A0A5K4EZS1_SCHMA Loading...

Spermatogenesis-associated protein 7 homolog

AlphaFold DB , UniProt , Accession A0A5K4EZS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 381 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
1M30Very low31.7Very low240 Ų240127.7 Ų127.7100%1.18268%0.676SS**  0133.90-76.7172.7166.200108.3
2N32.9Very low31.6Very low140 Ų140129.8 Ų129.875%0.74969%0.686SS**  trans26.8111.8159-60.90.8000119
3L32.2Very low31.8Very low143 Ų143131.1 Ų131.175%0.74969%0.693SS**  67.8135.584.3-67.8165.9000113
4N33.5Very low31.4Very low124 Ų124137.6 Ų137.666%0.66371%0.706SS**  cis-168.9151.1-21.1-119.16.1000107.4
5N31.8Very low31.7Very low142 Ų142135.2 Ų135.276%0.75970%0.703SS**  trans20.1152.3148.5-53.9-17.3000122.4
6S30.8Very low31.9Very low96 Ų96136.2 Ų136.267%0.67171%0.707SS**  cis175.5132-26.853.30000110.6
7N30.3Very low31.7Very low144 Ų144140.6 Ų140.677%0.7771%0.713SS**  trans66.1115.5145.3-72-19.1000126
8I33.3Very low31.6Very low135 Ų135141 Ų14169%0.69272%0.716SS**  94.8106114.3-70.6173.1000123.6
9N32.7Very low31.3Very low86 Ų86141.2 Ų141.246%0.4672%0.719SS.*  98.2124123.4-95.4-10.5000128.7
10R30.4Very low31.3Very low58 Ų58143.2 Ų143.222%0.21972%0.723CS.*  trans96.1123.9130.9-57.8147.8174-173.8-18.5125.7M32 N33 Y34 T35R10-M32 HydrophobicContact CG-CB 4.37Å; R10-N33 PolarHBondContact NE-O 3.4Å; R10-N33 PolarHBondContact NH2-O 3.01Å; R10-Y34 HydrophobicContact CB-CD2 3.77Å; R10-Y34 HydrophobicContact CB-CE2 3.21Å; R10-Y34 VanDerWaalsContact CD-CE2 3.42Å; R10-Y34 HydrophobicContact CG-CD2 3.85Å; R10-Y34 HydrophobicContact CG-CE2 3.74Å; R10-Y34 HydrophobicContact CG-CG 4.31Å; R10-T35 PolarHBondContact NH2-O 2.97Å
11N31.2Very low31.4Very low97 Ų97145.3 Ų145.352%0.51973%0.73SS.*  trans24.7133145.9-64.9-3000125.7
12L29.7Very low31.4Very low153 Ų153141.8 Ų141.880%0.80171%0.708SS**  167.1149.7113.5-91.6165.2000116.1
13N34.7Very low30.9Very low146 Ų146144.2 Ų144.278%0.78171%0.708SS**  trans88.5129.2154.3-61.3-19.6000124.6
14Y25.9Very low31.1Very low223 Ų223142.1 Ų142.188%0.87570%0.703SS**  trans-84.7-162.5180-62.7-96.8000114.3
15P36.4Very low30.7Very low101 Ų101142 Ų14266%0.65670%0.703SS**  cis-135.4-174.7-19.723.41.6000114.8
16I34.5Very low30.3Very low151 Ų151145.2 Ų145.277%0.77471%0.705SS**  175.5115.7116.5-84.6156.4000113.6
17W29.2Very low30.2Very low211 Ų211148.4 Ų148.480%0.79971%0.713SS**  trans23.5135.5150.3-60.384.2000126.3
18L29.7Very low30Very low148 Ų148147.6 Ų147.678%0.77571%0.714SS**  trans62.8130.3144.5-61.6163000118.5
19D25.4Very low29.8Very low144 Ų144148.1 Ų148.177%0.7772%0.724SS**  cis-162-173.644.7-169.510.5000111
20K30.8Very low29.6Very low182 Ų182148.6 Ų148.679%0.79173%0.733SS**  trans102.2107.8163.3-57.6175.7-177.3177.10119.1
21Q33.4Very low29.4Very low188 Ų188154.3 Ų154.388%0.87976%0.76SS**  trans30.1109.9130.6-58.4-171.24.600120.7
22K29.6Very low29.2Very low166 Ų166154.5 Ų154.572%0.72276%0.759SS**  trans58.3115130.6-92.6179.8167.8-172.60121.2
23Y24.2Very low29Very low190 Ų190151.9 Ų151.975%0.74575%0.746SS**  trans84.2161.7152.3-53.1-59.1000117.3
24P34.8Very low28.5Very low99 Ų99152.3 Ų152.364%0.64374%0.738SS**  -132.9-161.9-85.935.7-14.3000112.9
25N26.3Very low28.5Very low122 Ų122147 Ų14765%0.65273%0.729SS**  trans79.293.3157.7-66.4-5.4000120.2
26Y23.9Very low28.2Very low209 Ų209153 Ų15382%0.8274%0.738SS**  trans69.4158.2131.2-56.2-66.7000123
27I28.6Very low27.8Very low164 Ų164156.5 Ų156.584%0.84174%0.743SS**  trans99.8100.9161.2-48.7-177.2000117.3
28T24.6Very low28.2Very low127 Ų127151.1 Ų151.178%0.77974%0.735SS**  trans-61.5145.1170.148.50000116.8
29T30.7Very low28Very low146 Ų146151.3 Ų151.390%0.89674%0.737SS**  trans-164.5160.9134.346.70000109
30S26.9Very low28.1Very low95 Ų95156.3 Ų156.366%0.66475%0.745SS**  176.1110.3-51.8162.30000107.3
31K27.6Very low27.9Very low178 Ų178157.4 Ų157.477%0.77475%0.75SS**  trans64.8132.7153.3-62175.8179.4174.50121.5
32M25.6Very low27.7Very low102 Ų102156.1 Ų156.150%0.50275%0.748SS.*  -132.8144.6129.4-81.6-151.7173.700111.1R10R10-M32 HydrophobicContact CG-CB 4.37Å
33N26.3Very low27.7Very low98 Ų98154.8 Ų154.852%0.52475%0.754SS.*  trans-98116.8-163.1-68.2-47.6000114.5R10 T35R10-N33 PolarHBondContact NE-O 3.4Å; R10-N33 PolarHBondContact NH2-O 3.01Å; N33-T35 VanDerWaalsContact C-N 3.32Å; N33-T35 PolarHBondContact O-N 3.39Å; N33-T35 VanDerWaalsContact O-N 3.17Å
34Y24.5Very low28.2Very low155 Ų155151.4 Ų151.461%0.60876%0.756SS**  trans-45.6-8.1160.4-75.3-78.1000122.3R10 R36R10-Y34 HydrophobicContact CB-CD2 3.77Å; R10-Y34 HydrophobicContact CB-CE2 3.21Å; R10-Y34 VanDerWaalsContact CD-CE2 3.42Å; R10-Y34 HydrophobicContact CG-CD2 3.85Å; R10-Y34 HydrophobicContact CG-CE2 3.74Å; R10-Y34 HydrophobicContact CG-CG 4.31Å; Y34-R36 PolarHBondContact O-N 2.77Å
35T25.2Very low27.9Very low112 Ų112151.1 Ų151.169%0.68776%0.761SS**  trans-62.7123.6-163.541.30000113.7R10 N33R10-T35 PolarHBondContact NH2-O 2.97Å; N33-T35 VanDerWaalsContact C-N 3.32Å; N33-T35 PolarHBondContact O-N 3.39Å; N33-T35 VanDerWaalsContact O-N 3.17Å
36R29.5Very low28Very low225 Ų225149.8 Ų149.885%0.84977%0.767SS**  trans-145.5125.2154-140.7-171.8-85.7-150.41.3108.7Y34Y34-R36 PolarHBondContact O-N 2.77Å
37Y26.5Very low28.2Very low226 Ų226145.8 Ų145.889%0.88677%0.765SS**  trans-29.7163.9-171.6-81.2-97.8000122.2
38P38.6Very low28.3Very low97 Ų97142.2 Ų142.263%0.6376%0.755SS**  trans-96.7-178.2-164.240-35.3000114.8
39N24.2Very low28.5Very low153 Ų153144 Ų14482%0.81876%0.757SS**  trans69.1102.7166.6-66-23000118.1
40R28.2Very low28.6Very low248 Ų248146 Ų14694%0.93675%0.748SS**  -160127.4123.8-108.8165-175.3-177.60.6111.2
41K25.9Very low28.9Very low205 Ų205147.7 Ų147.789%0.89175%0.75SS**  trans-67.1131.1165.1-66.9177.4176.4-179.40108.6
42L30.7Very low29Very low162 Ų162149.5 Ų149.585%0.84875%0.752SS**  trans-149107.2148.5-78.8-174.9000109P44L42-P44 WeakPolarHBondContact O-CD 3.41Å
43T29.2Very low29.3Very low137 Ų137155.4 Ų155.484%0.8477%0.768SS**  trans-87.7113.5149.243.90000107.5
44P35.4Very low29.6Very low120 Ų120158.4 Ų158.478%0.77978%0.784SS**  trans-76.3122.8153.21.916.7000107.2L42L42-P44 WeakPolarHBondContact O-CD 3.41Å
45A27.7Very low29.8Very low92 Ų92159 Ų15976%0.7679%0.793SS**  trans-67.2156.1171.800000111.1
46A28.1Very low30.2Very low94 Ų94161.8 Ų161.878%0.77780%0.803SS**  trans-45.6147.4174.900000115.4
47T28Very low30.1Very low126 Ų126157.3 Ų157.377%0.77380%0.796SS**  trans-176.2148.4137.120.20000106.7
48S30.8Very low30.4Very low89 Ų89152.9 Ų152.962%0.62280%0.797SS**  cis-149.4160.828.654.80000108.6
49I29.8Very low29.7Very low163 Ų163158.7 Ų158.784%0.83681%0.808SS**SBend-131.2109.358.5-69.5161.2000108.1
50R32.5Very low30Very low188 Ų188155.9 Ų155.971%0.70981%0.806SS**  54.1122.572.1-89.7-170.8176.9178.60.8113
51L31.9Very low30Very low132 Ų132149 Ų14969%0.69180%0.795SS**  cis-139.3-165.65.2-73.9161000107.7
52R31.1Very low30.2Very low216 Ų216149.5 Ų149.582%0.81579%0.793SS**  cis-161.41787.7-145.3161.1-167.5169.52.8109.4
53R31.6Very low30.3Very low226 Ų226147.1 Ų147.185%0.85378%0.781SS**SBendtrans65.176.4165.6-66.3-171.8176.8179.3-0.2117.9
54N31.6Very low30.4Very low160 Ų160147.5 Ų147.586%0.85677%0.773SS**  177.8109.192.1-921.6000109.6
55E30.1Very low30Very low168 Ų168148.6 Ų148.679%0.78577%0.768SS**  trans-95.5136.6171-67167.8-162.500108.6
56N33.5Very low30.1Very low171 Ų171154.9 Ų154.991%0.91477%0.772SS**  trans-139.3105.4156.4-95.1-20.2000107
57N27.1Very low29.8Very low130 Ų130155.6 Ų155.670%0.69577%0.771SS**  trans-85.4148.1175.5-73.7-52.5000110.7
58C31.7Very low30.3Very low133 Ų133155.1 Ų155.190%0.89977%0.771SS**  trans-157.2135144.7-1050000110.9
59Y24.7Very low30.2Very low220 Ų220157 Ų15786%0.86378%0.783SS**  trans-85.4-178.5170.6-82.2-105000109.3
60A31.6Very low30Very low94 Ų94153.6 Ų153.678%0.77778%0.78SS**  cis-157.5-175.623.400000114
61S26.8Very low30.3Very low103 Ų103149.8 Ų149.872%0.7278%0.779SS**  trans-95-163.3-174.5-32.70000114.6
62Y30.6Very low30.2Very low216 Ų216150.3 Ų150.385%0.84778%0.783SS**  trans86.8138.2-174.4-61.6-89.2000113
63D32.9Very low30Very low111 Ų111146.4 Ų146.459%0.59478%0.777SS**  cis-157163.78.9-130.7-20.2000117.7
64H30.3Very low29.7Very low146 Ų146146.4 Ų146.468%0.67678%0.777SS**  trans31.3127.6149.9-68.7-25.6000127.3
65Q28.4Very low29.4Very low143 Ų143143.8 Ų143.867%0.66877%0.77SS**  95.3135.8123.6-81.1-171.652.500125
66R28.9Very low29.5Very low224 Ų224143.3 Ų143.385%0.84577%0.773SS**  trans77.1112.9149.3-73.2172.3-176.7-115.81.2121.9
67S22.8Very low29Very low108 Ų108143.5 Ų143.576%0.75577%0.771SS**  trans-92-178.7146.653.40000110.3
68P37.7Very low29.6Very low117 Ų117141.9 Ų141.976%0.7677%0.768SS**  cis-134.7158.9-49.136.1-21.5000113.3
69S28Very low29.6Very low127 Ų127141.6 Ų141.689%0.88876%0.762SS**  trans-162.4153.7154.453.40000112.3
70A25.3Very low29.7Very low93 Ų93137.1 Ų137.177%0.76975%0.752SS**  trans-126.7-173.8174.900000108.5
71P39.7Very low29.7Very low107 Ų107138.8 Ų138.870%0.69576%0.757SS**  -126.1168.6-63.837.2-25000112.1
72N28.7Very low29.7Very low143 Ų143140.7 Ų140.777%0.76576%0.755SS**  trans178.1130.6135.5-97.4-38.1000116.3
73L28.4Very low29.7Very low134 Ų134140.1 Ų140.170%0.70275%0.752SS**  trans29.3127.7136.2-67.5163.4000123.6
74R24.5Very low29.7Very low226 Ų226140 Ų14085%0.85375%0.752SS**  trans69.4143.8141.7-67.5178.2179.8179.5-0.6117.7
75C25.2Very low29.8Very low105 Ų105142.3 Ų142.371%0.70975%0.754SS**  cis-123.3-178.1-2.3-68.70000108.9
76D32.4Very low29.8Very low158 Ų158143.5 Ų143.585%0.84576%0.76SS**  -166.8169.756.7-77.1-46.7000112.8
77M23.3Very low29.9Very low175 Ų175141.6 Ų141.686%0.86276%0.761SS**  trans-147169.2175.3-108.6-173.682.800108
78P40Very low30.2Very low97 Ų97142.4 Ų142.463%0.6376%0.757SS**  cis-141.5-144.8-1837.3-14.3000113.4
79V31.5Very low29.8Very low127 Ų127143.4 Ų143.477%0.7776%0.756SS**  trans84.8105.5166.9-167.30000114.8
80N27.2Very low30.1Very low125 Ų125144.6 Ų144.667%0.66875%0.751SS**  95.1109.852.5-168.435.4000113
81C31.8Very low30.5Very low130 Ų130150.4 Ų150.488%0.87876%0.759SS**  trans-127.2132.5170.6-670000109.7
82Q26.8Very low30Very low143 Ų143153.9 Ų153.967%0.66876%0.764SS**  trans-112.6-176.4-176.6-68.5-179.6-8600112.2
83Y30.2Very low30Very low203 Ų203157 Ų15780%0.79677%0.766SS**  trans84.6138.1169.1-58.2-75000116.1
84D32.2Very low30Very low110 Ų110161.3 Ų161.359%0.58877%0.773SS**  cis-157.5162-10.7-143.84.5000112.6
85R32.2Very low30.2Very low193 Ų193161 Ų16173%0.72877%0.772SS**  trans61.5120.6154.5-69.7168.5-156.2-151.9-2.5123.6
86Q28.7Very low30.7Very low168 Ų168161.8 Ų161.879%0.78578%0.776SS**  49.2108.8126.7-62.6170.5-51.200119.9
87E31Very low30.6Very low184 Ų184164.8 Ų164.886%0.8678%0.775SS**  -169.9132.7102.1-100.3173.8-160.500112.5
88D29.6Very low31.1Very low126 Ų126165.2 Ų165.267%0.67478%0.775SS**  trans54.1114.8144.6-73.419.9000125.3
89N28.1Very low30.7Very low137 Ų137168.9 Ų168.973%0.73379%0.789SS**  59.168.3124.7-63.4-48.5000120.4
90L34.7Very low30.8Very low153 Ų153170.3 Ų170.380%0.80179%0.791SS**  trans-146.313164.1-116.2130.9000119.7
91F33.4Very low31Very low214 Ų214175.6 Ų175.694%0.93980%0.802SS**SBendtrans-124.621.6175.9-77.5-78.9000116.1
92K29.3Very low31Very low180 Ų180178.6 Ų178.678%0.78380%0.795SS**SBendtrans-96138152.3-71.7177.4179.3173.10108
93Y28.4Very low31.7Very low208 Ų208181.1 Ų181.182%0.81680%0.803SS**  trans74.273.6179.2-44.5-70.7000118.5
94R30.2Very low32Very low226 Ų226177.7 Ų177.785%0.85380%0.799SS**  trans-127.885137.6-77.1-163.2178.6-174.24.2111.1
95R28.2Very low32.2Very low218 Ų218177 Ų17782%0.82380%0.802SS**PPolyproline II helixtrans-55144.3155.5-69179.2175.9171.5-2107.9R97R95-R97 PolarHBondContact O-N 3.44Å
96P34.5Very low32.5Very low123 Ų123174.3 Ų174.380%0.79980%0.801SS**PPolyproline II helixtrans-54.9131.5172.523.9-32.9000108.9Q98P96-Q98 PolarHBondContact O-N 3.38Å; P96-Q98 VanDerWaalsContact O-N 3.1Å
97R31.1Very low33.3Very low220 Ų220175 Ų17583%0.8380%0.804SS**PPolyproline II helixtrans-57.6118.8-179-77.9175.6167.4155.3-7.1108.5R95 L99R95-R97 PolarHBondContact O-N 3.44Å; R97-L99 PolarHBondContact O-N 3.41Å
98Q33Very low33.7Very low185 Ų185170.8 Ų170.886%0.86480%0.801SS**PPolyproline II helixtrans-53.1131.5164.6-75.4175.5-34.800108P96 L100P96-Q98 PolarHBondContact O-N 3.38Å; P96-Q98 VanDerWaalsContact O-N 3.1Å; Q98-L100 VanDerWaalsContact C-N 3.25Å; Q98-L100 PolarHBondContact O-N 3.08Å
99L32.1Very low34.3Very low173 Ų173168.7 Ų168.791%0.90680%0.802SS**  trans-66.691.3173-71170.1000108R97 R101R97-L99 PolarHBondContact O-N 3.41Å; L99-R101 PolarHBondContact O-N 3.12Å
100L34.7Very low34.8Very low157 Ų157166.6 Ų166.682%0.82280%0.796SS**  trans-60.398.4173.9-173.173.5000107.6Q98 R102Q98-L100 VanDerWaalsContact C-N 3.25Å; Q98-L100 PolarHBondContact O-N 3.08Å; L100-R102 PolarHBondContact O-N 3.05Å
101R30.9Very low35.3Very low236 Ų236165.5 Ų165.589%0.89180%0.797SS**  trans-55105.1170.2-79.1-178.2169.5175.3-3.9107.3L99 K103L99-R101 PolarHBondContact O-N 3.12Å; R101-K103 PolarHBondContact O-N 3.34Å
102R32.6Very low35.9Very low193 Ų193162.6 Ų162.673%0.72879%0.792SS**  trans-55.3125.2170.6-85179.6158.7165.7-7.3107.7L100 D104 S105L100-R102 PolarHBondContact O-N 3.05Å; R102-D104 PolarHBondContact O-N 3.41Å; R102-D104 VanDerWaalsContact O-N 3.15Å; R102-S105 PolarHBondContact O-OG 3.49Å
103K39.6Very low36.2Very low196 Ų196158.2 Ų158.285%0.85278%0.78SS**THydrogen-bonded Turntrans-71.1-2.2175.3-79.6-167.7167.9-169.50112.5R101R101-K103 PolarHBondContact O-N 3.34Å
104D36.6Very low36.5Very low132 Ų132155.4 Ų155.471%0.70678%0.778SS**THydrogen-bonded Turntrans-108.310.1-162.7-12.1-58.9000111.5R102R102-D104 PolarHBondContact O-N 3.41Å; R102-D104 VanDerWaalsContact O-N 3.15Å
105S36.4Very low37.2Very low94 Ų94149.1 Ų149.166%0.65777%0.769SS**  trans-105.66.9-17962.10000114.6R102 Q107R102-S105 PolarHBondContact O-OG 3.49Å; S105-Q107 PolarHBondContact O-N 3.18Å
106I40.4Very low37.6Very low138 Ų138147 Ų14771%0.70877%0.768SS**  trans-86.293.6167.8-55.3176.8000107.1
107Q44.9Very low37.6Very low181 Ų181147.7 Ų147.785%0.84677%0.765SS**PPolyproline II helixtrans-69136.6168.3-68.2-177.9-10.400109S105S105-Q107 PolarHBondContact O-N 3.18Å
108A40Very low37.7Very low96 Ų96145.6 Ų145.679%0.79376%0.757SS**PPolyproline II helixtrans-64.6138171.100000109.7
109A40.8Very low37.9Very low83 Ų83142 Ų14269%0.68675%0.752SS**PPolyproline II helixtrans-61.7140177.700000110.7
110P39.3Very low38Very low93 Ų93141 Ų14160%0.60475%0.747SS**PPolyproline II helixtrans-60.4150176.7-21.932.9000111.9N112 V113P110-N112 PolarHBondContact O-N 3.36Å; P110-V113 PolarHBondContact O-N 3.29Å
111P45.1Very low37.7Very low129 Ų129142.8 Ų142.884%0.83874%0.744SS**THydrogen-bonded Turntrans-67.8-1.7-173.827.7-36.2000115.3
112N45.4Very low37.7Very low153 Ų153140.7 Ų140.782%0.81874%0.742SS**THydrogen-bonded Turntrans-103.415.7-175.3-64.24.7000113.4P110P110-N112 PolarHBondContact O-N 3.36Å
113V36.6Very low37.7Very low89 Ų89136.5 Ų136.554%0.53974%0.742SS.*SBendtrans-96.2126.1177-176.20000109.8P110P110-V113 PolarHBondContact O-N 3.29Å
114L35.3Very low37.3Very low149 Ų149133.1 Ų133.178%0.7874%0.738SS**  trans-67.8150.6-179.2-69.2169.4000112E116L114-E116 PolarHBondContact O-N 2.86Å
115S43Very low36.9Very low93 Ų93136.4 Ų136.465%0.6575%0.746SS**THydrogen-bonded Turntrans-77.315.4-160.7-610000116.6
116E36.8Very low36.9Very low175 Ų175137.5 Ų137.582%0.81875%0.749SS**THydrogen-bonded Turntrans-100.7-21.9-165.3-69.4172.2175.500113.8L114 R118L114-E116 PolarHBondContact O-N 2.86Å; E116-R118 PolarHBondContact O-N 3.27Å
117D34.6Very low36.5Very low136 Ų136134.5 Ų134.573%0.72775%0.752SS**G310 helixtrans-80.524.3176.7-72.9-33.1000114.5S119D117-S119 PolarHBondContact O-N 3.19Å
118R33.1Very low36Very low177 Ų177134 Ų13467%0.66875%0.75SS**G310 helixtrans-84.21.1-176.4-84.4-177.7168.3177.6-2115.5E116 L120 Y121E116-R118 PolarHBondContact O-N 3.27Å; R118-L120 PolarHBondContact O-N 3.3Å; R118-Y121 PolarHBondContact O-N 3.08Å
119S38.5Very low35.5Very low108 Ų108138.8 Ų138.876%0.75576%0.758SS**G310 helixtrans-68.1-18.717954.50000114.2D117D117-S119 PolarHBondContact O-N 3.19Å
120L33.8Very low35.3Very low154 Ų154137.6 Ų137.681%0.80675%0.754SS**G310 helixtrans-92.3-0.8175.6-73.2165.1000114.4R118R118-L120 PolarHBondContact O-N 3.3Å
121Y28.1Very low35Very low193 Ų193139.3 Ų139.376%0.75777%0.765SS**  trans-136.560.9177.1-84.2-86000111.9R118R118-Y121 PolarHBondContact O-N 3.08Å
122K32Very low34.3Very low193 Ų193144.6 Ų144.684%0.83977%0.769SS**  trans-126.668.6165.3-92.3-170173.3-177.60111.8
123S32.3Very low34.1Very low105 Ų105143.2 Ų143.273%0.73477%0.768SS**  trans-85.5113.7152.662.30000109.1
124T29.4Very low34.1Very low125 Ų125144.1 Ų144.177%0.76778%0.778SS**  trans43.392.6151.160.10000117.4
125F30.3Very low34Very low201 Ų201148.3 Ų148.388%0.88278%0.784SS**  trans-13356154-155-92.6000110.8
126T36.1Very low33.8Very low116 Ų116150.7 Ų150.771%0.71279%0.787SS**  trans-71.6117.7152.541.30000106.7Q128T126-Q128 PolarHBondContact O-N 3.43Å
127G32.2Very low33.9Very low75 Ų75149.5 Ų149.577%0.77378%0.782SS**  trans-72.333.7-171.700000115.6
128Q32.9Very low34.2Very low172 Ų172149 Ų14980%0.80479%0.786SS**SBendtrans-103.4132.5176.7-69.8-175.8-9.200110.1T126 G130T126-Q128 PolarHBondContact O-N 3.43Å; Q128-G130 PolarHBondContact O-N 3.48Å
129M29.5Very low34.6Very low195 Ų195151.6 Ų151.696%0.96180%0.796SS**  trans-74.189.6174.8-66.4-164.47700110.4
130G36.2Very low34.7Very low59 Ų59154.6 Ų154.661%0.60880%0.798SS**PPolyproline II helixtrans-60.5148.216700000111.6Q128Q128-G130 PolarHBondContact O-N 3.48Å
131P33.9Very low35Very low128 Ų128155.3 Ų155.383%0.83180%0.797SS**PPolyproline II helixtrans-61140.8-179.225.2-33.8000111.3
132R31.1Very low35.5Very low241 Ų241148 Ų14891%0.90978%0.78SS**PPolyproline II helixtrans-56.7125.2176.5-104.4-179.5175.6162.4-0.4109.6S134R132-S134 PolarHBondContact O-N 3.41Å
133P41.4Very low36.2Very low123 Ų123146.7 Ų146.780%0.79978%0.781SS**PPolyproline II helixtrans-60.6128.3174.623.8-32.4000109.7
134S36.4Very low36.8Very low109 Ų109146.6 Ų146.676%0.76277%0.772SS**PPolyproline II helixtrans-68.3147.1179.751.30000110.7R132 I136R132-S134 PolarHBondContact O-N 3.41Å; S134-I136 PolarHBondContact O-N 3.4Å
135R32.4Very low37.4Very low237 Ų237144.1 Ų144.189%0.89477%0.771SS**  trans-69.9101.4-176179.3178.6173.3174.5-3.1110.2Q137R135-Q137 PolarHBondContact O-N 3.39Å
136I39.1Very low38.1Very low142 Ų142140.9 Ų140.973%0.72876%0.762SS**  trans-52.2123.3171-57.9171.4000108.7S134S134-I136 PolarHBondContact O-N 3.4Å
137Q38.7Very low38.5Very low151 Ų151141 Ų14171%0.70676%0.755SS**  trans-79.1133.4177.2-62.6-169.237.100109.4R135 R139R135-Q137 PolarHBondContact O-N 3.39Å; Q137-R139 PolarHBondContact O-N 3.47Å
138P41.4Very low39.3Very low126 Ų126141 Ų14182%0.81874%0.74SS**THydrogen-bonded Turntrans-81.647.2-172.835.8-38.3000112.3
139R40.7Very low40Very low230 Ų230135.6 Ų135.687%0.86873%0.725SS**THydrogen-bonded Turntrans-113.3-7.8-176.8-124.5177.9-176.9169-0.1114.7Q137Q137-R139 PolarHBondContact O-N 3.47Å
140E41.1Very low40.8Very low171 Ų171133.4 Ų133.480%0.79971%0.712SS**SBendtrans-118.1-5.7-177.6-61-169.716400114.3G142E140-G142 PolarHBondContact O-N 3.14Å
141Q39.2Very low41.4Very low170 Ų170137.8 Ų137.879%0.79472%0.717SS**  trans-90.989169.5-69.4-172.1-5.900109.8
142G39.4Very low42.3Very low38 Ų38139 Ų13939%0.39271%0.709SS.*  trans-56.9156.3159.200000110.7E140 N144E140-G142 PolarHBondContact O-N 3.14Å; G142-N144 CarbonylContact O-C 3.58Å; G142-N144 PolarHBondContact O-N 3.15Å
143I46.4Very low43.2Very low167 Ų167129.5 Ų129.586%0.85668%0.678SS**SBendtrans-61.2-22.9-166.5-68172.9000112.9
144N44.9Very low43.8Very low103 Ų103130 Ų13055%0.55167%0.667SS**SBendtrans-128.1130.5161.6-64.5-57.6000109.4G142 L146 E147G142-N144 CarbonylContact O-C 3.58Å; G142-N144 PolarHBondContact O-N 3.15Å; N144-L146 PolarHBondContact O-N 3.14Å; N144-E147 PolarHBondContact O-N 2.91Å
145G41.7Very low44.8Very low72 Ų72128.1 Ų128.174%0.74265%0.654SS**THydrogen-bonded Turntrans-68.425.6178.900000115.9
146L44.9Very low45.8Very low134 Ų134120.4 Ų120.470%0.70263%0.63SS**THydrogen-bonded Turntrans-108.1-29.5178-71.3165000112.2N144 A149N144-L146 PolarHBondContact O-N 3.14Å; L146-A149 PolarHBondContact O-N 3.14Å
147E45.4Very low46.5Very low119 Ų119117 Ų11756%0.55661%0.613SS**Hα-helixtrans-71.2-36.9-174.9-69.1-179139.700112.8N144 A149 Q150 Q151N144-E147 PolarHBondContact O-N 2.91Å; E147-A149 VanDerWaalsContact C-N 3.28Å; E147-A149 PolarHBondContact O-N 3.45Å; E147-Q150 PolarHBondContact O-N 3.21Å; E147-Q151 PolarHBondContact O-N 3.01Å
148T48.2Very low47.3Very low74 Ų74116.8 Ų116.845%0.45461%0.612SS.*Hα-helixtrans-69.6-21.7178.615.20000113.8
149A47.4Very low48Very low59 Ų59114.7 Ų114.749%0.48860%0.6SS.*Hα-helixtrans-73.1-46.7174.100000111.1L146 E147 Q151 K152 V153L146-A149 PolarHBondContact O-N 3.14Å; E147-A149 VanDerWaalsContact C-N 3.28Å; E147-A149 PolarHBondContact O-N 3.45Å; A149-Q151 PolarHBondContact O-N 3.36Å; A149-K152 PolarHBondContact O-N 2.81Å; A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 2.8Å
150Q46.5Very low48.6Very low149 Ų149109.3 Ų109.370%0.69658%0.583SS**Hα-helixtrans-67.1-35.2-176.3-67.9-173.5-17.400113.2E147 V153 K154E147-Q150 PolarHBondContact O-N 3.21Å; Q150-V153 PolarHBondContact O-N 3.25Å; Q150-K154 PolarHBondContact O-N 3.41Å; Q150-K154 VanDerWaalsContact O-N 3.13Å
151Q48.7Very low48.9Very low151 Ų151108.5 Ų108.571%0.70658%0.584SS**Hα-helixtrans-68.5-35.7178.3-72.5-172.7-9.900113.5E147 A149 S155E147-Q151 PolarHBondContact O-N 3.01Å; A149-Q151 PolarHBondContact O-N 3.36Å; Q151-S155 PolarHBondContact O-N 3.17Å; Q151-S155 PolarHBondContact O-OG 2.91Å
152K52.9Low49.4Very low154 Ų154106 Ų10667%0.6758%0.576SS**Hα-helixtrans-69.7-38.5174.8-80.5-173.5175.2-179.40112.6A149 K154 S155 L156A149-K152 PolarHBondContact O-N 2.81Å; K152-K154 VanDerWaalsContact C-N 3.34Å; K152-S155 PolarHBondContact O-OG 2.91Å; K152-L156 PolarHBondContact O-N 3.32Å
153V51.1Low50Low41 Ų41109.9 Ų109.925%0.24859%0.592CS.*Hα-helixtrans-62.2-43.6176.31720000110.4A149 Q150 S155 L156 L157 I173A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 2.8Å; Q150-V153 PolarHBondContact O-N 3.25Å; V153-S155 PolarHBondContact O-N 3.2Å; V153-L156 PolarHBondContact O-N 2.89Å; V153-L157 HydrophobicContact CG1-CD1 3.51Å; V153-L157 WeakPolarHBondContact O-CD1 2.87Å; V153-L157 PolarHBondContact O-N 2.98Å; V153-I173 HydrophobicContact CG1-CG2 4.34Å
154K54.2Low50Low134 Ų134110 Ų11058%0.58359%0.589SS**Hα-helixtrans-63.4-43.6-178.3-163.3176.8179.9-164.80113.4Q150 K152 L156 L157 E158Q150-K154 PolarHBondContact O-N 3.41Å; Q150-K154 VanDerWaalsContact O-N 3.13Å; K152-K154 VanDerWaalsContact C-N 3.34Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 3.06Å; K154-L157 PolarHBondContact O-N 2.89Å; K154-E158 WeakPolarHBondContact CE-OE1 3.4Å; K154-E158 IonicContact NZ-OE1 2.67Å; K154-E158 WeakPolarHBondContact O-CG 3.23Å; K154-E158 PolarHBondContact O-N 3.23Å
155S56.2Low50.4Low69 Ų69108.5 Ų108.548%0.48358%0.58SS.*Hα-helixtrans-71.7-25.3177.959.20000113.9Q151 K152 V153 S159Q151-S155 PolarHBondContact O-N 3.17Å; Q151-S155 PolarHBondContact O-OG 2.91Å; K152-S155 PolarHBondContact O-OG 2.91Å; V153-S155 PolarHBondContact O-N 3.2Å; S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-OG 2.9Å
156L53.4Low51.2Low74 Ų74110.8 Ų110.839%0.38758%0.575SS.*Hα-helixtrans-74.9-33.4171.7-92.6156.7000113.1K152 V153 K154 S159K152-L156 PolarHBondContact O-N 3.32Å; V153-L156 PolarHBondContact O-N 2.89Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 3.06Å; L156-S159 PolarHBondContact O-OG 3.06Å
157L53.9Low51.7Low72 Ų72111.5 Ų111.538%0.37758%0.575SS.*Hα-helixtrans-76-31.4174-92.4131.9000113.2V153 K154 S159 L162 I173V153-L157 HydrophobicContact CG1-CD1 3.51Å; V153-L157 WeakPolarHBondContact O-CD1 2.87Å; V153-L157 PolarHBondContact O-N 2.98Å; K154-L157 PolarHBondContact O-N 2.89Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 3.12Å; L157-L162 HydrophobicContact CD2-CD2 4.32Å; L157-I173 HydrophobicContact CD1-CG2 4.31Å
158E55.5Low52.3Low146 Ų146110.6 Ų110.668%0.68257%0.574SS**THydrogen-bonded Turntrans-78.1-4.6176.1-73.1174.2173.900113.7K154K154-E158 WeakPolarHBondContact CE-OE1 3.4Å; K154-E158 IonicContact NZ-OE1 2.67Å; K154-E158 WeakPolarHBondContact O-CG 3.23Å; K154-E158 PolarHBondContact O-N 3.23Å
159S56.7Low52.7Low82 Ų82109 Ų10957%0.57356%0.564SS**THydrogen-bonded Turntrans-120.15.2-17356.30000116.2S155 L156 L157S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-OG 2.9Å; L156-S159 PolarHBondContact O-OG 3.06Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 3.12Å
160K52Low52.8Low116 Ų116112.7 Ų112.750%0.50457%0.566SS.*SBendtrans-138.8124.3178.3-67.3-174.4179.1-178.80111.9L162K160-L162 PolarHBondContact O-N 3.24Å
161D47.4Very low53.2Low154 Ų154111.5 Ų111.582%0.82456%0.559SS**  trans-59.2124.7173.1-75-46.1000110.9T163D161-T163 PolarHBondContact O-N 3.08Å
162L51.2Low53.5Low118 Ų118111.1 Ų111.162%0.61856%0.557SS**THydrogen-bonded Turntrans-75.618-163.7-89.7143.2000115.6L157 K160 I165L157-L162 HydrophobicContact CD2-CD2 4.32Å; K160-L162 PolarHBondContact O-N 3.24Å; L162-I165 HydrophobicContact CD2-CD1 3.78Å
163T50.9Low53.5Low119 Ų119104.8 Ų104.873%0.7353%0.53SS*.THydrogen-bonded Turntrans-96.7-11.9-17251.50000114.9D161D161-T163 PolarHBondContact O-N 3.08Å
164H47.3Very low53.3Low171 Ų171108.9 Ų108.979%0.79254%0.542SS*.  trans-137.979.7174.1-78.9-56.5000112.7
165I53.8Low53Low71 Ų71107.5 Ų107.536%0.36455%0.546SS..  trans-101.398.2167.7-59-178.6000108.6L162 V169 Y170 I173L162-I165 HydrophobicContact CD2-CD1 3.78Å; I165-V169 HydrophobicContact CG2-CB 4.08Å; I165-V169 HydrophobicContact CG2-CG1 4.27Å; I165-Y170 HydrophobicContact CG2-CD2 4.08Å; I165-I173 HydrophobicContact CD1-CD1 4.46Å
166N57.7Low52.6Low119 Ų119110.1 Ų110.164%0.63656%0.555SS**  trans-67.8154.4162.9-78.9-7.3000109.9D168 V169 Y170N166-D168 PolarHBondContact O-N 3.29Å; N166-D168 VanDerWaalsContact O-N 3.07Å; N166-V169 WeakPolarHBondContact O-CB 3.29Å; N166-V169 PolarHBondContact O-N 3.42Å; N166-Y170 PolarHBondContact O-N 3.04Å
167E55.7Low52.3Low149 Ų149112.2 Ų112.270%0.69657%0.572SS**Hα-helixtrans-53.1-34.4-176.4-65.3-170.9155.400113.8V169 Y170 K171E167-V169 VanDerWaalsContact C-N 3.29Å; E167-V169 PolarHBondContact O-N 3.33Å; E167-Y170 WeakPolarHBondContact O-CA 3.33Å; E167-Y170 WeakPolarHBondContact O-CB 3.49Å; E167-Y170 PolarHBondContact O-N 3.22Å; E167-Y170 VanDerWaalsContact O-N 3.09Å; E167-K171 WeakPolarHBondContact O-CG 3.36Å; E167-K171 PolarHBondContact O-N 3.42Å
168D58.1Low51.9Low100 Ų100114.1 Ų114.154%0.53558%0.583SS.*Hα-helixtrans-68.3-27.3178.8-59.2-36000113.2N166 K171 Q172N166-D168 PolarHBondContact O-N 3.29Å; N166-D168 VanDerWaalsContact O-N 3.07Å; D168-K171 IonicContact OD1-NZ 3.77Å; D168-K171 PolarHBondContact OD1-NZ 3.24Å; D168-Q172 WeakPolarHBondContact O-CG 3.39Å; D168-Q172 PolarHBondContact O-N 3.11Å
169V55.8Low51.3Low40 Ų40113.4 Ų113.424%0.24258%0.584CS.*Hα-helixtrans-75.6-35170.9-177.50000110.1I165 N166 E167 Q172 I173I165-V169 HydrophobicContact CG2-CB 4.08Å; I165-V169 HydrophobicContact CG2-CG1 4.27Å; N166-V169 WeakPolarHBondContact O-CB 3.29Å; N166-V169 PolarHBondContact O-N 3.42Å; E167-V169 VanDerWaalsContact C-N 3.29Å; E167-V169 PolarHBondContact O-N 3.33Å; V169-Q172 PolarHBondContact O-N 2.96Å; V169-I173 HydrophobicContact CG1-CD1 3.95Å; V169-I173 WeakPolarHBondContact O-CG1 3.42Å; V169-I173 PolarHBondContact O-N 2.82Å
170Y49.7Very low50.6Low137 Ų137112.3 Ų112.354%0.53758%0.576SS.*Hα-helixtrans-64-42.2175.1-154.6-84.8000111.7I165 N166 E167 Q172 I173 Y174I165-Y170 HydrophobicContact CG2-CD2 4.08Å; N166-Y170 PolarHBondContact O-N 3.04Å; E167-Y170 WeakPolarHBondContact O-CA 3.33Å; E167-Y170 WeakPolarHBondContact O-CB 3.49Å; E167-Y170 PolarHBondContact O-N 3.22Å; E167-Y170 VanDerWaalsContact O-N 3.09Å; Y170-Q172 VanDerWaalsContact C-N 3.26Å; Y170-Q172 PolarHBondContact O-N 3.11Å; Y170-I173 PolarHBondContact O-N 2.78Å; Y170-Y174 HydrophobicContact CD1-CD2 4.19Å; Y170-Y174 AromaticContact CE1-CD2 3.76Å; Y170-Y174 HydrophobicContact CE1-CD2 3.76Å; Y170-Y174 HydrophobicContact CE1-CE2 4.3Å; Y170-Y174 PolarHBondContact O-N 3.34Å
171K55Low50.5Low125 Ų125111.9 Ų111.954%0.54358%0.584SS.*Hα-helixtrans-61.5-29.7172.9-66.9169.4-163.9155.70113.2E167 D168 Y174E167-K171 WeakPolarHBondContact O-CG 3.36Å; E167-K171 PolarHBondContact O-N 3.42Å; D168-K171 IonicContact OD1-NZ 3.77Å; D168-K171 PolarHBondContact OD1-NZ 3.24Å; K171-Y174 CarbonylContact O-C 3.56Å
172Q56.1Low50.3Low142 Ų142112.4 Ų112.466%0.66458%0.575SS**Hα-helixtrans-78.4-32.9174.6-72.2176.615.600113.3D168 V169 Y170D168-Q172 WeakPolarHBondContact O-CG 3.39Å; D168-Q172 PolarHBondContact O-N 3.11Å; V169-Q172 PolarHBondContact O-N 2.96Å; Y170-Q172 VanDerWaalsContact C-N 3.26Å; Y170-Q172 PolarHBondContact O-N 3.11Å
173I51Low50.1Low22 Ų22110.5 Ų110.511%0.11357%0.565CS.*Hα-helixtrans-76.9-38179-65.9165.3000110.8V153 L157 I165 V169 Y170 P175V153-I173 HydrophobicContact CG1-CG2 4.34Å; L157-I173 HydrophobicContact CD1-CG2 4.31Å; I165-I173 HydrophobicContact CD1-CD1 4.46Å; V169-I173 HydrophobicContact CG1-CD1 3.95Å; V169-I173 WeakPolarHBondContact O-CG1 3.42Å; V169-I173 PolarHBondContact O-N 2.82Å; Y170-I173 PolarHBondContact O-N 2.78Å; I173-P175 WeakPolarHBondContact O-CD 3.47Å
174Y47.1Very low50.2Low127 Ų127108.6 Ų108.650%0.49855%0.554SS.*SBendtrans-115.984.2173.7-67.5-81.8000110.5Y170 K171 L176Y170-Y174 HydrophobicContact CD1-CD2 4.19Å; Y170-Y174 AromaticContact CE1-CD2 3.76Å; Y170-Y174 HydrophobicContact CE1-CD2 3.76Å; Y170-Y174 HydrophobicContact CE1-CE2 4.3Å; Y170-Y174 PolarHBondContact O-N 3.34Å; K171-Y174 CarbonylContact O-C 3.56Å; Y174-L176 PolarHBondContact O-N 2.87Å
175P49.1Very low50.3Low104 Ų104106 Ų10668%0.67555%0.546SS*.  trans-68.485.4165.430.3-33.7000108.6I173I173-P175 WeakPolarHBondContact O-CD 3.47Å
176L47Very low50.1Low125 Ų125107.7 Ų107.765%0.65455%0.551SS**  trans-53.9132.5159.4-77.7161.4000107.4Y174 N178Y174-L176 PolarHBondContact O-N 2.87Å; L176-N178 PolarHBondContact O-N 2.67Å
177P47.9Very low49.8Very low117 Ų117107.3 Ų107.376%0.7655%0.549SS*.  trans-76.661.6177.833.8-36000110.2
178N45.9Very low49.2Very low112 Ų112107 Ų10760%0.59955%0.547SS*.  trans-70.6-27.3176.5-71.4-4.9000111L176 S180 N183L176-N178 PolarHBondContact O-N 2.67Å; N178-S180 PolarHBondContact O-N 3.38Å; N178-N183 PolarHBondContact O-ND2 3.5Å
179D41.3Very low48.5Very low131 Ų131109.4 Ų109.470%0.70156%0.555SS**  trans-94.674.6171.1-56-34.7000109.8
180S41.9Very low48Very low59 Ų59112 Ų11241%0.41357%0.567SS.*  trans-60.6139.3150.6770000107.7N178 Y182 N183N178-S180 PolarHBondContact O-N 3.38Å; S180-Y182 PolarHBondContact O-N 2.95Å; S180-N183 PolarHBondContact O-N 3.14Å
181T50.1Low47.6Very low108 Ų108111.3 Ų111.366%0.66357%0.566SS**Hα-helixtrans-53.6-20.7178.338.50000113.3N183 T184 D185T181-N183 VanDerWaalsContact C-N 3.31Å; T181-N183 PolarHBondContact O-N 3.34Å; T181-T184 PolarHBondContact O-N 3.31Å; T181-T184 PolarHBondContact O-OG1 3.49Å; T181-D185 WeakPolarHBondContact O-CB 3.32Å; T181-D185 PolarHBondContact O-N 2.95Å; T181-D185 VanDerWaalsContact O-N 3.11Å
182Y43.1Very low47Very low165 Ų165111.5 Ų111.565%0.64757%0.569SS**Hα-helixtrans-62-30.6173.8-155.7-98.2000114.3S180 F186S180-Y182 PolarHBondContact O-N 2.95Å; Y182-F186 HydrophobicContact CD2-CE2 4.38Å; Y182-F186 HydrophobicContact CE2-CE2 4.03Å; Y182-F186 WeakPolarHBondContact O-CD2 3.38Å
183N47.2Very low46.3Very low77 Ų77111.8 Ų111.841%0.41258%0.576SS.*Hα-helixtrans-80.2-35179-82-14.6000112.6N178 S180 T181 N187N178-N183 PolarHBondContact O-ND2 3.5Å; S180-N183 PolarHBondContact O-N 3.14Å; T181-N183 VanDerWaalsContact C-N 3.31Å; T181-N183 PolarHBondContact O-N 3.34Å; N183-N187 WeakPolarHBondContact O-CB 3.5Å; N183-N187 PolarHBondContact O-ND2 3.21Å; N183-N187 VanDerWaalsContact O-ND2 3.08Å
184T54.1Low46Very low80 Ų80115.5 Ų115.549%0.49160%0.599SS.*Hα-helixtrans-74.7-36177.646.80000112.3T181 F186T181-T184 PolarHBondContact O-N 3.31Å; T181-T184 PolarHBondContact O-OG1 3.49Å; T184-F186 VanDerWaalsContact C-N 3.26Å; T184-F186 PolarHBondContact O-N 3.3Å
185D50Low45.5Very low116 Ų116117.8 Ų117.862%0.6261%0.608SS**Hα-helixtrans-73-14.8-174.6-70.5-3.9000113.8T181T181-D185 WeakPolarHBondContact O-CB 3.32Å; T181-D185 PolarHBondContact O-N 2.95Å; T181-D185 VanDerWaalsContact O-N 3.11Å
186F49Very low45.1Very low107 Ų107117.1 Ų117.147%0.46961%0.606SS.*Hα-helixtrans-120.3-19.9-172.8-79-81.7000116.3Y182 T184 I190Y182-F186 HydrophobicContact CD2-CE2 4.38Å; Y182-F186 HydrophobicContact CE2-CE2 4.03Å; Y182-F186 WeakPolarHBondContact O-CD2 3.38Å; T184-F186 VanDerWaalsContact C-N 3.26Å; T184-F186 PolarHBondContact O-N 3.3Å; F186-I190 HydrophobicContact CD1-CD1 4.09Å
187N50.2Low44.7Very low110 Ų110118.9 Ų118.959%0.58861%0.611SS**Hα-helixtrans-96.2-26.4-166.2-75-31.2000116.6N183N183-N187 WeakPolarHBondContact O-CB 3.5Å; N183-N187 PolarHBondContact O-ND2 3.21Å; N183-N187 VanDerWaalsContact O-ND2 3.08Å
188E43.2Very low44.3Very low142 Ų142121.1 Ų121.166%0.66462%0.616SS**SBendtrans-100.6-21.4-165.1-62.9-161.6147.300116.6Q192E188-Q192 PolarHBondContact O-OE1 3.05Å
189H43.7Very low44.2Very low151 Ų151120.7 Ų120.770%0.69962%0.618SS**SBendtrans-131.14.1-172.2-65.5-37000117.1Q192H189-Q192 PolarHBondContact ND1-OE1 2.81Å
190I46.4Very low44.3Very low96 Ų96122.4 Ų122.449%0.49263%0.626SS.*SBendtrans-87.8-20.6179.3-62.5177.7000112.4F186F186-I190 HydrophobicContact CD1-CD1 4.09Å
191F40Very low44.1Very low121 Ų121124.4 Ų124.453%0.53164%0.638SS.*SBendtrans-115.7-10.4-172.8-62.9-71.2000115.5D193 V194 Y195F191-D193 VanDerWaalsContact C-N 3.28Å; F191-D193 PolarHBondContact O-N 3.25Å; F191-V194 PolarHBondContact O-N 3.38Å; F191-V194 VanDerWaalsContact O-N 3.09Å; F191-Y195 HydrophobicContact CB-CD2 4.36Å; F191-Y195 HydrophobicContact CB-CE2 4.24Å; F191-Y195 WeakPolarHBondContact O-CD2 3.47Å
192Q44Very low43.6Very low130 Ų130126 Ų12661%0.60764%0.642SS**THydrogen-bonded Turntrans-66.4-27.6-179.9-83.4176.1-20.900113.4E188 H189 V194 S196E188-Q192 PolarHBondContact O-OE1 3.05Å; H189-Q192 PolarHBondContact ND1-OE1 2.81Å; Q192-V194 PolarHBondContact O-N 3.44Å; Q192-S196 PolarHBondContact O-OG 3.29Å
193D40.1Very low43.5Very low148 Ų148124.8 Ų124.879%0.79165%0.645SS**THydrogen-bonded Turntrans-79.6-1.6174.6-67.9-15.8000113.7F191F191-D193 VanDerWaalsContact C-N 3.28Å; F191-D193 PolarHBondContact O-N 3.25Å
194V44.9Very low43Very low100 Ų100127.1 Ų127.161%0.60666%0.658SS**THydrogen-bonded Turntrans-106.8-17.9-176.6-1750000112.6F191 Q192F191-V194 PolarHBondContact O-N 3.38Å; F191-V194 VanDerWaalsContact O-N 3.09Å; Q192-V194 PolarHBondContact O-N 3.44Å
195Y37.7Very low42.4Very low174 Ų174128.6 Ų128.668%0.68267%0.672SS**SBendtrans-118.615.7-174.6-66.4-71.8000114.2F191F191-Y195 HydrophobicContact CB-CD2 4.36Å; F191-Y195 HydrophobicContact CB-CE2 4.24Å; F191-Y195 WeakPolarHBondContact O-CD2 3.47Å
196S40.7Very low42Very low90 Ų90132.2 Ų132.263%0.62968%0.682SS**  trans-92.86.8-172.245.10000115.9Q192Q192-S196 PolarHBondContact O-OG 3.29Å
197E38.2Very low41.5Very low162 Ų162134.4 Ų134.476%0.75770%0.695SS**  trans-12888.8168.3-72-168.3164.400111.8T199E197-T199 PolarHBondContact O-N 3.02Å
198N39.6Very low41.2Very low164 Ų164136.3 Ų136.388%0.87770%0.701SS**  trans-73.233.2170.1-83-27.2000113.3
199T42.6Very low41.3Very low104 Ų104135.7 Ų135.764%0.63870%0.702SS**  trans-109.784.716736.20000108.4E197 P201E197-T199 PolarHBondContact O-N 3.02Å; T199-P201 WeakPolarHBondContact O-CD 3.24Å; T199-P201 VanDerWaalsContact O-N 3.12Å
200L43.6Very low41.3Very low167 Ų167133.7 Ų133.787%0.87470%0.696SS**  trans-50.3120.5165.2-74.6168.6000108.1N202L200-N202 PolarHBondContact O-N 3.42Å
201P38.9Very low41.3Very low101 Ų101133.6 Ų133.666%0.65670%0.704SS**  trans-62.1127.3176.125.3-32.4000107.5T199 I203T199-P201 WeakPolarHBondContact O-CD 3.24Å; T199-P201 VanDerWaalsContact O-N 3.12Å; P201-I203 VanDerWaalsContact C-N 3.26Å; P201-I203 PolarHBondContact O-N 2.91Å
202N38.5Very low41.6Very low140 Ų140131.9 Ų131.975%0.74970%0.704SS**  trans-69.689177-171.95.1000108.7L200 N204L200-N202 PolarHBondContact O-N 3.42Å; N202-N204 VanDerWaalsContact C-N 3.25Å; N202-N204 PolarHBondContact O-N 3.23Å
203I40.8Very low42Very low140 Ų140131.4 Ų131.472%0.71871%0.705SS**  trans-69.289.1176.7-61.6167.1000106.9P201 S205P201-I203 VanDerWaalsContact C-N 3.26Å; P201-I203 PolarHBondContact O-N 2.91Å; I203-S205 PolarHBondContact O-N 3.46Å
204N38Very low42.3Very low127 Ų127130.9 Ų130.968%0.67969%0.693SS**  trans-55.7102.4169.1-78.5-48.2000108.6N202 K206N202-N204 VanDerWaalsContact C-N 3.25Å; N202-N204 PolarHBondContact O-N 3.23Å; N204-K206 PolarHBondContact O-N 2.92Å
205S40.3Very low42.6Very low111 Ų111134.9 Ų134.978%0.77670%0.697SS**  trans-73.954.7178.352.30000111.9I203 M207I203-S205 PolarHBondContact O-N 3.46Å; S205-M207 PolarHBondContact O-N 3.08Å
206K41.2Very low43.4Very low191 Ų191134 Ų13483%0.8370%0.7SS**  trans-70.990.5157.6-73.7-169.7175.4-177.10107.2N204 Q208N204-K206 PolarHBondContact O-N 2.92Å; K206-Q208 VanDerWaalsContact C-N 3.33Å; K206-Q208 PolarHBondContact O-N 3.37Å
207M38.9Very low44.1Very low153 Ų153135 Ų13575%0.75470%0.698SS**  trans-53.6103.6161.4-71.2-173.573.700107.7S205S205-M207 PolarHBondContact O-N 3.08Å
208Q44.4Very low44.6Very low151 Ų151134.8 Ų134.871%0.70669%0.691SS**  trans-112.5103.2157.7-135.6174.26.100104.1K206 N210K206-Q208 VanDerWaalsContact C-N 3.33Å; K206-Q208 PolarHBondContact O-N 3.37Å; Q208-N210 PolarHBondContact O-N 3.05Å
209D45.3Very low44.8Very low129 Ų129131.5 Ų131.569%0.6967%0.67SS**  trans-70.357.7174.7-67.2-40.8000110S211D209-S211 PolarHBondContact O-N 2.98Å; D209-S211 VanDerWaalsContact O-N 3.09Å
210N43.3Very low45Very low109 Ų109131.3 Ų131.358%0.58367%0.673SS**  trans-84.360.6164.2-68.2-17.7000107.2Q208 T212Q208-N210 PolarHBondContact O-N 3.05Å; N210-T212 PolarHBondContact O-N 2.85Å
211S47Very low45.3Very low93 Ų93133.6 Ų133.665%0.6567%0.67SS**  trans-61.878.3159.553.60000107.5D209 D213D209-S211 PolarHBondContact O-N 2.98Å; D209-S211 VanDerWaalsContact O-N 3.09Å; S211-D213 PolarHBondContact O-N 3.31Å
212T45.9Very low45.9Very low85 Ų85136.3 Ų136.352%0.52168%0.678SS.*  trans-64.9122.3175.445.10000107.3N210 Y214 R215N210-T212 PolarHBondContact O-N 2.85Å; T212-Y214 PolarHBondContact O-N 3.24Å; T212-R215 PolarHBondContact O-N 2.9Å
213D52.5Low46.7Very low120 Ų120138.6 Ų138.664%0.64268%0.681SS**Hα-helixtrans-46.9-25.6176-65.4-58.8000112.3S211 R215 E216 N217S211-D213 PolarHBondContact O-N 3.31Å; D213-R215 VanDerWaalsContact C-N 3.31Å; D213-R215 PolarHBondContact O-N 2.69Å; D213-E216 PolarHBondContact O-N 3.45Å; D213-N217 VanDerWaalsContact O-CB 3.26Å; D213-N217 WeakPolarHBondContact O-CB 3.5Å; D213-N217 PolarHBondContact O-N 3.47Å; D213-N217 PolarHBondContact O-ND2 2.88Å
214Y46.3Very low47.4Very low138 Ų138137.4 Ų137.454%0.54168%0.682SS.*Hα-helixtrans-55.3-40174.2-162.9-94.6000113.9T212 Y218T212-Y214 PolarHBondContact O-N 3.24Å; Y214-Y218 AromaticContact CD2-CD2 3.48Å; Y214-Y218 HydrophobicContact CD2-CD2 3.48Å; Y214-Y218 VanDerWaalsContact CD2-CD2 3.48Å; Y214-Y218 AromaticContact CD2-CE2 3.87Å; Y214-Y218 HydrophobicContact CD2-CE2 3.87Å; Y214-Y218 HydrophobicContact CD2-CG 4.21Å; Y214-Y218 AromaticContact CE2-CD2 3.69Å; Y214-Y218 HydrophobicContact CE2-CD2 3.69Å; Y214-Y218 HydrophobicContact CE2-CE2 4.14Å; Y214-Y218 AromaticContact CE2-CG 3.99Å; Y214-Y218 HydrophobicContact CE2-CG 3.99Å; Y214-Y218 AromaticContact CG-CD2 3.98Å; Y214-Y218 HydrophobicContact CG-CD2 3.98Å; Y214-Y218 WeakPolarHBondContact O-CB 3.44Å; Y214-Y218 PolarHBondContact O-N 2.98Å
215R51.6Low48.3Very low184 Ų184134.8 Ų134.869%0.69467%0.673SS**Hα-helixtrans-76.8-30.5-175.2-149.2177.2-171.6-177.92.1112.5T212 D213 H219T212-R215 PolarHBondContact O-N 2.9Å; D213-R215 VanDerWaalsContact C-N 3.31Å; D213-R215 PolarHBondContact O-N 2.69Å; R215-H219 WeakPolarHBondContact O-CB 3.45Å
216E54.9Low49Very low156 Ų156138.8 Ų138.873%0.72967%0.67SS**Hα-helixtrans-80.8-38.2173.7-61.7-164.3156.500112.1D213D213-E216 PolarHBondContact O-N 3.45Å
217N54.6Low49.7Very low110 Ų110136 Ų13659%0.58867%0.665SS**Hα-helixtrans-84.7-30.4-176-70.7-64000115.1D213D213-N217 VanDerWaalsContact O-CB 3.26Å; D213-N217 WeakPolarHBondContact O-CB 3.5Å; D213-N217 PolarHBondContact O-N 3.47Å; D213-N217 PolarHBondContact O-ND2 2.88Å
218Y48.3Very low50.9Low158 Ų158134 Ų13462%0.6266%0.657SS**Hα-helixtrans-116.9-7.1-174.1-59.3-86.2000114.5Y214Y214-Y218 AromaticContact CD2-CD2 3.48Å; Y214-Y218 HydrophobicContact CD2-CD2 3.48Å; Y214-Y218 VanDerWaalsContact CD2-CD2 3.48Å; Y214-Y218 AromaticContact CD2-CE2 3.87Å; Y214-Y218 HydrophobicContact CD2-CE2 3.87Å; Y214-Y218 HydrophobicContact CD2-CG 4.21Å; Y214-Y218 AromaticContact CE2-CD2 3.69Å; Y214-Y218 HydrophobicContact CE2-CD2 3.69Å; Y214-Y218 HydrophobicContact CE2-CE2 4.14Å; Y214-Y218 AromaticContact CE2-CG 3.99Å; Y214-Y218 HydrophobicContact CE2-CG 3.99Å; Y214-Y218 AromaticContact CG-CD2 3.98Å; Y214-Y218 HydrophobicContact CG-CD2 3.98Å; Y214-Y218 WeakPolarHBondContact O-CB 3.44Å; Y214-Y218 PolarHBondContact O-N 2.98Å
219H44.2Very low51.6Low94 Ų94131 Ų13144%0.43565%0.649SS.*  trans-12357175.8-67.3-20.5000111.6R215 W221R215-H219 WeakPolarHBondContact O-CB 3.45Å; H219-W221 PolarHBondContact O-N 2.95Å
220S46.3Very low52.3Low101 Ų101128.3 Ų128.371%0.70663%0.634SS**  trans-66.675.9153.853.70000109.6I222S220-I222 PolarHBondContact O-N 3.31Å
221W49.6Very low52.8Low214 Ų214126.9 Ų126.981%0.81163%0.625SS**  trans-52114.3161.2-69.378.8000106.3H219 K223H219-W221 PolarHBondContact O-N 2.95Å; W221-K223 PolarHBondContact O-N 3.42Å
222I52Low53.3Low159 Ų159127.9 Ų127.982%0.81562%0.619SS**  trans-56.7105.8179.6-63.6172.5000105.8S220 P224S220-I222 PolarHBondContact O-N 3.31Å; I222-P224 WeakPolarHBondContact O-CD 3.46Å; I222-P224 VanDerWaalsContact O-N 3.07Å
223K55.5Low53.3Low188 Ų188131.3 Ų131.382%0.81762%0.622SS**PPolyproline II helixtrans-58.1119.7180-71.3-178.9179.3176.30105.9W221W221-K223 PolarHBondContact O-N 3.42Å
224P54.6Low53.5Low114 Ų114130 Ų13074%0.7461%0.614SS**PPolyproline II helixtrans-55.8130.8-177.721.3-31.9000107.9I222 R226I222-P224 WeakPolarHBondContact O-CD 3.46Å; I222-P224 VanDerWaalsContact O-N 3.07Å; P224-R226 PolarHBondContact O-N 3.11Å
225P56.6Low54.3Low73 Ų73126.1 Ų126.147%0.47462%0.616SS.*PPolyproline II helixtrans-57135.6-178.317.6-26000108.9V229 I230P225-V229 HydrophobicContact CB-CB 4.26Å; P225-V229 HydrophobicContact CB-CG1 4.29Å; P225-I230 HydrophobicContact CB-CD1 4.34Å; P225-I230 HydrophobicContact CB-CG1 4.07Å; P225-I230 HydrophobicContact CG-CD1 4.03Å; P225-I230 HydrophobicContact CG-CG1 3.96Å; P225-I230 WeakPolarHBondContact O-CD1 3.35Å
226R56.9Low54.3Low194 Ų194127.5 Ų127.573%0.73262%0.623SS**PPolyproline II helixtrans-61.7151.8179.5-71178.8167.1-177.7-4.6109.7P224 D228 V229 I230P224-R226 PolarHBondContact O-N 3.11Å; R226-D228 WeakPolarHBondContact CB-OD1 3.45Å; R226-D228 PolarHBondContact O-N 3.04Å; R226-D228 VanDerWaalsContact O-N 3.11Å; R226-V229 HydrophobicContact CB-CG2 4.47Å; R226-V229 WeakPolarHBondContact O-CA 3.33Å; R226-V229 WeakPolarHBondContact O-CB 3.49Å; R226-V229 PolarHBondContact O-N 2.89Å; R226-I230 PolarHBondContact O-N 3.48Å
227N54Low53.6Low132 Ų132125.4 Ų125.471%0.70662%0.617SS**Hα-helixtrans-59.1-27.9-172.7-71.6-12.3000113.8V229 I230 M231N227-V229 VanDerWaalsContact C-N 3.31Å; N227-I230 PolarHBondContact O-N 3.01Å; N227-M231 WeakPolarHBondContact O-CB 2.89Å; N227-M231 PolarHBondContact O-N 2.81Å
228D64Low53.5Low111 Ų111127.3 Ų127.359%0.59462%0.616SS**Hα-helixtrans-66.9-26.6172.857.7-24.2000113.7R226R226-D228 WeakPolarHBondContact CB-OD1 3.45Å; R226-D228 PolarHBondContact O-N 3.04Å; R226-D228 VanDerWaalsContact O-N 3.11Å
229V60.6Low54.2Low89 Ų89125.5 Ų125.554%0.53961%0.611SS.*Hα-helixtrans-78.2-33.2172.8-173.50000111.3P225 R226 N227 T241P225-V229 HydrophobicContact CB-CB 4.26Å; P225-V229 HydrophobicContact CB-CG1 4.29Å; R226-V229 HydrophobicContact CB-CG2 4.47Å; R226-V229 WeakPolarHBondContact O-CA 3.33Å; R226-V229 WeakPolarHBondContact O-CB 3.49Å; R226-V229 PolarHBondContact O-N 2.89Å; N227-V229 VanDerWaalsContact C-N 3.31Å; V229-T241 PolarHBondContact O-OG1 3Å
230I58.5Low54.9Low73 Ų73125.7 Ų125.737%0.37462%0.621SS.*Hα-helixtrans-88.4-30.2-176.5-53.7158.8000112.6P225 R226 N227 P240 T241P225-I230 HydrophobicContact CB-CD1 4.34Å; P225-I230 HydrophobicContact CB-CG1 4.07Å; P225-I230 HydrophobicContact CG-CD1 4.03Å; P225-I230 HydrophobicContact CG-CG1 3.96Å; P225-I230 WeakPolarHBondContact O-CD1 3.35Å; R226-I230 PolarHBondContact O-N 3.48Å; N227-I230 PolarHBondContact O-N 3.01Å; I230-P240 CarbonylContact O-C 3.52Å; I230-P240 WeakPolarHBondContact O-CA 3.42Å; I230-T241 VanDerWaalsContact C-OG1 3.26Å; I230-T241 WeakPolarHBondContact CA-OG1 3.35Å; I230-T241 PolarHBondContact O-N 3.03Å; I230-T241 PolarHBondContact O-OG1 3.07Å
231M54.8Low55.5Low78 Ų78123.2 Ų123.238%0.38460%0.602SS.*EExtended strand (participates in β ladder)trans-132.6114-171.2-71.7-108.5-77.500111.2N227 W238N227-M231 WeakPolarHBondContact O-CB 2.89Å; N227-M231 PolarHBondContact O-N 2.81Å; M231-W238 HydrophobicContact CB-CE3 4.19Å; M231-W238 HydrophobicContact CE-CB 3.8Å; M231-W238 HydrophobicContact CE-CG 4.26Å; M231-W238 HydrophobicContact SD-CB 4.35Å
232Q56.7Low56.2Low114 Ų114117.4 Ų117.453%0.53359%0.592SS.*EExtended strand (participates in β ladder)trans-92.8130.5175.1-163.3173.919.800110.2I234 K239 T241Q232-I234 HydrophobicContact CG-CG1 4.35Å; Q232-I234 PolarHBondContact O-N 3.19Å; Q232-K239 PolarHBondContact N-O 2.97Å; Q232-K239 PolarHBondContact O-N 3.15Å; Q232-T241 HydrophobicContact CB-CG2 3.89Å
233R47.2Very low56.7Low158 Ų158115.1 Ų115.160%0.59660%0.597SS**EExtended strand (participates in β ladder)trans-80116173.4-163.1178.2-173.1-144.52.5109.5G235 W238R233-G235 WeakPolarHBondContact CG-O 3.42Å; R233-W238 HydrophobicContact CB-CD2 4.39Å; R233-W238 HydrophobicContact CB-CE3 3.91Å; R233-W238 HydrophobicContact CB-CH2 4.1Å; R233-W238 HydrophobicContact CB-CZ3 3.76Å; R233-W238 HydrophobicContact CG-CD2 4.31Å; R233-W238 HydrophobicContact CG-CE3 4.33Å; R233-W238 HydrophobicContact CG-CH2 4.3Å; R233-W238 HydrophobicContact CG-CZ2 4.26Å; R233-W238 HydrophobicContact CG-CZ3 4.33Å
234I56.8Low56.7Low91 Ų91111.2 Ų111.247%0.46759%0.588SS.*EExtended strand (participates in β ladder)trans-117.892.6179-60177.3000107.7Q232 N237 K239Q232-I234 HydrophobicContact CG-CG1 4.35Å; Q232-I234 PolarHBondContact O-N 3.19Å; I234-N237 PolarHBondContact N-O 3.11Å; I234-N237 PolarHBondContact O-N 3.43Å; I234-K239 HydrophobicContact CD1-CB 4.48Å; I234-K239 HydrophobicContact CD1-CD 4.29Å
235G63.4Low56.8Low57 Ų57116 Ų11659%0.58859%0.593SS**THydrogen-bonded Turntrans66.8-128.6-170.300000111.5R233 N237R233-G235 WeakPolarHBondContact CG-O 3.42Å; G235-N237 VanDerWaalsContact C-N 3.33Å
236Y49.8Very low57.1Low213 Ų213119.1 Ų119.184%0.83561%0.605SS**THydrogen-bonded Turntrans-81.4-10.1177.9-63.5-75.3000114
237N40.9Very low57.5Low112 Ų112115.1 Ų115.160%0.59960%0.604SS**EExtended strand (participates in β ladder)trans-108139.1-174-65.1-30.9000111.5I234 G235I234-N237 PolarHBondContact N-O 3.11Å; I234-N237 PolarHBondContact O-N 3.43Å; G235-N237 VanDerWaalsContact C-N 3.33Å
238W52.7Low58.1Low150 Ų150115.4 Ų115.457%0.56860%0.601SS**EExtended strand (participates in β ladder)trans-86135.8168.8-62.894.3000109.7M231 R233M231-W238 HydrophobicContact CB-CE3 4.19Å; M231-W238 HydrophobicContact CE-CB 3.8Å; M231-W238 HydrophobicContact CE-CG 4.26Å; M231-W238 HydrophobicContact SD-CB 4.35Å; R233-W238 HydrophobicContact CB-CD2 4.39Å; R233-W238 HydrophobicContact CB-CE3 3.91Å; R233-W238 HydrophobicContact CB-CH2 4.1Å; R233-W238 HydrophobicContact CB-CZ3 3.76Å; R233-W238 HydrophobicContact CG-CD2 4.31Å; R233-W238 HydrophobicContact CG-CE3 4.33Å; R233-W238 HydrophobicContact CG-CH2 4.3Å; R233-W238 HydrophobicContact CG-CZ2 4.26Å; R233-W238 HydrophobicContact CG-CZ3 4.33Å
239K63.2Low58.2Low120 Ų120113.8 Ų113.852%0.52259%0.592SS.*EExtended strand (participates in β ladder)trans-129.2141.8170.3-70.5-172.5179177.60109.6Q232 I234Q232-K239 PolarHBondContact N-O 2.97Å; Q232-K239 PolarHBondContact O-N 3.15Å; I234-K239 HydrophobicContact CD1-CB 4.48Å; I234-K239 HydrophobicContact CD1-CD 4.29Å
240P59.2Low58.4Low99 Ų99114.2 Ų114.264%0.64360%0.597SS**EExtended strand (participates in β ladder)trans-62.5140.5172.727.8-34.2000109.7I230I230-P240 CarbonylContact O-C 3.52Å; I230-P240 WeakPolarHBondContact O-CA 3.42Å
241T59.4Low58.7Low48 Ų48113.4 Ų113.429%0.29460%0.598SS.*PPolyproline II helixtrans-67.4129.5168.147.60000108.4V229 I230 Q232 A243V229-T241 PolarHBondContact O-OG1 3Å; I230-T241 VanDerWaalsContact C-OG1 3.26Å; I230-T241 WeakPolarHBondContact CA-OG1 3.35Å; I230-T241 PolarHBondContact O-N 3.03Å; I230-T241 PolarHBondContact O-OG1 3.07Å; Q232-T241 HydrophobicContact CB-CG2 3.89Å; T241-A243 PolarHBondContact O-N 3.39Å
242P63.1Low59.1Low93 Ų93117 Ų11760%0.60461%0.611SS**PPolyproline II helixtrans-68.2126.9176.128-33.1000109.1V244P242-V244 PolarHBondContact O-N 3.09Å
243A62.3Low59.2Low111 Ų111118 Ų11892%0.91762%0.616SS**SBendtrans-60.7-18.2-177.700000114T241T241-A243 PolarHBondContact O-N 3.39Å
244V55.5Low59.6Low105 Ų105116.6 Ų116.664%0.63662%0.616SS**SBendtrans-125.9126.8171.6179.80000108.1P242 L246P242-V244 PolarHBondContact O-N 3.09Å; V244-L246 VanDerWaalsContact C-N 3.34Å; V244-L246 PolarHBondContact O-N 2.94Å
245Y58Low59.6Low216 Ų216117.8 Ų117.885%0.84763%0.63SS**  trans-73.487.8178.2-152.6-82.4000110
246L63.3Low59.4Low137 Ų137122.1 Ų122.172%0.71764%0.638SS**PPolyproline II helixtrans-71.1127169.7-66.7175.7000108.5V244V244-L246 VanDerWaalsContact C-N 3.34Å; V244-L246 PolarHBondContact O-N 2.94Å
247P64.2Low59.6Low110 Ų110121.1 Ų121.171%0.71464%0.641SS**PPolyproline II helixtrans-52.8144.4170.8-24.133.7000110.4D249P247-D249 PolarHBondContact O-N 2.81Å
248E65.9Low60Low138 Ų138119 Ų11965%0.64563%0.634SS**PPolyproline II helixtrans-60.6116.1170.5-71.7-163.1165.300109P250 H253E248-P250 WeakPolarHBondContact O-CD 3.33Å; E248-P250 VanDerWaalsContact O-N 3.13Å; E248-H253 IonicContact OE2-CD2 3Å; E248-H253 IonicContact OE2-CE1 3.93Å; E248-H253 IonicContact OE2-NE2 3.59Å; E248-H253 PolarHBondContact OE2-NE2 2.89Å
249D66.4Low59.9Low78 Ų78116 Ų11642%0.41764%0.636SS.*PPolyproline II helixtrans-53.5116.7175.6-176.8-19.8000109.2P247 S251 K252P247-D249 PolarHBondContact O-N 2.81Å; D249-S251 PolarHBondContact O-N 3.25Å; D249-S251 VanDerWaalsContact O-N 3.11Å; D249-S251 WeakPolarHBondContact OD1-CB 3.44Å; D249-S251 PolarHBondContact OD1-N 3.35Å; D249-S251 PolarHBondContact OD1-OG 3.21Å; D249-S251 PolarHBondContact OD2-OG 3.05Å; D249-K252 HydrophobicContact CB-CD 4.21Å; D249-K252 HydrophobicContact CB-CG 4.21Å; D249-K252 WeakPolarHBondContact O-CB 3.44Å; D249-K252 PolarHBondContact O-N 2.95Å
250P64.5Low59.6Low97 Ų97114 Ų11463%0.6363%0.634SS**G310 helixtrans-60.6-25.1-174.524.1-33.7000112.2E248 K252 H253 E254E248-P250 WeakPolarHBondContact O-CD 3.33Å; E248-P250 VanDerWaalsContact O-N 3.13Å; P250-K252 PolarHBondContact O-N 3.2Å; P250-H253 PolarHBondContact O-N 3.29Å; P250-E254 PolarHBondContact O-N 3.48Å; P250-E254 VanDerWaalsContact O-N 3.15Å
251S64.7Low59.4Low57 Ų57114.6 Ų114.640%0.39964%0.635SS.*G310 helixtrans-64.5-17.4175.870.20000113.9D249 H253 E254D249-S251 PolarHBondContact O-N 3.25Å; D249-S251 VanDerWaalsContact O-N 3.11Å; D249-S251 WeakPolarHBondContact OD1-CB 3.44Å; D249-S251 PolarHBondContact OD1-N 3.35Å; D249-S251 PolarHBondContact OD1-OG 3.21Å; D249-S251 PolarHBondContact OD2-OG 3.05Å; S251-H253 VanDerWaalsContact C-N 3.27Å; S251-H253 PolarHBondContact O-N 3.01Å; S251-E254 PolarHBondContact O-N 3.47Å
252K63.9Low59Low154 Ų154119.2 Ų119.267%0.6765%0.648SS**G310 helixtrans-69.5-26.3171.6-66.5174.6-179.91740112.9D249 P250D249-K252 HydrophobicContact CB-CD 4.21Å; D249-K252 HydrophobicContact CB-CG 4.21Å; D249-K252 WeakPolarHBondContact O-CB 3.44Å; D249-K252 PolarHBondContact O-N 2.95Å; P250-K252 PolarHBondContact O-N 3.2Å
253H58.4Low58.6Low134 Ų134122 Ų12262%0.6265%0.646SS**THydrogen-bonded Turntrans-99.5-10.7177.3-61-64.8000112.1E248 P250 S251E248-H253 IonicContact OE2-CD2 3Å; E248-H253 IonicContact OE2-CE1 3.93Å; E248-H253 IonicContact OE2-NE2 3.59Å; E248-H253 PolarHBondContact OE2-NE2 2.89Å; P250-H253 PolarHBondContact O-N 3.29Å; S251-H253 VanDerWaalsContact C-N 3.27Å; S251-H253 PolarHBondContact O-N 3.01Å
254E55.7Low58.4Low128 Ų128119.2 Ų119.260%0.59862%0.621SS**SBendtrans-64.8129167.4-71.8-177.9166.400109.5P250 S251 I256P250-E254 PolarHBondContact O-N 3.48Å; P250-E254 VanDerWaalsContact O-N 3.15Å; S251-E254 PolarHBondContact O-N 3.47Å; E254-I256 PolarHBondContact O-N 3.37Å
255P56.9Low58.4Low117 Ų117119.6 Ų119.676%0.7662%0.619SS**  trans-65.3109.917726.9-32.8000108.4E257P255-E257 PolarHBondContact O-N 3.13Å
256I60.7Low58.1Low147 Ų147114.8 Ų114.875%0.75460%0.603SS**  trans-45.1119.7176.1-58.7172000108.4E254 S258E254-I256 PolarHBondContact O-N 3.37Å; I256-S258 PolarHBondContact O-N 3.02Å; I256-S258 PolarHBondContact O-OG 3.35Å
257E52.2Low57.6Low192 Ų192112.5 Ų112.590%0.89760%0.595SS**  trans-68.843.1-179.6-64.8-165.6147.700113P255 C259P255-E257 PolarHBondContact O-N 3.13Å; E257-C259 PolarHBondContact O-N 3.38Å
258S50.6Low56.7Low67 Ų67112 Ų11247%0.46959%0.586SS.*  trans-72.536.1167.461.70000112.3I256 T260I256-S258 PolarHBondContact O-N 3.02Å; I256-S258 PolarHBondContact O-OG 3.35Å; S258-T260 PolarHBondContact O-N 3.47Å
259C50.2Low55.8Low89 Ų89112.5 Ų112.560%0.60159%0.586SS**  trans-69.381.1160.8-90.30000108.4E257E257-C259 PolarHBondContact O-N 3.38Å
260T56.3Low55Low78 Ų78111.1 Ų111.148%0.47958%0.583SS.*  trans-53.1145.216261.90000108.7S258 Y262 R263 S264S258-T260 PolarHBondContact O-N 3.47Å; T260-Y262 CarbonylContact O-C 3.46Å; T260-Y262 PolarHBondContact O-N 3.17Å; T260-R263 WeakPolarHBondContact O-CA 3.48Å; T260-R263 PolarHBondContact O-N 2.88Å; T260-R263 PolarHBondContact OG1-N 3.31Å; T260-S264 PolarHBondContact O-N 3.37Å
261V55Low54.4Low110 Ų110112.1 Ų112.167%0.66758%0.577SS**Hα-helixtrans-54.1-27.2178.8-177.50000111.7S264 N265V261-S264 WeakPolarHBondContact CA-OG 3.44Å; V261-S264 PolarHBondContact O-OG 2.71Å; V261-N265 WeakPolarHBondContact O-CB 3.1Å; V261-N265 PolarHBondContact O-N 2.85Å; V261-N265 PolarHBondContact O-ND2 2.74Å; V261-N265 PolarHBondContact O-OD1 3.32Å
262Y52.4Low53.8Low145 Ų145116.9 Ų116.957%0.56959%0.593SS**Hα-helixtrans-62.9-55.1169.2-171.5-94.2000112.2T260 S264 N265 F266T260-Y262 CarbonylContact O-C 3.46Å; T260-Y262 PolarHBondContact O-N 3.17Å; Y262-S264 PolarHBondContact O-N 2.87Å; Y262-N265 PolarHBondContact O-N 2.69Å; Y262-F266 HydrophobicContact CD1-CD2 4.21Å; Y262-F266 HydrophobicContact CD2-CD2 4.11Å; Y262-F266 AromaticContact CD2-CE2 3.82Å; Y262-F266 HydrophobicContact CD2-CE2 3.82Å; Y262-F266 HydrophobicContact CE1-CD2 4.04Å; Y262-F266 HydrophobicContact CE1-CE2 4.43Å; Y262-F266 AromaticContact CE2-CD2 3.94Å; Y262-F266 HydrophobicContact CE2-CD2 3.94Å; Y262-F266 AromaticContact CE2-CE2 3.5Å; Y262-F266 HydrophobicContact CE2-CE2 3.5Å; Y262-F266 HydrophobicContact CE2-CZ 4.48Å; Y262-F266 HydrophobicContact CG-CD2 4.24Å; Y262-F266 HydrophobicContact CG-CE2 4.41Å; Y262-F266 AromaticContact CZ-CD2 3.9Å; Y262-F266 AromaticContact CZ-CE2 3.84Å; Y262-F266 VanDerWaalsContact O-CD2 3.24Å; Y262-F266 WeakPolarHBondContact O-CD2 3.33Å; Y262-F266 PolarHBondContact O-N 3.02Å
263R52.9Low53.2Low151 Ų151115.9 Ų115.957%0.5759%0.585SS**Hα-helixtrans-59.7-45.1179-85.5-177.9166.6162.1-3.9112.4T260 N265 F266 T267T260-R263 WeakPolarHBondContact O-CA 3.48Å; T260-R263 PolarHBondContact O-N 2.88Å; T260-R263 PolarHBondContact OG1-N 3.31Å; R263-N265 PolarHBondContact O-N 3.02Å; R263-F266 PolarHBondContact O-N 2.84Å; R263-F266 VanDerWaalsContact O-N 3.14Å; R263-T267 WeakPolarHBondContact O-CB 3.43Å; R263-T267 VanDerWaalsContact O-CG2 3.32Å; R263-T267 WeakPolarHBondContact O-CG2 3.33Å; R263-T267 PolarHBondContact O-N 3.26Å; R263-T267 PolarHBondContact O-OG1 2.64Å
264S58.6Low52.9Low54 Ų54112.3 Ų112.338%0.37857%0.57SS.*Hα-helixtrans-58.8-33.3179.559.60000113.4T260 V261 Y262 T267T260-S264 PolarHBondContact O-N 3.37Å; V261-S264 WeakPolarHBondContact CA-OG 3.44Å; V261-S264 PolarHBondContact O-OG 2.71Å; Y262-S264 PolarHBondContact O-N 2.87Å; S264-T267 PolarHBondContact O-OG1 3.38Å
265N55.5Low52.8Low112 Ų112111.4 Ų111.460%0.59956%0.564SS**Hα-helixtrans-82.4-16.5-177.8-66.9-4.5000113.6V261 Y262 R263V261-N265 WeakPolarHBondContact O-CB 3.1Å; V261-N265 PolarHBondContact O-N 2.85Å; V261-N265 PolarHBondContact O-ND2 2.74Å; V261-N265 PolarHBondContact O-OD1 3.32Å; Y262-N265 PolarHBondContact O-N 2.69Å; R263-N265 PolarHBondContact O-N 3.02Å
266F52.4Low52.9Low116 Ų116109.5 Ų109.551%0.50956%0.559SS.*Hα-helixtrans-112.5-10-179.9-69.6-69.7000114.1Y262 R263 D268Y262-F266 HydrophobicContact CD1-CD2 4.21Å; Y262-F266 HydrophobicContact CD2-CD2 4.11Å; Y262-F266 AromaticContact CD2-CE2 3.82Å; Y262-F266 HydrophobicContact CD2-CE2 3.82Å; Y262-F266 HydrophobicContact CE1-CD2 4.04Å; Y262-F266 HydrophobicContact CE1-CE2 4.43Å; Y262-F266 AromaticContact CE2-CD2 3.94Å; Y262-F266 HydrophobicContact CE2-CD2 3.94Å; Y262-F266 AromaticContact CE2-CE2 3.5Å; Y262-F266 HydrophobicContact CE2-CE2 3.5Å; Y262-F266 HydrophobicContact CE2-CZ 4.48Å; Y262-F266 HydrophobicContact CG-CD2 4.24Å; Y262-F266 HydrophobicContact CG-CE2 4.41Å; Y262-F266 AromaticContact CZ-CD2 3.9Å; Y262-F266 AromaticContact CZ-CE2 3.84Å; Y262-F266 VanDerWaalsContact O-CD2 3.24Å; Y262-F266 WeakPolarHBondContact O-CD2 3.33Å; Y262-F266 PolarHBondContact O-N 3.02Å; R263-F266 PolarHBondContact O-N 2.84Å; R263-F266 VanDerWaalsContact O-N 3.14Å; F266-D268 VanDerWaalsContact C-N 3.3Å; F266-D268 PolarHBondContact O-N 3.34Å
267T52.8Low52.6Low89 Ų89113 Ų11355%0.54656%0.562SS.*THydrogen-bonded Turntrans-72.9-12.9177.3390000115.2R263 S264 F269 S270R263-T267 WeakPolarHBondContact O-CB 3.43Å; R263-T267 VanDerWaalsContact O-CG2 3.32Å; R263-T267 WeakPolarHBondContact O-CG2 3.33Å; R263-T267 PolarHBondContact O-N 3.26Å; R263-T267 PolarHBondContact O-OG1 2.64Å; S264-T267 PolarHBondContact O-OG1 3.38Å; T267-F269 PolarHBondContact O-N 2.78Å; T267-F269 VanDerWaalsContact O-N 3.11Å; T267-S270 PolarHBondContact O-N 3.34Å
268D44.3Very low52.8Low100 Ų100106.3 Ų106.354%0.53553%0.532SS..THydrogen-bonded Turntrans-73.60.7179.3-147.91.8000113.5F266 S270 R273F266-D268 VanDerWaalsContact C-N 3.3Å; F266-D268 PolarHBondContact O-N 3.34Å; D268-S270 PolarHBondContact O-N 3.45Å; D268-R273 IonicContact OD1-CZ 2.8Å; D268-R273 IonicContact OD1-NE 3.57Å; D268-R273 IonicContact OD1-NH1 2.87Å; D268-R273 PolarHBondContact OD1-NH1 3.43Å; D268-R273 IonicContact OD2-NH1 3.94Å; D268-R273 PolarHBondContact OD2-NH1 3.37Å
269F47.5Very low52.9Low147 Ų147110.2 Ų110.265%0.64554%0.54SS*.  trans-85.247.2161.9-69.2-70000112.2T267 K271 I274T267-F269 PolarHBondContact O-N 2.78Å; T267-F269 VanDerWaalsContact O-N 3.11Å; F269-K271 PolarHBondContact O-N 2.79Å; F269-I274 HydrophobicContact CB-CD1 4.29Å; F269-I274 HydrophobicContact CD1-CD1 3.98Å; F269-I274 HydrophobicContact CD1-CG1 4.26Å
270S49.1Very low53.2Low49 Ų49111.3 Ų111.334%0.34355%0.546SS..  trans-55.9135167.375.90000109T267 D268 E272 R273T267-S270 PolarHBondContact O-N 3.34Å; D268-S270 PolarHBondContact O-N 3.45Å; S270-E272 PolarHBondContact O-N 3.41Å; S270-R273 PolarHBondContact O-N 3.27Å; S270-R273 PolarHBondContact OG-N 3.4Å
271K52.2Low53.2Low118 Ų118111.6 Ų111.651%0.51355%0.551SS.*Hα-helixtrans-54.9-21.3-177.8-71.4-177.3174-177.60111.4F269 K275 D292F269-K271 PolarHBondContact O-N 2.79Å; K271-K275 WeakPolarHBondContact O-CB 3.39Å; K271-K275 VanDerWaalsContact O-CG 3.23Å; K271-K275 WeakPolarHBondContact O-CG 3.41Å; K271-K275 PolarHBondContact O-N 3.4Å; K271-D292 IonicContact NZ-OD1 2.81Å; K271-D292 PolarHBondContact NZ-OD1 3.34Å
272E51.9Low53.2Low157 Ų157111.2 Ų111.273%0.73454%0.542SS*.Hα-helixtrans-73.8-46.3174.5-59.2-172.8145.500114.6S270 I274 K275 A276S270-E272 PolarHBondContact O-N 3.41Å; E272-I274 VanDerWaalsContact C-N 3.29Å; E272-I274 PolarHBondContact O-N 3.23Å; E272-K275 PolarHBondContact O-N 3.37Å; E272-A276 WeakPolarHBondContact O-CB 3.35Å; E272-A276 PolarHBondContact O-N 3.26Å
273R51.1Low53.4Low133 Ų133109.6 Ų109.650%0.50254%0.538SS..Hα-helixtrans-63.9-34.5179.6-98.1-177168.3-170.9-3.4112.3D268 S270 R277D268-R273 IonicContact OD1-CZ 2.8Å; D268-R273 IonicContact OD1-NE 3.57Å; D268-R273 IonicContact OD1-NH1 2.87Å; D268-R273 PolarHBondContact OD1-NH1 3.43Å; D268-R273 IonicContact OD2-NH1 3.94Å; D268-R273 PolarHBondContact OD2-NH1 3.37Å; S270-R273 PolarHBondContact O-N 3.27Å; S270-R273 PolarHBondContact OG-N 3.4Å; R273-R277 PolarHBondContact O-N 3.48Å
274I53.2Low53.3Low60 Ų60106.7 Ų106.731%0.30855%0.546SS..Hα-helixtrans-68.3-49.4173.1-59.6171.4000110.2F269 E272 A276 R277 M278F269-I274 HydrophobicContact CB-CD1 4.29Å; F269-I274 HydrophobicContact CD1-CD1 3.98Å; F269-I274 HydrophobicContact CD1-CG1 4.26Å; E272-I274 VanDerWaalsContact C-N 3.29Å; E272-I274 PolarHBondContact O-N 3.23Å; I274-A276 VanDerWaalsContact C-N 3.28Å; I274-A276 PolarHBondContact O-N 2.7Å; I274-R277 PolarHBondContact O-N 3.19Å; I274-R277 VanDerWaalsContact O-N 3.14Å; I274-M278 HydrophobicContact CG2-CE 4.47Å; I274-M278 PolarHBondContact O-N 3.33Å
275K54.1Low52.8Low108 Ų108109.4 Ų109.447%0.4756%0.564SS.*Hα-helixtrans-59-36.4176.7-79.6177.4177.2-174.40112.5K271 E272 R277 M278 K283K271-K275 WeakPolarHBondContact O-CB 3.39Å; K271-K275 VanDerWaalsContact O-CG 3.23Å; K271-K275 WeakPolarHBondContact O-CG 3.41Å; K271-K275 PolarHBondContact O-N 3.4Å; E272-K275 PolarHBondContact O-N 3.37Å; K275-R277 VanDerWaalsContact C-N 3.29Å; K275-R277 PolarHBondContact O-N 3.04Å; K275-M278 PolarHBondContact O-N 2.91Å; K275-K283 WeakPolarHBondContact O-CE 3.43Å; K275-K283 PolarHBondContact O-NZ 2.95Å
276A57.5Low52.2Low78 Ų78108.3 Ų108.365%0.64555%0.552SS**Hα-helixtrans-64.8-30.4178.300000113.2E272 I274E272-A276 WeakPolarHBondContact O-CB 3.35Å; E272-A276 PolarHBondContact O-N 3.26Å; I274-A276 VanDerWaalsContact C-N 3.28Å; I274-A276 PolarHBondContact O-N 2.7Å
277R54.8Low52Low220 Ų220105.9 Ų105.983%0.8355%0.55SS*.Hα-helixtrans-88.7-8.8-179.6-69.3-179177179.90.7114.6R273 I274 K275R273-R277 PolarHBondContact O-N 3.48Å; I274-R277 PolarHBondContact O-N 3.19Å; I274-R277 VanDerWaalsContact O-N 3.14Å; K275-R277 VanDerWaalsContact C-N 3.29Å; K275-R277 PolarHBondContact O-N 3.04Å
278M55.6Low51.7Low52 Ų52105 Ų10526%0.25655%0.551SS.*SBendtrans-79.1134.5179.7-77.2-170.4154.700112.5I274 K275 Q282 K283 Y286I274-M278 HydrophobicContact CG2-CE 4.47Å; I274-M278 PolarHBondContact O-N 3.33Å; K275-M278 PolarHBondContact O-N 2.91Å; M278-Q282 HydrophobicContact CB-CB 4.19Å; M278-Q282 HydrophobicContact CG-CB 4.43Å; M278-Q282 HydrophobicContact SD-CB 4.37Å; M278-K283 HydrophobicContact CB-CG 4.09Å; M278-Y286 HydrophobicContact CE-CD2 3.88Å; M278-Y286 HydrophobicContact CE-CE2 3.63Å; M278-Y286 HydrophobicContact SD-CD2 3.58Å; M278-Y286 VanDerWaalsContact SD-CD2 3.58Å; M278-Y286 HydrophobicContact SD-CE2 3.73Å
279K54.7Low51.7Low148 Ų148105.2 Ų105.264%0.64355%0.551SS**  trans-59.2149.3170.9-68.4-174.7177.9-1770109.7S281 Q282 K283K279-S281 PolarHBondContact O-N 2.91Å; K279-S281 VanDerWaalsContact O-N 3.12Å; K279-Q282 WeakPolarHBondContact O-CB 3.42Å; K279-Q282 PolarHBondContact O-N 3.08Å; K279-K283 PolarHBondContact O-N 3.47Å
280P55.4Low51.8Low112 Ų112106.5 Ų106.573%0.72756%0.556SS**Hα-helixtrans-51.7-39.9-176.7-29.536000114.3Q282 K283 A284P280-Q282 VanDerWaalsContact C-N 3.27Å; P280-Q282 PolarHBondContact O-N 3.4Å; P280-K283 PolarHBondContact O-N 2.9Å; P280-A284 PolarHBondContact O-N 2.9Å
281S56.3Low51.7Low85 Ų85105.4 Ų105.459%0.59455%0.551SS**Hα-helixtrans-62.7-26.5175.952.20000114.6K279K279-S281 PolarHBondContact O-N 2.91Å; K279-S281 VanDerWaalsContact O-N 3.12Å
282Q55.3Low51.4Low101 Ų101105.2 Ų105.247%0.47256%0.555SS.*Hα-helixtrans-84.1-22.8177.7-66.4173.5-27.700112.5M278 K279 P280M278-Q282 HydrophobicContact CB-CB 4.19Å; M278-Q282 HydrophobicContact CG-CB 4.43Å; M278-Q282 HydrophobicContact SD-CB 4.37Å; K279-Q282 WeakPolarHBondContact O-CB 3.42Å; K279-Q282 PolarHBondContact O-N 3.08Å; P280-Q282 VanDerWaalsContact C-N 3.27Å; P280-Q282 PolarHBondContact O-N 3.4Å
283K56.9Low51Low111 Ų111104.6 Ų104.648%0.48355%0.55SS..Hα-helixtrans-70.3-37.3174.2-68.2-179.8174.9178.30111.9K275 M278 K279 P280 C285 Y286K275-K283 WeakPolarHBondContact O-CE 3.43Å; K275-K283 PolarHBondContact O-NZ 2.95Å; M278-K283 HydrophobicContact CB-CG 4.09Å; K279-K283 PolarHBondContact O-N 3.47Å; P280-K283 PolarHBondContact O-N 2.9Å; K283-C285 VanDerWaalsContact C-N 3.3Å; K283-C285 PolarHBondContact O-N 3.01Å; K283-Y286 WeakPolarHBondContact O-CB 3.19Å; K283-Y286 PolarHBondContact O-N 3.34Å
284A50.5Low50.7Low90 Ų90102.8 Ų102.874%0.74455%0.55SS*.Hα-helixtrans-63.9-32.8179.700000113.2P280P280-A284 PolarHBondContact O-N 2.9Å
285C47.8Very low50.3Low111 Ų111107.8 Ų107.875%0.7558%0.577SS**THydrogen-bonded Turntrans-93.414.4-179.3-56.10000114K283 S287K283-C285 VanDerWaalsContact C-N 3.3Å; K283-C285 PolarHBondContact O-N 3.01Å; C285-S287 PolarHBondContact O-N 2.79Å
286Y43.6Very low49.6Very low90 Ų90110.4 Ų110.435%0.35360%0.595SS.*  trans-92.480.3-171.3-157.2-84.7000112.2M278 K283M278-Y286 HydrophobicContact CE-CD2 3.88Å; M278-Y286 HydrophobicContact CE-CE2 3.63Å; M278-Y286 HydrophobicContact SD-CD2 3.58Å; M278-Y286 VanDerWaalsContact SD-CD2 3.58Å; M278-Y286 HydrophobicContact SD-CE2 3.73Å; K283-Y286 WeakPolarHBondContact O-CB 3.19Å; K283-Y286 PolarHBondContact O-N 3.34Å
287S48Very low48.9Very low65 Ų65109 Ų10946%0.45558%0.581SS.*  trans-71.1130.9175.362.10000112C285 I289 K290C285-S287 PolarHBondContact O-N 2.79Å; S287-I289 PolarHBondContact O-N 3.2Å; S287-I289 VanDerWaalsContact O-N 3.15Å; S287-K290 PolarHBondContact O-N 2.88Å; S287-K290 VanDerWaalsContact O-N 3.14Å
288A46Very low48.5Very low69 Ų69109 Ų10957%0.5759%0.588SS**G310 helixtrans-57.8-32.5-175.500000113.2K290 A291A288-K290 PolarHBondContact O-N 2.82Å; A288-K290 VanDerWaalsContact O-N 3.14Å; A288-A291 WeakPolarHBondContact O-CB 3.49Å; A288-A291 PolarHBondContact O-N 2.8Å
289I45.5Very low48.2Very low105 Ų105113.4 Ų113.454%0.53861%0.612SS.*G310 helixtrans-58.2-28.2-179.9-58167.1000112.6S287 A291 W323S287-I289 PolarHBondContact O-N 3.2Å; S287-I289 VanDerWaalsContact O-N 3.15Å; I289-A291 VanDerWaalsContact C-N 3.29Å; I289-A291 PolarHBondContact O-N 3.09Å; I289-W323 HydrophobicContact CD1-CH2 4.15Å
290K48.7Very low47.7Very low174 Ų174108.9 Ų108.976%0.75761%0.607SS**G310 helixtrans-72.7-18.2175.4-100-178.3177.9173.20113.7S287 A288S287-K290 PolarHBondContact O-N 2.88Å; S287-K290 VanDerWaalsContact O-N 3.14Å; A288-K290 PolarHBondContact O-N 2.82Å; A288-K290 VanDerWaalsContact O-N 3.14Å
291A46.8Very low47.3Very low27 Ų27113.1 Ų113.122%0.22361%0.609CS.*THydrogen-bonded Turntrans-87.3-26.1-177.100000113.7A288 I289A288-A291 WeakPolarHBondContact O-CB 3.49Å; A288-A291 PolarHBondContact O-N 2.8Å; I289-A291 VanDerWaalsContact C-N 3.29Å; I289-A291 PolarHBondContact O-N 3.09Å
292D46.9Very low46.9Very low113 Ų113116.3 Ų116.360%0.60461%0.614SS**SBendtrans-96.86.8-169.8-60.7-24000113.7K271K271-D292 IonicContact NZ-OD1 2.81Å; K271-D292 PolarHBondContact NZ-OD1 3.34Å
293K43.6Very low46.4Very low144 Ų144118.8 Ų118.863%0.62663%0.626SS**SBendtrans-98.831.8178.8-79.2-166.4172-174.80115.2I305K293-I305 HydrophobicContact CD-CD1 4.19Å
294L44.5Very low45.9Very low95 Ų95124.7 Ų124.750%0.49765%0.645SS.*  trans-131.237.6-177-72.8178.2000114.9Q302L294-Q302 HydrophobicContact CD1-CG 4.44Å; L294-Q302 VanDerWaalsContact CD1-NE2 3.33Å; L294-Q302 HydrophobicContact CD2-CG 3.68Å
295L44.3Very low45.9Very low166 Ų166124.9 Ų124.987%0.86963%0.632SS**SBendtrans-124.12.4171.3-76.4170.7000114.8
296N39.4Very low45.6Very low162 Ų162122.8 Ų122.887%0.86662%0.618SS**  trans-103.569.2176-76.94.8000112
297S43.2Very low45.8Very low49 Ų49124.9 Ų124.934%0.34364%0.64SS.*  trans-151121.915462.70000109.4D299 G300 R301S297-D299 PolarHBondContact O-N 3.29Å; S297-G300 PolarHBondContact O-N 3.11Å; S297-R301 PolarHBondContact OG-O 3.3Å
298F46Very low45.6Very low221 Ų221127.5 Ų127.597%0.96965%0.653SS**THydrogen-bonded Turntrans-72.2-16.5-175.6-147.6-101.4000112.4
299D50Low45.4Very low144 Ų144130.5 Ų130.577%0.7766%0.659SS**THydrogen-bonded Turntrans-101.97.7-177.5-61.9-27.9000114.1S297 R301S297-D299 PolarHBondContact O-N 3.29Å; D299-R301 PolarHBondContact O-N 2.99Å; D299-R301 VanDerWaalsContact O-N 3.11Å
300G44Very low44.9Very low52 Ų52134 Ų13454%0.53667%0.667SS.*  trans66.212.3176.700000115.8S297S297-G300 PolarHBondContact O-N 3.11Å
301R45.4Very low44.3Very low202 Ų202136.1 Ų136.176%0.76267%0.67SS**  trans-86123.8173.8-70.9-173.2175.8-1690.2110.3S297 D299 E303S297-R301 PolarHBondContact OG-O 3.3Å; D299-R301 PolarHBondContact O-N 2.99Å; D299-R301 VanDerWaalsContact O-N 3.11Å; R301-E303 PolarHBondContact O-N 3.1Å
302Q49.4Very low43.6Very low151 Ų151143.3 Ų143.371%0.70670%0.704SS**  trans-7288179.1-162.3-178.126.200110.8L294 R304L294-Q302 HydrophobicContact CD1-CG 4.44Å; L294-Q302 VanDerWaalsContact CD1-NE2 3.33Å; L294-Q302 HydrophobicContact CD2-CG 3.68Å; Q302-R304 PolarHBondContact O-N 3.26Å
303E43.8Very low42.8Very low154 Ų154142.1 Ų142.172%0.7271%0.705SS**PPolyproline II helixtrans-64.8119174.2-66.7-161.7159.100110.4R301R301-E303 PolarHBondContact O-N 3.1Å
304R47Very low42.4Very low235 Ų235144.1 Ų144.189%0.88771%0.714SS**PPolyproline II helixtrans-71.5133166.8-72.1-177.2175.2-178.6-0.9108Q302Q302-R304 PolarHBondContact O-N 3.26Å
305I49.7Very low42Very low93 Ų93146.7 Ų146.748%0.47773%0.727SS.*PPolyproline II helixtrans-50.4126.2169.2-58.9171.9000108K293 T307K293-I305 HydrophobicContact CD-CD1 4.19Å; I305-T307 PolarHBondContact O-N 2.76Å
306P42.6Very low41.5Very low68 Ų68141.4 Ų141.444%0.44271%0.713SS.*PPolyproline II helixtrans-56124.2176.9-25.333.5000110.3T308 L309P306-T308 PolarHBondContact O-N 2.74Å; P306-T308 VanDerWaalsContact O-N 3.08Å; P306-L309 HydrophobicContact CB-CD1 4.41Å; P306-L309 HydrophobicContact CB-CG 4.4Å; P306-L309 HydrophobicContact CG-CD1 4.31Å; P306-L309 PolarHBondContact O-N 3.09Å
307T46.5Very low41.4Very low134 Ų134140.3 Ų140.382%0.82271%0.706SS**G310 helixtrans-63.6-13.1177.246.50000112.7I305I305-T307 PolarHBondContact O-N 2.76Å
308T44.4Very low41Very low120 Ų120145.9 Ų145.974%0.73673%0.726SS**G310 helixtrans-85.4-2.7-178.952.60000115P306 Y310P306-T308 PolarHBondContact O-N 2.74Å; P306-T308 VanDerWaalsContact O-N 3.08Å; T308-Y310 VanDerWaalsContact C-N 3.35Å
309L42.5Very low40.5Very low131 Ų131142.9 Ų142.969%0.68672%0.72SS**G310 helixtrans-84-7176.9-76.1172.5000114.2P306P306-L309 HydrophobicContact CB-CD1 4.41Å; P306-L309 HydrophobicContact CB-CG 4.4Å; P306-L309 HydrophobicContact CG-CD1 4.31Å; P306-L309 PolarHBondContact O-N 3.09Å
310Y34.7Very low39.9Very low180 Ų180140.1 Ų140.171%0.70671%0.708SS**SBendtrans-103.7116.9165.3-65.5-85.3000108T308T308-Y310 VanDerWaalsContact C-N 3.35Å
311R36.1Very low39.7Very low218 Ų218144.1 Ų144.182%0.82372%0.717SS**  trans-62.4139.7162.6-84.7-176165.6174.2-4.5108.4S313R311-S313 PolarHBondContact O-N 3.24Å
312D30.9Very low39.3Very low177 Ų177139.8 Ų139.895%0.94771%0.71SS**THydrogen-bonded Turntrans-68.533175.8-60.7-56.6000114
313S31.4Very low38.9Very low88 Ų88141.5 Ų141.562%0.61571%0.709SS**THydrogen-bonded Turntrans-133.813.2-169.767.70000114.3R311R311-S313 PolarHBondContact O-N 3.24Å
314F35.2Very low38.7Very low187 Ų187138.7 Ų138.782%0.8271%0.707SS**  trans-98.8101.8173.4-148-91.6000111.3G316F314-G316 PolarHBondContact O-N 2.84Å
315I36.5Very low37.9Very low149 Ų149133.5 Ų133.576%0.76470%0.697SS**  trans-63.7125.3174.7-64.7165.7000108.5L317I315-L317 PolarHBondContact O-N 2.85Å
316G33.5Very low37.4Very low55 Ų55136.2 Ų136.257%0.56770%0.701SS**  trans-69.299.1-179.100000112.1F314 H318F314-G316 PolarHBondContact O-N 2.84Å; G316-H318 VanDerWaalsContact C-N 3.28Å; G316-H318 PolarHBondContact O-CD2 2.93Å; G316-H318 PolarHBondContact O-N 2.83Å
317L37Very low36.8Very low138 Ų138142.5 Ų142.572%0.72372%0.724SS**  trans-71.688.9161.4-77.1171000108.9I315 V320I315-L317 PolarHBondContact O-N 2.85Å; L317-V320 HydrophobicContact CB-CG2 4.43Å
318H35.6Very low36.2Very low166 Ų166142.7 Ų142.777%0.76972%0.719SS**THydrogen-bonded Turntrans-52.6139.1164.9-74-99.1000109.7G316G316-H318 VanDerWaalsContact C-N 3.28Å; G316-H318 PolarHBondContact O-CD2 2.93Å; G316-H318 PolarHBondContact O-N 2.83Å
319N34.6Very low35.5Very low159 Ų159145 Ų14585%0.8573%0.726SS**THydrogen-bonded Turntrans94.917.3173.3-47.7-17.3000119
320V38.2Very low34.9Very low86 Ų86148 Ų14852%0.52174%0.736SS.*  trans-88.1-15.2175-1720000114.1L317 N322L317-V320 HydrophobicContact CB-CG2 4.43Å; V320-N322 PolarHBondContact O-N 3.43Å
321D39.6Very low34.5Very low135 Ų135147.6 Ų147.672%0.72275%0.746SS**  trans-90.518.2-171.1-86-3.6000116W323D321-W323 PolarHBondContact O-N 3.37Å; D321-W323 VanDerWaalsContact O-N 3.08Å
322N36.3Very low34.3Very low112 Ų112142.8 Ų142.860%0.59975%0.746SS**  trans-79.785.5166.3-87.911.9000110.5V320 S324V320-N322 PolarHBondContact O-N 3.43Å; N322-S324 PolarHBondContact O-N 2.94Å
323W41.1Very low34.1Very low186 Ų186140.2 Ų140.271%0.70574%0.742SS**G310 helixtrans-74.3-4174.6-77.3-25000114.9I289 D321 D325I289-W323 HydrophobicContact CD1-CH2 4.15Å; D321-W323 PolarHBondContact O-N 3.37Å; D321-W323 VanDerWaalsContact O-N 3.08Å; W323-D325 VanDerWaalsContact C-N 3.31Å; W323-D325 PolarHBondContact O-N 2.83Å
324S39.6Very low34.1Very low96 Ų96141.7 Ų141.767%0.67175%0.752SS**G310 helixtrans-66.9-28.5177.550.70000114N322N322-S324 PolarHBondContact O-N 2.94Å
325D31Very low33.9Very low125 Ų125139.5 Ų139.567%0.66875%0.754SS**G310 helixtrans-1049.8-160.9-59.50.4000113.3W323W323-D325 VanDerWaalsContact C-N 3.31Å; W323-D325 PolarHBondContact O-N 2.83Å
326R37.3Very low33.7Very low151 Ų151139.2 Ų139.257%0.5776%0.759SS**  trans-11094177.4-58.8-167-158.5-170.18.6111.5I328R326-I328 HydrophobicContact CB-CD1 4.15Å; R326-I328 HydrophobicContact CB-CG1 4.17Å; R326-I328 PolarHBondContact O-N 2.96Å
327H30Very low33.8Very low200 Ų200141.4 Ų141.493%0.92677%0.766SS**  trans-60.7106159.4-77.9-80000109.4
328I34.3Very low33.6Very low137 Ų137146.6 Ų146.670%0.70378%0.776SS**  trans-125126.8172.3-61.4178000108R326R326-I328 HydrophobicContact CB-CD1 4.15Å; R326-I328 HydrophobicContact CB-CG1 4.17Å; R326-I328 PolarHBondContact O-N 2.96Å
329L30.1Very low33.7Very low169 Ų169145.5 Ų145.589%0.88578%0.781SS**  trans-60.5136.8-176.5-72.5150000111.4N331L329-N331 PolarHBondContact O-N 2.85Å
330Q29.1Very low33.7Very low195 Ų195140.6 Ų140.691%0.91177%0.768SS**  trans-67.5129.7168.4-69.5-177.4-16.600109.5
331N27.4Very low33.6Very low170 Ų170148.3 Ų148.391%0.90979%0.788SS**  trans-139.9135.8160.2-124.4-15.4000108.8L329L329-N331 PolarHBondContact O-N 2.85Å
332S31.4Very low33.4Very low117 Ų117152.8 Ų152.882%0.81880%0.796SS**  trans-119.6112.5-162.956.30000112.8
333S27.5Very low33.7Very low124 Ų124155.8 Ų155.887%0.86781%0.807SS**  trans-157142.4159.258.80000110.8
334S30Very low33.5Very low118 Ų118155.6 Ų155.683%0.82581%0.814SS**  trans-124104.9-177.159.10000111
335V31.8Very low33.5Very low141 Ų141156.5 Ų156.586%0.85581%0.811SS**  trans-133.4112.9165.7-177.90000108.2S337V335-S337 PolarHBondContact O-N 2.9Å
336T33.2Very low34.1Very low144 Ų144155.8 Ų155.888%0.88381%0.807SS**  trans-83106.6176.441.10000110.3
337S34.8Very low34.3Very low100 Ų100154.1 Ų154.170%0.69981%0.81SS**PPolyproline II helixtrans-69.1138.3173.648.90000112.1V335V335-S337 PolarHBondContact O-N 2.9Å
338R34Very low35Very low248 Ų248152 Ų15294%0.93680%0.802SS**PPolyproline II helixtrans-88.8134.9174.7-73.9179.5166.5-176.3-3.2109.7
339T36.6Very low35.4Very low142 Ų142153.8 Ų153.887%0.87180%0.801SS**PPolyproline II helixtrans-100.9126.1-176.848.70000112.5
340G33.9Very low35.9Very low57 Ų57152.6 Ų152.659%0.58879%0.785SS**  trans-147.2152.1176.300000111.3Y342G340-Y342 VanDerWaalsContact C-N 3.31Å; G340-Y342 PolarHBondContact O-N 3.06Å
341R36Very low36.5Very low248 Ų248151.7 Ų151.794%0.93678%0.778SS**THydrogen-bonded Turntrans-78.83.5-166.7-70.3-171.7178.8-173.90.4116.5
342Y36.4Very low37.1Very low229 Ų229146.7 Ų146.790%0.89877%0.767SS**THydrogen-bonded Turntrans-142.534.1-171.1-74.4-67.6000114.4G340G340-Y342 VanDerWaalsContact C-N 3.31Å; G340-Y342 PolarHBondContact O-N 3.06Å
343Q43.4Very low37.7Very low174 Ų174144.6 Ų144.681%0.81375%0.749SS**  trans-125.7139.9172-84.5174.7-60.100111.8
344Q37Very low38.2Very low183 Ų183145 Ų14586%0.85574%0.741SS**  trans-64.4157.2177.1-67159.2-49.500109.8D346Q344-D346 PolarHBondContact O-N 3.44Å; Q344-D346 VanDerWaalsContact O-N 3.12Å
345N39.3Very low38.8Very low115 Ų115144.9 Ų144.962%0.61574%0.735SS**  trans-56.7118.9177-63.5-14.7000109.9D347 M348N345-D347 HydrophobicContact CB-CB 4.22Å; N345-D347 PolarHBondContact O-N 3.39Å; N345-M348 WeakPolarHBondContact O-CB 3.4Å; N345-M348 PolarHBondContact O-N 3.25Å
346D42Very low39.3Very low109 Ų109144 Ų14458%0.58373%0.731SS**Hα-helixtrans-56.5-29.3170.3-76.3-32.9000110.8Q344 M348 Y349 W350Q344-D346 PolarHBondContact O-N 3.44Å; Q344-D346 VanDerWaalsContact O-N 3.12Å; D346-M348 PolarHBondContact O-N 3.31Å; D346-Y349 WeakPolarHBondContact O-CA 3.26Å; D346-Y349 WeakPolarHBondContact O-CB 3.36Å; D346-Y349 PolarHBondContact O-N 3.46Å; D346-W350 PolarHBondContact O-N 3.45Å
347D42.3Very low39.7Very low117 Ų117142.7 Ų142.763%0.62672%0.724SS**Hα-helixtrans-49.3-33.3170.7-54.1-22.7000112.6N345 F351N345-D347 HydrophobicContact CB-CB 4.22Å; N345-D347 PolarHBondContact O-N 3.39Å; D347-F351 WeakPolarHBondContact O-CB 3.43Å; D347-F351 WeakPolarHBondContact O-CD2 3.47Å; D347-F351 PolarHBondContact O-N 3.34Å
348M44.2Very low40Very low155 Ų155146.8 Ų146.876%0.76473%0.726SS**Hα-helixtrans-82.6-22.1-179.9-136.1165.9-163.200113.2N345 D346N345-M348 WeakPolarHBondContact O-CB 3.4Å; N345-M348 PolarHBondContact O-N 3.25Å; D346-M348 PolarHBondContact O-N 3.31Å
349Y42.1Very low40.2Very low174 Ų174145.4 Ų145.468%0.68272%0.721SS**Hα-helixtrans-75.5-35.8169.6-167.9-94.7000110.9D346 V353D346-Y349 WeakPolarHBondContact O-CA 3.26Å; D346-Y349 WeakPolarHBondContact O-CB 3.36Å; D346-Y349 PolarHBondContact O-N 3.46Å; Y349-V353 WeakPolarHBondContact O-CG2 3.47Å
350W40.9Very low40.4Very low144 Ų144145.1 Ų145.155%0.54571%0.714SS.*Hα-helixtrans-83.9-19.4177.7-66.5105.6000114.4D346 G352 V353D346-W350 PolarHBondContact O-N 3.45Å; W350-G352 PolarHBondContact O-N 2.87Å; W350-V353 HydrophobicContact CE3-CB 4.1Å; W350-V353 HydrophobicContact CE3-CG1 4.24Å; W350-V353 HydrophobicContact CZ3-CB 4.4Å; W350-V353 HydrophobicContact CZ3-CG1 4.03Å; W350-V353 PolarHBondContact O-N 2.82Å
351F43.3Very low40.5Very low176 Ų176146.1 Ų146.177%0.77271%0.708SS**THydrogen-bonded Turntrans-61.8-3.2-178.5-130-93.3000116D347D347-F351 WeakPolarHBondContact O-CB 3.43Å; D347-F351 WeakPolarHBondContact O-CD2 3.47Å; D347-F351 PolarHBondContact O-N 3.34Å
352G38.9Very low40.8Very low65 Ų65144 Ų14467%0.6771%0.706SS**THydrogen-bonded Turntrans-131.72.2176.900000115.8W350W350-G352 PolarHBondContact O-N 2.87Å
353V44.2Very low41Very low73 Ų73140.5 Ų140.544%0.44270%0.698SS.*THydrogen-bonded Turntrans-94.8-33.6-172.4178.70000112.8Y349 W350Y349-V353 WeakPolarHBondContact O-CG2 3.47Å; W350-V353 HydrophobicContact CE3-CB 4.1Å; W350-V353 HydrophobicContact CE3-CG1 4.24Å; W350-V353 HydrophobicContact CZ3-CB 4.4Å; W350-V353 HydrophobicContact CZ3-CG1 4.03Å; W350-V353 PolarHBondContact O-N 2.82Å
354D39Very low40.8Very low132 Ų132135.6 Ų135.671%0.70668%0.683SS**SBendtrans-106.125.1-172.1-70.9-25.3000114.6
355V41.8Very low40.8Very low116 Ų116131.7 Ų131.770%0.70367%0.671SS**  trans-105.97.7-178.6-153.40000113.5P357V355-P357 VanDerWaalsContact O-CD 3.29Å; V355-P357 WeakPolarHBondContact O-CD 3.41Å
356T41.9Very low40.4Very low123 Ų123135.5 Ų135.576%0.75568%0.683SS**SBendtrans-94.3102.3162.848.20000109.9Y358T356-Y358 PolarHBondContact O-N 3.23Å
357P42.3Very low40Very low116 Ų116135.2 Ų135.275%0.75369%0.685SS**  trans-60.2127.9171.225.6-32.7000108.5V355 R359V355-P357 VanDerWaalsContact O-CD 3.29Å; V355-P357 WeakPolarHBondContact O-CD 3.41Å; P357-R359 PolarHBondContact O-N 2.84Å
358Y41.2Very low39.4Very low186 Ų186138.1 Ų138.173%0.72970%0.695SS**  trans-57.2115.7173-165.9-96.9000107.8T356 D360T356-Y358 PolarHBondContact O-N 3.23Å; Y358-D360 PolarHBondContact O-N 2.98Å; Y358-D360 VanDerWaalsContact O-N 3.08Å
359R38.3Very low38.8Very low220 Ų220135.6 Ų135.683%0.8369%0.692SS**  trans-72.5103.9171.5-78.7-172.9175.6-175.1-0.4106.9P357 T361P357-R359 PolarHBondContact O-N 2.84Å; R359-T361 PolarHBondContact O-N 3.34Å
360D39.1Very low38.3Very low136 Ų136132.7 Ų132.773%0.72770%0.696SS**  trans-61.582160.6-88.4-11.3000109Y358Y358-D360 PolarHBondContact O-N 2.98Å; Y358-D360 VanDerWaalsContact O-N 3.08Å
361T36.6Very low37.7Very low77 Ų77136.6 Ų136.647%0.47271%0.713SS.*  trans-71125.4157.952.70000106.7R359 E363 S364R359-T361 PolarHBondContact O-N 3.34Å; T361-E363 PolarHBondContact O-N 3.34Å; T361-S364 PolarHBondContact O-N 3.15Å; T361-S364 PolarHBondContact O-OG 3.26Å
362K42.2Very low37.3Very low204 Ų204135.3 Ų135.389%0.88771%0.713SS**THydrogen-bonded Turntrans-64.99.2-177.6-71.9-176.8172.4-178.20114.6
363E40.5Very low37Very low156 Ų156140.6 Ų140.673%0.72972%0.72SS**THydrogen-bonded Turntrans-97.1-15.7-176.1-64.3165.516900112T361 V365T361-E363 PolarHBondContact O-N 3.34Å; E363-V365 VanDerWaalsContact C-N 3.32Å; E363-V365 PolarHBondContact O-N 2.9Å
364S40.1Very low36.5Very low70 Ų70142 Ų14249%0.4973%0.725SS.*SBendtrans-82.4-5.8179.361.10000114.2T361T361-S364 PolarHBondContact O-N 3.15Å; T361-S364 PolarHBondContact O-OG 3.26Å
365V37Very low36.5Very low101 Ų101141.2 Ų141.261%0.61273%0.728SS**SBendtrans-132.179.3-173.3-175.40000110.1E363E363-V365 VanDerWaalsContact C-N 3.32Å; E363-V365 PolarHBondContact O-N 2.9Å
366F31.2Very low36.2Very low195 Ų195144.5 Ų144.586%0.85573%0.729SS**  trans71.686.7170.5-53.1-81.3000119.2
367T33.1Very low36.2Very low103 Ų103145.6 Ų145.663%0.63273%0.725SS**  trans-152.6113.3137.143.20000106.8
368E30.4Very low36.1Very low178 Ų178150 Ų15083%0.83273%0.733SS**  50.811988.9-69.9-168.4160.100114.5
369S30.3Very low36.1Very low102 Ų102145.8 Ų145.871%0.71373%0.73SS**  trans51.376.6164.855.30000117.8Y371S369-Y371 PolarHBondContact O-N 2.99Å
370C31.5Very low36.1Very low114 Ų114144.2 Ų144.277%0.7773%0.732SS**  trans-72.776.8156.8-690000111L372C370-L372 PolarHBondContact O-N 3.26Å; C370-L372 VanDerWaalsContact O-N 3.08Å
371Y28.7Very low36.1Very low225 Ų225146.1 Ų146.188%0.88277%0.767SS**  trans-67.289.4142.8-83.3-89.4000106.9S369S369-Y371 PolarHBondContact O-N 2.99Å
372L35.9Very low36Very low150 Ų150149.6 Ų149.679%0.78578%0.781SS**  trans-117.6119.4166.1-89.4166.7000107.7C370C370-L372 PolarHBondContact O-N 3.26Å; C370-L372 VanDerWaalsContact O-N 3.08Å
373E32.9Very low35.7Very low175 Ų175146.7 Ų146.782%0.81878%0.776SS**  trans-60.6153.1-175.6-68.2165.9145.200111.9
374N32.9Very low35.5Very low102 Ų102146.2 Ų146.255%0.54578%0.778SS.*  trans-62.8127.2-174.4-166.12.6000110.4Y376 E377N374-Y376 PolarHBondContact O-N 3.48Å; N374-E377 PolarHBondContact O-N 2.95Å
375P38.6Very low35.2Very low117 Ų117150.6 Ų150.676%0.7680%0.795SS**THydrogen-bonded Turntrans-66.95-178.427.1-35.8000114.8
376Y36.1Very low35.1Very low184 Ų184153.8 Ų153.872%0.72281%0.807SS**THydrogen-bonded Turntrans-90-7.3176.4-79.2-81.5000115.2N374 K378 S379N374-Y376 PolarHBondContact O-N 3.48Å; Y376-K378 PolarHBondContact O-N 2.81Å; Y376-S379 PolarHBondContact O-OG 2.96Å
377E41Very low35.3Very low147 Ų147151 Ų15169%0.68780%0.804SS**THydrogen-bonded Turntrans-88.59.4-178.8-71.3-173146.300115N374N374-E377 PolarHBondContact O-N 2.95Å
378K41Very low35.5Very low208 Ų208154.4 Ų154.490%0.90482%0.816SS**THydrogen-bonded Turntrans-10818.7174.9-79.6-175176.8172.90115.3Y376Y376-K378 PolarHBondContact O-N 2.81Å
379S40.6Very low35.9Very low97 Ų97152.6 Ų152.668%0.67882%0.815SS**SBendtrans-12013.4172.655.90000114.2Y376Y376-S379 PolarHBondContact O-OG 2.96Å
380Q38Very low36.3Very low188 Ų188156.8 Ų156.888%0.87982%0.823SS**  trans-124.680.5166-70-170.3-6.400110.2
381A38.9Very low36.8Very low175 Ų175160.7 Ų160.7100%1.44683%0.828SS**  trans-142.80167.500000108.8

Retrieved 381 of 381 residues in 62.7 ms (Link to these results)