 3.29Å; E162-K166 VanDerWaalsContact O-N 3.14Å; M163-K166 WeakPolarHBondContact O-CB 3.4Å; M163-K166 PolarHBondContact O-N 3.02Å; L164-K166 VanDerWaalsContact C-N 3.26Å; L164-K166 PolarHBondContact O-N 2.98Å; K166-L168 VanDerWaalsContact C-N 3.32Å; K166-L168 PolarHBondContact O-N 3.41Å
167G96.6Very high93.1Very high55 Ų5555.3 Ų55.357%0.56732%0.317SS*.THydrogen-bonded Turntrans76.811.7179.200000115.4R136 C165R136-G167 PolarHBondContact NH1-O 3.21Å; C165-G167 PolarHBondContact O-N 2.91Å
168L97.4Very high93.4Very high20 Ų2056 Ų5611%0.10532%0.324CS..  trans-82.3159.7167.3-58.7-176.4000111.1R136 L137 L164 C165 K166 T172 V176R136-L168 HydrophobicContact CB-CD2 3.4Å; R136-L168 VanDerWaalsContact CB-CD2 3.4Å; R136-L168 HydrophobicContact CG-CD2 4.4Å; L137-L168 HydrophobicContact CB-CD1 4.2Å; L137-L168 HydrophobicContact CB-CD2 4.41Å; L137-L168 HydrophobicContact CD1-CD1 4.04Å; L164-L168 WeakPolarHBondContact O-CD1 3.21Å; C165-L168 WeakPolarHBondContact O-CB 3.46Å; C165-L168 PolarHBondContact O-N 3.26Å; K166-L168 VanDerWaalsContact C-N 3.32Å; K166-L168 PolarHBondContact O-N 3.41Å; L168-T172 HydrophobicContact CB-CG2 4.28Å; L168-T172 HydrophobicContact CD1-CG2 3.84Å; L168-T172 HydrophobicContact CG-CG2 4.48Å; L168-V176 HydrophobicContact CD1-CG2 4.33Å
169S97.1Very high93.5Very high50 Ų5051.4 Ų51.435%0.3531%0.31SS..  trans-68.8143.8171.557.40000111.3E133 P171 T172 S173E133-S169 VanDerWaalsContact OE2-CB 3.25Å; E133-S169 WeakPolarHBondContact OE2-CB 3.34Å; E133-S169 PolarHBondContact OE2-N 2.93Å; E133-S169 PolarHBondContact OE2-OG 2.84Å; S169-P171 VanDerWaalsContact C-CD 3.43Å; S169-P171 VanDerWaalsContact C-N 3.35Å; S169-P171 VanDerWaalsContact O-N 3.17Å; S169-T172 WeakPolarHBondContact O-CA 3.49Å; S169-T172 WeakPolarHBondContact O-CB 3.44Å; S169-T172 PolarHBondContact O-N 3.41Å; S169-T172 WeakPolarHBondContact OG-CB 3.32Å; S169-T172 PolarHBondContact OG-OG1 3.11Å; S169-S173 PolarHBondContact O-N 3.25Å; S169-S173 PolarHBondContact O-OG 2.83Å
170Q95.5Very high93.2Very high132 Ų13252.6 Ų52.662%0.61731%0.31SS*.Hα-helixtrans-49.8-43.1-177.3-167.867.353.200114.7T172 S173 N174Q170-T172 VanDerWaalsContact C-N 3.27Å; Q170-T172 PolarHBondContact O-N 3.21Å; Q170-S173 PolarHBondContact O-N 3.04Å; Q170-N174 PolarHBondContact NE2-OD1 2.9Å; Q170-N174 WeakPolarHBondContact O-CB 3.5Å; Q170-N174 PolarHBondContact O-N 3.46Å; Q170-N174 PolarHBondContact O-OD1 3.19Å; Q170-N174 VanDerWaalsContact O-OD1 3.12Å
171P94.9Very high92.3Very high91 Ų9158.2 Ų58.259%0.59134%0.337SS*.Hα-helixtrans-64.1-31.9176.8-2134.5000113S169 L175S169-P171 VanDerWaalsContact C-CD 3.43Å; S169-P171 VanDerWaalsContact C-N 3.35Å; S169-P171 VanDerWaalsContact O-N 3.17Å; P171-L175 PolarHBondContact O-N 3Å; P171-L175 VanDerWaalsContact O-N 3.14Å
172T95.4Very high90.6Very high14 Ų1461.1 Ų61.19%0.08635%0.351CS..Hα-helixtrans-75.3-42.7176.8-57.50000110.9L129 E133 L168 S169 Q170 N174 L175 V176L129-T172 HydrophobicContact CD1-CG2 4.35Å; L129-T172 HydrophobicContact CD2-CG2 3.7Å; E133-T172 HydrophobicContact CB-CG2 4.47Å; E133-T172 PolarHBondContact OE2-OG1 2.91Å; L168-T172 HydrophobicContact CB-CG2 4.28Å; L168-T172 HydrophobicContact CD1-CG2 3.84Å; L168-T172 HydrophobicContact CG-CG2 4.48Å; S169-T172 WeakPolarHBondContact O-CA 3.49Å; S169-T172 WeakPolarHBondContact O-CB 3.44Å; S169-T172 PolarHBondContact O-N 3.41Å; S169-T172 WeakPolarHBondContact OG-CB 3.32Å; S169-T172 PolarHBondContact OG-OG1 3.11Å; Q170-T172 VanDerWaalsContact C-N 3.27Å; Q170-T172 PolarHBondContact O-N 3.21Å; T172-N174 VanDerWaalsContact C-N 3.3Å; T172-N174 PolarHBondContact O-N 3.2Å; T172-L175 WeakPolarHBondContact O-CB 3.36Å; T172-L175 PolarHBondContact O-N 3.12Å; T172-L175 VanDerWaalsContact O-N 3.14Å; T172-V176 WeakPolarHBondContact O-CG2 3.47Å; T172-V176 PolarHBondContact O-N 2.66Å
173S94.9Very high88.4Confident16 Ų1656.7 Ų56.711%0.11235%0.346CS..Hα-helixtrans-60.6-40.3174.1-53.90000111.7S169 Q170 V176 A177S169-S173 PolarHBondContact O-N 3.25Å; S169-S173 PolarHBondContact O-OG 2.83Å; Q170-S173 PolarHBondContact O-N 3.04Å; S173-V176 PolarHBondContact O-N 2.87Å; S173-A177 WeakPolarHBondContact O-CB 3.46Å; S173-A177 PolarHBondContact O-N 2.75Å
174N92.9Very high86.1Confident97 Ų9760.6 Ų60.652%0.51938%0.378SS..Hα-helixtrans-62.4-41173.5-695.7000111.9Q170 T172 G178Q170-N174 PolarHBondContact NE2-OD1 2.9Å; Q170-N174 WeakPolarHBondContact O-CB 3.5Å; Q170-N174 PolarHBondContact O-N 3.46Å; Q170-N174 PolarHBondContact O-OD1 3.19Å; Q170-N174 VanDerWaalsContact O-OD1 3.12Å; T172-N174 VanDerWaalsContact C-N 3.3Å; T172-N174 PolarHBondContact O-N 3.2Å; N174-G178 PolarHBondContact O-N 3.29Å
175L92.5Very high83.4Confident35 Ų3568.4 Ų68.418%0.18341%0.414CS..Hα-helixtrans-64.7-44.9175.5179.163.3000111.8C122 L129 P171 T172 G178 C179C122-L175 HydrophobicContact CB-CG 4.36Å; L129-L175 HydrophobicContact CD2-CD2 4.09Å; P171-L175 PolarHBondContact O-N 3Å; P171-L175 VanDerWaalsContact O-N 3.14Å; T172-L175 WeakPolarHBondContact O-CB 3.36Å; T172-L175 PolarHBondContact O-N 3.12Å; T172-L175 VanDerWaalsContact O-N 3.14Å; L175-G178 PolarHBondContact O-N 2.85Å; L175-C179 WeakPolarHBondContact O-CB 3.39Å; L175-C179 PolarHBondContact O-N 3.21Å; L175-C179 PolarHBondContact O-SG 2.83Å; L175-C179 VanDerWaalsContact O-SG 3.34Å
176V92.8Very high80.5Confident0 Ų072.6 Ų72.60%044%0.444CS..Hα-helixtrans-60.2-47.3176.7171.50000111.1C122 L137 L164 L168 T172 S173 G178 C179 L180C122-V176 HydrophobicContact CB-CG2 4.07Å; L137-V176 HydrophobicContact CD1-CG2 4.17Å; L137-V176 HydrophobicContact CD2-CG2 4.27Å; L164-V176 HydrophobicContact CB-CG1 3.98Å; L164-V176 HydrophobicContact CD1-CG1 4.24Å; L168-V176 HydrophobicContact CD1-CG2 4.33Å; T172-V176 WeakPolarHBondContact O-CG2 3.47Å; T172-V176 PolarHBondContact O-N 2.66Å; S173-V176 PolarHBondContact O-N 2.87Å; V176-G178 PolarHBondContact O-N 3.09Å; V176-C179 PolarHBondContact O-N 2.74Å; V176-L180 HydrophobicContact CG1-CD1 3.86Å; V176-L180 WeakPolarHBondContact O-CB 3.39Å; V176-L180 PolarHBondContact O-N 3.25Å
177A89.9Confident77.9Confident42 Ų4273.2 Ų73.235%0.34746%0.458SS..Hα-helixtrans-63-40.3176.900000112.6V161 S173 L180 Q181V161-A177 HydrophobicContact CG1-CB 4.11Å; S173-A177 WeakPolarHBondContact O-CB 3.46Å; S173-A177 PolarHBondContact O-N 2.75Å; A177-L180 PolarHBondContact O-N 2.87Å; A177-Q181 PolarHBondContact O-N 3.05Å; A177-Q181 VanDerWaalsContact O-N 3.14Å
178G88.7Confident75.2Confident50 Ų5078.1 Ų78.152%0.51547%0.47SS..Hα-helixtrans-68.8-32.5176.600000114.1N174 L175 V176 Q181N174-G178 PolarHBondContact O-N 3.29Å; L175-G178 PolarHBondContact O-N 2.85Å; V176-G178 PolarHBondContact O-N 3.09Å; G178-Q181 VanDerWaalsContact O-CG 3.29Å; G178-Q181 WeakPolarHBondContact O-CG 3.4Å
179C88.2Confident72.5Confident54 Ų5484.3 Ų84.337%0.36550%0.502SS..Hα-helixtrans-74-35.1174.1-73.50000113C122 L175 V176C122-C179 HydrophobicContact CB-CB 3.82Å; L175-C179 WeakPolarHBondContact O-CB 3.39Å; L175-C179 PolarHBondContact O-N 3.21Å; L175-C179 PolarHBondContact O-SG 2.83Å; L175-C179 VanDerWaalsContact O-SG 3.34Å; V176-C179 PolarHBondContact O-N 2.74Å
180L83.2Confident69.5Low54 Ų5488.9 Ų88.928%0.28352%0.518SS..Hα-helixtrans-94.1-0.2-175-68.1171.8000114.6P121 F160 V161 L164 V176 A177 L182P121-L180 HydrophobicContact CB-CD1 4.39Å; P121-L180 HydrophobicContact CB-CD2 4.25Å; F160-L180 HydrophobicContact CD1-CD1 4.44Å; F160-L180 HydrophobicContact CE1-CD1 4.37Å; V161-L180 HydrophobicContact CG2-CB 3.85Å; V161-L180 HydrophobicContact CG2-CD1 3.84Å; L164-L180 HydrophobicContact CD1-CD1 3.4Å; V176-L180 HydrophobicContact CG1-CD1 3.86Å; V176-L180 WeakPolarHBondContact O-CB 3.39Å; V176-L180 PolarHBondContact O-N 3.25Å; A177-L180 PolarHBondContact O-N 2.87Å; L180-L182 PolarHBondContact O-N 3.09Å; L180-L182 VanDerWaalsContact O-N 3.15Å
181Q70.4Confident66.7Low158 Ų15891.9 Ų91.974%0.73853%0.529SS*.THydrogen-bonded Turntrans44.954160.3-60.9-174.85.200114.9A177 G178 G183A177-Q181 PolarHBondContact O-N 3.05Å; A177-Q181 VanDerWaalsContact O-N 3.14Å; G178-Q181 VanDerWaalsContact O-CG 3.29Å; G178-Q181 WeakPolarHBondContact O-CG 3.4Å; Q181-G183 PolarHBondContact O-N 3.49Å
182L58.7Low63.8Low73 Ų7394.9 Ų94.938%0.38254%0.535SS..  trans-64.399.8166.8-55.5-174.7000108.4G157 K158 V161 L180 S184G157-L182 WeakPolarHBondContact O-CD1 3.25Å; G157-L182 WeakPolarHBondContact O-CD2 3.43Å; K158-L182 HydrophobicContact CB-CD1 4.37Å; K158-L182 HydrophobicContact CG-CD1 4.01Å; V161-L182 HydrophobicContact CB-CD1 3.91Å; V161-L182 HydrophobicContact CG1-CD1 4.44Å; V161-L182 HydrophobicContact CG2-CD1 3.72Å; V161-L182 HydrophobicContact CG2-CD2 4.12Å; V161-L182 HydrophobicContact CG2-CG 3.92Å; L180-L182 PolarHBondContact O-N 3.09Å; L180-L182 VanDerWaalsContact O-N 3.15Å; L182-S184 PolarHBondContact O-N 3.03Å
183G45.2Very low61.1Low57 Ų57101.7 Ų101.759%0.58857%0.566SS**  trans-48.2121.1-150.300000115.8Q181 Q185Q181-G183 PolarHBondContact O-N 3.49Å; G183-Q185 PolarHBondContact O-N 2.96Å
184S46.9Very low58.3Low124 Ų124106 Ų10687%0.86759%0.588SS**  trans-57.398.3134.3-66.50000106.3L182 S186L182-S184 PolarHBondContact O-N 3.03Å; S184-S186 PolarHBondContact O-N 3.37Å; S184-S186 VanDerWaalsContact O-N 3.08Å
185Q37.3Very low55.7Low163 Ų163109.7 Ų109.776%0.76260%0.599SS**  trans-53119.9176.1-74.6-76.45300108.3G183 V187G183-Q185 PolarHBondContact O-N 2.96Å; Q185-V187 HydrophobicContact CB-CG2 4.26Å; Q185-V187 PolarHBondContact O-N 3.2Å
186S35.9Very low52.8Low113 Ų113113.4 Ų113.479%0.7963%0.628SS**  trans-75.473.5-178.555.30000110S184 L188S184-S186 PolarHBondContact O-N 3.37Å; S184-S186 VanDerWaalsContact O-N 3.08Å; S186-L188 PolarHBondContact O-N 3.07Å
187V42.4Very low50.7Low139 Ų139118.4 Ų118.484%0.84266%0.661SS**  trans-7566170.9-170.10000108.8Q185Q185-V187 HydrophobicContact CB-CG2 4.26Å; Q185-V187 PolarHBondContact O-N 3.2Å
188L39.9Very low48Very low159 Ų159123.8 Ų123.883%0.83268%0.682SS**  trans-137.797.6159.8-147.7176.1000108S186S186-L188 PolarHBondContact O-N 3.07Å
189L38.7Very low45.3Very low149 Ų149127.2 Ų127.278%0.7870%0.697SS**  trans-56.3143.3-179.1176.364.2000113.1
190E34.6Very low42.7Very low147 Ų147131.8 Ų131.869%0.68772%0.718SS**  trans4.7123.1155.7-77.7-70.6101.700118.3
191K37.1Very low40.4Very low194 Ų194135.3 Ų135.384%0.84375%0.746SS**  trans-100.168.5158-164.1-158.8173.8-163.80110.5
192H33.8Very low39Very low154 Ų154132.1 Ų132.171%0.71375%0.747SS**  trans-94.4124.1167.1-162.9-73.7000110.5
193E38.3Very low38Very low157 Ų157136.6 Ų136.673%0.73477%0.77SS**  trans-105.7102.4-178.7-178.8-178.6143.600109.1
194D37.3Very low37.6Very low108 Ų108137.7 Ų137.758%0.57877%0.769SS**  trans-158.2144145.8-129.8-13.7000116.8
195K37.4Very low37Very low174 Ų174138 Ų13876%0.75777%0.765SS**  trans18.7138.7162.7-66.2154.2-166.687.90122.2
196S31.2Very low37.2Very low113 Ų113137 Ų13779%0.7976%0.76SS**  trans-72.5177.4170.659.30000112.8
197P49.6Very low37.2Very low105 Ų105138.9 Ų138.968%0.68276%0.761SS**  cis-149.8179.223.246.4-26000120.1
198I32.7Very low37Very low154 Ų154140.4 Ų140.479%0.7976%0.757SS**  trans61.8113.3156.8-64.2151.7000119
199C32Very low36.6Very low122 Ų122139.3 Ų139.382%0.82475%0.752SS**  -158.1145.1120.562.20000110.6
200D33.1Very low36.5Very low151 Ų151142.5 Ų142.581%0.80776%0.755SS**  trans-72.4143.2-176-64.5-92.7000114.1
201S35.8Very low36.7Very low127 Ų127143 Ų14389%0.88876%0.757SS**  trans-157.198.2148.4-79.80000109.9
202A40.4Very low36.7Very low92 Ų92139 Ų13976%0.7675%0.754SS**  trans-73.4152.8165.600000110.8
203I38Very low37.8Very low166 Ų166137.8 Ų137.885%0.85176%0.76SS**  -178.6136.7128.8-94153.7000110.7
204S37.7Very low37.9Very low81 Ų81133.8 Ų133.857%0.56676%0.76SS**  trans54.198.4161.2-158.70000119.7H206S204-H206 PolarHBondContact OG-CD2 3.06Å; S204-H206 VanDerWaalsContact OG-CD2 3.28Å
205V34.1Very low38.4Very low130 Ų130136.7 Ų136.779%0.78878%0.775SS**  trans-92.7111.4151.4175.80000108.5
206H41Very low38.9Very low143 Ų143134.1 Ų134.166%0.66278%0.776SS**  trans-130.290.3170.6-77.1-23.8000111.4S204 F208S204-H206 PolarHBondContact OG-CD2 3.06Å; S204-H206 VanDerWaalsContact OG-CD2 3.28Å; H206-F208 HydrophobicContact CB-CD2 4.26Å; H206-F208 HydrophobicContact CB-CE2 3.99Å; H206-F208 PolarHBondContact O-N 2.63Å; H206-F208 VanDerWaalsContact O-N 3.16Å
207N35.9Very low39.7Very low152 Ų152133.9 Ų133.981%0.81378%0.775SS**  trans-66.2105.8164.9-82.410000109.7N209N207-N209 PolarHBondContact O-N 3.41Å
208F38.2Very low39.6Very low170 Ų170134.9 Ų134.975%0.74678%0.781SS**  trans-89.989165.1-83.8-78.1000110.7H206 Y210H206-F208 HydrophobicContact CB-CD2 4.26Å; H206-F208 HydrophobicContact CB-CE2 3.99Å; H206-F208 PolarHBondContact O-N 2.63Å; H206-F208 VanDerWaalsContact O-N 3.16Å; F208-Y210 PolarHBondContact O-N 3.07Å
209N31.5Very low40.8Very low137 Ų137132.4 Ų132.473%0.73378%0.775SS**  trans-77.3104.5171.8-17158.9000109.5N207N207-N209 PolarHBondContact O-N 3.41Å
210Y37Very low41.2Very low216 Ų216138.1 Ų138.185%0.84778%0.781SS**  trans-101.1134.9175.5-108.4-84.2000111.2F208F208-Y210 PolarHBondContact O-N 3.07Å
211Q38.3Very low41.6Very low156 Ų156134.8 Ų134.873%0.72978%0.782SS**  trans-139.6123.7-166.7-173.4168.1-1.400111.9
212S38.4Very low42Very low112 Ų112136 Ų13678%0.78377%0.774SS**  trans65.5166.7173.7-84.90000116.7
213P55Low42.3Very low128 Ų128138.4 Ų138.483%0.83177%0.771SS**  cis-109.3167.31.739.7-30000114.5
214G41.1Very low42.3Very low72 Ų72137.5 Ų137.574%0.74276%0.763SS**  trans-104.3169.6-175.700000115.8
215L47.2Very low42.8Very low170 Ų170140.2 Ų140.289%0.8978%0.776SS**  trans-132.5156.4166.4-78.4176.1000109.2
216P49.3Very low43.3Very low119 Ų119140.6 Ų140.677%0.77377%0.769SS**PPolyproline II helixtrans-83.1143.5-158.431.2-36.2000115.1
217S47.8Very low43.7Very low109 Ų109142.3 Ų142.376%0.76278%0.782SS**PPolyproline II helixtrans-83.5143.7164.8-59.20000111.3
218P48Very low43.9Very low126 Ų126142 Ų14282%0.81878%0.78SS**PPolyproline II helixtrans-62.8150171.4-23.334.9000113.2
219P56.6Low44.1Very low102 Ų102141.4 Ų141.466%0.66278%0.779SS**  trans-107.4169.1-165.240.9-37.5000116.6
220Y40.3Very low44.5Very low241 Ų241143.3 Ų143.395%0.94579%0.788SS**  trans73.4147.1165.9-66.5-73.1000119.7
221G43Very low44.5Very low81 Ų81140.9 Ų140.984%0.83578%0.782SS**  trans147.735.6173.500000117.5
222H43.4Very low44.5Very low154 Ų154139.1 Ų139.171%0.71378%0.784SS**  trans-96.3143.3176.1-176.630.8000111
223M46.3Very low44.4Very low141 Ų141142.8 Ų142.870%0.69579%0.789SS**  trans58.9150.3-178.362.2-92.9-69.800115
224E38.5Very low43.4Very low148 Ų148142.6 Ų142.669%0.69279%0.785SS**  cis-154.8155.935.5-166.1158.8-167.100113.5H226E224-H226 IonicContact OE2-NE2 3.49Å
225T48.4Very low43Very low137 Ų137149 Ų14984%0.8479%0.793SS**  trans-90.2105-179.945.50000112.2
226H43.9Very low42.4Very low139 Ų139150 Ų15064%0.64479%0.79SS**  trans-114.2114.6173.5-68.9-52.9000113.5E224 L228E224-H226 IonicContact OE2-NE2 3.49Å; H226-L228 PolarHBondContact O-N 3.14Å
227L48.8Very low41.8Very low178 Ų178150 Ų15093%0.93279%0.793SS**  trans-69.7109.7167.1-76.4160.3000110.4
228L41.6Very low41.3Very low146 Ų146153.3 Ų153.376%0.76480%0.801SS**  trans-135.183.6170.9-74.5179.6000113.6H226 L230H226-L228 PolarHBondContact O-N 3.14Å; L228-L230 PolarHBondContact O-N 3.01Å
229H42.1Very low40.6Very low158 Ų158150.6 Ų150.673%0.73180%0.796SS**  33.185.4126.6-156.5113.7000117.7
230L39Very low39.4Very low176 Ų176154.9 Ų154.992%0.92181%0.807SS**  trans-82.1115.4159.3-89.375.9000110L228L228-L230 PolarHBondContact O-N 3.01Å
231K37.2Very low39.2Very low166 Ų166149.2 Ų149.272%0.72280%0.802SS**  trans-109.7134.2167.1-144.7-179.3-174.4-174.70108.8
232P39.5Very low39.1Very low119 Ų119149.7 Ų149.777%0.77379%0.793SS**  trans-68.5141-179.627.2-34.8000111.7
233Q35.6Very low38.8Very low188 Ų188151.8 Ų151.888%0.87980%0.8SS**  trans-109.3141.8169-88.5-72.8-77.100110.2
234V34.5Very low38.2Very low125 Ų125148.4 Ų148.476%0.75880%0.801SS**  trans-91.5130.7-172.4177.30000110
235F31.3Very low38.1Very low206 Ų206147.1 Ų147.190%0.90481%0.809SS**  trans-74.8129.2174.8-137.6-93.1000110.7
236K35.7Very low37.5Very low192 Ų192149 Ų14984%0.83581%0.808SS**  trans-132.6147.4167.6-89.8-169.2171.7-174.90109.6
237S36.9Very low37.2Very low118 Ų118149.6 Ų149.683%0.82582%0.815SS**  trans-96.7121.2-169.1-173.80000113.3
238L36.1Very low37.6Very low179 Ų179145.7 Ų145.794%0.93780%0.8SS**  trans-170.2156.6156.8-135.962.1000107.3
239G32.9Very low37.2Very low68 Ų68146 Ų14670%0.70180%0.802SS**  cis-155.1-137.11.300000111.5
240E31.7Very low37Very low193 Ų193144.8 Ų144.890%0.90281%0.81SS**  trans-119.5153.4-171.8-63.5172.297.400114.1
241S37.3Very low37Very low121 Ų121142.3 Ų142.385%0.84681%0.807SS**  trans59143.9158-89.80000119.8
242S39.8Very low37.8Very low91 Ų91140.3 Ų140.364%0.63681%0.81SS**  cis-163.3-154.8-9-157.50000106.9
243F37.5Very low39Very low199 Ų199140 Ų14087%0.87381%0.808SS**  cis-164.5136.94.1-135.3-48.1000110
244G34Very low39.9Very low69 Ų69137.1 Ų137.171%0.71181%0.805SS**  trans77.1154.816800000116.7
245S36.2Very low40.9Very low121 Ų121140.9 Ų140.985%0.84681%0.807SS**  cis-156.2144.48-660000113.5
246H36.6Very low42.2Very low177 Ų177140 Ų14082%0.81981%0.806SS**  trans22.7121.6153.6-93.6-106.7000122.3
247L37.2Very low43.7Very low152 Ų152132.7 Ų132.780%0.79679%0.785SS**  -176.8-177.799-131.569.3000110.1
248P57.3Low44.8Very low96 Ų96132.5 Ų132.562%0.62378%0.781SS**  -126.9176.3-115.644.5-27.3000117.6
249D33.8Very low45.8Very low152 Ų152132 Ų13281%0.81378%0.778SS**  trans55.187.5150.1-57.1-22.5000120.7
250C37.8Very low47.2Very low133 Ų133135 Ų13590%0.89978%0.783SS**  trans-147.789.4144.9-111.80000109.6T252C250-T252 PolarHBondContact O-N 2.85Å
251S38.6Very low48.5Very low123 Ų123130.9 Ų130.986%0.8677%0.773SS**  trans-81.3112.2-177.3-173.80000111.8
252T53.2Low49.6Very low125 Ų125131 Ų13177%0.76777%0.771SS**PPolyproline II helixtrans-100.8132.1164.446.60000109.7C250C250-T252 PolarHBondContact O-N 2.85Å
253P64.6Low50.1Low113 Ų113134.5 Ų134.573%0.73478%0.782SS**PPolyproline II helixtrans-70.1148.9178.829.4-34.6000111.1Y255P253-Y255 PolarHBondContact O-N 3.05Å
254P54.8Low50.8Low127 Ų127129.9 Ų129.983%0.82577%0.774SS**PPolyproline II helixtrans-66.1131.2177.527.9-34.3000110.9E256P254-E256 PolarHBondContact O-N 3.3Å
255Y55.8Low51.6Low203 Ų203134.4 Ų134.480%0.79678%0.78SS**  trans-79.7102.8174.6175.7-99000110.1P253 G257P253-Y255 PolarHBondContact O-N 3.05Å; Y255-G257 PolarHBondContact O-N 3.47Å; Y255-G257 VanDerWaalsContact O-N 3.14Å
256E59Low52Low189 Ų189132.8 Ų132.888%0.88377%0.769SS**  trans-69.8103.4161.5-78.3-152.5136.700109.4P254P254-E256 PolarHBondContact O-N 3.3Å
257G67Low52.4Low38 Ų38127.2 Ų127.239%0.39276%0.759SS.*PPolyproline II helixtrans-68.8139.4165.900000110.4Y255 L259Y255-G257 PolarHBondContact O-N 3.47Å; Y255-G257 VanDerWaalsContact O-N 3.14Å; G257-L259 PolarHBondContact O-N 2.91Å
258P59.2Low52.9Low114 Ų114126.9 Ų126.974%0.7476%0.758SS**PPolyproline II helixtrans-63.7126.8-176.225.4-34.2000111.6T260P258-T260 PolarHBondContact O-N 3.24Å
259L56.7Low52.2Low169 Ų169132.1 Ų132.189%0.88577%0.771SS**PPolyproline II helixtrans-59125.1177.6-67.2170.5000111G257 P261G257-L259 PolarHBondContact O-N 2.91Å; L259-P261 WeakPolarHBondContact O-CD 3.44Å
260T62.6Low52.6Low131 Ų131130.2 Ų130.280%0.80477%0.77SS**PPolyproline II helixtrans-65.6122172.140.50000110.1P258P258-T260 PolarHBondContact O-N 3.24Å
261P58.6Low52.8Low106 Ų106131.4 Ų131.469%0.68877%0.767SS**PPolyproline II helixtrans-68.3141.6179.127.6-34.1000110.8L259 L263L259-P261 WeakPolarHBondContact O-CD 3.44Å; P261-L263 PolarHBondContact O-N 3.35Å
262P61.8Low52.8Low123 Ų123134 Ų13480%0.79976%0.763SS**PPolyproline II helixtrans-66.9134.4179.227.4-34.2000111.2S264P262-S264 PolarHBondContact O-N 3.18Å
263L50.2Low52.1Low165 Ų165136.8 Ų136.886%0.86477%0.767SS**  trans-7197.5178.9-65.1177.4000111.1P261 I265P261-L263 PolarHBondContact O-N 3.35Å; L263-I265 PolarHBondContact O-N 3.49Å; L263-I265 VanDerWaalsContact O-N 3.08Å
264S52Low50.6Low102 Ų102138.6 Ų138.671%0.71377%0.77SS**  trans-70.398.6173.9-175.50000111.4P262 S266P262-S264 PolarHBondContact O-N 3.18Å; S264-S266 VanDerWaalsContact C-N 3.28Å; S264-S266 PolarHBondContact O-N 3.1Å; S264-S266 VanDerWaalsContact O-N 3.1Å
265I51.3Low49.7Very low164 Ų164135.6 Ų135.684%0.84176%0.763SS**  trans-83.873.4169.9-55.4-178.8000109.1L263 G267L263-I265 PolarHBondContact O-N 3.49Å; L263-I265 VanDerWaalsContact O-N 3.08Å; I265-G267 VanDerWaalsContact C-N 3.32Å; I265-G267 PolarHBondContact O-N 3.08Å
266S44.7Very low48.6Very low87 Ų87131.6 Ų131.661%0.60876%0.764SS**  trans-89.767.9167.3540000110.3S264 N268S264-S266 VanDerWaalsContact C-N 3.28Å; S264-S266 PolarHBondContact O-N 3.1Å; S264-S266 VanDerWaalsContact O-N 3.1Å; S266-N268 PolarHBondContact O-N 3.01Å; S266-N268 PolarHBondContact O-OD1 2.98Å
267G44.3Very low48.2Very low59 Ų59128.1 Ų128.161%0.60876%0.758SS**  trans-79.172-176.200000113.8I265 F269I265-G267 VanDerWaalsContact C-N 3.32Å; I265-G267 PolarHBondContact O-N 3.08Å; G267-F269 PolarHBondContact O-N 3.08Å
268N47.8Very low46.9Very low145 Ų145133.4 Ų133.478%0.77578%0.778SS**  trans-76.557.4-176.3-68.725.1000113.6S266 S270S266-N268 PolarHBondContact O-N 3.01Å; S266-N268 PolarHBondContact O-OD1 2.98Å; N268-S270 VanDerWaalsContact C-N 3.33Å; N268-S270 PolarHBondContact O-N 3.49Å
269F43Very low46Very low206 Ų206135.9 Ų135.990%0.90478%0.784SS**  trans-7878.6172.9-103.2-86.3000111.6G267 L271G267-F269 PolarHBondContact O-N 3.08Å; F269-L271 PolarHBondContact O-N 3.33Å; F269-L271 VanDerWaalsContact O-N 3.14Å
270S42.5Very low45.1Very low113 Ų113135.9 Ų135.979%0.7978%0.779SS**  trans-70.6101.6164.8-72.20000109.8N268 K272N268-S270 VanDerWaalsContact C-N 3.33Å; N268-S270 PolarHBondContact O-N 3.49Å; S270-K272 PolarHBondContact O-N 3.3Å
271L40.3Very low43.8Very low158 Ų158138.3 Ų138.383%0.82778%0.778SS**  trans-61.7108.3170.6-17965.9000109.3F269 Q273F269-L271 PolarHBondContact O-N 3.33Å; F269-L271 VanDerWaalsContact O-N 3.14Å; L271-Q273 PolarHBondContact O-N 3.14Å; L271-Q273 VanDerWaalsContact O-N 3.07Å
272K40Very low42.7Very low178 Ų178138.3 Ų138.377%0.77478%0.781SS**  trans-66.2105.7168.9-89.2-79.1-173.9167.80108.7S270 D274S270-K272 PolarHBondContact O-N 3.3Å; K272-D274 VanDerWaalsContact C-N 3.34Å; K272-D274 PolarHBondContact O-N 3.31Å
273Q37.5Very low41.5Very low183 Ų183143 Ų14386%0.85578%0.784SS**  trans-85.377.7175.6-172.1179.21500109.2L271L271-Q273 PolarHBondContact O-N 3.14Å; L271-Q273 VanDerWaalsContact O-N 3.07Å
274D34Very low40.7Very low150 Ų150141.3 Ų141.380%0.80279%0.786SS**  trans-69.6134.1162.2-78.2-70.4000109K272K272-D274 VanDerWaalsContact C-N 3.34Å; K272-D274 PolarHBondContact O-N 3.31Å
275G36.1Very low40Very low65 Ų65145.2 Ų145.267%0.6779%0.791SS**  trans-113.7-160-175.800000112.8
276S33.1Very low39.9Very low118 Ų118144.9 Ų144.983%0.82579%0.788SS**  trans81.7142.7-179.7-157.20000115.4
277P49.3Very low40.1Very low117 Ų117145.6 Ų145.676%0.7679%0.79SS**  cis-122.4-177.7-21.927.1-6.4000113.2
278D39.4Very low40Very low149 Ų149150.2 Ų150.280%0.79780%0.795SS**  trans-59.7152170.7-153.6-2.2000112.9
279L41.8Very low39.6Very low165 Ų165154 Ų15486%0.86480%0.8SS**  trans-152.1117.5166.4-169.563.8000111.7
280E36.4Very low39.8Very low169 Ų169150.1 Ų150.179%0.7980%0.796SS**  trans-74.2-178.6177.4-80.3-149.197.100114.1
281K36.5Very low39.4Very low182 Ų182150.4 Ų150.479%0.79180%0.798SS**  trans-81.4162.4-162.2-62.7158.8-175.81530114.5
282S35.8Very low39.3Very low106 Ų106148.6 Ų148.674%0.74180%0.798SS**  trans72.8104.8141.845.10000120.7
283Y35.5Very low39.2Very low222 Ų222145.8 Ų145.887%0.87180%0.801SS**  65.1114121.3-108.8-91.8000120.6
284S32.9Very low39.3Very low129 Ų129145.5 Ų145.590%0.90281%0.805SS**  trans-156.7160.8137.9-85.10000110.3
285F37Very low39.3Very low184 Ų184144 Ų14481%0.80781%0.806SS**  trans-132.3116.6-161.3172.8-83.4000111
286M50.6Low39.2Very low158 Ų158146.3 Ų146.378%0.77881%0.812SS**  trans-164135.3165.4-137.3156.663.800112.4H288M286-H288 WeakPolarHBondContact CE-NE2 3.48Å
287P49.1Very low39.2Very low101 Ų101143.6 Ų143.666%0.65680%0.803SS**  trans-109.7133.3179.436.8-28.5000113.6
288H41.6Very low38.7Very low156 Ų156146.3 Ų146.372%0.72281%0.805SS**  trans-138.9155.8174.5-67.7-66.4000113.7M286M286-H288 WeakPolarHBondContact CE-NE2 3.48Å
289Y38.3Very low38.5Very low225 Ų225144.9 Ų144.988%0.88280%0.801SS**  trans-77.2158-172.3-86.2-111000113.5
290P47.4Very low38.6Very low125 Ų125145.5 Ų145.581%0.81280%0.799SS**  trans-69.6147.7169.131.6-35.4000111.4
291S34.5Very low38.4Very low118 Ų118142.3 Ų142.383%0.82580%0.795SS**  trans-134.5144170.4-170.60000110.3
292S39.4Very low38.8Very low120 Ų120140.3 Ų140.384%0.83980%0.799SS**  trans-79.7143-174.1-47.10000112.3
293S37.2Very low39.7Very low120 Ų120140.7 Ų140.784%0.83980%0.799SS**  trans-136.8118.9165.5530000111.9
294L39.3Very low39.8Very low177 Ų177140 Ų14093%0.92780%0.8SS**  trans-91.5132.2166.6-71.8161.7000108.4
295S35.1Very low40.3Very low119 Ų119142.5 Ų142.583%0.83280%0.798SS**  trans-165152.6153.5-163.10000113
296S33.4Very low40.3Very low113 Ų113138.7 Ų138.779%0.7980%0.801SS**  trans-28.9149.9164.5-147.60000115.9
297G33.3Very low39.7Very low61 Ų61134.8 Ų134.863%0.62980%0.801SS**  cis122.6116.311.700000110.7
298H38Very low39.6Very low174 Ų174136.2 Ų136.281%0.80681%0.808SS**  trans-148.5151.7176.7-137.763.2000111.7
299V34.9Very low39.8Very low119 Ų119134.2 Ų134.272%0.72181%0.808SS**  trans-128.6120-165.5-144.30000110.2
300H43.4Very low40Very low177 Ų177134.1 Ų134.182%0.81981%0.806SS**  trans-142.1141.5162.4-80.3-67.9000109.9
301S33.8Very low39.8Very low102 Ų102138.4 Ų138.471%0.71381%0.808SS**  trans-122.9177.8-171.3-58.30000111.2
302T45Very low40.3Very low141 Ų141139.9 Ų139.987%0.86581%0.807SS**  trans97.1145.3176.371.20000115.6
303P54.9Low40.9Very low113 Ų113139.4 Ų139.473%0.73480%0.799SS**  trans-128.8164.2-142.941-26.1000115.6
304F36.7Very low41.3Very low207 Ų207139.6 Ų139.691%0.90880%0.797SS**  trans-152.6156.4141.7-116.6-78.6000111
305Q42.7Very low41.9Very low182 Ų182138.4 Ų138.485%0.8579%0.79SS**  trans-88.9143.8-173.9-61.1169.6-55.400112.8
306A37.4Very low42.7Very low105 Ų105140.1 Ų140.187%0.86879%0.79SS**  164.5129120.500000111.4
307G39.3Very low43.5Very low75 Ų75142.8 Ų142.877%0.77379%0.792SS**  trans158.3111.8173.700000113.8
308T47Very low44Very low131 Ų131145.3 Ų145.380%0.80480%0.8SS**  trans-42.3142.2176.849.10000115.3R310T308-R310 PolarHBondContact O-N 3.43Å
309P45Very low44Very low114 Ų114147.4 Ų147.474%0.7480%0.802SS**  trans-65.7133.2176.829-34.8000111.5
310R41.6Very low44.2Very low223 Ų223148.4 Ų148.484%0.84280%0.804SS**  trans-88.3136.6158.4-67.7-174.8-176.5166.72.7108.4T308 D312T308-R310 PolarHBondContact O-N 3.43Å; R310-D312 PolarHBondContact O-N 3.07Å
311Y44.6Very low44Very low216 Ų216144.5 Ų144.585%0.84780%0.796SS**  trans-82.995166.5-73.8-91000108.7
312D44.8Very low44.4Very low149 Ų149149.8 Ų149.880%0.79780%0.802SS**  trans-82119.4159.7-79.6-55.7000108.2R310R310-D312 PolarHBondContact O-N 3.07Å
313V51.6Low44.6Very low110 Ų110148.2 Ų148.267%0.66779%0.794SS**  trans-97.3117.7178.8177.40000108.5I315V313-I315 HydrophobicContact CG1-CG1 4.25Å; V313-I315 PolarHBondContact O-N 3.16Å
314P46.3Very low43.9Very low124 Ų124151.8 Ų151.881%0.80580%0.801SS**  trans-70.2100.1173.7-15.630.6000109.9D316P314-D316 VanDerWaalsContact C-N 3.33Å; P314-D316 PolarHBondContact O-N 3.17Å
315I51.9Low44.3Very low151 Ų151150.1 Ų150.177%0.77480%0.795SS**  trans-87.481.4168.1-53.5179.3000107.8V313V313-I315 HydrophobicContact CG1-CG1 4.25Å; V313-I315 PolarHBondContact O-N 3.16Å
316D50.2Low44.1Very low156 Ų156144.9 Ų144.983%0.83479%0.791SS**  trans-118.292.9157.2-165.711.1000107.4P314P314-D316 VanDerWaalsContact C-N 3.33Å; P314-D316 PolarHBondContact O-N 3.17Å
317M51.7Low44.4Very low168 Ų168148.1 Ų148.183%0.82879%0.792SS**  trans-135.795.6-172.3-172160173.900108.5Y319M317-Y319 PolarHBondContact O-N 3.13Å; M317-Y319 VanDerWaalsContact O-N 3.16Å
318S42.8Very low44.3Very low115 Ų115147.9 Ų147.980%0.80479%0.789SS**  trans-50.2116-178.9-52.80000111.4D320S318-D320 PolarHBondContact O-N 3.18Å; S318-D320 VanDerWaalsContact O-N 3.09Å
319Y37.5Very low44.2Very low217 Ų217147.6 Ų147.685%0.85179%0.787SS**  trans-79.194.8-178.4-171.8-93.2000110.4M317M317-Y319 PolarHBondContact O-N 3.13Å; M317-Y319 VanDerWaalsContact O-N 3.16Å
320D40.6Very low44.1Very low141 Ų141149.9 Ų149.975%0.75479%0.788SS**  trans-73.5129.2177.8-142.1-22000110.8S318 Y322S318-D320 PolarHBondContact O-N 3.18Å; S318-D320 VanDerWaalsContact O-N 3.09Å; D320-Y322 PolarHBondContact O-N 3.43Å
321S38.7Very low44.4Very low95 Ų95147.2 Ų147.266%0.66479%0.789SS**  trans-98.495.6-160.8-162.80000112
322Y41.9Very low44.2Very low212 Ų212143.7 Ų143.783%0.83179%0.785SS**PPolyproline II helixtrans-69.2133.8176.9-94-95.8000112.1D320D320-Y322 PolarHBondContact O-N 3.43Å
323P50.3Low44.2Very low109 Ų109142.4 Ų142.471%0.70878%0.783SS**PPolyproline II helixtrans-76.1143.3-170.329.3-35.5000113.6H325P323-H325 PolarHBondContact O-N 2.81Å
324H38.9Very low43.8Very low187 Ų187142.7 Ų142.787%0.86679%0.785SS**PPolyproline II helixtrans-61.4123.4167.1-96.5-82.2000111G326H324-G326 PolarHBondContact O-N 3.4Å; H324-G326 VanDerWaalsContact O-N 3.14Å
325H46.2Very low43.5Very low172 Ų172145.7 Ų145.780%0.79679%0.786SS**  trans-71.3102165.830.7-88.7000109.3P323P323-H325 PolarHBondContact O-N 2.81Å
326G38.8Very low43.2Very low73 Ų73144.7 Ų144.775%0.75379%0.787SS**  trans-68.9132.4176.300000111.8H324 G328H324-G326 PolarHBondContact O-N 3.4Å; H324-G326 VanDerWaalsContact O-N 3.14Å; G326-G328 PolarHBondContact O-N 3.07Å; G326-G328 VanDerWaalsContact O-N 3.11Å
327I42.4Very low42.9Very low173 Ų173150 Ų15089%0.88781%0.807SS**  trans-76.598.9177.4-60.9173.9000108.8
328G37.8Very low42.5Very low69 Ų69149.2 Ų149.271%0.71181%0.806SS**  trans-85.5142.417000000111.9G326G326-G328 PolarHBondContact O-N 3.07Å; G326-G328 VanDerWaalsContact O-N 3.11Å
329T43.9Very low42.5Very low125 Ų125150.9 Ų150.977%0.76781%0.806SS**  trans-95169.6177.450.60000112.2
330Q43.4Very low42.7Very low163 Ų163147.3 Ų147.376%0.76280%0.803SS**  trans74.4140.1-176.3-42.3-72.719.900112.8
331L47.3Very low42.9Very low166 Ų166147.6 Ų147.687%0.86981%0.806SS**  cis-137.1-179.626.3-84.1169.4000114.1
332N40.8Very low43.1Very low142 Ų142150.9 Ų150.976%0.75982%0.815SS**  trans-99.8158.9-175.7-92.9-43.2000114.5
333T44.4Very low43.2Very low122 Ų122146.9 Ų146.975%0.74881%0.814SS**  trans78.7154.6152.2-53.90000118.6
334V43Very low42.7Very low117 Ų117149.6 Ų149.671%0.70982%0.821SS**  trans62.2140.9178.2-85.40000117.6
335F41.2Very low43Very low187 Ų187146.7 Ų146.782%0.8282%0.818SS**  cis-127.3158.95.7-121.5-80.6000112
336T46.3Very low42.7Very low130 Ų130144.6 Ų144.680%0.79882%0.82SS**  trans-115.1116.4162.648.40000109.8
337E43.2Very low43.1Very low268 Ų268151.1 Ų151.1100%1.25283%0.826SS**  trans-1550142.8-157.5169.3157.800108.4

Retrieved 337 of 337 residues in 63.4 ms (Link to these results)