A0A096NSC4_PAPAN Loading...

DSN1 component of MIS12 kinetochore complex

AlphaFold DB , UniProt , Accession A0A096NSC4, Species PAPAN (Papio anubis, Olive baboon), Gene DSN1, Length 354 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
1M41.6Very low39.6Very low225 Ų225135.5 Ų135.5100%1.10873%0.734SS**  0111.90-55-176.386.300105.7
2T34.4Very low39.3Very low121 Ų121135.8 Ų135.874%0.74273%0.727SS**  58.3115.268.665.20000110.4
3S41.3Very low38.7Very low106 Ų106139.2 Ų139.274%0.74173%0.731SS**  cis-143.2160.316.4-59.10000109.5
4V38.8Very low38.1Very low127 Ų127134.2 Ų134.277%0.7773%0.73SS**  cis62.6124.845.5-177.10000109.5
5T40.8Very low39.4Very low117 Ų117133.7 Ų133.772%0.71874%0.736SS**  cis-155.4140.345.5-10.20000109.6
6R38.7Very low38.8Very low186 Ų186133.1 Ų133.170%0.70274%0.737SS**  77.199.8100.5-169.5175.5-167132.211.3115.4E8R6-E8 WeakPolarHBondContact CG-OE1 3.47Å; R6-E8 IonicContact CZ-OE1 4Å; R6-E8 IonicContact CZ-OE2 2.89Å; R6-E8 IonicContact NE-OE1 2.7Å; R6-E8 PolarHBondContact NE-OE1 2.71Å; R6-E8 VanDerWaalsContact NE-OE1 3.13Å; R6-E8 IonicContact NE-OE2 3.84Å; R6-E8 PolarHBondContact NE-OE2 2.61Å; R6-E8 IonicContact NH2-OE1 2.75Å; R6-E8 PolarHBondContact NH2-OE1 2.98Å; R6-E8 IonicContact NH2-OE2 2.84Å; R6-E8 PolarHBondContact NH2-OE2 3.03Å
7S41.6Very low38.3Very low101 Ų101134.6 Ų134.671%0.70674%0.74SS**  84.5-17491.1-490000112.8
8E38.8Very low38.1Very low109 Ų109132.7 Ų132.751%0.50974%0.738SS.*  cis-162152.89-128.2129.9-116.100106.3R6R6-E8 WeakPolarHBondContact CG-OE1 3.47Å; R6-E8 IonicContact CZ-OE1 4Å; R6-E8 IonicContact CZ-OE2 2.89Å; R6-E8 IonicContact NE-OE1 2.7Å; R6-E8 PolarHBondContact NE-OE1 2.71Å; R6-E8 VanDerWaalsContact NE-OE1 3.13Å; R6-E8 IonicContact NE-OE2 3.84Å; R6-E8 PolarHBondContact NE-OE2 2.61Å; R6-E8 IonicContact NH2-OE1 2.75Å; R6-E8 PolarHBondContact NH2-OE1 2.98Å; R6-E8 IonicContact NH2-OE2 2.84Å; R6-E8 PolarHBondContact NH2-OE2 3.03Å
9I41.8Very low37.8Very low134 Ų134135.9 Ų135.969%0.68774%0.743SS**  cis-178.3171-10-172163.2000109.4
10I41.9Very low37.5Very low135 Ų135134.7 Ų134.769%0.69274%0.74SS**  trans78.9142.4154.3-92.7152.2000117.6
11D35.4Very low37.2Very low130 Ų130136.1 Ų136.170%0.69574%0.741SS**  cis-154.9-178.6-1.5-138.5-11.9000116.4
12E36.4Very low36.8Very low139 Ų139131.8 Ų131.865%0.6572%0.723SS**  trans-49.9179.2161.9-56.8-170.9124.200114.9
13K32.2Very low36.7Very low179 Ų179134.9 Ų134.978%0.77873%0.728SS**  cis-171.6134.935.3-154.7-178-15981.90115.6
14G29.8Very low36.2Very low70 Ų70137.6 Ų137.672%0.72273%0.729SS**  trans85.9165.5135.700000120.3
15P57.4Low35.9Very low126 Ų126139.3 Ų139.382%0.81873%0.733SS**  trans-128.5-155.4-164.433.3-10.1000113.6
16V30.6Very low35.3Very low124 Ų124141.5 Ų141.575%0.75274%0.735SS**  trans120.4105.7149.6178.60000117.9
17M30.5Very low35Very low159 Ų159138 Ų13878%0.78374%0.739SS**  trans78.1123.4139.8-69.8-80.2-8000125.1
18S33.9Very low34.4Very low101 Ų101137.4 Ų137.471%0.70674%0.735SS**  trans73.3162.1139.1780000118
19K32.1Very low34Very low193 Ų193140 Ų14084%0.83975%0.752SS**  cis-152.8168.616.9-154.9169.6-178.1-178.90112.7
20T32.4Very low33.5Very low112 Ų112138.5 Ų138.569%0.68775%0.753SS**  trans-68.1147.9176.750.10000115
21H30.5Very low33.4Very low164 Ų164137.4 Ų137.476%0.75976%0.755SS**  -170.2145.8106-122.6-33.8000113.5
22D33.1Very low33.2Very low134 Ų134137.5 Ų137.572%0.71776%0.76SS**  trans-68157.2158.7-47-96.5000111.8
23H33.8Very low32.9Very low187 Ų187137.7 Ų137.787%0.86676%0.761SS**  trans-149122.1135.9-98.1-62.7000111.6
24Q30.9Very low32.9Very low163 Ų163134.7 Ų134.776%0.76276%0.757SS**  trans-74.1145.4168.1176.5-172.121.900110.3
25L32.1Very low32.9Very low162 Ų162138.7 Ų138.785%0.84876%0.755SS**  trans-175.7144.4133.9-102.4164000112.6
26E28.5Very low31.6Very low163 Ų163137.6 Ų137.676%0.76275%0.746SS**  trans-84.2158168.9-61.4151.799.200110.2
27S30.4Very low31.6Very low112 Ų112140.6 Ų140.678%0.78375%0.749SS**  176.6154.3110.7-162.90000113.3
28S29.9Very low31.6Very low90 Ų90138.8 Ų138.863%0.62975%0.747SS**  trans-29.2148.4171.557.80000119
29L30Very low31.5Very low163 Ų163139.9 Ų139.985%0.85376%0.755SS**  -177.9128.696.6-91.3168.1000111.9
30S31.8Very low31.5Very low103 Ų103135.6 Ų135.672%0.7276%0.756SS**  trans-97.5165.7152.365.50000108.1
31P40.5Very low31.4Very low112 Ų112135.8 Ų135.873%0.72776%0.761SS**  -154.1-170.58635-12.3000115.2
32V29.9Very low31.3Very low132 Ų132135.2 Ų135.280%0.876%0.763SS**  trans71.5100.6166.1-168.60000114.5
33E31.5Very low31.2Very low143 Ų143136.1 Ų136.167%0.66876%0.763SS**  cis-145.6-120.72-155-170.156.200113.2F35E33-F35 WeakPolarHBondContact OE1-CD2 3.45Å; E33-F35 VanDerWaalsContact OE1-CE2 3.24Å; E33-F35 WeakPolarHBondContact OE1-CE2 3.29Å
34V30.6Very low31Very low116 Ų116133.7 Ų133.770%0.70375%0.754SS**  cis-150.6160.65.870.60000111.7
35F30.1Very low31Very low154 Ų154134 Ų13468%0.67576%0.755SS**  trans-56.3131.4177.9-68.3-101000111.8E33E33-F35 WeakPolarHBondContact OE1-CD2 3.45Å; E33-F35 VanDerWaalsContact OE1-CE2 3.24Å; E33-F35 WeakPolarHBondContact OE1-CE2 3.29Å
36T29.6Very low30.9Very low102 Ų102134.7 Ų134.763%0.62675%0.754SS**  cis67.3141.546.282.40000113.7
37K31.3Very low30.8Very low187 Ų187130.4 Ų130.481%0.81375%0.753SS**  cis-159.8173.4-6.5-124.1173.8-177.1176.20110.8
38T30.3Very low30.8Very low121 Ų121131.4 Ų131.474%0.74275%0.754SS**  trans-29.3150.9164.7-22.60000117.6
39S31.3Very low31Very low125 Ų125132.3 Ų132.387%0.87476%0.76SS**  -166.3157.8127.7-83.50000113.1
40A32.5Very low31.2Very low103 Ų103133.4 Ų133.485%0.85176%0.761SS**  trans-145151.3170.700000110.2
41S30.6Very low30.9Very low115 Ų115137.6 Ų137.680%0.80477%0.769SS**  trans-153.2148.9169.549.80000108.3
42L29Very low30.5Very low153 Ų153142.8 Ų142.880%0.80177%0.774SS**  cis92.977.119.8-158.573.4000116.2
43E29.9Very low30.5Very low152 Ų152143.9 Ų143.971%0.7177%0.774SS**  78.8150.6126.3-123.1179.7-175.300124.3
44M30Very low30.4Very low137 Ų137145.4 Ų145.468%0.67578%0.781SS**  trans63.7128.4164.9-60.1-57.4-170.200119.3
45H30.7Very low30.5Very low170 Ų170148.2 Ų148.279%0.78779%0.791SS**  -159.8130.365-95.7-85.4000116
46Q29.6Very low30.3Very low176 Ų176144.2 Ų144.282%0.82279%0.793SS**  trans25.5127.4132-163.516814.800122.8
47G27.1Very low30.3Very low72 Ų72145.5 Ų145.574%0.74281%0.806SS**  trans-166.9139.3158.800000111.7
48V30.8Very low30.5Very low133 Ų133142 Ų14281%0.80681%0.805SS**  trans-143.1133.4-171.5175.80000113
49S33.8Very low31.1Very low109 Ų109141.4 Ų141.476%0.76280%0.803SS**  trans-167.7102.9156.953.40000107.9
50E34.7Very low31.1Very low186 Ų186145 Ų14587%0.86980%0.803SS**  63.498.291.1-71.8-155.213200115.8
51E26.1Very low31Very low191 Ų191149.7 Ų149.789%0.89381%0.805SS**  -142.9155.5128-170.2160.2-168.400109.5
52R30.6Very low30.8Very low221 Ų221147.4 Ų147.483%0.83480%0.799SS**  trans-145105.8-155.9177.7-163.5-172.6175.95112.3
53I30.1Very low30.6Very low155 Ų155149.1 Ų149.180%0.79580%0.803SS**  trans-131.496.7161.7-53.4-178.3000110.2
54H29.5Very low30.4Very low176 Ų176148.2 Ų148.282%0.81580%0.803SS**  trans-107.7117.2159.6-80.5-71.7000108.9
55L33.4Very low30.4Very low175 Ų175147.4 Ų147.492%0.91681%0.809SS**  trans-138.995.1155.3-79-178.6000109
56G26.3Very low30.2Very low69 Ų69146.1 Ų146.171%0.71181%0.808SS**  trans-106.1136.416400000109.7
57S27.8Very low30.3Very low130 Ų130145.9 Ų145.991%0.90981%0.812SS**  trans-167.2119.5157.4-860000111.7
58S36.7Very low30.5Very low113 Ų113147 Ų14779%0.7981%0.808SS**  trans-123.2143.1149-166.80000105.4
59P41.8Very low30.5Very low108 Ų108150.1 Ų150.170%0.70181%0.813SS**  -153.3153.49637.8-19.6000117.4
60K32Very low30.4Very low202 Ų202153.1 Ų153.188%0.87882%0.816SS**  trans35.3134135.4-55.7176.7178.9-179.10120.9
61K30.8Very low30.1Very low201 Ų201153.3 Ų153.387%0.87482%0.816SS**  -164.8135.1111.9-169.3174.4179.4-1740113.6
62G25.4Very low30.2Very low66 Ų66154 Ų15468%0.6881%0.811SS**  trans81.1151.8156.900000116.8
63E24.8Very low30.3Very low190 Ų190149.8 Ų149.889%0.88880%0.804SS**  cis-152.9178.6-19.1-159.1147169.400110.1
64N27.4Very low30.1Very low132 Ų132150 Ų15071%0.70680%0.801SS**  trans-81.1151.3-162.4-150.517.4000114.2
65C29.1Very low30.1Very low121 Ų121146.2 Ų146.282%0.81880%0.795SS**  -175.9133.2121.8-930000112.1
66D27.1Very low29.8Very low142 Ų142147.7 Ų147.776%0.75979%0.794SS**  trans-65.2154.4163.3-76.3-73.8000112
67L30.9Very low29.9Very low172 Ų172148.8 Ų148.890%0.90179%0.791SS**  -153.3140.7118.1-104.3179.3000110.1
68S31.1Very low30Very low95 Ų95151 Ų15166%0.66479%0.791SS**  trans-83.9157.4-176.854.30000112.5
69H31.6Very low29.6Very low198 Ų198153.2 Ų153.292%0.91779%0.789SS**  trans-158.7139.5136.3-101.7-68.2000110.6
70Q31.3Very low29Very low173 Ų173156.6 Ų156.681%0.80880%0.8SS**  trans-142.5109.8-175.2177.5-166.132.800109.9
71E29.4Very low28.8Very low190 Ų190152.1 Ų152.189%0.88879%0.794SS**  trans-162.1132.4163.2-113.4166.217500108.2
72R26.9Very low29.5Very low206 Ų206147.9 Ų147.978%0.77779%0.787SS**  cis98.58414.7-156.1179.8-159.6177.87.8116.3
73L32.3Very low29.6Very low132 Ų132153.9 Ų153.969%0.69180%0.798SS**  trans78125.8143.3-61.7173.8000121.4
74Q27Very low29.9Very low158 Ų158152 Ų15274%0.73879%0.789SS**  trans74.7105.6131.2-68.9-177.71700122.9
75S28.5Very low30.1Very low98 Ų98153.6 Ų153.669%0.68579%0.792SS**  80.3147.9112.8-55.30000122.2
76K27.5Very low30.1Very low205 Ų205152.9 Ų152.989%0.89179%0.788SS**  trans76.9160.4165.2-59.2169.6-176.3173.10116.9
77S28.4Very low30.2Very low92 Ų92150.4 Ų150.464%0.64379%0.788SS**  cis179.1113-33.6171.60000110.9
78L29.8Very low30.1Very low176 Ų176147.6 Ų147.692%0.92178%0.782SS**  trans-150.5125.2160-66.6176.4000107.3
79H27.6Very low30.1Very low161 Ų161153.1 Ų153.175%0.74579%0.79SS**  cis91.280.119.7-156-65.5000116
80L30.2Very low30.4Very low178 Ų178152.2 Ų152.293%0.93279%0.787SS**  trans-143.6130.6163.1-76.1-179.2000111.8
81S27.2Very low30.7Very low108 Ų108150.3 Ų150.376%0.75578%0.782SS**  trans176.9157.2171.3-171.70000108.4
82P46.7Very low31Very low112 Ų112152.1 Ų152.173%0.72778%0.781SS**  cis-123.4179.4-43.937.5-24.4000111.2
83Q27.9Very low31.4Very low193 Ų193153.1 Ų153.190%0.90278%0.784SS**  trans-143.9144.8152.8-166.4159.8-8.300111.8
84E30.1Very low32Very low150 Ų150154.6 Ų154.670%0.70179%0.788SS**  trans-100-173.4-176.5-24176.2133.400110.2
85Q32.3Very low33Very low166 Ų166151.4 Ų151.478%0.77678%0.783SS**  cis-153.5157.74.2-129.1-177.381.700104.4
86S28.4Very low33.9Very low105 Ų105159.1 Ų159.173%0.73480%0.797SS**  cis-151.1-167.15.454.60000106.5
87A30.1Very low34.4Very low90 Ų90159.4 Ų159.474%0.74479%0.793SS**  cis-153.6-157.111.300000107.8
88S29Very low35Very low113 Ų113166.5 Ų166.579%0.7981%0.805SS**  cis-148.4-117.66.664.80000114.1
89Y30.8Very low35.5Very low211 Ų211163.9 Ų163.983%0.82780%0.802SS**  trans-93.2148.4-160.5-83.2-74.1000116.4
90Q38.1Very low36.3Very low180 Ų180161 Ų16184%0.84180%0.8SS**  trans72.567.5158.9-67.9-174.56.800118.7
91D36.1Very low36.9Very low133 Ų133161.7 Ų161.771%0.71180%0.801SS**  19.9115.3114.6-17834.8000118.7R93D91-R93 PolarHBondContact OD1-N 3.02Å; D91-R93 VanDerWaalsContact OD1-N 3.17Å
92R37Very low37.8Very low228 Ų228165.7 Ų165.786%0.8680%0.804SS**  -151.687.7126.2-119.1179.5-178.4-156.20.4111.6Q94R92-Q94 PolarHBondContact O-N 3.04Å; R92-Q94 VanDerWaalsContact O-N 3.08Å
93R33.8Very low37.5Very low227 Ų227166.6 Ų166.686%0.85780%0.799SS**  trans-69.4102.6175.1-75.9-176.6176.5-97.32.9111.8D91D91-R93 PolarHBondContact OD1-N 3.02Å; D91-R93 VanDerWaalsContact OD1-N 3.17Å
94Q45.1Very low38.1Very low163 Ų163163.6 Ų163.676%0.76279%0.794SS**  trans-103.292.9160.9-72.1-61.5-2600109.7R92R92-Q94 PolarHBondContact O-N 3.04Å; R92-Q94 VanDerWaalsContact O-N 3.08Å
95S47.6Very low38.7Very low90 Ų90162.6 Ų162.663%0.62979%0.793SS**  trans-77.3125.8-175.7610000111.8R97S95-R97 PolarHBondContact O-N 3.33Å
96W47.6Very low39.4Very low261 Ų261164.1 Ų164.199%0.98979%0.792SS**  trans-68.880.9170.3-76.168.1000110.8
97R39.4Very low40.6Very low211 Ų211168.7 Ų168.780%0.79679%0.793SS**  trans-110.7104.5175.3-79.7-78.6-170.8-116.67108.7S95 S99S95-R97 PolarHBondContact O-N 3.33Å; R97-S99 PolarHBondContact O-N 3.43Å
98R39.5Very low41.7Very low240 Ų240174.3 Ų174.391%0.90680%0.801SS**  trans10.2107.7158.4-64.8174176.7-95.60.2114.9S100R98-S100 PolarHBondContact O-N 3.41Å
99S40.3Very low43.2Very low122 Ų122174 Ų17485%0.85380%0.798SS**  trans-53123.2168.841.20000110.5R97R97-S99 PolarHBondContact O-N 3.43Å
100S44.8Very low44.6Very low101 Ų101171.3 Ų171.371%0.70680%0.797SS**  trans-68.6137.4-175.6-174.70000111.3R98 K102R98-S100 PolarHBondContact O-N 3.41Å; S100-K102 PolarHBondContact O-N 3.32Å
101M42.5Very low45.5Very low192 Ų192171 Ų17195%0.94680%0.796SS**SBendtrans-74.466.2170.7-73.7-174.167.300111.3
102K47.8Very low46.7Very low192 Ų192170.5 Ų170.584%0.83580%0.8SS**  trans-140.159168.2-79.2-161.1173.9-1740111.2S100S100-K102 PolarHBondContact O-N 3.32Å
103E38.9Very low47.8Very low131 Ų131165 Ų16561%0.61279%0.786SS**  trans-124.6117154.8-169157.5-144.100110N105 R106E103-N105 PolarHBondContact O-N 3.1Å; E103-R106 HydrophobicContact CG-CG 4.33Å; E103-R106 IonicContact OE1-CZ 3.36Å; E103-R106 IonicContact OE1-NE 3.21Å; E103-R106 PolarHBondContact OE1-NE 3.25Å; E103-R106 IonicContact OE1-NH2 3.69Å; E103-R106 PolarHBondContact OE1-NH2 3.11Å; E103-R106 IonicContact OE2-NE 2.71Å
104T40.3Very low49.3Very low129 Ų129159.1 Ų159.179%0.79177%0.768SS**  trans-76.5117.8-17045.80000111.7R106T104-R106 VanDerWaalsContact C-N 3.25Å; T104-R106 PolarHBondContact O-N 3.02Å
105N43.6Very low50.4Low129 Ų129158.5 Ų158.569%0.6977%0.765SS**  trans50.537.1153.7-149-21.4000115.4E103 R107E103-N105 PolarHBondContact O-N 3.1Å; N105-R107 PolarHBondContact O-N 3.45Å
106R46.9Very low51.5Low198 Ų198154.9 Ų154.975%0.74774%0.742SS**  trans-70.477.1163.7-70.5-159.2-163-117.97.3109.5E103 T104E103-R106 HydrophobicContact CG-CG 4.33Å; E103-R106 IonicContact OE1-CZ 3.36Å; E103-R106 IonicContact OE1-NE 3.21Å; E103-R106 PolarHBondContact OE1-NE 3.25Å; E103-R106 IonicContact OE1-NH2 3.69Å; E103-R106 PolarHBondContact OE1-NH2 3.11Å; E103-R106 IonicContact OE2-NE 2.71Å; T104-R106 VanDerWaalsContact C-N 3.25Å; T104-R106 PolarHBondContact O-N 3.02Å
107R52.8Low53Low201 Ų201146.6 Ų146.676%0.75872%0.716SS**  trans-45.9146.2150.4-58.4-179.6-178-167.9-2.6107.3N105 S109N105-R107 PolarHBondContact O-N 3.45Å; R107-S109 PolarHBondContact O-N 3.35Å
108K54.8Low54.9Low209 Ų209139.1 Ų139.191%0.90969%0.694SS**  trans-63.789.6169.4-67.7-179.6-178.7178.40107.7L110K108-L110 PolarHBondContact O-N 3.18Å
109S59.7Low57Low105 Ų105132.5 Ų132.573%0.73467%0.673SS**PPolyproline II helixtrans-60124.5178.151.60000107.6R107 H111R107-S109 PolarHBondContact O-N 3.35Å; S109-H111 PolarHBondContact O-N 3.32Å
110L60.3Low59.1Low155 Ų155127.7 Ų127.781%0.81264%0.638SS**PPolyproline II helixtrans-50.7143.2168.8-59.3175.3000108.3K108K108-L110 PolarHBondContact O-N 3.18Å
111H57.5Low61Low175 Ų175125.9 Ų125.981%0.8163%0.625SS**PPolyproline II helixtrans-51.1138.3177.4-76.9-87.3000109.5S109 I113S109-H111 PolarHBondContact O-N 3.32Å; H111-I113 PolarHBondContact O-N 3.39Å
112P61Low63.1Low122 Ų122126 Ų12679%0.79262%0.615SS**PPolyproline II helixtrans-48.9118.5-179.7-2935.4000110.2H114P112-H114 PolarHBondContact O-N 3.25Å; P112-H114 VanDerWaalsContact O-N 3.08Å
113I60.3Low64.8Low111 Ų111121.1 Ų121.157%0.56961%0.605SS**PPolyproline II helixtrans-59.2120.3-175.7-58.3173.2000106.9H111 Q115 I117 T118H111-I113 PolarHBondContact O-N 3.39Å; I113-Q115 PolarHBondContact O-N 3.33Å; I113-I117 HydrophobicContact CG2-CG2 3.5Å; I113-T118 HydrophobicContact CB-CG2 4.42Å; I113-T118 HydrophobicContact CG2-CG2 3.75Å
114H63.8Low67.1Low105 Ų105115.7 Ų115.749%0.48658%0.58SS.*  trans-53.5115.7-174.7171.2-60.6000109P112 G116 I117 K148P112-H114 PolarHBondContact O-N 3.25Å; P112-H114 VanDerWaalsContact O-N 3.08Å; H114-G116 VanDerWaalsContact C-N 3.26Å; H114-G116 PolarHBondContact ND1-N 3.26Å; H114-G116 PolarHBondContact O-N 2.92Å; H114-I117 VanDerWaalsContact O-CG2 3.32Å; H114-I117 WeakPolarHBondContact O-CG2 3.49Å; H114-I117 PolarHBondContact O-N 2.94Å; H114-K148 PolarHBondContact NE2-NZ 2.92Å
115Q69.5Low69.2Low150 Ų150111.9 Ų111.970%0.70156%0.559SS**Hα-helixtrans-48.7-44.9-165.7-69.9169.8-25.200113.4I113 I117 T118 E119I113-Q115 PolarHBondContact O-N 3.33Å; Q115-I117 PolarHBondContact O-N 3.3Å; Q115-T118 PolarHBondContact O-N 3.18Å; Q115-T118 PolarHBondContact O-OG1 3.39Å; Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 3.37Å
116G71.1Confident71Confident13 Ų13110.9 Ų110.913%0.13456%0.557CS.*Hα-helixtrans-59.4-11.7175.100000117.6H114 E119 F144H114-G116 VanDerWaalsContact C-N 3.26Å; H114-G116 PolarHBondContact ND1-N 3.26Å; H114-G116 PolarHBondContact O-N 2.92Å; G116-E119 WeakPolarHBondContact CA-OE2 3.36Å; G116-F144 WeakPolarHBondContact O-CE2 3.49Å
117I77.7Confident72.9Confident87 Ų87108.4 Ų108.445%0.44656%0.559SS.*Hα-helixtrans-93.5-30.1173-143.4173.9000111.7I113 H114 Q115 E119 L120 F144I113-I117 HydrophobicContact CG2-CG2 3.5Å; H114-I117 VanDerWaalsContact O-CG2 3.32Å; H114-I117 WeakPolarHBondContact O-CG2 3.49Å; H114-I117 PolarHBondContact O-N 2.94Å; Q115-I117 PolarHBondContact O-N 3.3Å; I117-E119 VanDerWaalsContact C-N 3.3Å; I117-L120 HydrophobicContact CG1-CD1 4.02Å; I117-F144 HydrophobicContact CD1-CE1 4.43Å; I117-F144 HydrophobicContact CG1-CE1 4.15Å
118T79Confident74.3Confident55 Ų55102 Ų10234%0.33754%0.54SS..Hα-helixtrans-75.8-19.4167.439.50000113.1I113 Q115 S121I113-T118 HydrophobicContact CB-CG2 4.42Å; I113-T118 HydrophobicContact CG2-CG2 3.75Å; Q115-T118 PolarHBondContact O-N 3.18Å; Q115-T118 PolarHBondContact O-OG1 3.39Å; T118-S121 PolarHBondContact O-OG 3.33Å
119E83.8Confident75.8Confident100 Ų10094.5 Ų94.547%0.46752%0.516SS..Hα-helixtrans-70.1-34.6172.7-76.4156.1-155.400111.5Q115 G116 I117 S121 R122 S123Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 3.37Å; G116-E119 WeakPolarHBondContact CA-OE2 3.36Å; I117-E119 VanDerWaalsContact C-N 3.3Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 3.11Å; E119-R122 CarbonylContact O-C 3.6Å; E119-R122 WeakPolarHBondContact O-CA 3.34Å; E119-R122 WeakPolarHBondContact O-CB 3.02Å; E119-R122 PolarHBondContact O-N 2.97Å; E119-S123 PolarHBondContact O-N 2.83Å; E119-S123 PolarHBondContact O-OG 2.93Å; E119-S123 VanDerWaalsContact O-OG 3.11Å
120L85.9Confident77Confident21 Ų2194.2 Ų94.211%0.1150%0.503CS..Hα-helixtrans-57.3-42.8178.2-56.7176.5000113I117 R122 S123 I124 L137 F144I117-L120 HydrophobicContact CG1-CD1 4.02Å; L120-R122 VanDerWaalsContact C-N 3.28Å; L120-R122 PolarHBondContact O-N 3.48Å; L120-S123 WeakPolarHBondContact CA-OG 3.35Å; L120-S123 PolarHBondContact O-OG 3.42Å; L120-I124 VanDerWaalsContact O-CD1 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.16Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-L137 HydrophobicContact CB-CD1 4.16Å; L120-F144 HydrophobicContact CD1-CB 3.8Å; L120-F144 HydrophobicContact CD1-CD1 4.01Å; L120-F144 HydrophobicContact CD1-CD2 4.24Å; L120-F144 HydrophobicContact CD1-CG 3.78Å; L120-F144 HydrophobicContact CD2-CB 3.92Å; L120-F144 HydrophobicContact CD2-CD2 3.97Å; L120-F144 HydrophobicContact CD2-CG 4.13Å; L120-F144 HydrophobicContact CG-CB 4.5Å; L120-F144 HydrophobicContact CG-CD2 4.45Å; L120-F144 HydrophobicContact CG-CG 4.44Å
121S83.4Confident78.2Confident64 Ų6487.2 Ų87.245%0.44847%0.467SS..THydrogen-bonded Turntrans-78.3-11.3177.559.10000113.7T118 E119T118-S121 PolarHBondContact O-OG 3.33Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 3.11Å
122R85.9Confident79.5Confident195 Ų19583 Ų8374%0.73645%0.447SS*.THydrogen-bonded Turntrans-96.4-28176-170.6-174.4-64170.90.6112.8E119 L120 I124E119-R122 CarbonylContact O-C 3.6Å; E119-R122 WeakPolarHBondContact O-CA 3.34Å; E119-R122 WeakPolarHBondContact O-CB 3.02Å; E119-R122 PolarHBondContact O-N 2.97Å; L120-R122 VanDerWaalsContact C-N 3.28Å; L120-R122 PolarHBondContact O-N 3.48Å; R122-I124 PolarHBondContact O-N 2.85Å
123S84.1Confident80.9Confident89 Ų8980.6 Ų80.662%0.62242%0.422SS*.SBendtrans-74.5-9.9177.149.40000114E119 L120E119-S123 PolarHBondContact O-N 2.83Å; E119-S123 PolarHBondContact O-OG 2.93Å; E119-S123 VanDerWaalsContact O-OG 3.11Å; L120-S123 WeakPolarHBondContact CA-OG 3.35Å; L120-S123 PolarHBondContact O-OG 3.42Å
124I87.9Confident82.4Confident17 Ų1777.3 Ų77.39%0.08741%0.405CS..SBendtrans-90.2131.4177.1-61.7162.4000108.4L120 R122 R133 C136 L137L120-I124 VanDerWaalsContact O-CD1 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.16Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; R122-I124 PolarHBondContact O-N 2.85Å; I124-R133 HydrophobicContact CG2-CB 4.08Å; I124-R133 HydrophobicContact CG2-CG 3.97Å; I124-C136 HydrophobicContact CD1-CB 4.05Å; I124-C136 HydrophobicContact CG1-CB 4.08Å; I124-C136 HydrophobicContact CG2-CB 3.89Å; I124-L137 VanDerWaalsContact CD1-CA 3.48Å; I124-L137 HydrophobicContact CD1-CB 3.65Å; I124-L137 HydrophobicContact CD1-CD1 3.94Å; I124-L137 HydrophobicContact CD1-CG 4.4Å
125S83.1Confident83.6Confident49 Ų4972.8 Ų72.834%0.34339%0.387SS..  trans-55.2142.9178.3157.80000111.7D127 R133S125-D127 VanDerWaalsContact C-N 3.33Å; S125-D127 WeakPolarHBondContact OG-CB 3.37Å; S125-D127 PolarHBondContact OG-N 3.38Å; S125-D127 PolarHBondContact OG-OD2 2.83Å; S125-R133 VanDerWaalsContact O-CD 3.3Å; S125-R133 WeakPolarHBondContact O-CD 3.23Å; S125-R133 WeakPolarHBondContact O-CG 3.35Å; S125-R133 PolarHBondContact O-NE 2.93Å
126V83.3Confident84.6Confident108 Ų10868 Ų6866%0.65537%0.369SS*.SBendtrans-85-9.2174.1-65.90000112.9L128V126-L128 VanDerWaalsContact C-N 3.3Å
127D85.1Confident85.5Confident145 Ų14569.9 Ų69.978%0.77538%0.376SS*.SBendtrans-86.2-5.3-176.8-37.1-73.2000112.3S125S125-D127 VanDerWaalsContact C-N 3.33Å; S125-D127 WeakPolarHBondContact OG-CB 3.37Å; S125-D127 PolarHBondContact OG-N 3.38Å; S125-D127 PolarHBondContact OG-OD2 2.83Å
128L83.6Confident86.2Confident68 Ų6869.5 Ų69.536%0.35637%0.374SS..SBendtrans-91.7148.9174.5-66.1173.5000110.7V126 K132 R133V126-L128 VanDerWaalsContact C-N 3.3Å; L128-K132 HydrophobicContact CB-CB 4.16Å; L128-K132 HydrophobicContact CD2-CD 4.35Å; L128-R133 HydrophobicContact CB-CG 3.71Å; L128-R133 WeakPolarHBondContact O-CD 3.47Å; L128-R133 WeakPolarHBondContact O-CG 3.42Å
129A85.5Confident86.7Confident51 Ų5168.3 Ų68.342%0.42137%0.366SS..  trans-60149.8173.200000112.2S131 K132 R133A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.48Å; A129-S131 VanDerWaalsContact O-N 3.16Å; A129-K132 WeakPolarHBondContact O-CA 3.27Å; A129-K132 WeakPolarHBondContact O-CB 3.37Å; A129-K132 PolarHBondContact O-N 3.29Å; A129-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 PolarHBondContact O-N 2.87Å
130E85.1Confident87.1Confident99 Ų9965 Ų6546%0.46335%0.353SS..Hα-helixtrans-52.5-39.3-177-81.756.5-133.100113.9R133 L134 F192E130-R133 PolarHBondContact O-N 2.75Å; E130-R133 IonicContact OE1-NH1 3.59Å; E130-R133 PolarHBondContact OE1-NH1 3.14Å; E130-L134 WeakPolarHBondContact O-CB 3.48Å; E130-L134 PolarHBondContact O-N 2.94Å; E130-F192 HydrophobicContact CB-CD1 3.89Å; E130-F192 HydrophobicContact CB-CD2 4.25Å; E130-F192 HydrophobicContact CB-CE1 3.71Å; E130-F192 HydrophobicContact CB-CE2 4.09Å; E130-F192 HydrophobicContact CB-CG 4.16Å; E130-F192 HydrophobicContact CB-CZ 3.82Å; E130-F192 HydrophobicContact CG-CD1 4.35Å; E130-F192 HydrophobicContact CG-CE1 4.19Å; E130-F192 WeakPolarHBondContact O-CZ 3.36Å
131S84.7Confident87.3Confident8 Ų866.2 Ų66.26%0.05636%0.364CS..Hα-helixtrans-64.5-43.717537.60000112.6A129 L134 G135 Q189A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.48Å; A129-S131 VanDerWaalsContact O-N 3.16Å; S131-L134 PolarHBondContact O-N 3.48Å; S131-G135 PolarHBondContact O-N 2.81Å; S131-Q189 PolarHBondContact OG-OE1 3.07Å
132K86.4Confident87.6Confident87 Ų8765.7 Ų65.738%0.37835%0.354SS..Hα-helixtrans-61-44.2170.8-70-170.2174-170.30111.8L128 A129 L134 G135 C136 E183L128-K132 HydrophobicContact CB-CB 4.16Å; L128-K132 HydrophobicContact CD2-CD 4.35Å; A129-K132 WeakPolarHBondContact O-CA 3.27Å; A129-K132 WeakPolarHBondContact O-CB 3.37Å; A129-K132 PolarHBondContact O-N 3.29Å; K132-L134 VanDerWaalsContact C-N 3.27Å; K132-L134 PolarHBondContact O-N 3.19Å; K132-G135 PolarHBondContact O-N 2.84Å; K132-G135 VanDerWaalsContact O-N 3.16Å; K132-C136 PolarHBondContact O-N 2.89Å; K132-C136 PolarHBondContact O-SG 3.48Å; K132-E183 WeakPolarHBondContact CE-OE1 3.28Å; K132-E183 WeakPolarHBondContact CE-OE2 3.43Å; K132-E183 HydrophobicContact CG-CG 4.43Å; K132-E183 WeakPolarHBondContact CG-OE2 3.3Å; K132-E183 IonicContact NZ-OE1 3.68Å
133R90.3Very high87.9Confident70 Ų7060.2 Ų60.226%0.26434%0.337SS..Hα-helixtrans-63.1-34.5178.6-66.8173.261.3-145.10.9111.6I124 S125 L128 A129 E130 L137I124-R133 HydrophobicContact CG2-CB 4.08Å; I124-R133 HydrophobicContact CG2-CG 3.97Å; S125-R133 VanDerWaalsContact O-CD 3.3Å; S125-R133 WeakPolarHBondContact O-CD 3.23Å; S125-R133 WeakPolarHBondContact O-CG 3.35Å; S125-R133 PolarHBondContact O-NE 2.93Å; L128-R133 HydrophobicContact CB-CG 3.71Å; L128-R133 WeakPolarHBondContact O-CD 3.47Å; L128-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 PolarHBondContact O-N 2.87Å; E130-R133 PolarHBondContact O-N 2.75Å; E130-R133 IonicContact OE1-NH1 3.59Å; E130-R133 PolarHBondContact OE1-NH1 3.14Å; R133-L137 VanDerWaalsContact O-CB 3.29Å; R133-L137 WeakPolarHBondContact O-CB 3.23Å; R133-L137 PolarHBondContact O-N 3.49Å
134L90.2Very high88.1Confident43 Ų4357.9 Ų57.923%0.22532%0.315CS..Hα-helixtrans-68.4-43.8171.8-176.158.4000112.2E130 S131 K132 L137 L138 L188 C191 F192E130-L134 WeakPolarHBondContact O-CB 3.48Å; E130-L134 PolarHBondContact O-N 2.94Å; S131-L134 PolarHBondContact O-N 3.48Å; K132-L134 VanDerWaalsContact C-N 3.27Å; K132-L134 PolarHBondContact O-N 3.19Å; L134-L137 PolarHBondContact O-N 3.34Å; L134-L137 VanDerWaalsContact O-N 3.13Å; L134-L138 WeakPolarHBondContact O-CG 3.16Å; L134-L138 PolarHBondContact O-N 3.46Å; L134-L188 HydrophobicContact CD2-CD2 3.89Å; L134-L188 HydrophobicContact CG-CD2 4.06Å; L134-C191 HydrophobicContact CD2-CB 3.91Å; L134-F192 HydrophobicContact CB-CE2 4.01Å; L134-F192 HydrophobicContact CB-CZ 3.99Å; L134-F192 HydrophobicContact CD2-CE2 3.72Å; L134-F192 HydrophobicContact CD2-CZ 3.99Å
135G89.7Confident88.2Confident10 Ų1059.8 Ų59.810%0.10333%0.33CS..Hα-helixtrans-57.7-48.2173.300000112.5S131 K132 L137 L138 L139S131-G135 PolarHBondContact O-N 2.81Å; K132-G135 PolarHBondContact O-N 2.84Å; K132-G135 VanDerWaalsContact O-N 3.16Å; G135-L137 VanDerWaalsContact C-N 3.31Å; G135-L137 PolarHBondContact O-N 2.89Å; G135-L138 PolarHBondContact O-N 3.47Å; G135-L139 PolarHBondContact O-N 3Å; G135-L139 VanDerWaalsContact O-N 3.17Å
136C89.9Confident88.5Confident48 Ų4859 Ų5932%0.32432%0.322SS..Hα-helixtrans-59.2-40.2172.5-62.90000112.2I124 K132 L139 S140I124-C136 HydrophobicContact CD1-CB 4.05Å; I124-C136 HydrophobicContact CG1-CB 4.08Å; I124-C136 HydrophobicContact CG2-CB 3.89Å; K132-C136 PolarHBondContact O-N 2.89Å; K132-C136 PolarHBondContact O-SG 3.48Å; C136-L139 PolarHBondContact O-N 3.15Å; C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 2.88Å; C136-S140 VanDerWaalsContact O-OG 3.12Å
137L91.8Very high88.7Confident53 Ų5360.3 Ų60.328%0.27732%0.321SS..Hα-helixtrans-66.9-37.1179.6-176.360.8000112.7L120 I124 R133 L134 G135 S141L120-L137 HydrophobicContact CB-CD1 4.16Å; I124-L137 VanDerWaalsContact CD1-CA 3.48Å; I124-L137 HydrophobicContact CD1-CB 3.65Å; I124-L137 HydrophobicContact CD1-CD1 3.94Å; I124-L137 HydrophobicContact CD1-CG 4.4Å; R133-L137 VanDerWaalsContact O-CB 3.29Å; R133-L137 WeakPolarHBondContact O-CB 3.23Å; R133-L137 PolarHBondContact O-N 3.49Å; L134-L137 PolarHBondContact O-N 3.34Å; L134-L137 VanDerWaalsContact O-N 3.13Å; G135-L137 VanDerWaalsContact C-N 3.31Å; G135-L137 PolarHBondContact O-N 2.89Å; L137-S141 WeakPolarHBondContact O-CB 3.32Å; L137-S141 PolarHBondContact O-N 2.88Å; L137-S141 PolarHBondContact O-OG 2.93Å
138L91.4Very high88.9Confident79 Ų7958 Ų5841%0.41430%0.304SS..Hα-helixtrans-61.8-47.4172.8-69.2169.3000110.7L134 G135 S141 F142 L188L134-L138 WeakPolarHBondContact O-CG 3.16Å; L134-L138 PolarHBondContact O-N 3.46Å; G135-L138 PolarHBondContact O-N 3.47Å; L138-S141 PolarHBondContact O-N 3.48Å; L138-F142 PolarHBondContact O-N 3.16Å; L138-L188 HydrophobicContact CD1-CD2 4.1Å
139L90.6Very high89Confident31 Ų3158.4 Ų58.416%0.16231%0.306CS..Hα-helixtrans-63.6-47.2178.3-174.562.2000112.3G135 C136 S141 F142 Q143 S172 L175 K176G135-L139 PolarHBondContact O-N 3Å; G135-L139 VanDerWaalsContact O-N 3.17Å; C136-L139 PolarHBondContact O-N 3.15Å; L139-S141 VanDerWaalsContact C-N 3.33Å; L139-S141 PolarHBondContact O-N 2.99Å; L139-F142 PolarHBondContact O-N 3.4Å; L139-Q143 WeakPolarHBondContact O-CG 3.41Å; L139-Q143 PolarHBondContact O-N 2.9Å; L139-S172 WeakPolarHBondContact CD1-O 3.43Å; L139-S172 WeakPolarHBondContact CD1-OG 3.35Å; L139-L175 HydrophobicContact CD1-CD2 4.31Å; L139-L175 HydrophobicContact CD1-CG 4.46Å; L139-K176 HydrophobicContact CD1-CB 4.17Å; L139-K176 HydrophobicContact CD2-CB 4.03Å; L139-K176 HydrophobicContact CD2-CD 4.27Å; L139-K176 HydrophobicContact CD2-CG 4.2Å
140S90.4Very high89Confident29 Ų2957.1 Ų57.120%0.20329%0.291CS..Hα-helixtrans-64-36.2176.3-620000112.4C136 F144C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 2.88Å; C136-S140 VanDerWaalsContact O-OG 3.12Å; S140-F144 VanDerWaalsContact O-CB 3.27Å; S140-F144 WeakPolarHBondContact O-CB 3.3Å; S140-F144 PolarHBondContact O-N 2.77Å
141S90.7Very high88.9Confident48 Ų4855.6 Ų55.634%0.33629%0.29SS..Hα-helixtrans-67.9-39.6175.2-60.20000112L137 L138 L139 F144 S145L137-S141 WeakPolarHBondContact O-CB 3.32Å; L137-S141 PolarHBondContact O-N 2.88Å; L137-S141 PolarHBondContact O-OG 2.93Å; L138-S141 PolarHBondContact O-N 3.48Å; L139-S141 VanDerWaalsContact C-N 3.33Å; L139-S141 PolarHBondContact O-N 2.99Å; S141-F144 PolarHBondContact O-N 2.88Å; S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.95Å
142F90.8Very high88.9Confident53 Ų5362.7 Ų62.723%0.23232%0.32CS..Hα-helixtrans-61.1-52.6173.1179.7-107.3000110.8L138 L139 F144 S145 I146 L171 L175L138-F142 PolarHBondContact O-N 3.16Å; L139-F142 PolarHBondContact O-N 3.4Å; F142-F144 VanDerWaalsContact C-N 3.33Å; F142-F144 PolarHBondContact O-N 3.49Å; F142-S145 PolarHBondContact O-N 2.76Å; F142-S145 PolarHBondContact O-OG 2.92Å; F142-I146 HydrophobicContact CD1-CG1 4.47Å; F142-I146 HydrophobicContact CE1-CG1 4.12Å; F142-I146 HydrophobicContact CE2-CD1 4.36Å; F142-I146 HydrophobicContact CE2-CG1 4.41Å; F142-I146 HydrophobicContact CZ-CD1 4.12Å; F142-I146 HydrophobicContact CZ-CG1 4.1Å; F142-I146 WeakPolarHBondContact O-CG1 3.39Å; F142-I146 PolarHBondContact O-N 3.28Å; F142-L171 HydrophobicContact CE1-CB 4.24Å; F142-L171 HydrophobicContact CZ-CB 3.9Å; F142-L175 HydrophobicContact CB-CD2 3.4Å; F142-L175 VanDerWaalsContact CB-CD2 3.4Å; F142-L175 HydrophobicContact CD1-CD2 3.8Å; F142-L175 HydrophobicContact CD2-CD2 4.11Å; F142-L175 HydrophobicContact CG-CD2 3.5Å
143Q90.6Very high88.5Confident79 Ų7960.7 Ų60.737%0.36931%0.313SS..Hα-helixtrans-59.5-40.6178.5-69.5178.1-2.200112.6L139 I146 Q147 S172L139-Q143 WeakPolarHBondContact O-CG 3.41Å; L139-Q143 PolarHBondContact O-N 2.9Å; Q143-I146 PolarHBondContact O-N 3.08Å; Q143-Q147 WeakPolarHBondContact O-CG 3.2Å; Q143-Q147 PolarHBondContact O-N 2.83Å; Q143-S172 PolarHBondContact NE2-OG 3.32Å
144F90Very high87.8Confident40 Ų4064.8 Ų64.818%0.17533%0.329CS..Hα-helixtrans-62.3-40.5173-179.2-99.1000112.4G116 I117 L120 S140 S141 F142 Q147 K148G116-F144 WeakPolarHBondContact O-CE2 3.49Å; I117-F144 HydrophobicContact CD1-CE1 4.43Å; I117-F144 HydrophobicContact CG1-CE1 4.15Å; L120-F144 HydrophobicContact CD1-CB 3.8Å; L120-F144 HydrophobicContact CD1-CD1 4.01Å; L120-F144 HydrophobicContact CD1-CD2 4.24Å; L120-F144 HydrophobicContact CD1-CG 3.78Å; L120-F144 HydrophobicContact CD2-CB 3.92Å; L120-F144 HydrophobicContact CD2-CD2 3.97Å; L120-F144 HydrophobicContact CD2-CG 4.13Å; L120-F144 HydrophobicContact CG-CB 4.5Å; L120-F144 HydrophobicContact CG-CD2 4.45Å; L120-F144 HydrophobicContact CG-CG 4.44Å; S140-F144 VanDerWaalsContact O-CB 3.27Å; S140-F144 WeakPolarHBondContact O-CB 3.3Å; S140-F144 PolarHBondContact O-N 2.77Å; S141-F144 PolarHBondContact O-N 2.88Å; F142-F144 VanDerWaalsContact C-N 3.33Å; F142-F144 PolarHBondContact O-N 3.49Å; F144-Q147 PolarHBondContact O-N 3.45Å; F144-K148 HydrophobicContact CD1-CG 4.17Å; F144-K148 HydrophobicContact CE1-CG 3.9Å; F144-K148 HydrophobicContact CE2-CG 4.48Å; F144-K148 HydrophobicContact CZ-CD 4.39Å; F144-K148 VanDerWaalsContact CZ-CE 3.4Å; F144-K148 HydrophobicContact CZ-CG 4.08Å; F144-K148 WeakPolarHBondContact O-CB 3.03Å; F144-K148 WeakPolarHBondContact O-CG 3.49Å; F144-K148 PolarHBondContact O-N 3.25Å
145S89.5Confident86.9Confident58 Ų5869.9 Ų69.941%0.40636%0.356SS..Hα-helixtrans-66.3-3917774.30000112.4S141 F142 K148 L149S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.95Å; F142-S145 PolarHBondContact O-N 2.76Å; F142-S145 PolarHBondContact O-OG 2.92Å; S145-K148 PolarHBondContact O-N 2.99Å; S145-L149 VanDerWaalsContact O-CB 3.3Å; S145-L149 WeakPolarHBondContact O-CB 3.43Å; S145-L149 PolarHBondContact O-N 3.46Å
146I89.2Confident86.3Confident33 Ų3371.9 Ų71.917%0.16937%0.366CS..Hα-helixtrans-61.1-46.8171.4-65.5-61.5000111F142 Q143 K148 L149 E150 F164 A168F142-I146 HydrophobicContact CD1-CG1 4.47Å; F142-I146 HydrophobicContact CE1-CG1 4.12Å; F142-I146 HydrophobicContact CE2-CD1 4.36Å; F142-I146 HydrophobicContact CE2-CG1 4.41Å; F142-I146 HydrophobicContact CZ-CD1 4.12Å; F142-I146 HydrophobicContact CZ-CG1 4.1Å; F142-I146 WeakPolarHBondContact O-CG1 3.39Å; F142-I146 PolarHBondContact O-N 3.28Å; Q143-I146 PolarHBondContact O-N 3.08Å; I146-K148 VanDerWaalsContact C-N 3.3Å; I146-K148 PolarHBondContact O-N 3.47Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.15Å; I146-E150 PolarHBondContact O-N 2.92Å; I146-F164 HydrophobicContact CD1-CZ 4.15Å; I146-F164 HydrophobicContact CG2-CE1 4Å; I146-F164 HydrophobicContact CG2-CZ 4.06Å; I146-A168 HydrophobicContact CD1-CB 4.09Å; I146-A168 HydrophobicContact CG1-CB 4.22Å; I146-A168 HydrophobicContact CG2-CB 3.79Å
147Q87.5Confident85Confident135 Ų13580 Ų8063%0.63140%0.397SS*.Hα-helixtrans-64.6-32.1177.5-72.1175.513.600113.1Q143 F144 P151Q143-Q147 WeakPolarHBondContact O-CG 3.2Å; Q143-Q147 PolarHBondContact O-N 2.83Å; F144-Q147 PolarHBondContact O-N 3.45Å; Q147-P151 WeakPolarHBondContact O-CD 3.3Å
148K88.3Confident84Confident95 Ų9581.3 Ų81.341%0.41342%0.423SS..Hα-helixtrans-75.7-27.9172.9-74.1-66.1-166.7175.40113H114 F144 S145 I146 F152H114-K148 PolarHBondContact NE2-NZ 2.92Å; F144-K148 HydrophobicContact CD1-CG 4.17Å; F144-K148 HydrophobicContact CE1-CG 3.9Å; F144-K148 HydrophobicContact CE2-CG 4.48Å; F144-K148 HydrophobicContact CZ-CD 4.39Å; F144-K148 VanDerWaalsContact CZ-CE 3.4Å; F144-K148 HydrophobicContact CZ-CG 4.08Å; F144-K148 WeakPolarHBondContact O-CB 3.03Å; F144-K148 WeakPolarHBondContact O-CG 3.49Å; F144-K148 PolarHBondContact O-N 3.25Å; S145-K148 PolarHBondContact O-N 2.99Å; I146-K148 VanDerWaalsContact C-N 3.3Å; I146-K148 PolarHBondContact O-N 3.47Å; K148-F152 VanDerWaalsContact O-CD2 3.24Å; K148-F152 WeakPolarHBondContact O-CD2 3.41Å; K148-F152 VanDerWaalsContact O-CE2 3.24Å; K148-F152 WeakPolarHBondContact O-CE2 3.32Å
149L86.1Confident83.3Confident78 Ų7884.4 Ų84.441%0.40843%0.433SS..Hα-helixtrans-83.1-37.2179.1-177.460.4000112.9S145 I146 P151 F152 L153 F164S145-L149 VanDerWaalsContact O-CB 3.3Å; S145-L149 WeakPolarHBondContact O-CB 3.43Å; S145-L149 PolarHBondContact O-N 3.46Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.15Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; L149-F152 PolarHBondContact O-N 3Å; L149-L153 HydrophobicContact CD1-CD1 4.42Å; L149-L153 HydrophobicContact CD1-CD2 4.45Å; L149-L153 HydrophobicContact CD1-CG 4.25Å; L149-L153 HydrophobicContact CD2-CD1 4.13Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 PolarHBondContact O-N 3.37Å; L149-F164 HydrophobicContact CD2-CE2 4.37Å; L149-F164 HydrophobicContact CD2-CZ 4.32Å
150E85.7Confident82.8Confident23 Ų2386 Ų8611%0.10745%0.447CS..G310 helixtrans-49.3-44.2-175.5-166.6-165.2103.800114.1I146 F152 L153 R154 L161 F164 R165I146-E150 PolarHBondContact O-N 2.92Å; E150-F152 VanDerWaalsContact C-N 3.32Å; E150-F152 PolarHBondContact O-N 3.35Å; E150-L153 PolarHBondContact O-N 3.49Å; E150-R154 IonicContact OE1-CZ 3.27Å; E150-R154 IonicContact OE1-NE 3.29Å; E150-R154 IonicContact OE1-NH2 3.66Å; E150-R154 PolarHBondContact OE1-NH2 3.33Å; E150-L161 HydrophobicContact CG-CD1 3.94Å; E150-L161 HydrophobicContact CG-CG 4.48Å; E150-F164 HydrophobicContact CB-CE1 4.14Å; E150-F164 HydrophobicContact CG-CD1 4.45Å; E150-F164 HydrophobicContact CG-CE1 4.22Å; E150-R165 VanDerWaalsContact CD-NH2 3.25Å; E150-R165 IonicContact OE1-CZ 2.71Å; E150-R165 IonicContact OE1-NE 2.66Å; E150-R165 IonicContact OE1-NH2 3.16Å; E150-R165 PolarHBondContact OE1-NH2 3.44Å; E150-R165 IonicContact OE2-CZ 3.96Å; E150-R165 IonicContact OE2-NE 3.66Å; E150-R165 PolarHBondContact OE2-NE 3.36Å; E150-R165 IonicContact OE2-NH2 2.74Å; E150-R165 PolarHBondContact OE2-NH2 2.89Å
151P84.3Confident82.4Confident67 Ų6787.9 Ų87.944%0.43545%0.454SS..G310 helixtrans-60.8-38.1-179.6-24.135.6000113.5Q147 L149 L153 R154Q147-P151 WeakPolarHBondContact O-CD 3.3Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; P151-L153 VanDerWaalsContact C-N 3.27Å; P151-L153 PolarHBondContact O-N 2.93Å; P151-R154 PolarHBondContact O-N 3.4Å
152F82.8Confident82.1Confident157 Ų15793.4 Ų93.469%0.68948%0.475SS*.G310 helixtrans-74.5-16.7-177.9-59.8-72.8000113.4K148 L149 E150K148-F152 VanDerWaalsContact O-CD2 3.24Å; K148-F152 WeakPolarHBondContact O-CD2 3.41Å; K148-F152 VanDerWaalsContact O-CE2 3.24Å; K148-F152 WeakPolarHBondContact O-CE2 3.32Å; L149-F152 PolarHBondContact O-N 3Å; E150-F152 VanDerWaalsContact C-N 3.32Å; E150-F152 PolarHBondContact O-N 3.35Å
153L79.3Confident81.8Confident45 Ų4594 Ų9424%0.23649%0.485CS..G310 helixtrans-92.1-2.9178.3-61.7-178.6000113.3L149 E150 P151 T156 F164L149-L153 HydrophobicContact CD1-CD1 4.42Å; L149-L153 HydrophobicContact CD1-CD2 4.45Å; L149-L153 HydrophobicContact CD1-CG 4.25Å; L149-L153 HydrophobicContact CD2-CD1 4.13Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 PolarHBondContact O-N 3.37Å; E150-L153 PolarHBondContact O-N 3.49Å; P151-L153 VanDerWaalsContact C-N 3.27Å; P151-L153 PolarHBondContact O-N 2.93Å; L153-T156 PolarHBondContact O-OG1 3.05Å; L153-F164 HydrophobicContact CD1-CD2 3.83Å; L153-F164 HydrophobicContact CD1-CE1 4.42Å; L153-F164 HydrophobicContact CD1-CE2 3.55Å; L153-F164 HydrophobicContact CD1-CG 4.38Å; L153-F164 HydrophobicContact CD1-CZ 3.88Å
154R74.4Confident81.7Confident156 Ų15692.2 Ų92.259%0.58948%0.476SS*.THydrogen-bonded Turntrans-72.4-28.5-177.3-69.1178.6179.1-1660.5113.6E150 P151 L161E150-R154 IonicContact OE1-CZ 3.27Å; E150-R154 IonicContact OE1-NE 3.29Å; E150-R154 IonicContact OE1-NH2 3.66Å; E150-R154 PolarHBondContact OE1-NH2 3.33Å; P151-R154 PolarHBondContact O-N 3.4Å; R154-L161 HydrophobicContact CG-CD1 4.02Å
155D71.8Confident81.6Confident151 Ų15196.2 Ų96.281%0.80749%0.49SS*.THydrogen-bonded Turntrans-93.11.5-176.4-55.7-41.6000113.1K157D155-K157 PolarHBondContact O-N 3.49Å
156T76.5Confident81.6Confident51 Ų5196.4 Ų96.431%0.31350%0.495SS..  trans-88.1111.4-172.8590000112.5L153 G158 F159L153-T156 PolarHBondContact O-OG1 3.05Å; T156-G158 PolarHBondContact O-N 3.12Å; T156-F159 PolarHBondContact O-N 3.49Å; T156-F159 WeakPolarHBondContact OG1-CD2 3.37Å; T156-F159 WeakPolarHBondContact OG1-CG 3.34Å
157K63.1Low81.7Confident220 Ų220101.7 Ų101.796%0.95752%0.517SS*.THydrogen-bonded Turntrans-65.399-175.6-166.9175-173.9177.10112D155D155-K157 PolarHBondContact O-N 3.49Å
158G71.2Confident81.8Confident80 Ų8095.9 Ų95.983%0.82549%0.492SS*.THydrogen-bonded Turntrans130.7-11.1178.500000114.6T156T156-G158 PolarHBondContact O-N 3.12Å
159F75.9Confident82Confident144 Ų14495 Ų9563%0.63250%0.498SS*.  trans-90.5135176.4-72.6-100.5000111.2T156T156-F159 PolarHBondContact O-N 3.49Å; T156-F159 WeakPolarHBondContact OG1-CD2 3.37Å; T156-F159 WeakPolarHBondContact OG1-CG 3.34Å
160S80.8Confident82.3Confident64 Ų6494.4 Ų94.445%0.44850%0.5SS..  trans-102.4118.1168.161.20000110.1E162 S163 F164S160-E162 PolarHBondContact O-N 2.94Å; S160-E162 VanDerWaalsContact O-N 3.17Å; S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.95Å; S160-S163 WeakPolarHBondContact OG-CB 3.26Å; S160-S163 PolarHBondContact OG-OG 2.9Å; S160-F164 PolarHBondContact O-N 2.78Å; S160-F164 VanDerWaalsContact O-N 3.08Å
161L82.1Confident82.7Confident68 Ų6897.5 Ų97.536%0.35652%0.517SS..Hα-helixtrans-59.5-28.6-177.4179.7145.8000112.7E150 R154 R165E150-L161 HydrophobicContact CG-CD1 3.94Å; E150-L161 HydrophobicContact CG-CG 4.48Å; R154-L161 HydrophobicContact CG-CD1 4.02Å; L161-R165 HydrophobicContact CD2-CG 4.38Å; L161-R165 WeakPolarHBondContact O-CB 3.24Å; L161-R165 WeakPolarHBondContact O-CG 3.4Å; L161-R165 PolarHBondContact O-N 3.33Å
162E84.3Confident83.1Confident165 Ų16594.8 Ų94.877%0.77150%0.5SS*.Hα-helixtrans-64.4-46.6172.8-175.1174.2-161.100112.6S160 R165 A166S160-E162 PolarHBondContact O-N 2.94Å; S160-E162 VanDerWaalsContact O-N 3.17Å; E162-R165 PolarHBondContact O-N 2.87Å; E162-A166 WeakPolarHBondContact O-CB 3.35Å; E162-A166 PolarHBondContact O-N 3.1Å
163S85.5Confident83.6Confident64 Ų6491.3 Ų91.345%0.44849%0.486SS..Hα-helixtrans-69.7-34.9177.472.40000112.1S160 A166 K167S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.95Å; S160-S163 WeakPolarHBondContact OG-CB 3.26Å; S160-S163 PolarHBondContact OG-OG 2.9Å; S163-A166 PolarHBondContact O-N 3.04Å; S163-K167 WeakPolarHBondContact O-CB 3.35Å; S163-K167 WeakPolarHBondContact O-CG 3.48Å; S163-K167 PolarHBondContact O-N 2.94Å
164F87.9Confident84.3Confident42 Ų4295 Ų9518%0.18450%0.502CS..Hα-helixtrans-59.9-48.8171.4174.6-102.4000111.3I146 L149 E150 L153 S160 K167 A168I146-F164 HydrophobicContact CD1-CZ 4.15Å; I146-F164 HydrophobicContact CG2-CE1 4Å; I146-F164 HydrophobicContact CG2-CZ 4.06Å; L149-F164 HydrophobicContact CD2-CE2 4.37Å; L149-F164 HydrophobicContact CD2-CZ 4.32Å; E150-F164 HydrophobicContact CB-CE1 4.14Å; E150-F164 HydrophobicContact CG-CD1 4.45Å; E150-F164 HydrophobicContact CG-CE1 4.22Å; L153-F164 HydrophobicContact CD1-CD2 3.83Å; L153-F164 HydrophobicContact CD1-CE1 4.42Å; L153-F164 HydrophobicContact CD1-CE2 3.55Å; L153-F164 HydrophobicContact CD1-CG 4.38Å; L153-F164 HydrophobicContact CD1-CZ 3.88Å; S160-F164 PolarHBondContact O-N 2.78Å; S160-F164 VanDerWaalsContact O-N 3.08Å; F164-K167 PolarHBondContact O-N 3.13Å; F164-A168 WeakPolarHBondContact O-CB 3.39Å; F164-A168 PolarHBondContact O-N 3.21Å
165R87.4Confident85.1Confident124 Ų12489.8 Ų89.847%0.46849%0.485SS..Hα-helixtrans-63.3-44.3176.4-77-176.7174.8179.81.9112.3E150 L161 E162 K167 A168 S169E150-R165 VanDerWaalsContact CD-NH2 3.25Å; E150-R165 IonicContact OE1-CZ 2.71Å; E150-R165 IonicContact OE1-NE 2.66Å; E150-R165 IonicContact OE1-NH2 3.16Å; E150-R165 PolarHBondContact OE1-NH2 3.44Å; E150-R165 IonicContact OE2-CZ 3.96Å; E150-R165 IonicContact OE2-NE 3.66Å; E150-R165 PolarHBondContact OE2-NE 3.36Å; E150-R165 IonicContact OE2-NH2 2.74Å; E150-R165 PolarHBondContact OE2-NH2 2.89Å; L161-R165 HydrophobicContact CD2-CG 4.38Å; L161-R165 WeakPolarHBondContact O-CB 3.24Å; L161-R165 WeakPolarHBondContact O-CG 3.4Å; L161-R165 PolarHBondContact O-N 3.33Å; E162-R165 PolarHBondContact O-N 2.87Å; R165-K167 VanDerWaalsContact C-N 3.31Å; R165-K167 PolarHBondContact O-N 2.98Å; R165-A168 PolarHBondContact O-N 3.3Å; R165-S169 WeakPolarHBondContact O-CB 3.41Å; R165-S169 PolarHBondContact O-N 2.94Å; R165-S169 PolarHBondContact O-OG 3.11Å
166A90Very high86.2Confident63 Ų6386 Ų8652%0.52146%0.462SS..Hα-helixtrans-58.6-42176.300000112.1E162 S163 S170E162-A166 WeakPolarHBondContact O-CB 3.35Å; E162-A166 PolarHBondContact O-N 3.1Å; S163-A166 PolarHBondContact O-N 3.04Å; A166-S170 WeakPolarHBondContact O-CB 3.37Å; A166-S170 PolarHBondContact O-N 2.97Å
167K90.3Very high86.9Confident144 Ų14489.5 Ų89.563%0.62647%0.474SS*.Hα-helixtrans-70-40.1174.9-72.5-65.2-176.3-176.90112.9S163 F164 R165 S170 L171S163-K167 WeakPolarHBondContact O-CB 3.35Å; S163-K167 WeakPolarHBondContact O-CG 3.48Å; S163-K167 PolarHBondContact O-N 2.94Å; F164-K167 PolarHBondContact O-N 3.13Å; R165-K167 VanDerWaalsContact C-N 3.31Å; R165-K167 PolarHBondContact O-N 2.98Å; K167-S170 PolarHBondContact O-N 3.39Å; K167-L171 WeakPolarHBondContact O-CB 3.43Å; K167-L171 WeakPolarHBondContact O-CG 3.5Å; K167-L171 PolarHBondContact O-N 3.49Å
168A90.9Very high88.2Confident12 Ų1285.2 Ų85.210%0.09946%0.456CS..Hα-helixtrans-65-39.7176.500000112.4I146 F164 R165 S172I146-A168 HydrophobicContact CD1-CB 4.09Å; I146-A168 HydrophobicContact CG1-CB 4.22Å; I146-A168 HydrophobicContact CG2-CB 3.79Å; F164-A168 WeakPolarHBondContact O-CB 3.39Å; F164-A168 PolarHBondContact O-N 3.21Å; R165-A168 PolarHBondContact O-N 3.3Å; A168-S172 VanDerWaalsContact O-CB 3.24Å; A168-S172 WeakPolarHBondContact O-CB 3.44Å; A168-S172 PolarHBondContact O-N 3.09Å
169S90.8Very high89.2Confident77 Ų7781.8 Ų81.854%0.53842%0.419SS..Hα-helixtrans-66.1-43.8172.7-670000112.1R165 L171 S172 E173R165-S169 WeakPolarHBondContact O-CB 3.41Å; R165-S169 PolarHBondContact O-N 2.94Å; R165-S169 PolarHBondContact O-OG 3.11Å; S169-L171 PolarHBondContact O-N 2.9Å; S169-S172 WeakPolarHBondContact O-CB 3.46Å; S169-S172 PolarHBondContact O-N 3.14Å; S169-E173 PolarHBondContact O-N 3.39Å; S169-E173 VanDerWaalsContact O-N 3.07Å
170S93.6Very high89.9Confident66 Ų6678.7 Ų78.746%0.46241%0.409SS..Hα-helixtrans-57.2-48.7174.7-171.50000111.8A166 K167 S172 E173 E174A166-S170 WeakPolarHBondContact O-CB 3.37Å; A166-S170 PolarHBondContact O-N 2.97Å; K167-S170 PolarHBondContact O-N 3.39Å; S170-S172 VanDerWaalsContact C-N 3.32Å; S170-S172 PolarHBondContact O-N 3.16Å; S170-E173 PolarHBondContact O-N 3Å; S170-E174 WeakPolarHBondContact O-CB 3.42Å; S170-E174 PolarHBondContact O-N 3.35Å
171L93.1Very high90.4Very high88 Ų8877 Ų7746%0.46140%0.403SS..Hα-helixtrans-70-27178-69.9169000112.7F142 K167 S169 L175F142-L171 HydrophobicContact CE1-CB 4.24Å; F142-L171 HydrophobicContact CZ-CB 3.9Å; K167-L171 WeakPolarHBondContact O-CB 3.43Å; K167-L171 WeakPolarHBondContact O-CG 3.5Å; K167-L171 PolarHBondContact O-N 3.49Å; S169-L171 PolarHBondContact O-N 2.9Å; L171-L175 WeakPolarHBondContact O-CB 3.24Å; L171-L175 PolarHBondContact O-N 3.35Å
172S92.6Very high90.7Very high9 Ų975.6 Ų75.66%0.06340%0.395CS..Hα-helixtrans-69.8-40.2175-177.20000112L139 Q143 A168 S169 S170 K176L139-S172 WeakPolarHBondContact CD1-O 3.43Å; L139-S172 WeakPolarHBondContact CD1-OG 3.35Å; Q143-S172 PolarHBondContact NE2-OG 3.32Å; A168-S172 VanDerWaalsContact O-CB 3.24Å; A168-S172 WeakPolarHBondContact O-CB 3.44Å; A168-S172 PolarHBondContact O-N 3.09Å; S169-S172 WeakPolarHBondContact O-CB 3.46Å; S169-S172 PolarHBondContact O-N 3.14Å; S170-S172 VanDerWaalsContact C-N 3.32Å; S170-S172 PolarHBondContact O-N 3.16Å; S172-K176 VanDerWaalsContact O-CB 3.28Å; S172-K176 WeakPolarHBondContact O-CB 3.49Å; S172-K176 PolarHBondContact O-N 3.06Å
173E93.2Very high90.9Very high85 Ų8570.9 Ų70.940%0.39737%0.373SS..Hα-helixtrans-75.8-34.2175.8-66.4-60.6112.800111.7S169 S170 K176 H177S169-E173 PolarHBondContact O-N 3.39Å; S169-E173 VanDerWaalsContact O-N 3.07Å; S170-E173 PolarHBondContact O-N 3Å; E173-K176 WeakPolarHBondContact O-CB 3.5Å; E173-K176 PolarHBondContact O-N 2.96Å; E173-K176 IonicContact OE1-NZ 2.97Å; E173-K176 IonicContact OE2-NZ 3.55Å; E173-K176 PolarHBondContact OE2-NZ 3.18Å; E173-H177 PolarHBondContact O-CD2 3.34Å; E173-H177 VanDerWaalsContact O-CD2 3.25Å; E173-H177 PolarHBondContact O-N 3.01Å
174E94.6Very high91Very high122 Ų12273.9 Ų73.957%0.5739%0.389SS*.Hα-helixtrans-63.3-45.6171.1-171.6173.4-17300111.7S170 K176 H177 F178S170-E174 WeakPolarHBondContact O-CB 3.42Å; S170-E174 PolarHBondContact O-N 3.35Å; E174-K176 VanDerWaalsContact C-N 3.31Å; E174-K176 PolarHBondContact O-N 2.88Å; E174-H177 PolarHBondContact O-N 3.22Å; E174-F178 WeakPolarHBondContact O-CB 3.47Å; E174-F178 PolarHBondContact O-N 2.98Å
175L92.4Very high91Very high47 Ų4775.8 Ų75.825%0.24640%0.401CS..Hα-helixtrans-62.6-36174.317762.4000112.4L139 F142 L171 F178 A179L139-L175 HydrophobicContact CD1-CD2 4.31Å; L139-L175 HydrophobicContact CD1-CG 4.46Å; F142-L175 HydrophobicContact CB-CD2 3.4Å; F142-L175 VanDerWaalsContact CB-CD2 3.4Å; F142-L175 HydrophobicContact CD1-CD2 3.8Å; F142-L175 HydrophobicContact CD2-CD2 4.11Å; F142-L175 HydrophobicContact CG-CD2 3.5Å; L171-L175 WeakPolarHBondContact O-CB 3.24Å; L171-L175 PolarHBondContact O-N 3.35Å; L175-F178 PolarHBondContact O-N 3.22Å; L175-A179 WeakPolarHBondContact O-CB 3.42Å; L175-A179 PolarHBondContact O-N 2.98Å
176K93Very high90.8Very high72 Ų7270.9 Ų70.931%0.31339%0.389SS..Hα-helixtrans-65.8-51175.7171.4-179.5152.5-157.60111.1L139 S172 E173 E174 F178 A179 D180L139-K176 HydrophobicContact CD1-CB 4.17Å; L139-K176 HydrophobicContact CD2-CB 4.03Å; L139-K176 HydrophobicContact CD2-CD 4.27Å; L139-K176 HydrophobicContact CD2-CG 4.2Å; S172-K176 VanDerWaalsContact O-CB 3.28Å; S172-K176 WeakPolarHBondContact O-CB 3.49Å; S172-K176 PolarHBondContact O-N 3.06Å; E173-K176 WeakPolarHBondContact O-CB 3.5Å; E173-K176 PolarHBondContact O-N 2.96Å; E173-K176 IonicContact OE1-NZ 2.97Å; E173-K176 IonicContact OE2-NZ 3.55Å; E173-K176 PolarHBondContact OE2-NZ 3.18Å; E174-K176 VanDerWaalsContact C-N 3.31Å; E174-K176 PolarHBondContact O-N 2.88Å; K176-F178 PolarHBondContact O-N 3.4Å; K176-A179 PolarHBondContact O-N 3.36Å; K176-D180 VanDerWaalsContact O-CG 3.23Å; K176-D180 PolarHBondContact O-N 3.31Å
177H92.3Very high90.6Very high124 Ų12470.5 Ų70.557%0.57438%0.38SS*.Hα-helixtrans-60.4-34.2173.8-71-44.3000112.9E173 E174 D180 G181E173-H177 PolarHBondContact O-CD2 3.34Å; E173-H177 VanDerWaalsContact O-CD2 3.25Å; E173-H177 PolarHBondContact O-N 3.01Å; E174-H177 PolarHBondContact O-N 3.22Å; H177-D180 IonicContact ND1-OD2 3.91Å; H177-G181 PolarHBondContact O-N 2.98Å
178F91Very high90.3Very high129 Ų12964.1 Ų64.157%0.56635%0.353SS*.Hα-helixtrans-68.8-39173.1-174-113.4000112.3E174 L175 K176 G181 L182E174-F178 WeakPolarHBondContact O-CB 3.47Å; E174-F178 PolarHBondContact O-N 2.98Å; L175-F178 PolarHBondContact O-N 3.22Å; K176-F178 PolarHBondContact O-N 3.4Å; F178-G181 PolarHBondContact O-N 3.18Å; F178-L182 HydrophobicContact CD1-CD1 3.84Å; F178-L182 HydrophobicContact CD1-CG 4.37Å; F178-L182 HydrophobicContact CE1-CD1 3.47Å; F178-L182 VanDerWaalsContact CE1-CD1 3.47Å; F178-L182 HydrophobicContact CE1-CG 4.1Å; F178-L182 HydrophobicContact CE2-CG 4.5Å; F178-L182 HydrophobicContact CZ-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD2 4.22Å; F178-L182 HydrophobicContact CZ-CG 4.16Å; F178-L182 WeakPolarHBondContact O-CG 3.44Å; F178-L182 PolarHBondContact O-N 2.99Å
179A90.9Very high90.1Very high8 Ų867.6 Ų67.67%0.06637%0.367CS..Hα-helixtrans-67.5-40.217500000112.4L175 K176 G181 L182 E183L175-A179 WeakPolarHBondContact O-CB 3.42Å; L175-A179 PolarHBondContact O-N 2.98Å; K176-A179 PolarHBondContact O-N 3.36Å; A179-G181 VanDerWaalsContact C-N 3.29Å; A179-G181 PolarHBondContact O-N 3.48Å; A179-L182 PolarHBondContact O-N 3.05Å; A179-E183 PolarHBondContact O-N 3.24Å
180D90.6Very high89.8Confident79 Ų7969.3 Ų69.342%0.42237%0.365SS..Hα-helixtrans-59.3-43.4170.8-59.7-30.8000110.1K176 H177 E183 T184K176-D180 VanDerWaalsContact O-CG 3.23Å; K176-D180 PolarHBondContact O-N 3.31Å; H177-D180 IonicContact ND1-OD2 3.91Å; D180-E183 WeakPolarHBondContact O-CB 3.46Å; D180-E183 PolarHBondContact O-N 2.81Å; D180-T184 PolarHBondContact O-N 3.03Å; D180-T184 VanDerWaalsContact O-N 3.12Å; D180-T184 PolarHBondContact O-OG1 3.14Å
181G91.6Very high89.2Confident30 Ų3070.2 Ų70.231%0.30937%0.371SS..Hα-helixtrans-56.5-50.7172.100000113.3H177 F178 A179 E183 T184 D185H177-G181 PolarHBondContact O-N 2.98Å; F178-G181 PolarHBondContact O-N 3.18Å; A179-G181 VanDerWaalsContact C-N 3.29Å; A179-G181 PolarHBondContact O-N 3.48Å; G181-E183 PolarHBondContact O-N 3.29Å; G181-T184 PolarHBondContact O-N 3.14Å; G181-T184 PolarHBondContact O-OG1 2.6Å; G181-D185 PolarHBondContact O-N 2.89Å
182L88.4Confident88.4Confident37 Ų3770 Ų7019%0.19437%0.366CS..Hα-helixtrans-68.4-13177.8-68.8176.6000114.3F178 A179 D185 T187 L188F178-L182 HydrophobicContact CD1-CD1 3.84Å; F178-L182 HydrophobicContact CD1-CG 4.37Å; F178-L182 HydrophobicContact CE1-CD1 3.47Å; F178-L182 VanDerWaalsContact CE1-CD1 3.47Å; F178-L182 HydrophobicContact CE1-CG 4.1Å; F178-L182 HydrophobicContact CE2-CG 4.5Å; F178-L182 HydrophobicContact CZ-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD2 4.22Å; F178-L182 HydrophobicContact CZ-CG 4.16Å; F178-L182 WeakPolarHBondContact O-CG 3.44Å; F178-L182 PolarHBondContact O-N 2.99Å; A179-L182 PolarHBondContact O-N 3.05Å; L182-D185 VanDerWaalsContact C-OD1 3.26Å; L182-D185 VanDerWaalsContact CA-OD1 3.23Å; L182-D185 WeakPolarHBondContact CA-OD1 3.42Å; L182-T187 HydrophobicContact CD2-CG2 4.06Å; L182-T187 PolarHBondContact O-N 3.37Å; L182-L188 HydrophobicContact CB-CD1 4.14Å; L182-L188 HydrophobicContact CB-CG 3.89Å; L182-L188 WeakPolarHBondContact O-CB 3.24Å; L182-L188 WeakPolarHBondContact O-CG 3.39Å; L182-L188 PolarHBondContact O-N 2.74Å
183E88.1Confident87.7Confident67 Ų6775 Ų7531%0.31339%0.388SS..Hα-helixtrans-78-49.7165.3-160.2-156.5140.400109.7K132 A179 D180 G181 D185 G186 L188K132-E183 WeakPolarHBondContact CE-OE1 3.28Å; K132-E183 WeakPolarHBondContact CE-OE2 3.43Å; K132-E183 HydrophobicContact CG-CG 4.43Å; K132-E183 WeakPolarHBondContact CG-OE2 3.3Å; K132-E183 IonicContact NZ-OE1 3.68Å; A179-E183 PolarHBondContact O-N 3.24Å; D180-E183 WeakPolarHBondContact O-CB 3.46Å; D180-E183 PolarHBondContact O-N 2.81Å; G181-E183 PolarHBondContact O-N 3.29Å; E183-D185 PolarHBondContact O-N 2.87Å; E183-G186 PolarHBondContact O-N 3.48Å; E183-G186 VanDerWaalsContact O-N 3.11Å; E183-L188 HydrophobicContact CB-CD1 4.34Å
184T87.8Confident86Confident127 Ų12777.4 Ų77.478%0.77940%0.399SS*.Hα-helixtrans-69.9-25.3-175.558.20000115.4D180 G181 G186D180-T184 PolarHBondContact O-N 3.03Å; D180-T184 VanDerWaalsContact O-N 3.12Å; D180-T184 PolarHBondContact O-OG1 3.14Å; G181-T184 PolarHBondContact O-N 3.14Å; G181-T184 PolarHBondContact O-OG1 2.6Å; T184-G186 VanDerWaalsContact C-N 3.26Å
185D88.1Confident84.1Confident82 Ų8275.4 Ų75.444%0.43940%0.399SS..THydrogen-bonded Turntrans-84-0.617383.3-23.4000113.4G181 L182 E183 T187 K190G181-D185 PolarHBondContact O-N 2.89Å; L182-D185 VanDerWaalsContact C-OD1 3.26Å; L182-D185 VanDerWaalsContact CA-OD1 3.23Å; L182-D185 WeakPolarHBondContact CA-OD1 3.42Å; E183-D185 PolarHBondContact O-N 2.87Å; D185-T187 PolarHBondContact O-N 3.25Å; D185-T187 WeakPolarHBondContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CB 3.18Å; D185-T187 PolarHBondContact OD1-N 3.31Å; D185-T187 PolarHBondContact OD1-OG1 3Å; D185-T187 WeakPolarHBondContact OD2-CB 3.19Å; D185-T187 PolarHBondContact OD2-OG1 3.34Å; D185-K190 PolarHBondContact O-NZ 2.86Å; D185-K190 VanDerWaalsContact O-NZ 3.11Å
186G83.5Confident82.1Confident21 Ų2180.1 Ų80.122%0.21642%0.424CS..SBendtrans69.310.9-176.500000114.6E183 T184 Q189 K190E183-G186 PolarHBondContact O-N 3.48Å; E183-G186 VanDerWaalsContact O-N 3.11Å; T184-G186 VanDerWaalsContact C-N 3.26Å; G186-Q189 WeakPolarHBondContact O-CB 3.45Å; G186-Q189 PolarHBondContact O-N 2.8Å; G186-K190 WeakPolarHBondContact O-CG 3.21Å; G186-K190 PolarHBondContact O-N 2.72Å
187T86Confident80.1Confident54 Ų5478.3 Ų78.333%0.33143%0.426SS..THydrogen-bonded Turntrans-71-36.6-178.8-66.80000112.2L182 D185 Q189 K190L182-T187 HydrophobicContact CD2-CG2 4.06Å; L182-T187 PolarHBondContact O-N 3.37Å; D185-T187 PolarHBondContact O-N 3.25Å; D185-T187 WeakPolarHBondContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CB 3.18Å; D185-T187 PolarHBondContact OD1-N 3.31Å; D185-T187 PolarHBondContact OD1-OG1 3Å; D185-T187 WeakPolarHBondContact OD2-CB 3.19Å; D185-T187 PolarHBondContact OD2-OG1 3.34Å; T187-Q189 VanDerWaalsContact C-N 3.28Å; T187-Q189 PolarHBondContact O-N 3.26Å; T187-K190 PolarHBondContact O-N 3.3Å; T187-K190 PolarHBondContact OG1-NZ 2.94Å
188L84.5Confident78.2Confident10 Ų1076.1 Ų76.15%0.05242%0.415CS..THydrogen-bonded Turntrans-66.8-29.6168.1-68.6174.8000112.4L134 L138 L182 E183 C191 F192L134-L188 HydrophobicContact CD2-CD2 3.89Å; L134-L188 HydrophobicContact CG-CD2 4.06Å; L138-L188 HydrophobicContact CD1-CD2 4.1Å; L182-L188 HydrophobicContact CB-CD1 4.14Å; L182-L188 HydrophobicContact CB-CG 3.89Å; L182-L188 WeakPolarHBondContact O-CB 3.24Å; L182-L188 WeakPolarHBondContact O-CG 3.39Å; L182-L188 PolarHBondContact O-N 2.74Å; E183-L188 HydrophobicContact CB-CD1 4.34Å; L188-C191 WeakPolarHBondContact O-CB 3.48Å; L188-C191 PolarHBondContact O-N 3.43Å; L188-F192 WeakPolarHBondContact O-CD2 3.18Å
189Q85.5Confident76.4Confident86 Ų8673 Ų7340%0.40241%0.413SS..G310 helixtrans-68.6-39.7177.3-164.866.514.300111.4S131 G186 T187 C191 F192 E193S131-Q189 PolarHBondContact OG-OE1 3.07Å; G186-Q189 WeakPolarHBondContact O-CB 3.45Å; G186-Q189 PolarHBondContact O-N 2.8Å; T187-Q189 VanDerWaalsContact C-N 3.28Å; T187-Q189 PolarHBondContact O-N 3.26Å; Q189-C191 PolarHBondContact O-N 2.75Å; Q189-C191 VanDerWaalsContact O-N 3.09Å; Q189-F192 PolarHBondContact O-N 2.86Å; Q189-E193 PolarHBondContact O-N 2.81Å
190K84.4Confident74.8Confident112 Ų11276.1 Ų76.149%0.48743%0.434SS..G310 helixtrans-59.6-17.5174.8-66.8164.8-156.1124.50113.9D185 G186 T187 F192D185-K190 PolarHBondContact O-NZ 2.86Å; D185-K190 VanDerWaalsContact O-NZ 3.11Å; G186-K190 WeakPolarHBondContact O-CG 3.21Å; G186-K190 PolarHBondContact O-N 2.72Å; T187-K190 PolarHBondContact O-N 3.3Å; T187-K190 PolarHBondContact OG1-NZ 2.94Å; K190-F192 VanDerWaalsContact C-N 3.32Å
191C81.4Confident73.4Confident86 Ų8676.9 Ų76.958%0.58144%0.438SS*.G310 helixtrans-73.8-21.7172.5-60.10000113.5L134 L188 Q189L134-C191 HydrophobicContact CD2-CB 3.91Å; L188-C191 WeakPolarHBondContact O-CB 3.48Å; L188-C191 PolarHBondContact O-N 3.43Å; Q189-C191 PolarHBondContact O-N 2.75Å; Q189-C191 VanDerWaalsContact O-N 3.09Å
192F77.1Confident72.2Confident82 Ų8282.1 Ų82.136%0.3645%0.452SS..THydrogen-bonded Turntrans-103.8-32.1178.8-62.6-79.7000112.1E130 L134 L188 Q189 K190 H194E130-F192 HydrophobicContact CB-CD1 3.89Å; E130-F192 HydrophobicContact CB-CD2 4.25Å; E130-F192 HydrophobicContact CB-CE1 3.71Å; E130-F192 HydrophobicContact CB-CE2 4.09Å; E130-F192 HydrophobicContact CB-CG 4.16Å; E130-F192 HydrophobicContact CB-CZ 3.82Å; E130-F192 HydrophobicContact CG-CD1 4.35Å; E130-F192 HydrophobicContact CG-CE1 4.19Å; E130-F192 WeakPolarHBondContact O-CZ 3.36Å; L134-F192 HydrophobicContact CB-CE2 4.01Å; L134-F192 HydrophobicContact CB-CZ 3.99Å; L134-F192 HydrophobicContact CD2-CE2 3.72Å; L134-F192 HydrophobicContact CD2-CZ 3.99Å; L188-F192 WeakPolarHBondContact O-CD2 3.18Å; Q189-F192 PolarHBondContact O-N 2.86Å; K190-F192 VanDerWaalsContact C-N 3.32Å; F192-H194 PolarHBondContact O-N 2.95Å; F192-H194 VanDerWaalsContact O-N 3.12Å; F192-H194 PolarHBondContact O-ND1 3.23Å; F192-H194 VanDerWaalsContact O-ND1 3.1Å
193E77.6Confident71.6Confident115 Ų11584.3 Ų84.354%0.53747%0.471SS..SBendtrans-50.7120.1167.3-70.2175.9-176.700110Q189 S195Q189-E193 PolarHBondContact O-N 2.81Å; E193-S195 PolarHBondContact O-N 3.42Å
194H57.2Low71.3Confident135 Ų13586.5 Ų86.563%0.62548%0.484SS*.  trans-71103.8173-79.929.4000107.6F192 N196 K198F192-H194 PolarHBondContact O-N 2.95Å; F192-H194 VanDerWaalsContact O-N 3.12Å; F192-H194 PolarHBondContact O-ND1 3.23Å; F192-H194 VanDerWaalsContact O-ND1 3.1Å; H194-N196 PolarHBondContact O-N 2.99Å; H194-K198 HydrophobicContact CB-CD 4.08Å; H194-K198 PolarHBondContact CD2-NZ 3.33Å; H194-K198 PolarHBondContact NE2-NZ 2.95Å; H194-K198 VanDerWaalsContact NE2-NZ 3.1Å
195S54.3Low71.2Confident81 Ų8186.3 Ų86.357%0.56648%0.475SS*.  trans-44.5131.6-179.954.10000110.6E193 G197 K198E193-S195 PolarHBondContact O-N 3.42Å; S195-G197 PolarHBondContact O-N 2.83Å; S195-K198 WeakPolarHBondContact O-CB 3.19Å; S195-K198 PolarHBondContact O-N 3.41Å
196N51.2Low71.3Confident146 Ų14684.6 Ų84.678%0.78147%0.472SS*.THydrogen-bonded Turntrans-59.7-13.5-174.1-79.9-61.9000113.8H194 K198 A199H194-N196 PolarHBondContact O-N 2.99Å; N196-K198 PolarHBondContact O-N 2.71Å; N196-A199 WeakPolarHBondContact O-CB 3.16Å; N196-A199 PolarHBondContact O-N 2.85Å
197G50.4Low71.6Confident33 Ų3386.4 Ų86.434%0.3448%0.481SS..Hα-helixtrans-51.8-33.4164.300000113.6S195 A199 S200 D201S195-G197 PolarHBondContact O-N 2.83Å; G197-A199 PolarHBondContact O-N 2.64Å; G197-S200 WeakPolarHBondContact CA-OG 3.44Å; G197-S200 CarbonylContact O-C 3.52Å; G197-S200 PolarHBondContact O-N 2.81Å; G197-S200 VanDerWaalsContact O-N 3.09Å; G197-S200 PolarHBondContact O-OG 3.38Å; G197-D201 PolarHBondContact O-N 3.42Å
198K53.1Low71.9Confident79 Ų7986.3 Ų86.334%0.34348%0.48SS..Hα-helixtrans-60.7-26.9175.2-66.7-164.2-170.6-179.90113.6H194 S195 N196 D201 F202H194-K198 HydrophobicContact CB-CD 4.08Å; H194-K198 PolarHBondContact CD2-NZ 3.33Å; H194-K198 PolarHBondContact NE2-NZ 2.95Å; H194-K198 VanDerWaalsContact NE2-NZ 3.1Å; S195-K198 WeakPolarHBondContact O-CB 3.19Å; S195-K198 PolarHBondContact O-N 3.41Å; N196-K198 PolarHBondContact O-N 2.71Å; K198-D201 WeakPolarHBondContact CA-OD2 3.36Å; K198-D201 PolarHBondContact O-N 3.42Å; K198-F202 WeakPolarHBondContact O-CD2 3.28Å; K198-F202 WeakPolarHBondContact O-CG 3.12Å; K198-F202 PolarHBondContact O-N 2.73Å
199A52.9Low72.4Confident64 Ų6488.3 Ų88.353%0.52950%0.498SS..Hα-helixtrans-71.2-40.6175.900000111.5N196 G197 S203N196-A199 WeakPolarHBondContact O-CB 3.16Å; N196-A199 PolarHBondContact O-N 2.85Å; G197-A199 PolarHBondContact O-N 2.64Å; A199-S203 PolarHBondContact O-N 2.95Å
200S56.7Low72.8Confident72 Ų7289.5 Ų89.550%0.50350%0.504SS..Hα-helixtrans-67-37168.236.50000112.3G197 S203 L204G197-S200 WeakPolarHBondContact CA-OG 3.44Å; G197-S200 CarbonylContact O-C 3.52Å; G197-S200 PolarHBondContact O-N 2.81Å; G197-S200 VanDerWaalsContact O-N 3.09Å; G197-S200 PolarHBondContact O-OG 3.38Å; S200-S203 PolarHBondContact O-N 3.28Å; S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.22Å; S200-L204 PolarHBondContact O-N 2.91Å
201D60.9Low73.4Confident95 Ų9589.4 Ų89.451%0.50851%0.507SS..Hα-helixtrans-64.3-41.9177.4-60-32.9000111.2G197 K198 L204 E205G197-D201 PolarHBondContact O-N 3.42Å; K198-D201 WeakPolarHBondContact CA-OD2 3.36Å; K198-D201 PolarHBondContact O-N 3.42Å; D201-L204 PolarHBondContact O-N 2.93Å; D201-E205 VanDerWaalsContact O-CB 3.22Å; D201-E205 WeakPolarHBondContact O-CB 3.35Å; D201-E205 PolarHBondContact O-N 2.95Å
202F67.3Low74.2Confident140 Ų14091.5 Ų91.561%0.61451%0.506SS*.Hα-helixtrans-64.8-39174-77.8-55.5000112.7K198 L204 E205 A206K198-F202 WeakPolarHBondContact O-CD2 3.28Å; K198-F202 WeakPolarHBondContact O-CG 3.12Å; K198-F202 PolarHBondContact O-N 2.73Å; F202-L204 VanDerWaalsContact C-N 3.33Å; F202-E205 PolarHBondContact O-N 3.25Å; F202-A206 WeakPolarHBondContact O-CB 3.39Å; F202-A206 PolarHBondContact O-N 2.87Å
203S76Confident75.1Confident84 Ų8494.3 Ų94.359%0.58752%0.52SS*.Hα-helixtrans-67.1-35.2174.9-171.50000112.3A199 S200 S207A199-S203 PolarHBondContact O-N 2.95Å; S200-S203 PolarHBondContact O-N 3.28Å; S203-S207 PolarHBondContact O-N 3.28Å; S203-S207 VanDerWaalsContact O-N 3.12Å
204L82.2Confident76.1Confident112 Ų11295.1 Ų95.159%0.58652%0.519SS*.Hα-helixtrans-75-38.9176.5-177.2146.5000111.1S200 D201 F202 S207 V208S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.22Å; S200-L204 PolarHBondContact O-N 2.91Å; D201-L204 PolarHBondContact O-N 2.93Å; F202-L204 VanDerWaalsContact C-N 3.33Å; L204-S207 PolarHBondContact O-N 2.88Å; L204-V208 HydrophobicContact CD2-CG2 4.06Å; L204-V208 HydrophobicContact CG-CG2 4.5Å; L204-V208 VanDerWaalsContact O-CB 3.24Å; L204-V208 WeakPolarHBondContact O-CB 3.46Å; L204-V208 WeakPolarHBondContact O-CG2 3.24Å; L204-V208 PolarHBondContact O-N 3.48Å
205E86.1Confident78Confident123 Ų12393.3 Ų93.358%0.57551%0.513SS*.Hα-helixtrans-63.4-41.9174.3-177.9168.4-145.600111.3D201 F202 V208 A209D201-E205 VanDerWaalsContact O-CB 3.22Å; D201-E205 WeakPolarHBondContact O-CB 3.35Å; D201-E205 PolarHBondContact O-N 2.95Å; F202-E205 PolarHBondContact O-N 3.25Å; E205-V208 CarbonylContact O-C 3.58Å; E205-V208 PolarHBondContact O-N 3Å; E205-A209 WeakPolarHBondContact O-CB 3.36Å; E205-A209 PolarHBondContact O-N 3.47Å
206A88.5Confident80Confident46 Ų4693.8 Ų93.838%0.3851%0.513SS..Hα-helixtrans-60.4-51.4172.400000111.8F202 V208 A209 E210F202-A206 WeakPolarHBondContact O-CB 3.39Å; F202-A206 PolarHBondContact O-N 2.87Å; A206-V208 VanDerWaalsContact C-N 3.28Å; A206-V208 PolarHBondContact O-N 3.39Å; A206-A209 WeakPolarHBondContact O-CA 3.4Å; A206-A209 WeakPolarHBondContact O-CB 3.17Å; A206-A209 PolarHBondContact O-N 2.94Å; A206-E210 WeakPolarHBondContact O-CG 3.29Å; A206-E210 PolarHBondContact O-N 2.78Å
207S89.4Confident82.3Confident59 Ų5993 Ų9341%0.41350%0.502SS..Hα-helixtrans-62.1-35177.3-173.80000112.8S203 L204 M211S203-S207 PolarHBondContact O-N 3.28Å; S203-S207 VanDerWaalsContact O-N 3.12Å; L204-S207 PolarHBondContact O-N 2.88Å; S207-M211 VanDerWaalsContact O-CB 3.26Å; S207-M211 WeakPolarHBondContact O-CB 3.35Å; S207-M211 PolarHBondContact O-N 2.98Å
208V93.5Very high84.6Confident52 Ų5297.3 Ų97.332%0.31551%0.512SS..Hα-helixtrans-71.5-28.6173.5165.40000112L204 E205 A206 K212L204-V208 HydrophobicContact CD2-CG2 4.06Å; L204-V208 HydrophobicContact CG-CG2 4.5Å; L204-V208 VanDerWaalsContact O-CB 3.24Å; L204-V208 WeakPolarHBondContact O-CB 3.46Å; L204-V208 WeakPolarHBondContact O-CG2 3.24Å; L204-V208 PolarHBondContact O-N 3.48Å; E205-V208 CarbonylContact O-C 3.58Å; E205-V208 PolarHBondContact O-N 3Å; A206-V208 VanDerWaalsContact C-N 3.28Å; A206-V208 PolarHBondContact O-N 3.39Å; V208-K212 HydrophobicContact CG1-CD 4.33Å; V208-K212 VanDerWaalsContact O-CD 3.3Å; V208-K212 WeakPolarHBondContact O-CD 3.44Å; V208-K212 WeakPolarHBondContact O-CG 3.36Å; V208-K212 PolarHBondContact O-N 2.98Å; V208-K212 VanDerWaalsContact O-N 3.12Å
209A93.8Very high86.7Confident52 Ų5295.9 Ų95.943%0.4351%0.512SS..Hα-helixtrans-72.2-47.8172.200000111.4E205 A206 M211 K212 E213E205-A209 WeakPolarHBondContact O-CB 3.36Å; E205-A209 PolarHBondContact O-N 3.47Å; A206-A209 WeakPolarHBondContact O-CA 3.4Å; A206-A209 WeakPolarHBondContact O-CB 3.17Å; A206-A209 PolarHBondContact O-N 2.94Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.7Å; A209-K212 WeakPolarHBondContact O-CB 3.4Å; A209-K212 PolarHBondContact O-N 3.02Å; A209-K212 VanDerWaalsContact O-N 3.13Å; A209-E213 PolarHBondContact O-N 2.91Å
210E95.3Very high88.8Confident111 Ų11197.7 Ų97.752%0.51951%0.512SS..Hα-helixtrans-56-46.7172.3-69.2170.3-178.300111.1A206 K212 E213 Y214A206-E210 WeakPolarHBondContact O-CG 3.29Å; A206-E210 PolarHBondContact O-N 2.78Å; E210-K212 VanDerWaalsContact C-N 3.32Å; E210-K212 PolarHBondContact O-N 3.15Å; E210-E213 WeakPolarHBondContact O-CB 3.26Å; E210-E213 PolarHBondContact O-N 3.42Å; E210-E213 VanDerWaalsContact O-N 3.11Å; E210-Y214 HydrophobicContact CB-CE2 4.36Å; E210-Y214 WeakPolarHBondContact O-CD2 3.1Å; E210-Y214 PolarHBondContact O-N 3.08Å
211M96.9Very high90.8Very high111 Ų11198.2 Ų98.255%0.54751%0.506SS..Hα-helixtrans-61.1-38.3176.9-171.3-177.1-64.500112.3S207 A209 Y214 I215S207-M211 VanDerWaalsContact O-CB 3.26Å; S207-M211 WeakPolarHBondContact O-CB 3.35Å; S207-M211 PolarHBondContact O-N 2.98Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.7Å; M211-Y214 PolarHBondContact O-N 3.1Å; M211-I215 HydrophobicContact CG-CD1 4.04Å; M211-I215 WeakPolarHBondContact O-CB 3.31Å; M211-I215 WeakPolarHBondContact O-CD1 3.36Å; M211-I215 WeakPolarHBondContact O-CG1 3.47Å; M211-I215 PolarHBondContact O-N 3.4Å
212K97.2Very high92.6Very high130 Ų130101.1 Ų101.157%0.56551%0.51SS*.Hα-helixtrans-65.2-40.8173.3-73.9161.4-172.3166.10111.6V208 A209 E210 I215 T216V208-K212 HydrophobicContact CG1-CD 4.33Å; V208-K212 VanDerWaalsContact O-CD 3.3Å; V208-K212 WeakPolarHBondContact O-CD 3.44Å; V208-K212 WeakPolarHBondContact O-CG 3.36Å; V208-K212 PolarHBondContact O-N 2.98Å; V208-K212 VanDerWaalsContact O-N 3.12Å; A209-K212 WeakPolarHBondContact O-CB 3.4Å; A209-K212 PolarHBondContact O-N 3.02Å; A209-K212 VanDerWaalsContact O-N 3.13Å; E210-K212 VanDerWaalsContact C-N 3.32Å; E210-K212 PolarHBondContact O-N 3.15Å; K212-I215 PolarHBondContact O-N 3.36Å; K212-T216 WeakPolarHBondContact O-CG2 3.32Å; K212-T216 PolarHBondContact O-N 3.29Å; K212-T216 PolarHBondContact O-OG1 3.46Å
213E96.8Very high94Very high140 Ų140100.2 Ų100.265%0.65451%0.508SS*.Hα-helixtrans-62-48.6175.4-168.8-179.8154.800110.9A209 E210 I215 T216 K217A209-E213 PolarHBondContact O-N 2.91Å; E210-E213 WeakPolarHBondContact O-CB 3.26Å; E210-E213 PolarHBondContact O-N 3.42Å; E210-E213 VanDerWaalsContact O-N 3.11Å; E213-I215 VanDerWaalsContact C-N 3.33Å; E213-I215 PolarHBondContact O-N 3.07Å; E213-T216 PolarHBondContact O-N 3.27Å; E213-T216 VanDerWaalsContact O-N 3.11Å; E213-T216 PolarHBondContact O-OG1 2.88Å; E213-K217 WeakPolarHBondContact O-CB 3.33Å; E213-K217 PolarHBondContact O-N 2.8Å
214Y97.6Very high95.1Very high133 Ų133100.6 Ų100.652%0.52250%0.503SS..Hα-helixtrans-58.1-42173.9-72.2-59.2000112.4E210 M211 T216 K217 F218E210-Y214 HydrophobicContact CB-CE2 4.36Å; E210-Y214 WeakPolarHBondContact O-CD2 3.1Å; E210-Y214 PolarHBondContact O-N 3.08Å; M211-Y214 PolarHBondContact O-N 3.1Å; Y214-T216 PolarHBondContact O-N 3.18Å; Y214-K217 PolarHBondContact O-N 3Å; Y214-F218 WeakPolarHBondContact O-CB 3.47Å; Y214-F218 WeakPolarHBondContact O-CD2 3.39Å; Y214-F218 WeakPolarHBondContact O-CG 3.35Å; Y214-F218 PolarHBondContact O-N 2.88Å
215I97.9Very high95.9Very high96 Ų96102.8 Ų102.849%0.49250%0.503SS..Hα-helixtrans-60.6-42.7174.8-73.1163.4000111.3M211 K212 E213 S219M211-I215 HydrophobicContact CG-CD1 4.04Å; M211-I215 WeakPolarHBondContact O-CB 3.31Å; M211-I215 WeakPolarHBondContact O-CD1 3.36Å; M211-I215 WeakPolarHBondContact O-CG1 3.47Å; M211-I215 PolarHBondContact O-N 3.4Å; K212-I215 PolarHBondContact O-N 3.36Å; E213-I215 VanDerWaalsContact C-N 3.33Å; E213-I215 PolarHBondContact O-N 3.07Å; I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.28Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.17Å
216T97.4Very high96.4Very high92 Ų92101.2 Ų101.256%0.56450%0.499SS*.Hα-helixtrans-68.1-40.3176.2580000112.4K212 E213 Y214 S219 L220K212-T216 WeakPolarHBondContact O-CG2 3.32Å; K212-T216 PolarHBondContact O-N 3.29Å; K212-T216 PolarHBondContact O-OG1 3.46Å; E213-T216 PolarHBondContact O-N 3.27Å; E213-T216 VanDerWaalsContact O-N 3.11Å; E213-T216 PolarHBondContact O-OG1 2.88Å; Y214-T216 PolarHBondContact O-N 3.18Å; T216-S219 PolarHBondContact O-N 3.46Å; T216-L220 PolarHBondContact O-N 3.08Å
217K98.1Very high96.9Very high128 Ų128105.5 Ų105.556%0.55751%0.511SS*.Hα-helixtrans-61.4-51176.1-176.7-178.8176.3-177.40111.7E213 Y214 S219 L220 E221E213-K217 WeakPolarHBondContact O-CB 3.33Å; E213-K217 PolarHBondContact O-N 2.8Å; Y214-K217 PolarHBondContact O-N 3Å; K217-S219 VanDerWaalsContact C-N 3.29Å; K217-S219 PolarHBondContact O-N 3.13Å; K217-L220 PolarHBondContact O-N 2.8Å; K217-E221 WeakPolarHBondContact O-CB 3.38Å; K217-E221 PolarHBondContact O-N 3.26Å
218F98.1Very high97.3Very high125 Ų125106 Ų10655%0.54851%0.509SS..Hα-helixtrans-66.6-29.4177.5-66.6-49.6000112.7Y214 R222Y214-F218 WeakPolarHBondContact O-CB 3.47Å; Y214-F218 WeakPolarHBondContact O-CD2 3.39Å; Y214-F218 WeakPolarHBondContact O-CG 3.35Å; Y214-F218 PolarHBondContact O-N 2.88Å; F218-R222 WeakPolarHBondContact O-CB 3.42Å; F218-R222 PolarHBondContact O-N 3.32Å
219S97.8Very high97.5Very high49 Ų49108.2 Ų108.234%0.34352%0.518SS..Hα-helixtrans-67.6-41.2173.4-62.30000112.1I215 T216 K217 Q223I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.28Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.17Å; T216-S219 PolarHBondContact O-N 3.46Å; K217-S219 VanDerWaalsContact C-N 3.29Å; K217-S219 PolarHBondContact O-N 3.13Å; S219-Q223 PolarHBondContact O-N 2.96Å; S219-Q223 VanDerWaalsContact O-N 3.12Å
220L98Very high97.7Very high102 Ų102110.8 Ų110.853%0.53452%0.524SS..Hα-helixtrans-68.3-44.3173.8178.161.9000111.5T216 K217 R222 Q223 I224T216-L220 PolarHBondContact O-N 3.08Å; K217-L220 PolarHBondContact O-N 2.8Å; L220-R222 PolarHBondContact O-N 3.5Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3Å; L220-Q223 VanDerWaalsContact O-N 3.16Å; L220-I224 HydrophobicContact CD1-CD1 4.43Å; L220-I224 HydrophobicContact CG-CD1 4.18Å; L220-I224 WeakPolarHBondContact O-CG1 3.45Å; L220-I224 PolarHBondContact O-N 3.15Å
221E98.4Very high97.8Very high82 Ų82110.7 Ų110.738%0.38352%0.524SS..Hα-helixtrans-59.7-45.2176.7-177.6172.8173.800111.4K217 Q223 I224 W225K217-E221 WeakPolarHBondContact O-CB 3.38Å; K217-E221 PolarHBondContact O-N 3.26Å; E221-Q223 VanDerWaalsContact C-N 3.34Å; E221-Q223 PolarHBondContact O-N 3.12Å; E221-I224 WeakPolarHBondContact O-CB 3.5Å; E221-I224 PolarHBondContact O-N 3.33Å; E221-I224 VanDerWaalsContact O-N 3.15Å; E221-W225 PolarHBondContact O-N 3.43Å; E221-W225 PolarHBondContact OE1-NE1 2.69Å
222R97.8Very high97.8Very high156 Ų156112.3 Ų112.359%0.58952%0.524SS*.Hα-helixtrans-58.3-45.2173.1-170.7-172.866-143.1-9.3111.6F218 L220 I224 W225 D226F218-R222 WeakPolarHBondContact O-CB 3.42Å; F218-R222 PolarHBondContact O-N 3.32Å; L220-R222 PolarHBondContact O-N 3.5Å; R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.16Å; R222-W225 PolarHBondContact O-N 3.47Å; R222-W225 VanDerWaalsContact O-N 3.13Å; R222-D226 IonicContact NE-OD2 3.52Å; R222-D226 WeakPolarHBondContact O-CB 3.42Å; R222-D226 PolarHBondContact O-N 3.4Å
223Q98Very high97.8Very high121 Ų121111.2 Ų111.257%0.56552%0.522SS*.Hα-helixtrans-60-36.3176.9-178.1-177.6-19.300112.4S219 L220 E221 Q227S219-Q223 PolarHBondContact O-N 2.96Å; S219-Q223 VanDerWaalsContact O-N 3.12Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3Å; L220-Q223 VanDerWaalsContact O-N 3.16Å; E221-Q223 VanDerWaalsContact C-N 3.34Å; E221-Q223 PolarHBondContact O-N 3.12Å; Q223-Q227 WeakPolarHBondContact O-CB 3.41Å; Q223-Q227 PolarHBondContact O-N 2.96Å
224I98.3Very high97.8Very high93 Ų93110.8 Ų110.848%0.47752%0.52SS..Hα-helixtrans-67.3-43.8174.7-66.1166.5000110.5L220 E221 R222 Q227 L228L220-I224 HydrophobicContact CD1-CD1 4.43Å; L220-I224 HydrophobicContact CG-CD1 4.18Å; L220-I224 WeakPolarHBondContact O-CG1 3.45Å; L220-I224 PolarHBondContact O-N 3.15Å; E221-I224 WeakPolarHBondContact O-CB 3.5Å; E221-I224 PolarHBondContact O-N 3.33Å; E221-I224 VanDerWaalsContact O-N 3.15Å; R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.16Å; I224-Q227 PolarHBondContact O-N 3.31Å; I224-L228 VanDerWaalsContact O-CB 3.32Å; I224-L228 WeakPolarHBondContact O-CB 3.19Å; I224-L228 PolarHBondContact O-N 2.91Å
225W98.5Very high97.7Very high157 Ų157108.2 Ų108.260%0.59551%0.512SS*.Hα-helixtrans-63.8-42.3174.9-74.6113.7000112.7E221 R222 Q227 L228 L229E221-W225 PolarHBondContact O-N 3.43Å; E221-W225 PolarHBondContact OE1-NE1 2.69Å; R222-W225 PolarHBondContact O-N 3.47Å; R222-W225 VanDerWaalsContact O-N 3.13Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; W225-Q227 PolarHBondContact O-N 2.98Å; W225-L228 HydrophobicContact CE3-CD2 4.07Å; W225-L228 HydrophobicContact CZ3-CD2 3.96Å; W225-L228 PolarHBondContact O-N 2.86Å; W225-L229 VanDerWaalsContact O-CB 3.31Å; W225-L229 WeakPolarHBondContact O-CB 3.07Å; W225-L229 PolarHBondContact O-N 3.47Å
226D98.3Very high97.5Very high91 Ų91106.4 Ų106.449%0.48751%0.512SS..Hα-helixtrans-60.1-42.9175.3-66-31.7000110.7R222 L230R222-D226 IonicContact NE-OD2 3.52Å; R222-D226 WeakPolarHBondContact O-CB 3.42Å; R222-D226 PolarHBondContact O-N 3.4Å; D226-L230 WeakPolarHBondContact O-CB 3.39Å; D226-L230 PolarHBondContact O-N 2.94Å; D226-L230 VanDerWaalsContact O-N 3.08Å
227Q97.9Very high97.3Very high136 Ų136108.5 Ų108.564%0.63652%0.515SS*.Hα-helixtrans-68.5-40.9176.7-175175.11500112.6Q223 I224 W225 L230 H231Q223-Q227 WeakPolarHBondContact O-CB 3.41Å; Q223-Q227 PolarHBondContact O-N 2.96Å; I224-Q227 PolarHBondContact O-N 3.31Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; W225-Q227 PolarHBondContact O-N 2.98Å; Q227-L230 PolarHBondContact O-N 3.11Å; Q227-H231 WeakPolarHBondContact O-CB 3.46Å; Q227-H231 PolarHBondContact O-N 3.46Å
228L98.3Very high97Very high69 Ų69106.6 Ų106.636%0.36151%0.508SS..Hα-helixtrans-67.7-39.7178.9-173.464.6000111.6I224 W225 H231 Y232I224-L228 VanDerWaalsContact O-CB 3.32Å; I224-L228 WeakPolarHBondContact O-CB 3.19Å; I224-L228 PolarHBondContact O-N 2.91Å; W225-L228 HydrophobicContact CE3-CD2 4.07Å; W225-L228 HydrophobicContact CZ3-CD2 3.96Å; W225-L228 PolarHBondContact O-N 2.86Å; L228-H231 PolarHBondContact O-N 3.31Å; L228-Y232 HydrophobicContact CD1-CD2 4.06Å; L228-Y232 HydrophobicContact CD1-CE2 3.59Å; L228-Y232 HydrophobicContact CD2-CE2 4.48Å; L228-Y232 HydrophobicContact CG-CD2 4.05Å; L228-Y232 HydrophobicContact CG-CE2 3.87Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 2.85Å; L228-Y232 VanDerWaalsContact O-N 3.07Å
229L98.1Very high96.7Very high99 Ų99104.6 Ų104.652%0.51850%0.502SS..Hα-helixtrans-59.8-49.4172.6-17676.3000110.7W225 H231 Y232 Q233W225-L229 VanDerWaalsContact O-CB 3.31Å; W225-L229 WeakPolarHBondContact O-CB 3.07Å; W225-L229 PolarHBondContact O-N 3.47Å; L229-H231 VanDerWaalsContact C-N 3.34Å; L229-H231 PolarHBondContact O-N 2.9Å; L229-Y232 PolarHBondContact O-N 3.22Å; L229-Q233 WeakPolarHBondContact O-CB 3.12Å; L229-Q233 VanDerWaalsContact O-CG 3.29Å; L229-Q233 WeakPolarHBondContact O-CG 3.3Å; L229-Q233 PolarHBondContact O-N 2.85Å
230L97.8Very high96.4Very high106 Ų106108.6 Ų108.656%0.55552%0.519SS*.Hα-helixtrans-63.4-39179.3-173.666.3000111.9D226 Q227 Q233 Q234D226-L230 WeakPolarHBondContact O-CB 3.39Å; D226-L230 PolarHBondContact O-N 2.94Å; D226-L230 VanDerWaalsContact O-N 3.08Å; Q227-L230 PolarHBondContact O-N 3.11Å; L230-Q233 PolarHBondContact O-N 3.5Å; L230-Q234 WeakPolarHBondContact O-CB 3.18Å; L230-Q234 PolarHBondContact O-N 3.37Å
231H97.7Very high95.8Very high109 Ų109106.9 Ų106.951%0.50552%0.516SS..Hα-helixtrans-58.7-52.9174.4-175.4-72.9000111.3Q227 L228 L229 Q233 Q234 E235Q227-H231 WeakPolarHBondContact O-CB 3.46Å; Q227-H231 PolarHBondContact O-N 3.46Å; L228-H231 PolarHBondContact O-N 3.31Å; L229-H231 VanDerWaalsContact C-N 3.34Å; L229-H231 PolarHBondContact O-N 2.9Å; H231-Q233 VanDerWaalsContact C-N 3.32Å; H231-Q233 PolarHBondContact O-N 2.83Å; H231-Q234 PolarHBondContact O-N 3.13Å; H231-E235 IonicContact CE1-OE2 3.13Å; H231-E235 PolarHBondContact CE1-OE2 3.43Å; H231-E235 VanDerWaalsContact CE1-OE2 3.27Å; H231-E235 IonicContact ND1-OE2 2.64Å; H231-E235 PolarHBondContact ND1-OE2 3.37Å; H231-E235 VanDerWaalsContact O-CB 3.26Å; H231-E235 WeakPolarHBondContact O-CB 3.24Å; H231-E235 PolarHBondContact O-N 3.42Å
232Y96.8Very high95.1Very high144 Ų144108.3 Ų108.357%0.56552%0.517SS*.Hα-helixtrans-68-29.9-179.6-76.6-55.4000113.5L228 L229 E235 A236L228-Y232 HydrophobicContact CD1-CD2 4.06Å; L228-Y232 HydrophobicContact CD1-CE2 3.59Å; L228-Y232 HydrophobicContact CD2-CE2 4.48Å; L228-Y232 HydrophobicContact CG-CD2 4.05Å; L228-Y232 HydrophobicContact CG-CE2 3.87Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 2.85Å; L228-Y232 VanDerWaalsContact O-N 3.07Å; L229-Y232 PolarHBondContact O-N 3.22Å; Y232-E235 WeakPolarHBondContact CD1-OE2 3.2Å; Y232-A236 VanDerWaalsContact O-CB 3.24Å; Y232-A236 WeakPolarHBondContact O-CB 3.24Å; Y232-A236 PolarHBondContact O-N 3.3Å
233Q96.8Very high94.1Very high108 Ų108102.8 Ų102.851%0.50551%0.509SS..Hα-helixtrans-65.8-47.8171.2-75174.2-4.700111.4L229 L230 H231 A236 E237L229-Q233 WeakPolarHBondContact O-CB 3.12Å; L229-Q233 VanDerWaalsContact O-CG 3.29Å; L229-Q233 WeakPolarHBondContact O-CG 3.3Å; L229-Q233 PolarHBondContact O-N 2.85Å; L230-Q233 PolarHBondContact O-N 3.5Å; H231-Q233 VanDerWaalsContact C-N 3.32Å; H231-Q233 PolarHBondContact O-N 2.83Å; Q233-A236 PolarHBondContact O-N 3.12Å; Q233-E237 WeakPolarHBondContact O-CB 3.26Å; Q233-E237 PolarHBondContact O-N 2.77Å
234Q96.1Very high92.6Very high131 Ų13199.8 Ų99.861%0.61250%0.501SS*.Hα-helixtrans-64.9-40.4177.4-175.4179.5-5.300111.9L230 H231 E237 E238L230-Q234 WeakPolarHBondContact O-CB 3.18Å; L230-Q234 PolarHBondContact O-N 3.37Å; H231-Q234 PolarHBondContact O-N 3.13Å; Q234-E237 PolarHBondContact O-N 2.94Å; Q234-E238 WeakPolarHBondContact O-CB 3.44Å; Q234-E238 PolarHBondContact O-N 3.11Å
235E95.6Very high91.1Very high79 Ų7997.7 Ų97.737%0.36950%0.498SS..Hα-helixtrans-64.7-42176.2-175.6175.5-174.300111.3H231 Y232 E238 I239H231-E235 IonicContact CE1-OE2 3.13Å; H231-E235 PolarHBondContact CE1-OE2 3.43Å; H231-E235 VanDerWaalsContact CE1-OE2 3.27Å; H231-E235 IonicContact ND1-OE2 2.64Å; H231-E235 PolarHBondContact ND1-OE2 3.37Å; H231-E235 VanDerWaalsContact O-CB 3.26Å; H231-E235 WeakPolarHBondContact O-CB 3.24Å; H231-E235 PolarHBondContact O-N 3.42Å; Y232-E235 WeakPolarHBondContact CD1-OE2 3.2Å; E235-E238 PolarHBondContact O-N 3.32Å; E235-I239 HydrophobicContact CG-CD1 3.87Å; E235-I239 WeakPolarHBondContact O-CB 3.38Å; E235-I239 WeakPolarHBondContact O-CD1 3.39Å; E235-I239 WeakPolarHBondContact O-CG1 3.47Å; E235-I239 PolarHBondContact O-N 2.88Å
236A93.7Very high89.2Confident58 Ų5895.4 Ų95.448%0.47949%0.494SS..Hα-helixtrans-65.9-40.8174.700000112.7Y232 Q233 L240Y232-A236 VanDerWaalsContact O-CB 3.24Å; Y232-A236 WeakPolarHBondContact O-CB 3.24Å; Y232-A236 PolarHBondContact O-N 3.3Å; Q233-A236 PolarHBondContact O-N 3.12Å; A236-L240 VanDerWaalsContact O-CB 3.28Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.71Å
237E92.6Very high87.3Confident136 Ų13693.8 Ų93.864%0.63649%0.493SS*.Hα-helixtrans-67.3-37.7175.1-174.7173.1-15800111.9Q233 Q234 S241Q233-E237 WeakPolarHBondContact O-CB 3.26Å; Q233-E237 PolarHBondContact O-N 2.77Å; Q234-E237 PolarHBondContact O-N 2.94Å; E237-S241 WeakPolarHBondContact O-CB 3.22Å; E237-S241 PolarHBondContact O-N 3.41Å; E237-S241 PolarHBondContact O-OG 2.81Å
238E92.9Very high85.3Confident87 Ų8794.4 Ų94.441%0.40749%0.494SS..Hα-helixtrans-68.1-45.4175.3-172.9-78146.900111.3Q234 E235 L240 S241 R242Q234-E238 WeakPolarHBondContact O-CB 3.44Å; Q234-E238 PolarHBondContact O-N 3.11Å; E235-E238 PolarHBondContact O-N 3.32Å; E238-L240 VanDerWaalsContact C-N 3.34Å; E238-L240 PolarHBondContact O-N 3.38Å; E238-S241 PolarHBondContact O-N 2.73Å; E238-R242 WeakPolarHBondContact O-CB 3.12Å; E238-R242 PolarHBondContact O-N 2.83Å; E238-R242 IonicContact OE1-CZ 2.6Å; E238-R242 IonicContact OE1-NH1 3.68Å; E238-R242 PolarHBondContact OE1-NH1 3.25Å; E238-R242 IonicContact OE2-CZ 3.19Å; E238-R242 IonicContact OE2-NH1 2.72Å; E238-R242 PolarHBondContact OE2-NH1 2.89Å
239I91.8Very high83.3Confident83 Ų8397.2 Ų97.243%0.42651%0.508SS..Hα-helixtrans-59.8-43.8174.6-70.8163.4000110.8E235 G243E235-I239 HydrophobicContact CG-CD1 3.87Å; E235-I239 WeakPolarHBondContact O-CB 3.38Å; E235-I239 WeakPolarHBondContact O-CD1 3.39Å; E235-I239 WeakPolarHBondContact O-CG1 3.47Å; E235-I239 PolarHBondContact O-N 2.88Å; I239-G243 PolarHBondContact O-N 3.48Å
240L90.6Very high81Confident134 Ų13496 Ų9670%0.70250%0.504SS*.Hα-helixtrans-66.1-42.9178.1-17763.7000111.8A236 E238 G243 S244A236-L240 VanDerWaalsContact O-CB 3.28Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.71Å; E238-L240 VanDerWaalsContact C-N 3.34Å; E238-L240 PolarHBondContact O-N 3.38Å; L240-G243 PolarHBondContact O-N 2.74Å; L240-S244 PolarHBondContact O-N 2.98Å
241S85.9Confident78.5Confident66 Ų6698.8 Ų98.846%0.46252%0.515SS..Hα-helixtrans-67.8-43.6178.3-62.50000111.9E237 E238 S244 A245E237-S241 WeakPolarHBondContact O-CB 3.22Å; E237-S241 PolarHBondContact O-N 3.41Å; E237-S241 PolarHBondContact O-OG 2.81Å; E238-S241 PolarHBondContact O-N 2.73Å; S241-S244 PolarHBondContact O-N 3.39Å; S241-A245 WeakPolarHBondContact O-CB 3.47Å; S241-A245 PolarHBondContact O-N 3.12Å
242R83.1Confident76Confident111 Ų111100 Ų10042%0.41953%0.53SS..Hα-helixtrans-62.3-46.1173.9-175177.167.3-120.8-3.6110.5E238 S244 A245 E246E238-R242 WeakPolarHBondContact O-CB 3.12Å; E238-R242 PolarHBondContact O-N 2.83Å; E238-R242 IonicContact OE1-CZ 2.6Å; E238-R242 IonicContact OE1-NH1 3.68Å; E238-R242 PolarHBondContact OE1-NH1 3.25Å; E238-R242 IonicContact OE2-CZ 3.19Å; E238-R242 IonicContact OE2-NH1 2.72Å; E238-R242 PolarHBondContact OE2-NH1 2.89Å; R242-S244 VanDerWaalsContact C-N 3.28Å; R242-S244 PolarHBondContact O-N 3Å; R242-A245 PolarHBondContact O-N 2.89Å; R242-A245 VanDerWaalsContact O-N 3.14Å; R242-E246 WeakPolarHBondContact O-CB 3.3Å; R242-E246 PolarHBondContact O-N 3.28Å
243G76.4Confident73.4Confident40 Ų4099.5 Ų99.541%0.41253%0.53SS..Hα-helixtrans-57.1-39.2174.400000113I239 L240 A247I239-G243 PolarHBondContact O-N 3.48Å; L240-G243 PolarHBondContact O-N 2.74Å; G243-A247 WeakPolarHBondContact O-CB 3.48Å; G243-A247 PolarHBondContact O-N 2.74Å
244S68.2Low71.1Confident58 Ų58100.8 Ų100.841%0.40655%0.545SS..Hα-helixtrans-70.9-38.2174.7-167.70000113.4L240 S241 R242 K248L240-S244 PolarHBondContact O-N 2.98Å; S241-S244 PolarHBondContact O-N 3.39Å; R242-S244 VanDerWaalsContact C-N 3.28Å; R242-S244 PolarHBondContact O-N 3Å; S244-K248 WeakPolarHBondContact O-CD 3.35Å; S244-K248 WeakPolarHBondContact O-CG 3.5Å; S244-K248 PolarHBondContact O-N 2.83Å
245A65.3Low68.7Low49 Ų49100.3 Ų100.341%0.40554%0.543SS..Hα-helixtrans-70.8-45.3177.600000111.7S241 R242 K248 I249S241-A245 WeakPolarHBondContact O-CB 3.47Å; S241-A245 PolarHBondContact O-N 3.12Å; R242-A245 PolarHBondContact O-N 2.89Å; R242-A245 VanDerWaalsContact O-N 3.14Å; A245-K248 PolarHBondContact O-N 2.93Å; A245-I249 WeakPolarHBondContact O-CD1 3.4Å; A245-I249 VanDerWaalsContact O-CG1 3.26Å; A245-I249 WeakPolarHBondContact O-CG1 3.49Å; A245-I249 PolarHBondContact O-N 3.39Å
246E59.3Low66.7Low109 Ų109101.8 Ų101.851%0.50956%0.56SS.*Hα-helixtrans-64.1-44.3177.7-169.3164.4-161.600110.5R242 K248 I249 T250R242-E246 WeakPolarHBondContact O-CB 3.3Å; R242-E246 PolarHBondContact O-N 3.28Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.49Å; E246-I249 PolarHBondContact O-N 2.82Å; E246-T250 WeakPolarHBondContact O-CB 3.08Å; E246-T250 PolarHBondContact O-N 3.25Å; E246-T250 PolarHBondContact O-OG1 2.86Å
247A57.8Low64.7Low57 Ų57106.4 Ų106.447%0.47157%0.573SS.*Hα-helixtrans-54.6-46.6171.300000112.6G243 I249 T250 E251G243-A247 WeakPolarHBondContact O-CB 3.48Å; G243-A247 PolarHBondContact O-N 2.74Å; A247-I249 VanDerWaalsContact C-N 3.28Å; A247-I249 PolarHBondContact O-N 2.9Å; A247-T250 PolarHBondContact O-N 2.83Å; A247-E251 WeakPolarHBondContact O-CB 3.06Å; A247-E251 PolarHBondContact O-N 3.01Å
248K56.3Low63Low149 Ų149105 Ų10565%0.64857%0.574SS**Hα-helixtrans-66.8-24.8177.3-74.9168.7179.4159.60114S244 A245 E246S244-K248 WeakPolarHBondContact O-CD 3.35Å; S244-K248 WeakPolarHBondContact O-CG 3.5Å; S244-K248 PolarHBondContact O-N 2.83Å; A245-K248 PolarHBondContact O-N 2.93Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.49Å
249I55.8Low61.4Low129 Ų129107.9 Ų107.966%0.66258%0.582SS**Hα-helixtrans-82.8-37.1175.2-68.8163.3000110.5A245 E246 A247A245-I249 WeakPolarHBondContact O-CD1 3.4Å; A245-I249 VanDerWaalsContact O-CG1 3.26Å; A245-I249 WeakPolarHBondContact O-CG1 3.49Å; A245-I249 PolarHBondContact O-N 3.39Å; E246-I249 PolarHBondContact O-N 2.82Å; A247-I249 VanDerWaalsContact C-N 3.28Å; A247-I249 PolarHBondContact O-N 2.9Å
250T50.3Low59.9Low72 Ų72113.8 Ų113.844%0.44260%0.599SS.*Hα-helixtrans-81.1-27.1-176.3-540000113.6E246 A247 V252 K253E246-T250 WeakPolarHBondContact O-CB 3.08Å; E246-T250 PolarHBondContact O-N 3.25Å; E246-T250 PolarHBondContact O-OG1 2.86Å; A247-T250 PolarHBondContact O-N 2.83Å; T250-V252 PolarHBondContact O-N 3.31Å; T250-K253 PolarHBondContact O-N 2.69Å
251E44.7Very low58.9Low166 Ų166111.4 Ų111.478%0.77661%0.607SS**THydrogen-bonded Turntrans-55.5-22.6-177.5-172.4168.8-159.300114.3A247A247-E251 WeakPolarHBondContact O-CB 3.06Å; A247-E251 PolarHBondContact O-N 3.01Å
252V46.9Very low58.5Low135 Ų135110.3 Ų110.382%0.81860%0.599SS**THydrogen-bonded Turntrans-115.1-12.3-177.4179.80000113.8T250T250-V252 PolarHBondContact O-N 3.31Å
253K41.2Very low58.4Low132 Ų132111 Ų11157%0.57462%0.621SS**  trans-143.688.8-179.5-155.8-171.6-168.6-167.90113.5T250 E255T250-K253 PolarHBondContact O-N 2.69Å; K253-E255 HydrophobicContact CD-CB 4.39Å; K253-E255 VanDerWaalsContact CE-OE1 3.24Å; K253-E255 WeakPolarHBondContact CE-OE1 3.43Å; K253-E255 HydrophobicContact CG-CB 4.36Å; K253-E255 IonicContact NZ-OE1 2.81Å; K253-E255 PolarHBondContact NZ-OE1 3.03Å; K253-E255 PolarHBondContact O-N 3.09Å
254V48.9Very low58.8Low135 Ų135115 Ų11582%0.81863%0.629SS**  trans-7175.8156.6-174.40000108.3
255E44.9Very low59.6Low121 Ų121114.7 Ų114.757%0.56562%0.623SS**  trans-63.4141.9164.6-165.7159.2-98.900108.2K253 M257K253-E255 HydrophobicContact CD-CB 4.39Å; K253-E255 VanDerWaalsContact CE-OE1 3.24Å; K253-E255 WeakPolarHBondContact CE-OE1 3.43Å; K253-E255 HydrophobicContact CG-CB 4.36Å; K253-E255 IonicContact NZ-OE1 2.81Å; K253-E255 PolarHBondContact NZ-OE1 3.03Å; K253-E255 PolarHBondContact O-N 3.09Å; E255-M257 PolarHBondContact O-N 3.19Å
256P53.7Low60.5Low111 Ų111119.8 Ų119.872%0.72164%0.638SS**  trans-63.2100.9-173.9-23.334.6000110.8T258P256-T258 PolarHBondContact O-N 3.45Å
257M52.7Low61.8Low155 Ų155119.7 Ų119.776%0.76465%0.645SS**  trans-58.399.3-178-165.666.316800108.5E255 Y259E255-M257 PolarHBondContact O-N 3.19Å; M257-Y259 WeakPolarHBondContact O-CD2 3.24Å; M257-Y259 WeakPolarHBondContact O-CE2 3.24Å; M257-Y259 PolarHBondContact O-N 3.2Å
258T57.4Low63.1Low105 Ų105120.7 Ų120.764%0.64464%0.642SS**  trans-66.3110.1-174.749.90000108.1P256 R260P256-T258 PolarHBondContact O-N 3.45Å; T258-R260 PolarHBondContact O-N 3.2Å
259Y57.4Low64.4Low149 Ų149119.2 Ų119.258%0.58464%0.641SS**  trans-7041.4-175.9-68.7-87.1000113.2M257 G261 S262 N265 L268M257-Y259 WeakPolarHBondContact O-CD2 3.24Å; M257-Y259 WeakPolarHBondContact O-CE2 3.24Å; M257-Y259 PolarHBondContact O-N 3.2Å; Y259-G261 PolarHBondContact O-N 2.93Å; Y259-S262 WeakPolarHBondContact O-CB 3.3Å; Y259-S262 PolarHBondContact O-N 2.94Å; Y259-N265 PolarHBondContact O-OD1 3.42Å; Y259-L268 HydrophobicContact CD1-CD1 4.4Å; Y259-L268 HydrophobicContact CD2-CD1 4.04Å; Y259-L268 HydrophobicContact CG-CD1 3.8Å
260R61.6Low65.9Low207 Ų207118.1 Ų118.178%0.78164%0.641SS**THydrogen-bonded Turntrans-63.2-7.4-168.2-170.4179.5-81.8-104.44.5114.4T258T258-R260 PolarHBondContact O-N 3.2Å
261G68.6Low67.8Low84 Ų84122.3 Ų122.387%0.86665%0.653SS**THydrogen-bonded Turntrans-122.79.3172.200000115Y259Y259-G261 PolarHBondContact O-N 2.93Å
262S77.8Confident69.9Low42 Ų42117.4 Ų117.429%0.29464%0.635SS.*  trans-72.8141.9175.7177.80000111.2Y259 Q264 N265Y259-S262 WeakPolarHBondContact O-CB 3.3Å; Y259-S262 PolarHBondContact O-N 2.94Å; S262-Q264 PolarHBondContact O-N 3.4Å; S262-Q264 VanDerWaalsContact O-N 3.15Å; S262-Q264 PolarHBondContact OG-N 3.24Å; S262-Q264 VanDerWaalsContact OG-N 3.1Å; S262-N265 WeakPolarHBondContact O-CB 3.49Å; S262-N265 PolarHBondContact O-N 3.06Å
263S81.4Confident72.1Confident127 Ų127115.5 Ų115.589%0.88862%0.62SS**THydrogen-bonded Turntrans-60.7-18.8168.8540000113.1
264Q84.6Confident74.5Confident123 Ų123116 Ų11658%0.57562%0.62SS**THydrogen-bonded Turntrans-101.813.1174.9-64.1-177.4-26.800113.1S262 E266 V267 L268S262-Q264 PolarHBondContact O-N 3.4Å; S262-Q264 VanDerWaalsContact O-N 3.15Å; S262-Q264 PolarHBondContact OG-N 3.24Å; S262-Q264 VanDerWaalsContact OG-N 3.1Å; Q264-E266 PolarHBondContact O-N 3.1Å; Q264-V267 PolarHBondContact O-N 3.49Å; Q264-L268 WeakPolarHBondContact O-CG 3.36Å; Q264-L268 PolarHBondContact O-N 3.02Å
265N85.5Confident76.7Confident51 Ų51116 Ų11627%0.27361%0.611SS.*Hα-helixtrans-54.4-36.1-178.917667.5000112.8Y259 S262 L268 N269Y259-N265 PolarHBondContact O-OD1 3.42Å; S262-N265 WeakPolarHBondContact O-CB 3.49Å; S262-N265 PolarHBondContact O-N 3.06Å; N265-L268 PolarHBondContact O-N 3.35Å; N265-N269 PolarHBondContact ND2-ND2 3.29Å; N265-N269 WeakPolarHBondContact O-CB 3.32Å; N265-N269 VanDerWaalsContact O-CG 3.3Å; N265-N269 PolarHBondContact O-N 3.08Å; N265-N269 PolarHBondContact O-ND2 3.02Å; N265-N269 PolarHBondContact OD1-ND2 3.03Å
266E83.6Confident79.1Confident157 Ų157116 Ų11673%0.73461%0.609SS**Hα-helixtrans-61.5-48.4174-174.7173.9-172.500112.1Q264 L268 N269 T270Q264-E266 PolarHBondContact O-N 3.1Å; E266-L268 PolarHBondContact O-N 3.32Å; E266-N269 PolarHBondContact O-N 2.99Å; E266-T270 WeakPolarHBondContact O-CB 3.44Å; E266-T270 PolarHBondContact O-N 2.73Å; E266-T270 PolarHBondContact O-OG1 3.12Å
267V87.8Confident81.1Confident106 Ų106114.7 Ų114.764%0.64260%0.595SS**Hα-helixtrans-63.1-42.4177.9-176.60000111.3Q264 T270Q264-V267 PolarHBondContact O-N 3.49Å; V267-T270 PolarHBondContact O-N 2.89Å
268L83.9Confident83.1Confident78 Ų78113.3 Ų113.341%0.40859%0.59SS.*Hα-helixtrans-67.3-37-179.9-66.8171.9000112.6Y259 Q264 N265 E266 T270Y259-L268 HydrophobicContact CD1-CD1 4.4Å; Y259-L268 HydrophobicContact CD2-CD1 4.04Å; Y259-L268 HydrophobicContact CG-CD1 3.8Å; Q264-L268 WeakPolarHBondContact O-CG 3.36Å; Q264-L268 PolarHBondContact O-N 3.02Å; N265-L268 PolarHBondContact O-N 3.35Å; E266-L268 PolarHBondContact O-N 3.32Å; L268-T270 VanDerWaalsContact C-N 3.34Å
269N82.9Confident84.9Confident119 Ų119113.2 Ų113.264%0.63658%0.582SS**Hα-helixtrans-76.3-20.8174-68.9-51000113N265 E266 K271N265-N269 PolarHBondContact ND2-ND2 3.29Å; N265-N269 WeakPolarHBondContact O-CB 3.32Å; N265-N269 VanDerWaalsContact O-CG 3.3Å; N265-N269 PolarHBondContact O-N 3.08Å; N265-N269 PolarHBondContact O-ND2 3.02Å; N265-N269 PolarHBondContact OD1-ND2 3.03Å; E266-N269 PolarHBondContact O-N 2.99Å; N269-K271 PolarHBondContact O-N 2.78Å
270T88.4Confident86.7Confident106 Ų106109.5 Ų109.565%0.6557%0.573SS**THydrogen-bonded Turntrans-85.315177.2-51.60000112.5E266 V267 L268 P272E266-T270 WeakPolarHBondContact O-CB 3.44Å; E266-T270 PolarHBondContact O-N 2.73Å; E266-T270 PolarHBondContact O-OG1 3.12Å; V267-T270 PolarHBondContact O-N 2.89Å; L268-T270 VanDerWaalsContact C-N 3.34Å; T270-P272 WeakPolarHBondContact O-CD 3.42Å
271K89.5Confident88.3Confident159 Ų159104.5 Ų104.569%0.69156%0.558SS**  trans-64.3119.3176.9-177.5-179.2177.8-178.20111N269 Y274N269-K271 PolarHBondContact O-N 2.78Å; K271-Y274 HydrophobicContact CG-CE2 4.39Å
272P89.5Confident89.6Confident64 Ų64103.5 Ų103.542%0.41654%0.538SS..  trans-76157.4179.432.1-35.4000112.2T270 Y274T270-P272 WeakPolarHBondContact O-CD 3.42Å; P272-Y274 HydrophobicContact CG-CD2 4.47Å; P272-Y274 HydrophobicContact CG-CE1 4.08Å; P272-Y274 HydrophobicContact CG-CE2 3.82Å; P272-Y274 WeakPolarHBondContact O-CD2 3.27Å; P272-Y274 PolarHBondContact O-N 2.99Å; P272-Y274 VanDerWaalsContact O-N 3.07Å
273D91.9Very high90.4Very high94 Ų94107 Ų10750%0.50355%0.548SS..  trans-79.687.2176.6-176.4-6.1000111.5Q275 K276 I277D273-Q275 PolarHBondContact O-N 2.78Å; D273-Q275 WeakPolarHBondContact OD1-CA 3.49Å; D273-Q275 WeakPolarHBondContact OD1-CB 3.48Å; D273-Q275 PolarHBondContact OD1-N 3.17Å; D273-K276 HydrophobicContact CB-CB 4.07Å; D273-K276 PolarHBondContact O-N 2.98Å; D273-K276 PolarHBondContact OD1-N 3.08Å; D273-K276 WeakPolarHBondContact OD2-CB 3.48Å; D273-I277 WeakPolarHBondContact O-CG1 3.32Å; D273-I277 PolarHBondContact O-N 3.15Å
274Y93.3Very high91.1Very high142 Ų142105 Ų10556%0.55753%0.53SS*.Hα-helixtrans-62.1-26.2174.7-61.4-79.6000113.5K271 P272 I277 L278K271-Y274 HydrophobicContact CG-CE2 4.39Å; P272-Y274 HydrophobicContact CG-CD2 4.47Å; P272-Y274 HydrophobicContact CG-CE1 4.08Å; P272-Y274 HydrophobicContact CG-CE2 3.82Å; P272-Y274 WeakPolarHBondContact O-CD2 3.27Å; P272-Y274 PolarHBondContact O-N 2.99Å; P272-Y274 VanDerWaalsContact O-N 3.07Å; Y274-I277 HydrophobicContact CD1-CD1 4.48Å; Y274-I277 PolarHBondContact O-N 3.02Å; Y274-L278 WeakPolarHBondContact O-CG 3.33Å; Y274-L278 PolarHBondContact O-N 3.04Å
275Q94.3Very high91.7Very high136 Ų136106.1 Ų106.164%0.63653%0.533SS*.Hα-helixtrans-73.8-39.7179.8-176.7168.3-21.300110.9D273 I277 L278 Q279D273-Q275 PolarHBondContact O-N 2.78Å; D273-Q275 WeakPolarHBondContact OD1-CA 3.49Å; D273-Q275 WeakPolarHBondContact OD1-CB 3.48Å; D273-Q275 PolarHBondContact OD1-N 3.17Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; Q275-L278 PolarHBondContact O-N 3.05Å; Q275-Q279 WeakPolarHBondContact O-CG 3.41Å; Q275-Q279 PolarHBondContact O-N 2.88Å
276K94.8Very high92.2Very high121 Ų121107.9 Ų107.953%0.52654%0.543SS..Hα-helixtrans-64.3-34.4169.4-179.2175.9-177.9178.60112.6D273 N280D273-K276 HydrophobicContact CB-CB 4.07Å; D273-K276 PolarHBondContact O-N 2.98Å; D273-K276 PolarHBondContact OD1-N 3.08Å; D273-K276 WeakPolarHBondContact OD2-CB 3.48Å; K276-N280 WeakPolarHBondContact O-CB 3.18Å; K276-N280 PolarHBondContact O-N 3.32Å; K276-N280 PolarHBondContact O-ND2 2.89Å
277I95.3Very high92.8Very high84 Ų84104 Ų10443%0.43153%0.532SS..Hα-helixtrans-63-48.1172.2-65.7170000110.3D273 Y274 Q275 Q279 N280 Q281D273-I277 WeakPolarHBondContact O-CG1 3.32Å; D273-I277 PolarHBondContact O-N 3.15Å; Y274-I277 HydrophobicContact CD1-CD1 4.48Å; Y274-I277 PolarHBondContact O-N 3.02Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; I277-Q279 PolarHBondContact O-N 2.95Å; I277-N280 PolarHBondContact O-N 3.37Å; I277-N280 VanDerWaalsContact O-N 3.14Å; I277-Q281 PolarHBondContact O-N 2.95Å
278L95.9Very high93.3Very high125 Ų125104 Ų10465%0.65453%0.526SS*.Hα-helixtrans-60.8-43.7176.3-74.1162.5000112.6Y274 Q275 N280 Q281 S282Y274-L278 WeakPolarHBondContact O-CG 3.33Å; Y274-L278 PolarHBondContact O-N 3.04Å; Q275-L278 PolarHBondContact O-N 3.05Å; L278-N280 VanDerWaalsContact C-N 3.26Å; L278-N280 PolarHBondContact O-N 2.89Å; L278-Q281 WeakPolarHBondContact O-CB 3.33Å; L278-Q281 PolarHBondContact O-N 3.4Å; L278-Q281 VanDerWaalsContact O-N 3.14Å; L278-S282 PolarHBondContact O-N 3.32Å; L278-S282 VanDerWaalsContact O-N 3.09Å
279Q95Very high93.9Very high104 Ų104106 Ų10649%0.48653%0.534SS..Hα-helixtrans-62.2-32174.2-74.2177.6-500113Q275 I277 K283Q275-Q279 WeakPolarHBondContact O-CG 3.41Å; Q275-Q279 PolarHBondContact O-N 2.88Å; I277-Q279 PolarHBondContact O-N 2.95Å; Q279-K283 WeakPolarHBondContact O-CG 3.35Å; Q279-K283 PolarHBondContact O-N 3.29Å
280N95.6Very high94.6Very high71 Ų71106 Ų10638%0.3853%0.533SS..Hα-helixtrans-74.4-33.2174.6-72.4-11.2000112K276 I277 L278 K283 V284K276-N280 WeakPolarHBondContact O-CB 3.18Å; K276-N280 PolarHBondContact O-N 3.32Å; K276-N280 PolarHBondContact O-ND2 2.89Å; I277-N280 PolarHBondContact O-N 3.37Å; I277-N280 VanDerWaalsContact O-N 3.14Å; L278-N280 VanDerWaalsContact C-N 3.26Å; L278-N280 PolarHBondContact O-N 2.89Å; N280-K283 PolarHBondContact O-N 2.93Å; N280-K283 PolarHBondContact OD1-NZ 2.93Å; N280-V284 WeakPolarHBondContact O-CG2 3.41Å; N280-V284 PolarHBondContact O-N 2.98Å
281Q94.9Very high95.1Very high101 Ų101104.7 Ų104.747%0.47253%0.525SS..Hα-helixtrans-63.2-41171.6-65.4-60.7-30.100111.6I277 L278 K283 V284 F285I277-Q281 PolarHBondContact O-N 2.95Å; L278-Q281 WeakPolarHBondContact O-CB 3.33Å; L278-Q281 PolarHBondContact O-N 3.4Å; L278-Q281 VanDerWaalsContact O-N 3.14Å; Q281-K283 VanDerWaalsContact C-N 3.34Å; Q281-K283 PolarHBondContact O-N 2.67Å; Q281-V284 WeakPolarHBondContact O-CB 3.4Å; Q281-V284 PolarHBondContact O-N 3.05Å; Q281-F285 VanDerWaalsContact O-CD2 3.24Å; Q281-F285 WeakPolarHBondContact O-CD2 3.5Å; Q281-F285 PolarHBondContact O-N 3.1Å; Q281-F285 VanDerWaalsContact O-N 3.13Å
282S94.9Very high95.5Very high64 Ų64102.5 Ų102.545%0.44852%0.518SS..Hα-helixtrans-53.2-51173.1-162.50000111.4L278 V284 F285 D286L278-S282 PolarHBondContact O-N 3.32Å; L278-S282 VanDerWaalsContact O-N 3.09Å; S282-V284 PolarHBondContact O-N 2.68Å; S282-V284 VanDerWaalsContact O-N 3.16Å; S282-F285 WeakPolarHBondContact O-CA 3.11Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 3.34Å; S282-D286 PolarHBondContact O-N 3.09Å; S282-D286 VanDerWaalsContact O-OD1 3.1Å
283K95.1Very high95.8Very high115 Ų115104.1 Ų104.150%0.552%0.523SS..Hα-helixtrans-61.6-25.1178.7-62.5166.1-162.2162.30114.1Q279 N280 Q281 D286 C287Q279-K283 WeakPolarHBondContact O-CG 3.35Å; Q279-K283 PolarHBondContact O-N 3.29Å; N280-K283 PolarHBondContact O-N 2.93Å; N280-K283 PolarHBondContact OD1-NZ 2.93Å; Q281-K283 VanDerWaalsContact C-N 3.34Å; Q281-K283 PolarHBondContact O-N 2.67Å; K283-D286 WeakPolarHBondContact CA-OD2 3.33Å; K283-C287 VanDerWaalsContact O-CB 3.24Å; K283-C287 WeakPolarHBondContact O-CB 3.4Å; K283-C287 PolarHBondContact O-N 3.06Å; K283-C287 VanDerWaalsContact O-N 3.1Å
284V97.2Very high96.1Very high84 Ų84106.1 Ų106.151%0.50953%0.529SS..Hα-helixtrans-75.5-35.5173.8171.40000110.8N280 Q281 S282 M288N280-V284 WeakPolarHBondContact O-CG2 3.41Å; N280-V284 PolarHBondContact O-N 2.98Å; Q281-V284 WeakPolarHBondContact O-CB 3.4Å; Q281-V284 PolarHBondContact O-N 3.05Å; S282-V284 PolarHBondContact O-N 2.68Å; S282-V284 VanDerWaalsContact O-N 3.16Å; V284-M288 WeakPolarHBondContact O-CB 3.42Å; V284-M288 PolarHBondContact O-N 3.47Å
285F96.4Very high96.3Very high147 Ų147104.7 Ų104.765%0.64553%0.531SS*.Hα-helixtrans-66.5-47.8169.5-72.1-72.5000111.6Q281 S282 C287 M288 E289Q281-F285 VanDerWaalsContact O-CD2 3.24Å; Q281-F285 WeakPolarHBondContact O-CD2 3.5Å; Q281-F285 PolarHBondContact O-N 3.1Å; Q281-F285 VanDerWaalsContact O-N 3.13Å; S282-F285 WeakPolarHBondContact O-CA 3.11Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 3.34Å; F285-C287 PolarHBondContact O-N 2.88Å; F285-M288 PolarHBondContact O-N 3.05Å; F285-E289 PolarHBondContact O-N 3.12Å
286D96.4Very high96.4Very high89 Ų89103.1 Ų103.148%0.47652%0.524SS..Hα-helixtrans-54.7-39.4176.8-47.9-23.4000111.4S282 K283 L290S282-D286 PolarHBondContact O-N 3.09Å; S282-D286 VanDerWaalsContact O-OD1 3.1Å; K283-D286 WeakPolarHBondContact CA-OD2 3.33Å; D286-L290 PolarHBondContact O-N 3.44Å
287C96.2Very high96.6Very high74 Ų7499 Ų9950%0.552%0.516SS..Hα-helixtrans-71.2-41.2176.3-172.80000112.8K283 F285 L290 V291K283-C287 VanDerWaalsContact O-CB 3.24Å; K283-C287 WeakPolarHBondContact O-CB 3.4Å; K283-C287 PolarHBondContact O-N 3.06Å; K283-C287 VanDerWaalsContact O-N 3.1Å; F285-C287 PolarHBondContact O-N 2.88Å; C287-L290 PolarHBondContact O-N 3.25Å; C287-V291 WeakPolarHBondContact O-CG2 3.41Å; C287-V291 PolarHBondContact O-N 3.11Å; C287-V291 VanDerWaalsContact O-N 3.11Å
288M97.3Very high96.6Very high108 Ų10898.2 Ų98.253%0.53252%0.518SS..Hα-helixtrans-65.4-39.4177.1-175.26980.700111.7V284 F285 V291 M292V284-M288 WeakPolarHBondContact O-CB 3.42Å; V284-M288 PolarHBondContact O-N 3.47Å; F285-M288 PolarHBondContact O-N 3.05Å; M288-V291 PolarHBondContact O-N 2.77Å; M288-M292 HydrophobicContact CG-CE 4.33Å; M288-M292 WeakPolarHBondContact O-CG 3.34Å; M288-M292 PolarHBondContact O-N 3.32Å
289E97.3Very high96.7Very high120 Ų12096.4 Ų96.456%0.56151%0.512SS*.Hα-helixtrans-59-50.3174.8-174.4168.8-153.400110.9F285 V291 M292 D293F285-E289 PolarHBondContact O-N 3.12Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 2.63Å; E289-M292 PolarHBondContact O-N 3.14Å; E289-M292 VanDerWaalsContact O-N 3.12Å; E289-D293 PolarHBondContact O-N 2.81Å
290L97.7Very high96.8Very high119 Ų11997.4 Ų97.462%0.62351%0.514SS*.Hα-helixtrans-57.8-41.4176.7-177.663.3000113D286 C287 D293 E294D286-L290 PolarHBondContact O-N 3.44Å; C287-L290 PolarHBondContact O-N 3.25Å; L290-D293 PolarHBondContact O-N 2.72Å; L290-E294 WeakPolarHBondContact O-CB 3.48Å; L290-E294 PolarHBondContact O-N 3.36Å
291V97.8Very high96.9Very high78 Ų78100.7 Ų100.747%0.47353%0.527SS..Hα-helixtrans-67.9-36.5177.5170.40000111.8C287 M288 E289 L295C287-V291 WeakPolarHBondContact O-CG2 3.41Å; C287-V291 PolarHBondContact O-N 3.11Å; C287-V291 VanDerWaalsContact O-N 3.11Å; M288-V291 PolarHBondContact O-N 2.77Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 2.63Å; V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.49Å; V291-L295 PolarHBondContact O-N 2.89Å
292M97.7Very high97Very high112 Ų112100.6 Ų100.655%0.55253%0.53SS*.Hα-helixtrans-67.9-39.7174.1-71.7-171.7-6000112M288 E289 L295 Q296M288-M292 HydrophobicContact CG-CE 4.33Å; M288-M292 WeakPolarHBondContact O-CG 3.34Å; M288-M292 PolarHBondContact O-N 3.32Å; E289-M292 PolarHBondContact O-N 3.14Å; E289-M292 VanDerWaalsContact O-N 3.12Å; M292-L295 PolarHBondContact O-N 2.84Å; M292-Q296 VanDerWaalsContact O-CB 3.32Å; M292-Q296 WeakPolarHBondContact O-CB 3.49Å; M292-Q296 PolarHBondContact O-N 2.75Å
293D97.8Very high97.1Very high98 Ų98101.7 Ų101.752%0.52453%0.528SS..Hα-helixtrans-67.3-43.7176.7-89-4.8000112.4E289 L290 L295 Q296 G297E289-D293 PolarHBondContact O-N 2.81Å; L290-D293 PolarHBondContact O-N 2.72Å; D293-L295 VanDerWaalsContact C-N 3.35Å; D293-L295 PolarHBondContact O-N 2.7Å; D293-Q296 PolarHBondContact O-N 3.13Å; D293-G297 PolarHBondContact O-N 2.9Å
294E97.1Very high97.2Very high136 Ų13698.6 Ų98.664%0.63652%0.523SS*.Hα-helixtrans-62-42.4174.8-175.9175.9-165.700111.5L290 G297 S298L290-E294 WeakPolarHBondContact O-CB 3.48Å; L290-E294 PolarHBondContact O-N 3.36Å; E294-G297 PolarHBondContact O-N 3.5Å; E294-S298 WeakPolarHBondContact O-CB 3.46Å; E294-S298 PolarHBondContact O-N 3.47Å; E294-S298 PolarHBondContact O-OG 3.33Å
295L97.6Very high97.2Very high113 Ų113100.4 Ų100.459%0.59253%0.525SS*.Hα-helixtrans-63.8-44.6175.1-179.561.1000111.5V291 M292 D293 S298 V299V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.49Å; V291-L295 PolarHBondContact O-N 2.89Å; M292-L295 PolarHBondContact O-N 2.84Å; D293-L295 VanDerWaalsContact C-N 3.35Å; D293-L295 PolarHBondContact O-N 2.7Å; L295-S298 PolarHBondContact O-N 3.27Å; L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 2.82Å
296Q97.3Very high97.3Very high102 Ų10297.5 Ų97.548%0.47751%0.514SS..Hα-helixtrans-65.8-39.7178.3-163.5-162.277.300111.7M292 D293 V299 K300M292-Q296 VanDerWaalsContact O-CB 3.32Å; M292-Q296 WeakPolarHBondContact O-CB 3.49Å; M292-Q296 PolarHBondContact O-N 2.75Å; D293-Q296 PolarHBondContact O-N 3.13Å; Q296-V299 PolarHBondContact O-N 2.95Å; Q296-K300 HydrophobicContact CG-CD 4.49Å; Q296-K300 VanDerWaalsContact O-CG 3.3Å; Q296-K300 WeakPolarHBondContact O-CG 3.48Å; Q296-K300 PolarHBondContact O-N 3.11Å
297G97.2Very high97.3Very high35 Ų3598.5 Ų98.536%0.36152%0.516SS..Hα-helixtrans-61.5-45.3172.900000112.1D293 E294 V299 K300 Q301D293-G297 PolarHBondContact O-N 2.9Å; E294-G297 PolarHBondContact O-N 3.5Å; G297-V299 PolarHBondContact O-N 3.35Å; G297-K300 PolarHBondContact O-N 2.89Å; G297-Q301 PolarHBondContact O-N 2.97Å
298S97.1Very high97.3Very high68 Ų68101.7 Ų101.748%0.47652%0.524SS..Hα-helixtrans-61.3-42.5176.7-60.90000112.4E294 L295 Q301 L302E294-S298 WeakPolarHBondContact O-CB 3.46Å; E294-S298 PolarHBondContact O-N 3.47Å; E294-S298 PolarHBondContact O-OG 3.33Å; L295-S298 PolarHBondContact O-N 3.27Å; S298-Q301 PolarHBondContact O-N 3.34Å; S298-L302 PolarHBondContact O-N 3.34Å
299V97.7Very high97.2Very high87 Ų8798 Ų9853%0.52751%0.508SS..Hα-helixtrans-65.2-41.8175.3170.40000111.6L295 Q296 G297 Q301 L302 Q303L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 2.82Å; Q296-V299 PolarHBondContact O-N 2.95Å; G297-V299 PolarHBondContact O-N 3.35Å; V299-Q301 PolarHBondContact O-N 3.37Å; V299-L302 PolarHBondContact O-N 2.93Å; V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 PolarHBondContact O-N 3.45Å
300K97.1Very high97.1Very high125 Ų12596.6 Ų96.654%0.54351%0.508SS..Hα-helixtrans-61.6-41.5174.4-74.4163.8172.9172.10112Q296 G297 Q303 A304Q296-K300 HydrophobicContact CG-CD 4.49Å; Q296-K300 VanDerWaalsContact O-CG 3.3Å; Q296-K300 WeakPolarHBondContact O-CG 3.48Å; Q296-K300 PolarHBondContact O-N 3.11Å; G297-K300 PolarHBondContact O-N 2.89Å; K300-Q303 PolarHBondContact O-N 3.27Å; K300-A304 PolarHBondContact O-N 2.98Å
301Q97.5Very high96.9Very high139 Ų13996.2 Ų96.265%0.6550%0.503SS*.Hα-helixtrans-65.2-41.2177.2-174.961.328.500111.9G297 S298 V299 A304 F305G297-Q301 PolarHBondContact O-N 2.97Å; S298-Q301 PolarHBondContact O-N 3.34Å; V299-Q301 PolarHBondContact O-N 3.37Å; Q301-A304 PolarHBondContact O-N 3.45Å; Q301-F305 PolarHBondContact O-N 3.35Å; Q301-F305 VanDerWaalsContact O-N 3.08Å
302L97.3Very high96.7Very high100 Ų10095.6 Ų95.652%0.52450%0.501SS..Hα-helixtrans-64.3-42.4174.3179.860.7000111.8S298 V299 F305 M306S298-L302 PolarHBondContact O-N 3.34Å; V299-L302 PolarHBondContact O-N 2.93Å; L302-F305 PolarHBondContact O-N 2.89Å; L302-M306 HydrophobicContact CG-CE 4.46Å; L302-M306 WeakPolarHBondContact O-CG 3.34Å; L302-M306 PolarHBondContact O-N 3.01Å
303Q97.2Very high96.5Very high87 Ų8797 Ų9741%0.40751%0.505SS..Hα-helixtrans-59.4-47.6175.9-178.662.82700111.5V299 K300 F305 M306 E307V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 PolarHBondContact O-N 3.45Å; K300-Q303 PolarHBondContact O-N 3.27Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 2.85Å; Q303-M306 PolarHBondContact O-N 3.22Å; Q303-M306 VanDerWaalsContact O-N 3.16Å; Q303-M306 VanDerWaalsContact OE1-CE 3.26Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.24Å; Q303-E307 PolarHBondContact NE2-OE1 3.04Å; Q303-E307 WeakPolarHBondContact O-CG 3.37Å; Q303-E307 PolarHBondContact O-N 2.83Å
304A97Very high96.3Very high49 Ų4998.1 Ų98.141%0.40551%0.507SS..Hα-helixtrans-60.1-40.9176.500000112.4K300 Q301 E307 E308K300-A304 PolarHBondContact O-N 2.98Å; Q301-A304 PolarHBondContact O-N 3.45Å; A304-E307 PolarHBondContact O-N 2.91Å; A304-E308 PolarHBondContact O-N 2.86Å
305F97.4Very high96.1Very high122 Ų12297.2 Ų97.254%0.53550%0.501SS..Hα-helixtrans-64.5-37.8174.8173.9-101.7000112.9Q301 L302 Q303 S309Q301-F305 PolarHBondContact O-N 3.35Å; Q301-F305 VanDerWaalsContact O-N 3.08Å; L302-F305 PolarHBondContact O-N 2.89Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 2.85Å; F305-S309 WeakPolarHBondContact O-CB 3.44Å; F305-S309 PolarHBondContact O-N 2.86Å; F305-S309 PolarHBondContact O-OG 3.12Å
306M96.7Very high95.9Very high87 Ų8795.6 Ų95.643%0.42950%0.495SS..Hα-helixtrans-67.2-39.2173.9-70.2-169.5-62.300112L302 Q303 S309 T310L302-M306 HydrophobicContact CG-CE 4.46Å; L302-M306 WeakPolarHBondContact O-CG 3.34Å; L302-M306 PolarHBondContact O-N 3.01Å; Q303-M306 PolarHBondContact O-N 3.22Å; Q303-M306 VanDerWaalsContact O-N 3.16Å; Q303-M306 VanDerWaalsContact OE1-CE 3.26Å; M306-S309 PolarHBondContact O-N 2.88Å; M306-T310 WeakPolarHBondContact O-CB 3.41Å; M306-T310 WeakPolarHBondContact O-CG2 3.45Å; M306-T310 PolarHBondContact O-N 3.19Å; M306-T310 PolarHBondContact O-OG1 3.48Å
307E97.1Very high95.6Very high110 Ų11094 Ų9451%0.51450%0.496SS..Hα-helixtrans-67.1-43.4176.1-73.5176-159.800112.2Q303 A304 T310 Q311Q303-E307 WeakPolarHBondContact CG-OE1 3.24Å; Q303-E307 PolarHBondContact NE2-OE1 3.04Å; Q303-E307 WeakPolarHBondContact O-CG 3.37Å; Q303-E307 PolarHBondContact O-N 2.83Å; A304-E307 PolarHBondContact O-N 2.91Å; E307-T310 WeakPolarHBondContact CA-OG1 3.29Å; E307-T310 PolarHBondContact O-OG1 3.47Å; E307-T310 VanDerWaalsContact O-OG1 3.14Å; E307-Q311 VanDerWaalsContact O-CB 3.23Å; E307-Q311 WeakPolarHBondContact O-CB 3.4Å; E307-Q311 PolarHBondContact O-N 3.36Å
308E96.3Very high95.2Very high141 Ų14195.5 Ų95.566%0.65950%0.498SS*.Hα-helixtrans-63.5-45.4173.4-177.4171.7-154.100111.4A304 Q311 C312A304-E308 PolarHBondContact O-N 2.86Å; E308-Q311 PolarHBondContact O-N 3.32Å; E308-C312 VanDerWaalsContact O-CB 3.3Å; E308-C312 WeakPolarHBondContact O-CB 3.32Å; E308-C312 PolarHBondContact O-N 2.94Å
309S94.8Very high94.7Very high30 Ų3098.8 Ų98.821%0.2151%0.505CS..Hα-helixtrans-61-49.2178.9-65.30000111.8F305 M306 Q311 C312 F313F305-S309 WeakPolarHBondContact O-CB 3.44Å; F305-S309 PolarHBondContact O-N 2.86Å; F305-S309 PolarHBondContact O-OG 3.12Å; M306-S309 PolarHBondContact O-N 2.88Å; S309-Q311 PolarHBondContact O-N 2.93Å; S309-C312 WeakPolarHBondContact O-CB 3.5Å; S309-C312 PolarHBondContact O-N 2.88Å; S309-F313 WeakPolarHBondContact O-CD2 3.28Å; S309-F313 WeakPolarHBondContact O-CG 3.5Å; S309-F313 PolarHBondContact O-N 2.89Å
310T95.2Very high94Very high90 Ų90100.6 Ų100.655%0.55251%0.512SS*.Hα-helixtrans-65.1-38.5177.950.80000111.8M306 E307 C312 F313 Q314M306-T310 WeakPolarHBondContact O-CB 3.41Å; M306-T310 WeakPolarHBondContact O-CG2 3.45Å; M306-T310 PolarHBondContact O-N 3.19Å; M306-T310 PolarHBondContact O-OG1 3.48Å; E307-T310 WeakPolarHBondContact CA-OG1 3.29Å; E307-T310 PolarHBondContact O-OG1 3.47Å; E307-T310 VanDerWaalsContact O-OG1 3.14Å; T310-C312 VanDerWaalsContact C-N 3.34Å; T310-C312 PolarHBondContact O-N 3.29Å; T310-F313 PolarHBondContact O-N 3.31Å; T310-Q314 VanDerWaalsContact O-CB 3.3Å; T310-Q314 WeakPolarHBondContact O-CB 3.42Å; T310-Q314 PolarHBondContact O-N 3.17Å
311Q94.5Very high93.2Very high111 Ų11196.5 Ų96.552%0.51950%0.504SS..Hα-helixtrans-64.7-37.5173.1-164.1-165.494.900111.9E307 E308 S309 Q314 K315E307-Q311 VanDerWaalsContact O-CB 3.23Å; E307-Q311 WeakPolarHBondContact O-CB 3.4Å; E307-Q311 PolarHBondContact O-N 3.36Å; E308-Q311 PolarHBondContact O-N 3.32Å; S309-Q311 PolarHBondContact O-N 2.93Å; Q311-Q314 PolarHBondContact O-N 3.4Å; Q311-K315 HydrophobicContact CG-CD 4.45Å; Q311-K315 WeakPolarHBondContact O-CB 3.34Å; Q311-K315 WeakPolarHBondContact O-CD 3.39Å; Q311-K315 VanDerWaalsContact O-CG 3.23Å; Q311-K315 WeakPolarHBondContact O-CG 3.5Å; Q311-K315 PolarHBondContact O-N 3.13Å
312C93.1Very high92.4Very high65 Ų6596.1 Ų96.144%0.43950%0.501SS..Hα-helixtrans-64.7-49.8174.9-171.10000111.7E308 S309 T310 Q314 K315 V316E308-C312 VanDerWaalsContact O-CB 3.3Å; E308-C312 WeakPolarHBondContact O-CB 3.32Å; E308-C312 PolarHBondContact O-N 2.94Å; S309-C312 WeakPolarHBondContact O-CB 3.5Å; S309-C312 PolarHBondContact O-N 2.88Å; T310-C312 VanDerWaalsContact C-N 3.34Å; T310-C312 PolarHBondContact O-N 3.29Å; C312-Q314 VanDerWaalsContact C-N 3.3Å; C312-Q314 PolarHBondContact O-N 3.04Å; C312-K315 WeakPolarHBondContact O-CB 3.35Å; C312-K315 PolarHBondContact O-N 3.34Å; C312-K315 VanDerWaalsContact O-N 3.15Å; C312-V316 PolarHBondContact O-N 2.83Å
313F94.1Very high91.4Very high143 Ų143100 Ų10063%0.62751%0.508SS*.Hα-helixtrans-59.1-40.4174.8-69.7-55000112S309 T310 V316 S317S309-F313 WeakPolarHBondContact O-CD2 3.28Å; S309-F313 WeakPolarHBondContact O-CG 3.5Å; S309-F313 PolarHBondContact O-N 2.89Å; T310-F313 PolarHBondContact O-N 3.31Å; F313-V316 WeakPolarHBondContact O-CG2 3.13Å; F313-V316 PolarHBondContact O-N 3.07Å; F313-S317 WeakPolarHBondContact O-CB 3.29Å; F313-S317 PolarHBondContact O-N 3.37Å
314Q93.3Very high90Very high121 Ų12199.1 Ų99.157%0.56551%0.512SS*.Hα-helixtrans-66.5-39.8175.6-169.668.1-13.400112.2T310 Q311 C312 V318T310-Q314 VanDerWaalsContact O-CB 3.3Å; T310-Q314 WeakPolarHBondContact O-CB 3.42Å; T310-Q314 PolarHBondContact O-N 3.17Å; Q311-Q314 PolarHBondContact O-N 3.4Å; C312-Q314 VanDerWaalsContact C-N 3.3Å; C312-Q314 PolarHBondContact O-N 3.04Å; Q314-V318 WeakPolarHBondContact O-CB 3.43Å; Q314-V318 VanDerWaalsContact O-CG2 3.27Å; Q314-V318 WeakPolarHBondContact O-CG2 3.23Å; Q314-V318 PolarHBondContact O-N 3.42Å
315K93.8Very high88.3Confident117 Ų117101.4 Ų101.451%0.50952%0.517SS..Hα-helixtrans-59.1-50.3173.8-78.1160.3169.3169.50111.5Q311 C312 V318 Q319Q311-K315 HydrophobicContact CG-CD 4.45Å; Q311-K315 WeakPolarHBondContact O-CB 3.34Å; Q311-K315 WeakPolarHBondContact O-CD 3.39Å; Q311-K315 VanDerWaalsContact O-CG 3.23Å; Q311-K315 WeakPolarHBondContact O-CG 3.5Å; Q311-K315 PolarHBondContact O-N 3.13Å; C312-K315 WeakPolarHBondContact O-CB 3.35Å; C312-K315 PolarHBondContact O-N 3.34Å; C312-K315 VanDerWaalsContact O-N 3.15Å; K315-V318 PolarHBondContact O-N 3.39Å; K315-Q319 WeakPolarHBondContact O-CG 3.37Å; K315-Q319 PolarHBondContact O-N 2.89Å
316V92.6Very high86.5Confident78 Ų78103 Ų10347%0.47353%0.526SS..Hα-helixtrans-71.2-35.4-179.5-59.40000112.5C312 F313 Q319 L320C312-V316 PolarHBondContact O-N 2.83Å; F313-V316 WeakPolarHBondContact O-CG2 3.13Å; F313-V316 PolarHBondContact O-N 3.07Å; V316-Q319 PolarHBondContact O-N 3Å; V316-L320 WeakPolarHBondContact O-CB 3.33Å; V316-L320 PolarHBondContact O-N 3.29Å
317S89.9Confident84.5Confident70 Ų70106.1 Ų106.149%0.4954%0.54SS..Hα-helixtrans-60.6-47173.2-178.40000111.5F313 Q319 L320 G321F313-S317 WeakPolarHBondContact O-CB 3.29Å; F313-S317 PolarHBondContact O-N 3.37Å; S317-Q319 PolarHBondContact O-N 3.16Å; S317-L320 PolarHBondContact O-N 2.99Å; S317-G321 PolarHBondContact O-N 3.44Å
318V88.7Confident82.3Confident66 Ų66103.4 Ų103.440%0.453%0.528SS..Hα-helixtrans-65.9-37175.61700000112Q314 K315 K322Q314-V318 WeakPolarHBondContact O-CB 3.43Å; Q314-V318 VanDerWaalsContact O-CG2 3.27Å; Q314-V318 WeakPolarHBondContact O-CG2 3.23Å; Q314-V318 PolarHBondContact O-N 3.42Å; K315-V318 PolarHBondContact O-N 3.39Å; V318-K322 HydrophobicContact CG1-CD 4.14Å; V318-K322 WeakPolarHBondContact O-CB 3.46Å; V318-K322 VanDerWaalsContact O-CG 3.24Å; V318-K322 WeakPolarHBondContact O-CG 3.3Å; V318-K322 PolarHBondContact O-N 3.48Å
319Q86.8Confident80.5Confident137 Ų137102.9 Ų102.964%0.6453%0.53SS*.Hα-helixtrans-67.2-43.1174.5-75.6-175.514.600112.5K315 V316 S317 K322 R323K315-Q319 WeakPolarHBondContact O-CG 3.37Å; K315-Q319 PolarHBondContact O-N 2.89Å; V316-Q319 PolarHBondContact O-N 3Å; S317-Q319 PolarHBondContact O-N 3.16Å; Q319-K322 PolarHBondContact O-N 2.86Å; Q319-R323 WeakPolarHBondContact O-CB 3.44Å; Q319-R323 PolarHBondContact O-N 3.28Å
320L83.8Confident78.7Confident125 Ų125107.2 Ų107.265%0.65456%0.557SS**Hα-helixtrans-66-43.9177.3-177.762.4000111.1V316 S317 R323 S324V316-L320 WeakPolarHBondContact O-CB 3.33Å; V316-L320 PolarHBondContact O-N 3.29Å; S317-L320 PolarHBondContact O-N 2.99Å; L320-R323 PolarHBondContact O-N 2.99Å; L320-S324 VanDerWaalsContact O-CB 3.28Å; L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 3.22Å
321G80.6Confident77Confident38 Ų38105.6 Ų105.639%0.39255%0.55SS..Hα-helixtrans-59-46.1173.600000112.2S317 L325S317-G321 PolarHBondContact O-N 3.44Å; G321-L325 WeakPolarHBondContact O-CB 2.94Å; G321-L325 PolarHBondContact O-N 3.27Å
322K81.2Confident75.4Confident132 Ų132105.3 Ų105.357%0.57456%0.557SS**Hα-helixtrans-59.1-52.9172-77.4173179.8-178.80111.4V318 Q319 S324 L325 Q326V318-K322 HydrophobicContact CG1-CD 4.14Å; V318-K322 WeakPolarHBondContact O-CB 3.46Å; V318-K322 VanDerWaalsContact O-CG 3.24Å; V318-K322 WeakPolarHBondContact O-CG 3.3Å; V318-K322 PolarHBondContact O-N 3.48Å; Q319-K322 PolarHBondContact O-N 2.86Å; K322-S324 PolarHBondContact O-N 3.42Å; K322-L325 PolarHBondContact O-N 3.34Å; K322-Q326 WeakPolarHBondContact O-CB 3.5Å; K322-Q326 PolarHBondContact O-N 3.11Å
323R75.6Confident74Confident180 Ų180104.4 Ų104.468%0.67956%0.555SS**Hα-helixtrans-60.9-43.6-176-162175.2-168.3120.20.7112Q319 L320 Q327Q319-R323 WeakPolarHBondContact O-CB 3.44Å; Q319-R323 PolarHBondContact O-N 3.28Å; L320-R323 PolarHBondContact O-N 2.99Å; R323-Q327 WeakPolarHBondContact O-CB 3.34Å; R323-Q327 WeakPolarHBondContact O-CG 3.37Å; R323-Q327 PolarHBondContact O-N 2.84Å
324S67.7Low72.4Confident70 Ų70102.9 Ų102.949%0.4955%0.545SS..Hα-helixtrans-62.7-51.5174.1-178.30000112L320 K322 Q326 L328L320-S324 VanDerWaalsContact O-CB 3.28Å; L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 3.22Å; K322-S324 PolarHBondContact O-N 3.42Å; S324-Q326 VanDerWaalsContact C-N 3.29Å; S324-Q326 PolarHBondContact O-N 3.2Å; S324-L328 WeakPolarHBondContact O-CG 3.49Å; S324-L328 PolarHBondContact O-N 3Å; S324-L328 VanDerWaalsContact O-N 3.11Å
325L60.6Low70.8Confident96 Ų96105.1 Ų105.150%0.50355%0.553SS.*Hα-helixtrans-75.6-15.2-175.1-158.271.8000114.2G321 K322 R334G321-L325 WeakPolarHBondContact O-CB 2.94Å; G321-L325 PolarHBondContact O-N 3.27Å; K322-L325 PolarHBondContact O-N 3.34Å; L325-R334 PolarHBondContact O-NH1 3.07Å
326Q59.4Low69.2Low155 Ų155105.3 Ų105.372%0.72456%0.559SS**Hα-helixtrans-104.3-21.3179.5-164.2170.113.100113.1K322 S324K322-Q326 WeakPolarHBondContact O-CB 3.5Å; K322-Q326 PolarHBondContact O-N 3.11Å; S324-Q326 VanDerWaalsContact C-N 3.29Å; S324-Q326 PolarHBondContact O-N 3.2Å
327Q54.8Low67.8Low154 Ų154107.3 Ų107.372%0.7257%0.566SS**Hα-helixtrans-74-19157-71.6-171-81.700111.7R323 D329R323-Q327 WeakPolarHBondContact O-CB 3.34Å; R323-Q327 WeakPolarHBondContact O-CG 3.37Å; R323-Q327 PolarHBondContact O-N 2.84Å; Q327-D329 PolarHBondContact O-N 2.87Å
328L52.3Low66.2Low53 Ų53111.6 Ų111.628%0.27758%0.576SS.*  trans-78.456.1164.2-71.9169.8000112.4S324 R334S324-L328 WeakPolarHBondContact O-CG 3.49Å; S324-L328 PolarHBondContact O-N 3Å; S324-L328 VanDerWaalsContact O-N 3.11Å; L328-R334 PolarHBondContact O-NH1 2.66Å
329D58.9Low64.6Low129 Ų129113.8 Ų113.869%0.6959%0.585SS**  trans-52.1165.1150.6-137.814000109.5Q327 S331Q327-D329 PolarHBondContact O-N 2.87Å; D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.01Å
330P56.9Low63.1Low121 Ų121114.4 Ų114.479%0.78659%0.588SS**SBendtrans-69.264.8-149.129-38000117
331S58.8Low61.6Low56 Ų56116.2 Ų116.239%0.39260%0.597SS.*  trans-79.4140.5178.41760000111.1D329 A333 R334D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.01Å; S331-A333 PolarHBondContact O-N 2.97Å; S331-R334 WeakPolarHBondContact O-CB 3.45Å; S331-R334 PolarHBondContact O-N 3.41Å
332P61.6Low59.9Low105 Ų105121.3 Ų121.368%0.68261%0.611SS**THydrogen-bonded Turntrans-51.9-31.4-176.7-30.136.2000115.3R334 K335P332-R334 PolarHBondContact O-N 3.28Å; P332-R334 VanDerWaalsContact O-N 3.11Å; P332-K335 WeakPolarHBondContact O-CB 3.4Å; P332-K335 PolarHBondContact O-N 3.44Å
333A61.8Low57.9Low47 Ų47121.2 Ų121.239%0.38862%0.616SS.*Hα-helixtrans-55-29.8178.300000113.5S331 K335 L336 L337S331-A333 PolarHBondContact O-N 2.97Å; A333-K335 PolarHBondContact O-N 3.31Å; A333-L336 PolarHBondContact O-N 3.16Å; A333-L336 VanDerWaalsContact O-N 3.1Å; A333-L337 PolarHBondContact O-N 2.89Å
334R61.5Low56.5Low111 Ų111118.1 Ų118.142%0.41962%0.62SS.*Hα-helixtrans-66.7-21.2179.6-158.2168-178.1152.81.8112.9L325 L328 S331 P332 K338L325-R334 PolarHBondContact O-NH1 3.07Å; L328-R334 PolarHBondContact O-NH1 2.66Å; S331-R334 WeakPolarHBondContact O-CB 3.45Å; S331-R334 PolarHBondContact O-N 3.41Å; P332-R334 PolarHBondContact O-N 3.28Å; P332-R334 VanDerWaalsContact O-N 3.11Å; R334-K338 WeakPolarHBondContact O-CB 3.39Å; R334-K338 PolarHBondContact O-N 3.32Å
335K59.9Low55.1Low167 Ų167121 Ų12173%0.72664%0.637SS**Hα-helixtrans-71.8-38.8171.1-68.1-174.7177.3-179.60112.1P332 A333 K338 L339P332-K335 WeakPolarHBondContact O-CB 3.4Å; P332-K335 PolarHBondContact O-N 3.44Å; A333-K335 PolarHBondContact O-N 3.31Å; K335-K338 PolarHBondContact O-N 2.97Å; K335-L339 WeakPolarHBondContact O-CG 2.76Å; K335-L339 PolarHBondContact O-N 2.96Å
336L60.3Low54Low122 Ų122121 Ų12164%0.63965%0.651SS**Hα-helixtrans-66.4-45.8-179.9-61.7174.1000111.6A333 K338 L339 Q340A333-L336 PolarHBondContact O-N 3.16Å; A333-L336 VanDerWaalsContact O-N 3.1Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 3.25Å; L336-L339 PolarHBondContact O-N 2.87Å; L336-Q340 PolarHBondContact O-N 3.3Å
337L61.7Low53.1Low119 Ų119120.3 Ų120.362%0.62366%0.658SS**Hα-helixtrans-65-34.6176.9-67.6174.4000112.6A333 L339 Q340 L341A333-L337 PolarHBondContact O-N 2.89Å; L337-L339 VanDerWaalsContact C-N 3.35Å; L337-Q340 PolarHBondContact O-N 2.97Å; L337-L341 PolarHBondContact O-N 3.12Å
338K57.4Low52.2Low161 Ų161124.9 Ų124.970%0.767%0.668SS**Hα-helixtrans-71.7-29.1178.9-155175.4-174.2-174.90112.8R334 K335 L336R334-K338 WeakPolarHBondContact O-CB 3.39Å; R334-K338 PolarHBondContact O-N 3.32Å; K335-K338 PolarHBondContact O-N 2.97Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 3.25Å
339L54.6Low51.4Low111 Ų111125.4 Ų125.458%0.58169%0.687SS**Hα-helixtrans-69.1-41171.5-73.3166.1000112.1K335 L336 L337 L341 Q342K335-L339 WeakPolarHBondContact O-CG 2.76Å; K335-L339 PolarHBondContact O-N 2.96Å; L336-L339 PolarHBondContact O-N 2.87Å; L337-L339 VanDerWaalsContact C-N 3.35Å; L339-L341 VanDerWaalsContact C-N 3.28Å; L339-L341 PolarHBondContact O-N 3.05Å; L339-Q342 PolarHBondContact O-N 3.45Å
340Q55.6Low50.3Low151 Ų151125.5 Ų125.571%0.70670%0.698SS**Hα-helixtrans-60.2-37177-72.5-70.3-1600112.5L336 L337 Q342L336-Q340 PolarHBondContact O-N 3.3Å; L337-Q340 PolarHBondContact O-N 2.97Å; Q340-Q342 VanDerWaalsContact C-N 3.31Å; Q340-Q342 PolarHBondContact O-N 2.97Å
341L53.3Low49.3Very low163 Ų163123.6 Ų123.685%0.85370%0.7SS**THydrogen-bonded Turntrans-83.2-0.2179.8-145.976.6000114.4L337 L339L337-L341 PolarHBondContact O-N 3.12Å; L339-L341 VanDerWaalsContact C-N 3.28Å; L339-L341 PolarHBondContact O-N 3.05Å
342Q44.2Very low48.2Very low144 Ų144126.8 Ų126.867%0.67372%0.722SS**THydrogen-bonded Turntrans-100.88.5-176.7-154.7164.113.900113.6L339 Q340 P344L339-Q342 PolarHBondContact O-N 3.45Å; Q340-Q342 VanDerWaalsContact C-N 3.31Å; Q340-Q342 PolarHBondContact O-N 2.97Å; Q342-P344 VanDerWaalsContact O-CD 3.29Å; Q342-P344 WeakPolarHBondContact O-CD 3.14Å
343N38.4Very low47.2Very low130 Ų130127.2 Ų127.270%0.69573%0.726SS**  trans-105.796.4172.9-73.7-34.6000111
344P45.9Very low46.1Very low115 Ų115137.9 Ų137.975%0.74777%0.768SS**PPolyproline II helixtrans-83.6127.6174.731.8-32.6000111.9Q342Q342-P344 VanDerWaalsContact O-CD 3.29Å; Q342-P344 WeakPolarHBondContact O-CD 3.14Å
345P39.9Very low45.3Very low130 Ų130139.2 Ų139.284%0.84479%0.785SS**PPolyproline II helixtrans-72127.8156.9-1027.2000109
346A37Very low44.5Very low98 Ų98137.7 Ų137.781%0.8179%0.789SS**PPolyproline II helixtrans-76.6152.7178.600000112.8R348A346-R348 PolarHBondContact O-N 2.66Å
347T40.8Very low43.6Very low140 Ų140138.6 Ų138.686%0.85980%0.797SS**PPolyproline II helixtrans-47.5118.1-177-44.60000115.7
348R35.8Very low42.6Very low249 Ų249139.8 Ų139.894%0.9481%0.807SS**  trans-147.3142.7142.5-66.8-167.4-179.9-162.2-0.1108.3A346A346-R348 PolarHBondContact O-N 2.66Å
349G34.2Very low41.6Very low65 Ų65138.4 Ų138.467%0.6781%0.814SS**  cis149.4120.4-6.100000111.2
350S37.3Very low40.8Very low131 Ų131140.3 Ų140.392%0.91683%0.829SS**  trans60.5127.4-178.8-63.30000116.9
351G35.7Very low39.7Very low81 Ų81139.5 Ų139.584%0.83584%0.838SS**  trans-93.8-161.1174.600000113.5
352S35.5Very low38.7Very low122 Ų122137.7 Ų137.785%0.85384%0.837SS**  trans-155.4160.7165.1-1680000110.6
353C40.2Very low38.2Very low115 Ų115137.2 Ų137.278%0.77785%0.851SS**  trans-63.6154.5-175.1-40.90000114.3
354Q38.1Very low38.2Very low270 Ų270137.8 Ų137.8100%1.26287%0.865SS**  -152.20102.4-108.9176.2-1000111.2

Retrieved 354 of 354 residues in 331.5 ms (Link to these results)