A0A096MYQ0_PAPAN Loading...

Syntabulin

AlphaFold DB (A0A2K5MVM5), UniProt , Accession A0A096MYQ0, Species PAPAN (Papio anubis, Olive baboon), Gene SYBU, Length 663 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
1M33.8Very low37.4Very low244 Ų244168.3 Ų168.3100%1.20285%0.852SS**  0118.50-59.3-59.8-8700107.9
2G35.1Very low36.8Very low73 Ų73171.8 Ų171.875%0.75385%0.848SS**  trans-106.9-151165.900000109.7
3P55.4Low36.5Very low116 Ų116169.4 Ų169.475%0.75385%0.848SS**  cis-133.4162.4-16.839.9-25.7000113.4
4L36.5Very low36.2Very low170 Ų170167.7 Ų167.789%0.8984%0.836SS**  trans-158.597.7159.7-129.976.3000108.3
5R44.5Very low35.9Very low228 Ų228167.9 Ų167.986%0.8683%0.833SS**  69.296.792.2-69-71.1-172.7-154-0.6114.3
6E36.1Very low35.6Very low195 Ų195168.6 Ų168.691%0.91183%0.832SS**  trans-64.4157.6159.5-57.3163121.900111
7S37.9Very low35.2Very low121 Ų121166.7 Ų166.785%0.84683%0.827SS**  trans-144.9104.8160.555.80000111.7
8K34.5Very low35.3Very low181 Ų181168.6 Ų168.679%0.78783%0.829SS**  trans-84.3133.9173.2-175.9-174.5-178.5-171.50109
9K35.5Very low35.1Very low190 Ų190169.2 Ų169.283%0.82683%0.83SS**  trans-144.8118.5165.4-78.8-162.8172.8-175.30111.3
10E30.8Very low35.2Very low152 Ų152168.7 Ų168.771%0.7183%0.829SS**  trans-66.8151.2165.5-60.399.8160.500111.3
11H31.5Very low35.3Very low181 Ų181166.1 Ų166.184%0.83883%0.828SS**  trans-110.393.1162-103.3-99.8000109.9V13H11-V13 PolarHBondContact O-N 3Å; H11-V13 VanDerWaalsContact O-N 3.08Å
12R30.3Very low35.6Very low211 Ų211165.4 Ų165.480%0.79681%0.812SS**  trans-58104.3172.6-179-175.4-171.5175.83.6110.1Q14R12-Q14 PolarHBondContact O-N 2.81Å
13V33Very low36Very low140 Ų140167.9 Ų167.985%0.84882%0.817SS**  trans-75.4107.1167.5178.50000107.6H11H11-V13 PolarHBondContact O-N 3Å; H11-V13 VanDerWaalsContact O-N 3.08Å
14Q31.3Very low35.7Very low146 Ų146173.3 Ų173.368%0.68282%0.823SS**  trans-88.5128.3179.8-167.1163.42.700109.3R12 H16R12-Q14 PolarHBondContact O-N 2.81Å; Q14-H16 PolarHBondContact O-N 3.43Å
15H31.6Very low36.6Very low170 Ų170172.4 Ų172.479%0.78782%0.818SS**  trans-55.5138.7170.6-97.7-130.8000110.2
16H31.6Very low36.9Very low179 Ų179167.2 Ų167.283%0.82981%0.813SS**  trans-124.8110.6165.8-125.2-55.2000107.7Q14 K18Q14-H16 PolarHBondContact O-N 3.43Å; H16-K18 PolarHBondContact O-N 3.25Å
17D29.4Very low37.3Very low137 Ų137168.9 Ų168.973%0.73381%0.811SS**  trans-61.2131.3179-60-68.8000110.6E19D17-E19 PolarHBondContact O-N 2.96Å
18K35.8Very low37.4Very low200 Ų200170.4 Ų170.487%0.8781%0.809SS**  trans-85.296172.7-73.2175.3180170.20107.9H16 I20H16-K18 PolarHBondContact O-N 3.25Å; K18-I20 PolarHBondContact O-N 3.46Å
19E31.5Very low37.7Very low180 Ų180169.2 Ų169.284%0.84181%0.81SS**  trans-48.5116173.2-73.8-171.5103.100110.7D17 S21D17-E19 PolarHBondContact O-N 2.96Å; E19-S21 VanDerWaalsContact C-N 3.33Å; E19-S21 PolarHBondContact O-N 3Å
20I38.6Very low37.9Very low159 Ų159167.2 Ų167.282%0.81581%0.808SS**  trans-67.397.8171.4-60.6173.3000106.6K18 R22K18-I20 PolarHBondContact O-N 3.46Å; I20-R22 PolarHBondContact O-N 3.26Å
21S37.3Very low38.3Very low115 Ų115171 Ų17180%0.80482%0.815SS**  trans-61.698.7-175.6-70.80000110.4E19E19-S21 VanDerWaalsContact C-N 3.33Å; E19-S21 PolarHBondContact O-N 3Å
22R39.6Very low38.4Very low229 Ų229167.8 Ų167.886%0.86481%0.811SS**  trans-61.3152.8178.8-65.5-174.4177.9-164.5-0.7110.8I20 R24I20-R22 PolarHBondContact O-N 3.26Å; R22-R24 PolarHBondContact O-N 3.21Å; R22-R24 VanDerWaalsContact O-N 3.12Å
23S43.4Very low38.4Very low125 Ų125165.8 Ų165.887%0.87481%0.81SS**  trans-45.3112.8-177.838.80000113.3
24R48.4Very low38.4Very low230 Ų230166.6 Ų166.687%0.86881%0.806SS**PPolyproline II helixtrans-92.8121.9162.8-90-173175171.33109.1R22R22-R24 PolarHBondContact O-N 3.21Å; R22-R24 VanDerWaalsContact O-N 3.12Å
25I56.1Low38.4Very low152 Ų152164.7 Ų164.778%0.77981%0.806SS**PPolyproline II helixtrans-50.9128.3165.9-59167.3000108.2R27I25-R27 PolarHBondContact O-N 3.33Å
26P51.5Low38.5Very low119 Ų119165.5 Ų165.577%0.77381%0.811SS**PPolyproline II helixtrans-62122.5177.124.9-32.9000109.5
27R43.1Very low38.5Very low229 Ų229165 Ų16586%0.86481%0.808SS**PPolyproline II helixtrans-77.1134.5176.5-77-176169.4161.2-2.9109.9I25 I29I25-R27 PolarHBondContact O-N 3.33Å; R27-I29 PolarHBondContact O-N 3.03Å
28L40.8Very low38.6Very low154 Ų154167.7 Ų167.781%0.80682%0.817SS**  trans-55.5110.9175.3-65.1171.4000110.7L30L28-L30 HydrophobicContact CB-CD1 4.33Å; L28-L30 PolarHBondContact O-N 3.45Å
29I41.5Very low38.4Very low156 Ų156166.3 Ų166.380%0.881%0.813SS**  trans-91.495.1165.8-58.3178.2000106.9R27 R31R27-I29 PolarHBondContact O-N 3.03Å; I29-R31 PolarHBondContact O-N 2.98Å; I29-R31 VanDerWaalsContact O-N 3.12Å
30L39.3Very low38.3Very low148 Ų148167.3 Ų167.378%0.77582%0.815SS**  trans-62.9112.9164.3-9369.6000108.2L28L28-L30 HydrophobicContact CB-CD1 4.33Å; L28-L30 PolarHBondContact O-N 3.45Å
31R38.2Very low37.9Very low231 Ų231166.1 Ų166.187%0.87282%0.815SS**PPolyproline II helixtrans-68.2131.2163.1-83-175.8171.4168-1108.5I29 H33I29-R31 PolarHBondContact O-N 2.98Å; I29-R31 VanDerWaalsContact O-N 3.12Å; R31-H33 PolarHBondContact O-N 2.72Å
32P34.1Very low37.5Very low114 Ų114165.6 Ų165.674%0.7481%0.811SS**PPolyproline II helixtrans-59.8126.8169.9-23.834.7000110.9M34P32-M34 PolarHBondContact O-N 3Å
33H29.8Very low38.1Very low169 Ų169161 Ų16178%0.78281%0.81SS**PPolyproline II helixtrans-69.1116.5176.3174.4-75.2000110.4R31R31-H33 PolarHBondContact O-N 2.72Å
34M33.8Very low37.2Very low156 Ų156159.3 Ų159.377%0.76880%0.804SS**PPolyproline II helixtrans-83.6129.4172-78.1-69.816800110.2P32 Q36P32-M34 PolarHBondContact O-N 3Å; M34-Q36 PolarHBondContact O-N 2.93Å
35P32Very low36.4Very low106 Ų106153.3 Ų153.369%0.68880%0.798SS**  trans-69.4113.8179.228.4-33.5000110.5Q37P35-Q37 PolarHBondContact O-N 2.85Å
36Q33.2Very low35Very low188 Ų188155.7 Ų155.788%0.87981%0.805SS**  trans-71.6122179.6-165.6169.9900110.5M34M34-Q36 PolarHBondContact O-N 2.93Å
37Q30.4Very low33.9Very low167 Ų167155 Ų15578%0.7880%0.804SS**  trans-68.3135.7179.2-73.4-177-29.100111.3P35 H39P35-Q37 PolarHBondContact O-N 2.85Å; Q37-H39 PolarHBondContact O-N 3.36Å; Q37-H39 VanDerWaalsContact O-N 3.09Å
38Q32Very low34Very low195 Ų195148.9 Ų148.991%0.91179%0.793SS**  trans-69.5103.2176.5-68.5178.7-15.800110.8K40Q38-K40 PolarHBondContact O-N 2.72Å
39H31.4Very low33.3Very low170 Ų170150.2 Ų150.279%0.78779%0.793SS**  trans-74.7122.1165.8-88.7-99.7000110.3Q37Q37-H39 PolarHBondContact O-N 3.36Å; Q37-H39 VanDerWaalsContact O-N 3.09Å
40K30.2Very low32.8Very low201 Ų201148.2 Ų148.287%0.87479%0.793SS**  trans-64.3132.6170.2-71-177.2175-1770110.3Q38Q38-K40 PolarHBondContact O-N 2.72Å
41V30.9Very low32.6Very low135 Ų135149.9 Ų149.982%0.81880%0.797SS**  trans-129.8141.8157.6-1760000108
42S28.6Very low32.3Very low104 Ų104147.1 Ų147.173%0.72779%0.794SS**  trans-159.6154.9-173.2-72.30000107.9
43P51.3Low32.2Very low131 Ų131151.1 Ų151.185%0.85180%0.803SS**  -126.2156.9-109.338.4-27.5000116.7
44A24.5Very low32.2Very low90 Ų90146.9 Ų146.974%0.74479%0.792SS**  trans-155.2115.2163.400000105.9
45S31.1Very low32.2Very low105 Ų105150.5 Ų150.573%0.73480%0.797SS**  76.310364.774.40000113.9
46E26.9Very low32.1Very low201 Ų201153 Ų15394%0.93980%0.8SS**  -169.1161.9121.4-106.1169.8-166.700112
47S30Very low31.9Very low106 Ų106152.2 Ų152.274%0.74179%0.794SS**  trans-149.5139177.2-175.70000106.1
48P44.8Very low32Very low99 Ų99151.2 Ų151.264%0.64379%0.794SS**  -148.5164.795.336.4-19000114.9
49F25.1Very low32.5Very low182 Ų182147.1 Ų147.180%0.79878%0.784SS**  169.7140.2116.9-96.6-71.5000109.9
50S31.4Very low32.5Very low115 Ų115144.5 Ų144.580%0.80479%0.785SS**  trans-156.6111.8-178.159.30000112.1
51E35Very low32.5Very low183 Ų183140.3 Ų140.386%0.85578%0.781SS**  trans-146.4144.5174.7-60.9178.4162.400104.9
52E31.4Very low32.6Very low172 Ų172139.7 Ų139.780%0.80478%0.782SS**  cis-153.4140.70.7179.4-169.4125.900108
53E32.4Very low32.7Very low199 Ų199137.7 Ų137.793%0.9378%0.778SS**  trans-143.2145.7159-162.8174.1137.800109.7
54S30.8Very low32Very low80 Ų80143.5 Ų143.556%0.55978%0.783SS**  trans-134145-160.1-86.10000114
55R32.9Very low32.4Very low232 Ų232144.9 Ų144.988%0.87579%0.788SS**  trans82.2148.1-179.8-51.3178-175.9-143-2.3113.1
56E30.1Very low32.7Very low158 Ų158144.1 Ų144.174%0.73879%0.788SS**  cis-145.5156.124.3-154.7149.2-119.400115.3
57F27.8Very low33.3Very low172 Ų172146.4 Ų146.475%0.75479%0.788SS**  trans-5.2123.5171.3-79.1-96.8000119.5
58N33.6Very low33.7Very low145 Ų145147.5 Ų147.578%0.77579%0.79SS**  -175.7160.873.8-94.5-63.1000113
59P43.1Very low33.3Very low109 Ų109150.2 Ų150.271%0.70881%0.805SS**  trans-105.7143.6-177.437.7-31.5000115.6
60S30.5Very low33.8Very low115 Ų115147 Ų14780%0.80481%0.805SS**  trans-168.3134.9147.8-89.60000115.7
61S29.9Very low34.1Very low113 Ų113146.3 Ų146.379%0.7980%0.8SS**  trans60.3130.815166.20000122.4
62S32.8Very low34Very low122 Ų122144.4 Ų144.485%0.85380%0.796SS**  trans42131.1141.9-151.30000120.6
63G31.8Very low34.3Very low62 Ų62140.1 Ų140.164%0.63978%0.784SS**  cis117.4120.48.200000112.2
64R35.5Very low34.5Very low253 Ų253139.9 Ų139.996%0.95578%0.781SS**  trans57.7124.6176.6-68.6179.6161.2-150.7-3.9117.4
65S33.3Very low34.7Very low120 Ų120141.5 Ų141.584%0.83979%0.791SS**  -170.9141.9100.3-166.50000111
66A38.1Very low34.9Very low89 Ų89134.7 Ų134.774%0.73678%0.779SS**  trans-117.7142.5169.800000109.3
67R38.3Very low35.2Very low248 Ų248134.9 Ų134.994%0.93679%0.785SS**  trans-161.8141.9154.7-115.3159.3-172.7159.22.3113.5
68T38.4Very low35.7Very low129 Ų129133.6 Ų133.679%0.79179%0.786SS**  trans-93.4153.8177.3500000111.8
69V35.9Very low36.2Very low157 Ų157132.6 Ų132.695%0.95279%0.785SS**  trans-153.6156.6146.9-105.50000110.2
70S36.1Very low35.7Very low115 Ų115130.8 Ų130.880%0.80479%0.786SS**  trans-144.9151.2-171.6177.60000112.2
71S37.3Very low36.3Very low100 Ų100131.5 Ų131.570%0.69979%0.79SS**  trans179.7162.1174.5-82.40000109.8
72N34.8Very low37Very low143 Ų143132.4 Ų132.477%0.76579%0.793SS**  cis-175.1160.2-25.2-100.4-3.7000107.7
73S36.2Very low36.9Very low81 Ų81131.7 Ų131.757%0.56679%0.788SS**  cis-178.6127.5-22.953.60000110.5
74F37Very low37.4Very low194 Ų194133.6 Ų133.685%0.85179%0.791SS**  trans63.8160.9168.5-75.8-95.9000116.8
75C34.6Very low37.3Very low114 Ų114130.5 Ų130.577%0.7779%0.788SS**  cis-136.9-164.34.2-101.10000109.4
76S38.7Very low37.2Very low90 Ų90129.3 Ų129.363%0.62978%0.779SS**  164.6104.6-61.7-77.50000111.5
77D35.8Very low36.9Very low162 Ų162132 Ų13287%0.86679%0.787SS**  trans-177134.4160.9-94.7-12.9000106.2
78D38.6Very low36.6Very low144 Ų144125.2 Ų125.277%0.7778%0.777SS**  cis77.4131.834.5-140.121.4000112.3
79T42.7Very low37.1Very low125 Ų125124.2 Ų124.277%0.76777%0.773SS**  cis-144.4170.122.7540000112.9
80G33.3Very low37Very low71 Ų71123 Ų12373%0.73277%0.765SS**  trans141.594.2147.400000118.7
81C43Very low36.8Very low129 Ų129127 Ų12787%0.87277%0.768SS**  trans-138.7140.3164.6-73.50000111
82P44.5Very low36.9Very low132 Ų132128.2 Ų128.286%0.85777%0.772SS**  trans-94.8158.3158.435.9-30.4000111.3
83S31.8Very low37.4Very low108 Ų108126.7 Ų126.776%0.75577%0.77SS**  trans-151.8159.8-174.5-177.80000113.6
84S40.6Very low37.2Very low101 Ų101128.2 Ų128.271%0.70678%0.78SS**  trans74.8118.9155.4-60.20000120.7
85Q34.8Very low36.8Very low189 Ų189126 Ų12688%0.88378%0.777SS**  170.9146.3121.7-91.4171.941.900109.7
86S31.7Very low36.6Very low94 Ų94125.1 Ų125.166%0.65778%0.778SS**  cis-163.7131.8-4.252.60000114.4
87V31.1Very low36.1Very low147 Ų147123.8 Ų123.889%0.89178%0.778SS**  67.2162.2129.2-172.90000120.8
88S30.9Very low35.9Very low104 Ų104124.1 Ų124.173%0.72778%0.78SS**  trans-142.8-167.1-165-114.10000109.5
89P50.6Low35.6Very low109 Ų109122.8 Ų122.871%0.70878%0.782SS**  cis-139.4-166.2-39.742-24000114
90V32.9Very low35.8Very low131 Ų131122.1 Ų122.179%0.79478%0.78SS**  trans61.7125.3155.3175.20000121.1
91K31.6Very low35.7Very low200 Ų200127 Ų12787%0.8779%0.787SS**  trans-165.5133.3134.6-117.1172.2-1771760115.9
92T38.7Very low35Very low125 Ų125123.7 Ų123.777%0.76778%0.775SS**  trans-119-179.4154.251.80000106.6
93P45.7Very low34.2Very low111 Ų111127.2 Ų127.272%0.72178%0.777SS**  cis-142.7-151.114.343.7-21000115.1
94S32.6Very low34.1Very low112 Ų112127.5 Ų127.578%0.78378%0.778SS**  trans92.9153.3160.8-530000118.9
95D28.1Very low35Very low149 Ų149129 Ų12980%0.79779%0.786SS**  cis-170.3150.9-36.3-171.922.1000109
96A30Very low34.5Very low94 Ų94122.9 Ų122.978%0.77777%0.773SS**  trans53.2154.4170.100000119.1
97G30Very low34.8Very low62 Ų62124 Ų12464%0.63978%0.781SS**  cis175.5-170.2-4.100000111.9
98N30.2Very low34.9Very low170 Ų170123.3 Ų123.391%0.90977%0.772SS**  trans80.4111.5166.9-51.7-12.6000119.6
99S32.1Very low35.3Very low115 Ų115126 Ų12680%0.80477%0.773SS**  trans-98.9171.4144.7-38.60000108.4
100P48.3Very low34.7Very low111 Ų111125.9 Ų125.972%0.72177%0.767SS**  -155.4-179.266.142.1-21.4000117.5
101I30.4Very low34.8Very low173 Ų173127.8 Ų127.889%0.88777%0.765SS**  trans68.7153.5161.2-109.966.8000116.1
102G27.9Very low34.9Very low61 Ų61123.4 Ų123.463%0.62976%0.755SS**  cis-161.6-166.1100000111.8
103F28.1Very low34.8Very low205 Ų205126.5 Ų126.590%0.89975%0.753SS**  trans-89.9158-167.8-71.9-97.1000116.7
104C30.4Very low34.5Very low114 Ų114130 Ų13077%0.7776%0.756SS**  trans-2.4169149.4-56.50000122.2
105P57.9Low34.6Very low133 Ų133133.8 Ų133.886%0.86476%0.759SS**  cis-139.1-169.5-31.938.9-19.5000113.9
106G26.3Very low34.9Very low61 Ų61131.8 Ų131.863%0.62976%0.756SS**  trans158.8147.3167.900000111.3
107S36.4Very low35.2Very low116 Ų116132.5 Ų132.581%0.81175%0.75SS**  cis58.9136.633.374.20000113.5
108D34.4Very low35.5Very low134 Ų134137.3 Ų137.372%0.71776%0.76SS**  cis-161.2-167.132.6-149.8-23000112.8
109E37.7Very low35.7Very low159 Ų159132.1 Ų132.174%0.74375%0.746SS**  trans72.4150.5164-45.8-61.8-178.400119.9
110D39.5Very low36Very low108 Ų108135.2 Ų135.258%0.57875%0.75SS**  cis-165.1164.2-32-176.526.2000108.2
111F33.9Very low35.4Very low170 Ų170136.5 Ų136.575%0.74676%0.756SS**  167115.3117.5-96.1-57000116.7
112T35Very low35.5Very low109 Ų109131.3 Ų131.367%0.66975%0.745SS**  trans74.3148.8151.278.10000118.5
113R35.4Very low35.8Very low190 Ų190138.3 Ų138.372%0.71776%0.761SS**  cis-160.4126.32.7123.3-169.5-44.6-146.19.3113
114K39.5Very low35.9Very low183 Ų183132.1 Ų132.180%0.79676%0.756SS**  trans58.4149.5143.8-45.3175.3-165.8-175.40117.6
115K34.7Very low35.8Very low192 Ų192132.6 Ų132.684%0.83576%0.76SS**  cis-158.9128.413.1-172.3-175.2172.1-170.50111.9
116C35.2Very low34.7Very low108 Ų108134 Ų13473%0.7376%0.759SS**  trans4.8152.6134.8-62.10000120.9
117T35.7Very low34.9Very low108 Ų108139.4 Ų139.466%0.66377%0.768SS**  cis174.9152.25.3-99.80000113.7
118I36.3Very low34.7Very low163 Ų163139 Ų13984%0.83677%0.765SS**  trans61.7149159.6-78162.8000119.3
119G34.1Very low34.6Very low61 Ų61137.2 Ų137.263%0.62976%0.762SS**  cis145.8167.9-8.600000114.9
120M39.4Very low34.6Very low180 Ų180139 Ų13989%0.88776%0.763SS**  trans67.7153.9167.6-76.9171.463.100118.7
121V34.6Very low34.2Very low139 Ų139143 Ų14384%0.84277%0.771SS**  cis-162.5170-18.471.20000110.1
122G32.8Very low34.4Very low64 Ų64143 Ų14366%0.6677%0.771SS**  trans130.1112.5169.200000111.8
123E34.2Very low34.5Very low207 Ų207146 Ų14697%0.96777%0.774SS**  cis93118.941-167.8168.1-141.800113.7
124G30.2Very low34.4Very low76 Ų76143.3 Ų143.378%0.78477%0.77SS**  trans160.6144.5-176.500000111.4
125S29.3Very low34.3Very low123 Ų123140.4 Ų140.486%0.8677%0.773SS**  trans-150.1179.9-165-1690000114.4
126I33.7Very low34.5Very low163 Ų163141 Ų14184%0.83678%0.775SS**  trans98159.5168.8-56176.7000116.4
127Q30.9Very low34.4Very low175 Ų175142 Ų14282%0.81878%0.784SS**  trans-132-178.7-144.8-50.6172.4-48.900115.7
128S33Very low34Very low107 Ų107140.3 Ų140.375%0.74879%0.787SS**  trans84.8135.5159.778.90000116.7
129S32.4Very low34Very low96 Ų96140.8 Ų140.867%0.67179%0.791SS**  cis86.7144.527.191.60000114.4
130R37.8Very low34Very low198 Ų198143.9 Ų143.975%0.74780%0.797SS**  cis-127.1-15030.7-56.3169-175.5139.41.9110.4
131Y29.8Very low34.1Very low192 Ų192144.8 Ų144.875%0.75380%0.796SS**  cis-147.3142.816.7-66.6-92.2000109.4
132K38Very low34.6Very low170 Ų170144.2 Ų144.274%0.73980%0.795SS**  64118.586.2-123.9-157.2176.7-149.10114.7E134K132-E134 IonicContact NZ-OE1 3Å; K132-E134 PolarHBondContact NZ-OE1 2.96Å
133K36.7Very low34.5Very low170 Ų170144.8 Ų144.874%0.73980%0.801SS**  -165.1129.972.9174.2178.1-178.9-171.40114.8
134E34.6Very low34.6Very low135 Ų135140.2 Ų140.263%0.63179%0.792SS**  trans43.1154.5147.6-69.4141.2-149.300121.8K132K132-E134 IonicContact NZ-OE1 3Å; K132-E134 PolarHBondContact NZ-OE1 2.96Å
135S36.2Very low34.7Very low122 Ų122145.5 Ų145.585%0.85380%0.796SS**  cis-146.3-177.66.956.80000112.6
136K39Very low35Very low205 Ų205143.8 Ų143.889%0.89179%0.789SS**  trans-116130.7-177.9-72179.3175.1179.80113.6
137S33.9Very low35.1Very low129 Ų129143.7 Ų143.790%0.90279%0.79SS**  trans161.9146.6139.155.60000110.5
138G28.2Very low35.3Very low71 Ų71145.3 Ų145.373%0.73280%0.795SS**  cis169.2144.4-13.400000112.9
139L34.6Very low35.2Very low174 Ų174145.8 Ų145.891%0.91180%0.798SS**  trans69.5155167.1-156.563.6000118.5
140V35.3Very low35.2Very low126 Ų126146.7 Ų146.776%0.76480%0.804SS**  trans67.5123.1176.6-164.70000116.3
141K41.8Very low35Very low199 Ų199142.6 Ų142.687%0.86581%0.807SS**  trans-92127.4166.5-65.2179.1178.4-178.90109.4
142P43.9Very low35Very low127 Ų127139.6 Ų139.683%0.82581%0.813SS**  trans-81.3140.9155.833-29.8000109.5
143G31.8Very low35Very low76 Ų76136.8 Ų136.878%0.78482%0.815SS**  trans-146.2121.9171.700000108.9
144S35.1Very low34.9Very low110 Ų110136 Ų13677%0.76983%0.825SS**  trans-134.9157-177.8-650000110.3
145E32.2Very low34.8Very low188 Ų188132.5 Ų132.588%0.87983%0.825SS**  trans102.5132.1162.9-60.7173.4-165.200117.1
146A36.3Very low34.7Very low86 Ų86132.5 Ų132.571%0.71183%0.825SS**  trans49.4120.3168.200000117.6
147D35.7Very low34.4Very low161 Ų161130.7 Ų130.786%0.86182%0.823SS**  cis-162.3160.141.1-95.4-40.9000113.1
148F35.2Very low34.4Very low209 Ų209129.8 Ų129.892%0.91782%0.817SS**  trans-97.8102.5174.2-86.2-86.1000112.5
149S31.9Very low34.8Very low117 Ų117130 Ų13082%0.81881%0.811SS**  trans-170.7100.9153.4-87.30000113.7
150S30.6Very low35.4Very low115 Ų115127.3 Ų127.380%0.80481%0.805SS**  168.4127.8127.9-78.10000113.8
151S34.3Very low35.4Very low113 Ų113129.2 Ų129.279%0.7981%0.805SS**  trans20141.9142.5-50.60000122.5
152S30.2Very low35Very low128 Ų128124.2 Ų124.290%0.89579%0.791SS**  trans-139.6152.9153.9-73.40000110.1
153S37.1Very low34.4Very low111 Ų111125.6 Ų125.678%0.77679%0.786SS**  trans-130.2152.5-160.9-45.90000112.9
154T34.7Very low34.5Very low154 Ų154128.7 Ų128.795%0.94578%0.782SS**  trans-176.3142.9150.140.40000108.6
155G32.1Very low34.4Very low61 Ų61128.5 Ų128.563%0.62978%0.781SS**  cis-157.8153.6-7.200000108.8
156S34Very low34.6Very low123 Ų123125.7 Ų125.786%0.8678%0.776SS**  64.6124.493.7-53.90000113.2
157I34.2Very low34.4Very low167 Ų167126.4 Ų126.486%0.85678%0.783SS**  cis-133.9-174.920.360.3174.4000110.2
158S33.6Very low34Very low109 Ų109122.4 Ų122.476%0.76278%0.779SS**  cis-153.7-178.2960.50000112.1
159A35.6Very low33.7Very low75 Ų75118.6 Ų118.662%0.6278%0.779SS**  trans-146.1169.4162.900000108.7
160P48.1Very low33.8Very low118 Ų118122 Ų12277%0.76678%0.779SS**  -135.3138.973.822.20000113.8
161E34.7Very low34Very low167 Ų167127.9 Ų127.978%0.7878%0.783SS**  77.4130.668.3-78.2-169.988.500115.2
162V34Very low33.8Very low93 Ų93128.7 Ų128.756%0.56479%0.789SS**  cis-124-126.3-6.8-155.50000110.9M164V162-M164 HydrophobicContact CG1-CE 4.34Å
163H31.1Very low33.8Very low157 Ų157127.9 Ų127.973%0.72778%0.784SS**  cis-147.7146.95.6-85.4-78.7000113.2
164M34.7Very low33.3Very low140 Ų140128.4 Ų128.469%0.6979%0.787SS**  trans20.6123.6146.1-45-44.6162.500120.7V162V162-M164 HydrophobicContact CG1-CE 4.34Å
165S32.2Very low33.3Very low106 Ų106125.9 Ų125.974%0.74178%0.776SS**  71.8145.860.1-58.50000114.1
166T36.3Very low33.4Very low129 Ų129134 Ų13479%0.79179%0.787SS**  cis-149.5163.128.351.70000114.4
167A31.1Very low33.3Very low102 Ų102135.4 Ų135.484%0.84379%0.785SS**  trans54.5152.4148.100000121.9
168G29.2Very low33.5Very low77 Ų77139.1 Ų139.179%0.79479%0.788SS**  cis127.8104.7-8.700000114.8
169S28.2Very low33.3Very low129 Ų129137.1 Ų137.190%0.90279%0.786SS**  trans-156.9169.7162.3-164.20000112.3
170K34.1Very low33.9Very low187 Ų187138.6 Ų138.681%0.81379%0.788SS**  trans-118.4149.9-167.6-63.9173-178.4172.30112.7
171R35Very low33.1Very low239 Ų239141.9 Ų141.990%0.90279%0.793SS**  trans29.9130.3148.6-62.5-178.6174.4-155.3-1.6119
172S28.8Very low32.8Very low130 Ų130137 Ų13791%0.90979%0.788SS**  173.9171.399.750.70000112.9
173S30.4Very low32.8Very low112 Ų112144.6 Ų144.678%0.78381%0.807SS**  trans-116.3146.1-174.754.60000112.3
174S27.8Very low32.9Very low121 Ų121141.3 Ų141.385%0.84680%0.802SS**  trans-163.6157.7142.754.90000113.1
175S34.2Very low32.7Very low102 Ų102142.7 Ų142.771%0.71381%0.812SS**  trans-93.7149.3178.1163.30000111.8
176R33.5Very low32.7Very low231 Ų231141.5 Ų141.587%0.87282%0.816SS**  trans-144.2124.6156-70.7-164.9171177.3-2.6112.3
177N32.8Very low32.5Very low153 Ų153140.3 Ų140.382%0.81882%0.82SS**  trans-86.2144162.8-81.8-51.8000110.5
178R37.8Very low32.7Very low244 Ų244140.7 Ų140.792%0.92182%0.816SS**  trans-167.8132.4159.8-109.8169.1-169.2175.41.9112
179G29.8Very low32.9Very low68 Ų68141 Ų14170%0.70181%0.806SS**  trans-117.4-157.1151.400000108.8
180P47.6Very low33.2Very low105 Ų105143.4 Ų143.468%0.68280%0.803SS**  cis-134.9-155.6-0.839.8-19.3000113.2
181H30.9Very low33.3Very low187 Ų187143.9 Ų143.987%0.86681%0.805SS**  trans78.3143.6176.3-42.6-61.7000116.4
182G28.6Very low33.7Very low66 Ų66138.4 Ų138.468%0.6880%0.8SS**  cis168.8164.8-9.700000113.6
183R35.2Very low33.7Very low251 Ų251135.6 Ų135.695%0.94779%0.792SS**  trans72.8146.4179-71.8-179.4155-146.3-6.5116.5
184S31.8Very low33.7Very low89 Ų89136.3 Ų136.362%0.62280%0.797SS**  cis-166.3155.3-6.745.10000114.9
185N31.5Very low33.9Very low168 Ų168136 Ų13690%0.89880%0.795SS**  trans78.9131.7153.1-61.5-7.8000121
186G31.8Very low34.7Very low81 Ų81137 Ų13784%0.83580%0.798SS**  trans156.7119.2172.300000110.9
187A32.8Very low34.4Very low105 Ų105131.9 Ų131.987%0.86880%0.798SS**  trans-101.8173.4-17900000111
188S35.3Very low34.4Very low110 Ų110129.9 Ų129.977%0.76980%0.796SS**  cis-155.4161.11554.60000113.8
189S33.7Very low34.6Very low83 Ų83123.3 Ų123.358%0.5879%0.785SS**  trans15.6129.8148.3-155.90000119.4
190H33.5Very low34.8Very low180 Ų180130 Ų13083%0.83379%0.789SS**  -162.4158.668.8-91.1-84.7000114.5
191K37.4Very low34Very low197 Ų197130.9 Ų130.986%0.85778%0.784SS**  trans-131.5174.1166.9-102.9-175.1177.1-1790107.8
192P41.7Very low34.2Very low124 Ų124130.9 Ų130.981%0.80578%0.782SS**  cis-120.1-166.79.138.8-21000112.2
193G29.4Very low34.3Very low71 Ų71134.8 Ų134.873%0.73279%0.787SS**  cis125.4101.2-9.700000115.1
194S30.8Very low34.3Very low127 Ų127130.9 Ų130.989%0.88878%0.784SS**  trans-170.7164.6165.157.60000112.6
195S32.2Very low34.3Very low114 Ų114135.3 Ų135.380%0.79780%0.8SS**  trans-170.2168.3174.260.60000109.5
196P49.7Very low34.3Very low122 Ų122132.6 Ų132.679%0.79279%0.794SS**  cis-126172.8-18.240.5-27000113.4
197S28.7Very low34.5Very low125 Ų125136.2 Ų136.287%0.87479%0.791SS**  trans-162.2157153.354.80000113.2
198S31.8Very low34.4Very low110 Ų110139.7 Ų139.777%0.76979%0.794SS**  trans-124.1175.9169.469.80000107.8
199P43.3Very low34.1Very low106 Ų106139.2 Ų139.269%0.68879%0.79SS**  cis-139.5-175.810.643.5-25.7000116.9
200R32.9Very low34Very low209 Ų209146.4 Ų146.479%0.78980%0.804SS**  trans81.4143.1152.2-90.5173170.9-117.16.4121.2
201E30.6Very low33.8Very low123 Ų123145.1 Ų145.158%0.57580%0.803SS**  trans64.285.4148.8-67.2162-138.200119.5
202K34.8Very low33.5Very low187 Ų187143.5 Ų143.581%0.81380%0.799SS**  -177.3158.9101.3-92.3143.5-162.9151.60114.8
203D32.5Very low33Very low148 Ų148144.3 Ų144.379%0.79180%0.796SS**  trans-53.8123.8-167.9-47.2-62.2000116.7
204L34.4Very low33.1Very low169 Ų169146 Ų14689%0.88580%0.797SS**  trans-155.888.1147.9-83-166.9000111.2
205L31.4Very low33.6Very low182 Ų182145.6 Ų145.695%0.95379%0.791SS**  trans-136.1112.1157.7-83.2-179.3000109.6
206S32.4Very low33.5Very low112 Ų112146.3 Ų146.378%0.78379%0.79SS**  trans-115.9142.5177.1-96.20000111.2
207M34.8Very low32.7Very low156 Ų156148.2 Ų148.277%0.76879%0.793SS**  trans61.568.2158.5-56.5-54.8-69.500117.9
208L30.5Very low33Very low178 Ų178148.7 Ų148.793%0.93279%0.785SS**  trans-123.7113.8141.9-110.5167.6000108.7R210L208-R210 PolarHBondContact O-N 3.2Å
209C30.4Very low33.1Very low101 Ų101152 Ų15268%0.68279%0.788SS**  trans-78.5113.2-163.3-65.30000113.3
210R31.3Very low33Very low233 Ų233151.9 Ų151.988%0.87979%0.787SS**  trans-53.5132.9161.2173.5-171.3-176.4-175.82.6111L208L208-R210 PolarHBondContact O-N 3.2Å
211N27.9Very low32.8Very low153 Ų153147.2 Ų147.282%0.81879%0.787SS**  trans-156.1114.1157.1-98.8-31.6000110.7
212Q32.8Very low33.1Very low164 Ų164152.3 Ų152.377%0.76680%0.802SS**  trans-151.4123.2168-86.7-71.556.200108.8
213L31.5Very low33.4Very low140 Ų140147.7 Ų147.773%0.73380%0.799SS**  trans53.299.2152.6-67.7147.3000121.2
214S30.6Very low33.6Very low108 Ų108146.4 Ų146.476%0.75580%0.798SS**  63.8167.3129.574.60000120.9
215P41.2Very low33.5Very low117 Ų117144 Ų14476%0.7680%0.796SS**  cis-127.2175.8-1.742.3-27.7000116.2
216V30.2Very low33.6Very low129 Ų129140.7 Ų140.778%0.78279%0.788SS**  trans-2.4124.6160.2-175.60000118.8
217N33.2Very low34.2Very low162 Ų162141 Ų14187%0.86679%0.787SS**  trans-147.6158.9137.9-147.3-39.3000110.5
218I35.5Very low33.9Very low136 Ų136139.7 Ų139.770%0.69779%0.794SS**  trans-107.5121.1-165.3-60.1169.4000110.9
219H33.3Very low34.2Very low180 Ų180136.4 Ų136.483%0.83379%0.786SS**  trans-157.7130.9145.7-130.8-85.3000112.3
220P41.8Very low34.4Very low103 Ų103137.3 Ų137.367%0.66979%0.793SS**  trans-90.2128.9176.833.1-31.9000112
221S28.7Very low34.7Very low111 Ų111134.1 Ų134.178%0.77679%0.793SS**  trans-168.9125.9151.2-87.10000112.8
222Y35.6Very low35.2Very low229 Ų229132.9 Ų132.990%0.89880%0.796SS**  trans38.4129.5149.6-77-91.8000121.9
223A41.9Very low35.4Very low90 Ų90128.1 Ų128.174%0.74479%0.792SS**  trans-70.3138.5176.500000113.4
224P35.9Very low35.9Very low121 Ų121126.5 Ų126.579%0.78679%0.792SS**  trans-91106.116833.2-29.6000111.2
225S32.7Very low36.1Very low119 Ų119131 Ų13183%0.83279%0.794SS**  trans-69.1127.5166.5-59.50000110.8
226S33.3Very low36.3Very low112 Ų112134.4 Ų134.478%0.78380%0.797SS**  trans-83.6169.4170.9-52.80000110.6
227P44.1Very low36.9Very low119 Ų119132.1 Ų132.177%0.77380%0.799SS**  -121.6170.5-102.321.90.4000113.1
228S30.3Very low37.2Very low129 Ų129129.8 Ų129.890%0.90280%0.796SS**  trans-148.4124.9160.4-78.20000110.6
229S36.9Very low37.7Very low109 Ų109130.8 Ų130.876%0.76280%0.802SS**  trans-92.3143.9-173.249.20000112
230S34.1Very low38Very low119 Ų119128.2 Ų128.283%0.83280%0.803SS**  -167.9147127.8-850000111.4
231N37.6Very low37.9Very low166 Ų166128.2 Ų128.289%0.88881%0.805SS**  trans-73.6143.2-174.6-53.1-29.8000111.9
232S38.8Very low38.9Very low127 Ų127129.1 Ų129.189%0.88881%0.809SS**  -160.1157.3108.8-158.50000110.3
233G36Very low39.1Very low65 Ų65125 Ų12567%0.6780%0.801SS**  trans-110.9156.4-169.200000115
234S41.9Very low39.6Very low105 Ų105129 Ų12973%0.73481%0.806SS**  trans53.7114.1148-156.60000119.3
235Y35.6Very low40.2Very low204 Ų204133.5 Ų133.580%0.881%0.807SS**  -158179.292.8-126.2-101.8000112.4
236K45.3Very low41.6Very low188 Ų188140 Ų14082%0.81781%0.814SS**  trans-48.8138.1178.2-71.2166.5166.3-78.80112.7
237G41.8Very low42.1Very low80 Ų80139.7 Ų139.783%0.82581%0.812SS**  trans-82.1175.7174.600000114.4
238S40.8Very low42.7Very low114 Ų114137.8 Ų137.880%0.79781%0.813SS**  trans-151.5132.5159.8-174.90000108.8
239D45.4Very low44Very low156 Ų156141.9 Ų141.983%0.83481%0.809SS**  trans-67.9135.9167.3-53.9-83.7000109.9
240C38.5Very low44.4Very low127 Ų127147.4 Ų147.486%0.85882%0.815SS**  trans-167.1120.5158.9-103.60000111
241S40.6Very low45.7Very low102 Ų102149.8 Ų149.871%0.71382%0.815SS**  trans-70.9149.1178.9-50.90000112.5I243S241-I243 VanDerWaalsContact C-N 3.34Å; S241-I243 PolarHBondContact O-N 3.48Å
242P48.9Very low46.1Very low131 Ų131147.3 Ų147.385%0.85181%0.811SS**  trans-74.780.2177.631.4-35.8000112M244P242-M244 PolarHBondContact O-N 3.25Å
243I40.2Very low47Very low142 Ų142147.5 Ų147.573%0.72881%0.81SS**  trans-70.7119.3173-64.7179.7000109.7S241 R245S241-I243 VanDerWaalsContact C-N 3.34Å; S241-I243 PolarHBondContact O-N 3.48Å; I243-R245 HydrophobicContact CG2-CG 4.3Å; I243-R245 PolarHBondContact O-N 3.46Å
244M52.6Low47.9Very low173 Ų173147.3 Ų147.385%0.85281%0.809SS**  trans-68.7106177-64.4-137.58200112.1P242P242-M244 PolarHBondContact O-N 3.25Å
245R49.4Very low48.4Very low216 Ų216150 Ų15082%0.81581%0.809SS**  trans-125.9121.9165.4-68.8-7286.7164.53.8109.5I243I243-R245 HydrophobicContact CG2-CG 4.3Å; I243-R245 PolarHBondContact O-N 3.46Å
246R61.3Low49.6Very low256 Ų256147.1 Ų147.197%0.96681%0.808SS**  trans-64.6137.4168-65.9175.1177.1161.6-3109
247S44.3Very low50.2Low106 Ų106147.6 Ų147.674%0.74181%0.813SS**  trans-142.590.5155.9-169.30000109.5
248G57.1Low50.9Low78 Ų78146.6 Ų146.680%0.80480%0.802SS**  trans-92.3114.7163.200000108.6
249R57.4Low51.9Low216 Ų216147.1 Ų147.182%0.81580%0.8SS**  trans-156.1124166.6-121.5-173.5-66-130.14.2110.9
250Y45.3Very low52.9Low225 Ų225150.3 Ų150.388%0.88280%0.801SS**  trans55.3119.7168.8-91.2-102.5000118.7
251M60Low54.3Low169 Ų169148.8 Ų148.883%0.83379%0.789SS**  trans-79.2116.9166.8-59.7-93.161.800108.7
252S47.5Very low55.6Low114 Ų114146.2 Ų146.280%0.79777%0.77SS**  trans-100.6111.5165.3-1670000108.6G254S252-G254 PolarHBondContact O-N 2.94Å
253C56.2Low56.4Low130 Ų130144.4 Ų144.488%0.87875%0.754SS**  trans-81.383.7-177.4-62.70000110.3
254G55.9Low57.7Low62 Ų62142.5 Ų142.564%0.63975%0.75SS**  trans-149.5-9-175.400000118S252S252-G254 PolarHBondContact O-N 2.94Å
255E52.8Low58.4Low160 Ų160138.8 Ų138.875%0.74873%0.731SS**  trans-109.243-169.7-157.859.6-110.500113.7H257E255-H257 PolarHBondContact O-N 3.34Å
256N60.3Low59.5Low145 Ų145135.1 Ų135.178%0.77572%0.723SS**THydrogen-bonded Turntrans-8189.4168.7-70.4-49.8000109
257H58.7Low60.1Low197 Ų197130.4 Ų130.491%0.91271%0.706SS**THydrogen-bonded Turntrans171.113.6149.7-80.5-36.2000113.8E255E255-H257 PolarHBondContact O-N 3.34Å
258G56Low61.9Low59 Ų59128.1 Ų128.161%0.60869%0.685SS**  trans-101.2-10.3177.300000116.8R260G258-R260 PolarHBondContact O-N 2.85Å
259V60.4Low63.5Low125 Ų125127.8 Ų127.876%0.75867%0.668SS**  trans-76.792.5-175.7-173.30000110.2
260R66.8Low65Low223 Ų223122.2 Ų122.284%0.84266%0.66SS**  trans-44.8130.4161.7176.1-179178.6170.21.7108.1G258 P262G258-R260 PolarHBondContact O-N 2.85Å; R260-P262 WeakPolarHBondContact O-CD 3.45Å
261P67.9Low67.3Low95 Ų95118 Ų11862%0.61765%0.652SS**  trans-49.1127.4178.3-29.135.2000110.2N263P261-N263 PolarHBondContact O-N 3.46Å
262P68.6Low68.9Low48 Ų48114.1 Ų114.131%0.31263%0.632SS.*  trans-42.7141.1172.3-31.232.3000111.4R260 Q266 Y267R260-P262 WeakPolarHBondContact O-CD 3.45Å; P262-Q266 HydrophobicContact CB-CB 3.82Å; P262-Y267 HydrophobicContact CB-CD2 4.24Å; P262-Y267 HydrophobicContact CB-CE2 3.85Å; P262-Y267 WeakPolarHBondContact CD-OH 3.4Å; P262-Y267 HydrophobicContact CG-CE1 4.42Å; P262-Y267 HydrophobicContact CG-CE2 4.34Å; P262-Y267 VanDerWaalsContact O-CE2 3.27Å; P262-Y267 WeakPolarHBondContact O-CE2 3.25Å
263N65.9Low71Confident94 Ų94112.3 Ų112.350%0.50361%0.611SS.*  trans-52.5133.9173.4-179.9-12.8000107.5P261 E265 Q266P261-N263 PolarHBondContact O-N 3.46Å; N263-E265 PolarHBondContact O-N 2.88Å; N263-Q266 HydrophobicContact CB-CG 4.25Å; N263-Q266 WeakPolarHBondContact O-CA 3.47Å; N263-Q266 VanDerWaalsContact O-CB 3.29Å; N263-Q266 WeakPolarHBondContact O-CB 3.48Å; N263-Q266 PolarHBondContact O-N 3.24Å
264P67.1Low72.8Confident101 Ų101113 Ų11366%0.65660%0.599SS**G310 helixtrans-43.2-34.6-1745.6-25.2000115.8Q266 Y267P264-Q266 VanDerWaalsContact C-N 3.29Å; P264-Q266 PolarHBondContact O-N 3.48Å; P264-Y267 PolarHBondContact O-N 2.91Å
265E67.4Low74.6Confident95 Ų95114.6 Ų114.644%0.44459%0.59SS.*G310 helixtrans-63.5-26.2174.9-60.5-172.7-167.800114.8N263 Y267 L268 Q273N263-E265 PolarHBondContact O-N 2.88Å; E265-Y267 VanDerWaalsContact C-N 3.31Å; E265-L268 WeakPolarHBondContact O-CB 3.43Å; E265-L268 PolarHBondContact O-N 2.86Å; E265-Q273 HydrophobicContact CB-CG 4.31Å; E265-Q273 PolarHBondContact OE2-NE2 3.2Å
266Q72.6Confident76.6Confident140 Ų140110.3 Ų110.365%0.65457%0.574SS**G310 helixtrans-78-12.4178.8-62178.4-53.800113.4P262 N263 P264 L268P262-Q266 HydrophobicContact CB-CB 3.82Å; N263-Q266 HydrophobicContact CB-CG 4.25Å; N263-Q266 WeakPolarHBondContact O-CA 3.47Å; N263-Q266 VanDerWaalsContact O-CB 3.29Å; N263-Q266 WeakPolarHBondContact O-CB 3.48Å; N263-Q266 PolarHBondContact O-N 3.24Å; P264-Q266 VanDerWaalsContact C-N 3.29Å; P264-Q266 PolarHBondContact O-N 3.48Å; Q266-L268 VanDerWaalsContact C-N 3.34Å
267Y72.8Confident78.3Confident156 Ų156106.7 Ų106.761%0.61256%0.557SS**G310 helixtrans-85-10.9166.8-66-80.9000112.5P262 P264 E265P262-Y267 HydrophobicContact CB-CD2 4.24Å; P262-Y267 HydrophobicContact CB-CE2 3.85Å; P262-Y267 WeakPolarHBondContact CD-OH 3.4Å; P262-Y267 HydrophobicContact CG-CE1 4.42Å; P262-Y267 HydrophobicContact CG-CE2 4.34Å; P262-Y267 VanDerWaalsContact O-CE2 3.27Å; P262-Y267 WeakPolarHBondContact O-CE2 3.25Å; P264-Y267 PolarHBondContact O-N 2.91Å; E265-Y267 VanDerWaalsContact C-N 3.31Å
268L82.6Confident80.1Confident58 Ų58101.7 Ų101.730%0.30454%0.541SS..SBendtrans-85.8140.8175.2-57-178.3000109.7E265 Q266 Q272 Q273 V276E265-L268 WeakPolarHBondContact O-CB 3.43Å; E265-L268 PolarHBondContact O-N 2.86Å; Q266-L268 VanDerWaalsContact C-N 3.34Å; L268-Q272 HydrophobicContact CB-CB 3.84Å; L268-Q272 HydrophobicContact CD2-CB 4.22Å; L268-Q272 HydrophobicContact CG-CB 4.43Å; L268-Q273 HydrophobicContact CB-CB 4.34Å; L268-V276 HydrophobicContact CD1-CG2 4.02Å
269T90.6Very high82.1Confident71 Ų71104.9 Ų104.944%0.43653%0.534SS..  trans-60.215416459.60000110.1L271 Q272 Q273T269-L271 PolarHBondContact O-N 2.84Å; T269-Q272 PolarHBondContact O-N 3.44Å; T269-Q272 WeakPolarHBondContact OG1-CG 3.25Å; T269-Q272 PolarHBondContact OG1-N 3.15Å; T269-Q272 PolarHBondContact OG1-OE1 2.97Å; T269-Q273 PolarHBondContact O-N 3.31Å
270P90.3Very high83.8Confident100 Ų100103.9 Ų103.965%0.64952%0.521SS*.Hα-helixtrans-56.9-19.8176.1-27.836000114.5K274P270-K274 WeakPolarHBondContact O-CB 3.26Å; P270-K274 WeakPolarHBondContact O-CD 3.31Å; P270-K274 VanDerWaalsContact O-CG 3.25Å; P270-K274 WeakPolarHBondContact O-CG 3.3Å; P270-K274 PolarHBondContact O-N 2.96Å
271L92.3Very high85.3Confident137 Ų13798.1 Ų98.172%0.71751%0.506SS*.Hα-helixtrans-75.4-48170.9-178.259.9000111.8T269 K274 E275T269-L271 PolarHBondContact O-N 2.84Å; L271-K274 PolarHBondContact O-N 3.4Å; L271-E275 WeakPolarHBondContact O-CB 3.47Å; L271-E275 PolarHBondContact O-N 2.95Å
272Q93.9Very high86.8Confident87 Ų87100.1 Ų100.141%0.40751%0.505SS..Hα-helixtrans-64.4-39.6176.5-74.2162.3-50.800112.3L268 T269 E275 V276L268-Q272 HydrophobicContact CB-CB 3.84Å; L268-Q272 HydrophobicContact CD2-CB 4.22Å; L268-Q272 HydrophobicContact CG-CB 4.43Å; T269-Q272 PolarHBondContact O-N 3.44Å; T269-Q272 WeakPolarHBondContact OG1-CG 3.25Å; T269-Q272 PolarHBondContact OG1-N 3.15Å; T269-Q272 PolarHBondContact OG1-OE1 2.97Å; Q272-E275 PolarHBondContact O-N 2.81Å; Q272-V276 WeakPolarHBondContact O-CG2 3.43Å; Q272-V276 PolarHBondContact O-N 2.91Å
273Q91.7Very high88.2Confident76 Ų76102.2 Ų102.236%0.35552%0.517SS..Hα-helixtrans-61.1-47.8175.3-165.3-172.717.500110.4E265 L268 T269 E275 V276 T277E265-Q273 HydrophobicContact CB-CG 4.31Å; E265-Q273 PolarHBondContact OE2-NE2 3.2Å; L268-Q273 HydrophobicContact CB-CB 4.34Å; T269-Q273 PolarHBondContact O-N 3.31Å; Q273-E275 VanDerWaalsContact C-N 3.32Å; Q273-E275 PolarHBondContact O-N 3.39Å; Q273-V276 PolarHBondContact O-N 3.31Å; Q273-T277 PolarHBondContact O-N 3.05Å; Q273-T277 PolarHBondContact O-OG1 3.3Å
274K93.4Very high89.8Confident144 Ų144103.3 Ų103.363%0.62652%0.518SS*.Hα-helixtrans-57.1-42.7172.6-77.7175.7179.8-176.90112.4P270 L271 T277 V278P270-K274 WeakPolarHBondContact O-CB 3.26Å; P270-K274 WeakPolarHBondContact O-CD 3.31Å; P270-K274 VanDerWaalsContact O-CG 3.25Å; P270-K274 WeakPolarHBondContact O-CG 3.3Å; P270-K274 PolarHBondContact O-N 2.96Å; L271-K274 PolarHBondContact O-N 3.4Å; K274-T277 PolarHBondContact O-N 2.9Å; K274-V278 WeakPolarHBondContact O-CB 3.32Å; K274-V278 VanDerWaalsContact O-CG2 3.3Å; K274-V278 WeakPolarHBondContact O-CG2 3.39Å; K274-V278 PolarHBondContact O-N 3.47Å
275E95.4Very high91.3Very high96 Ų96104 Ų10445%0.44952%0.515SS..Hα-helixtrans-64.3-41179.4-159.5-158.1-162.600112L271 Q272 Q273 V278 R279L271-E275 WeakPolarHBondContact O-CB 3.47Å; L271-E275 PolarHBondContact O-N 2.95Å; Q272-E275 PolarHBondContact O-N 2.81Å; Q273-E275 VanDerWaalsContact C-N 3.32Å; Q273-E275 PolarHBondContact O-N 3.39Å; E275-V278 PolarHBondContact O-N 3.12Å; E275-R279 WeakPolarHBondContact O-CG 3.19Å; E275-R279 PolarHBondContact O-N 3.39Å; E275-R279 IonicContact OE1-CZ 2.67Å; E275-R279 IonicContact OE1-NH1 3.15Å; E275-R279 IonicContact OE1-NH2 3.73Å; E275-R279 PolarHBondContact OE1-NH2 3.04Å; E275-R279 IonicContact OE2-CZ 3.32Å; E275-R279 IonicContact OE2-NH1 3.18Å; E275-R279 PolarHBondContact OE2-NH1 3.07Å; E275-R279 IonicContact OE2-NH2 2.82Å; E275-R279 PolarHBondContact OE2-NH2 3Å
276V94.8Very high92.8Very high70 Ų70104.8 Ų104.842%0.42452%0.517SS..Hα-helixtrans-64.1-44.2172.5171.70000111L268 Q272 Q273 V278 R279 H280L268-V276 HydrophobicContact CD1-CG2 4.02Å; Q272-V276 WeakPolarHBondContact O-CG2 3.43Å; Q272-V276 PolarHBondContact O-N 2.91Å; Q273-V276 PolarHBondContact O-N 3.31Å; V276-V278 VanDerWaalsContact C-N 3.34Å; V276-V278 PolarHBondContact O-N 3.42Å; V276-R279 PolarHBondContact O-N 2.84Å; V276-H280 PolarHBondContact O-N 3.12Å
277T94.7Very high94Very high68 Ų68101.1 Ų101.142%0.41750%0.5SS..Hα-helixtrans-59.8-43.2174.2-50.40000111.6Q273 K274 H280 L281Q273-T277 PolarHBondContact O-N 3.05Å; Q273-T277 PolarHBondContact O-OG1 3.3Å; K274-T277 PolarHBondContact O-N 2.9Å; T277-H280 PolarHBondContact O-N 3.36Å; T277-L281 HydrophobicContact CG2-CD1 3.98Å; T277-L281 HydrophobicContact CG2-CG 4.32Å; T277-L281 WeakPolarHBondContact O-CB 3.35Å; T277-L281 VanDerWaalsContact O-CG 3.32Å; T277-L281 WeakPolarHBondContact O-CG 3.46Å; T277-L281 PolarHBondContact O-N 3.4Å
278V97.1Very high95.2Very high93 Ų9396.8 Ų96.856%0.56449%0.492SS*.Hα-helixtrans-64.3-42.1177167.20000111.5K274 E275 V276 L281 K282K274-V278 WeakPolarHBondContact O-CB 3.32Å; K274-V278 VanDerWaalsContact O-CG2 3.3Å; K274-V278 WeakPolarHBondContact O-CG2 3.39Å; K274-V278 PolarHBondContact O-N 3.47Å; E275-V278 PolarHBondContact O-N 3.12Å; V276-V278 VanDerWaalsContact C-N 3.34Å; V276-V278 PolarHBondContact O-N 3.42Å; V278-L281 PolarHBondContact O-N 2.91Å; V278-K282 VanDerWaalsContact O-CB 3.23Å; V278-K282 WeakPolarHBondContact O-CB 3.46Å; V278-K282 PolarHBondContact O-N 3Å
279R96.9Very high96Very high126 Ų12699.6 Ų99.648%0.47550%0.504SS..Hα-helixtrans-59-47172.2-72.7-175.7-172.695.6-1.3111.4E275 V276 K282 T283E275-R279 WeakPolarHBondContact O-CG 3.19Å; E275-R279 PolarHBondContact O-N 3.39Å; E275-R279 IonicContact OE1-CZ 2.67Å; E275-R279 IonicContact OE1-NH1 3.15Å; E275-R279 IonicContact OE1-NH2 3.73Å; E275-R279 PolarHBondContact OE1-NH2 3.04Å; E275-R279 IonicContact OE2-CZ 3.32Å; E275-R279 IonicContact OE2-NH1 3.18Å; E275-R279 PolarHBondContact OE2-NH1 3.07Å; E275-R279 IonicContact OE2-NH2 2.82Å; E275-R279 PolarHBondContact OE2-NH2 3Å; V276-R279 PolarHBondContact O-N 2.84Å; R279-K282 PolarHBondContact O-N 3.49Å; R279-T283 PolarHBondContact O-N 2.91Å; R279-T283 PolarHBondContact O-OG1 2.89Å; R279-T283 VanDerWaalsContact O-OG1 3.09Å
280H97.8Very high96.4Very high104 Ų104102.7 Ų102.748%0.48151%0.508SS..Hα-helixtrans-62.2-46.2179.2-176.351000112.6V276 T277 T283 K284V276-H280 PolarHBondContact O-N 3.12Å; T277-H280 PolarHBondContact O-N 3.36Å; H280-T283 PolarHBondContact O-N 3.25Å; H280-K284 WeakPolarHBondContact NE2-CE 3.36Å; H280-K284 PolarHBondContact NE2-NZ 3.24Å; H280-K284 PolarHBondContact O-N 2.72Å
281L98.6Very high96.8Very high102 Ų102104.1 Ų104.153%0.53450%0.5SS..Hα-helixtrans-64.5-40.1176.5-70174.8000111.8T277 V278 T283 K284 L285T277-L281 HydrophobicContact CG2-CD1 3.98Å; T277-L281 HydrophobicContact CG2-CG 4.32Å; T277-L281 WeakPolarHBondContact O-CB 3.35Å; T277-L281 VanDerWaalsContact O-CG 3.32Å; T277-L281 WeakPolarHBondContact O-CG 3.46Å; T277-L281 PolarHBondContact O-N 3.4Å; V278-L281 PolarHBondContact O-N 2.91Å; L281-T283 PolarHBondContact O-N 3.02Å; L281-K284 PolarHBondContact O-N 3.07Å; L281-L285 WeakPolarHBondContact O-CB 3.39Å; L281-L285 PolarHBondContact O-N 3.29Å
282K98.3Very high97.1Very high137 Ų137102.3 Ų102.360%0.59649%0.49SS*.Hα-helixtrans-64-38.9175.1-172.3170.6-175.7171.40112.2V278 R279 K286V278-K282 VanDerWaalsContact O-CB 3.23Å; V278-K282 WeakPolarHBondContact O-CB 3.46Å; V278-K282 PolarHBondContact O-N 3Å; R279-K282 PolarHBondContact O-N 3.49Å; K282-K286 WeakPolarHBondContact O-CG 3.29Å; K282-K286 PolarHBondContact O-N 3.31Å; K282-K286 VanDerWaalsContact O-N 3.13Å
283T98.4Very high97.3Very high91 Ų91104 Ų10456%0.55850%0.498SS*.Hα-helixtrans-67.6-42.2173.8-61.30000111.8R279 H280 L281 K286 E287R279-T283 PolarHBondContact O-N 2.91Å; R279-T283 PolarHBondContact O-OG1 2.89Å; R279-T283 VanDerWaalsContact O-OG1 3.09Å; H280-T283 PolarHBondContact O-N 3.25Å; L281-T283 PolarHBondContact O-N 3.02Å; T283-K286 PolarHBondContact O-N 2.83Å; T283-E287 WeakPolarHBondContact O-CB 3.41Å; T283-E287 PolarHBondContact O-N 2.96Å
284K98.5Very high97.6Very high118 Ų118106 Ų10651%0.51351%0.508SS..Hα-helixtrans-62.3-42.9173.8-82.4-178.8166.5-179.90112.5H280 L281 E287 S288H280-K284 WeakPolarHBondContact NE2-CE 3.36Å; H280-K284 PolarHBondContact NE2-NZ 3.24Å; H280-K284 PolarHBondContact O-N 2.72Å; L281-K284 PolarHBondContact O-N 3.07Å; K284-E287 WeakPolarHBondContact O-CB 3.36Å; K284-E287 PolarHBondContact O-N 3.21Å; K284-E287 VanDerWaalsContact O-N 3.14Å; K284-S288 PolarHBondContact O-N 3.42Å; K284-S288 PolarHBondContact O-OG 2.84Å; K284-S288 VanDerWaalsContact O-OG 3.13Å
285L98.7Very high97.9Very high115 Ų115105.6 Ų105.660%0.60250%0.502SS*.Hα-helixtrans-59.8-49.2177.4-179.961000111L281 E287 S288 E289L281-L285 WeakPolarHBondContact O-CB 3.39Å; L281-L285 PolarHBondContact O-N 3.29Å; L285-E287 PolarHBondContact O-N 2.83Å; L285-S288 WeakPolarHBondContact CA-OG 3.08Å; L285-S288 PolarHBondContact O-N 3.46Å; L285-S288 PolarHBondContact O-OG 3.27Å; L285-E289 VanDerWaalsContact O-CB 3.29Å; L285-E289 WeakPolarHBondContact O-CB 3.44Å; L285-E289 PolarHBondContact O-N 3.14Å
286K98.7Very high98Very high112 Ų112105.6 Ų105.649%0.48750%0.502SS..Hα-helixtrans-62.1-27175.1-74-161.8166.2-148.70114K282 T283 E289 R290K282-K286 WeakPolarHBondContact O-CG 3.29Å; K282-K286 PolarHBondContact O-N 3.31Å; K282-K286 VanDerWaalsContact O-N 3.13Å; T283-K286 PolarHBondContact O-N 2.83Å; K286-E289 WeakPolarHBondContact CA-OE2 3.29Å; K286-R290 WeakPolarHBondContact O-CG 3.27Å; K286-R290 VanDerWaalsContact O-CZ 3.32Å; K286-R290 PolarHBondContact O-N 3.47Å; K286-R290 PolarHBondContact O-NH1 3.44Å
287E98.5Very high98.2Very high63 Ų63105.7 Ų105.729%0.29451%0.506SS..Hα-helixtrans-77.4-40.3175177.963.1-173.200111.8T283 K284 L285 R290 R291T283-E287 WeakPolarHBondContact O-CB 3.41Å; T283-E287 PolarHBondContact O-N 2.96Å; K284-E287 WeakPolarHBondContact O-CB 3.36Å; K284-E287 PolarHBondContact O-N 3.21Å; K284-E287 VanDerWaalsContact O-N 3.14Å; L285-E287 PolarHBondContact O-N 2.83Å; E287-R290 IonicContact OE2-CZ 2.67Å; E287-R290 IonicContact OE2-NE 3.4Å; E287-R290 PolarHBondContact OE2-NE 3.45Å; E287-R290 IonicContact OE2-NH2 2.72Å; E287-R290 PolarHBondContact OE2-NH2 2.95Å; E287-R291 VanDerWaalsContact O-CG 3.26Å; E287-R291 WeakPolarHBondContact O-CG 3.36Å; E287-R291 PolarHBondContact O-N 3.22Å; E287-R291 VanDerWaalsContact O-N 3.13Å; E287-R291 IonicContact OE1-CZ 3.56Å; E287-R291 IonicContact OE1-NE 3.83Å; E287-R291 PolarHBondContact OE1-NE 2.67Å; E287-R291 IonicContact OE1-NH2 3.44Å; E287-R291 PolarHBondContact OE1-NH2 3.26Å
288S98.4Very high98.4Very high64 Ų64107.4 Ų107.445%0.44851%0.509SS..Hα-helixtrans-66.1-37.5170.842.50000112.8K284 L285 R291 L292K284-S288 PolarHBondContact O-N 3.42Å; K284-S288 PolarHBondContact O-OG 2.84Å; K284-S288 VanDerWaalsContact O-OG 3.13Å; L285-S288 WeakPolarHBondContact CA-OG 3.08Å; L285-S288 PolarHBondContact O-N 3.46Å; L285-S288 PolarHBondContact O-OG 3.27Å; S288-R291 PolarHBondContact O-N 3.07Å; S288-L292 WeakPolarHBondContact O-CB 3.3Å; S288-L292 PolarHBondContact O-N 3.09Å
289E98.6Very high98.5Very high118 Ų118107.1 Ų107.155%0.55150%0.504SS*.Hα-helixtrans-59.1-49.6174.9-178.2-179.1-151.500111L285 K286 R291 L292 H293L285-E289 VanDerWaalsContact O-CB 3.29Å; L285-E289 WeakPolarHBondContact O-CB 3.44Å; L285-E289 PolarHBondContact O-N 3.14Å; K286-E289 WeakPolarHBondContact CA-OE2 3.29Å; E289-R291 PolarHBondContact O-N 3.48Å; E289-L292 PolarHBondContact O-N 3.03Å; E289-H293 PolarHBondContact O-N 3.29Å
290R98.5Very high98.6Very high135 Ų135105.9 Ų105.951%0.50951%0.51SS..Hα-helixtrans-57.9-47.2173.3-78.2-173.3-64.8-88.46.4113.1K286 E287 L292 H293 E294K286-R290 WeakPolarHBondContact O-CG 3.27Å; K286-R290 VanDerWaalsContact O-CZ 3.32Å; K286-R290 PolarHBondContact O-N 3.47Å; K286-R290 PolarHBondContact O-NH1 3.44Å; E287-R290 IonicContact OE2-CZ 2.67Å; E287-R290 IonicContact OE2-NE 3.4Å; E287-R290 PolarHBondContact OE2-NE 3.45Å; E287-R290 IonicContact OE2-NH2 2.72Å; E287-R290 PolarHBondContact OE2-NH2 2.95Å; R290-L292 VanDerWaalsContact C-N 3.26Å; R290-L292 PolarHBondContact O-N 3.49Å; R290-H293 PolarHBondContact O-N 3.47Å; R290-E294 WeakPolarHBondContact O-CB 3.44Å; R290-E294 PolarHBondContact O-N 2.8Å
291R98.7Very high98.6Very high130 Ų130107 Ų10749%0.49152%0.515SS..Hα-helixtrans-69.3-21.7-179.3-69.7172.4-170.3-1683113.9E287 S288 E289 R295E287-R291 VanDerWaalsContact O-CG 3.26Å; E287-R291 WeakPolarHBondContact O-CG 3.36Å; E287-R291 PolarHBondContact O-N 3.22Å; E287-R291 VanDerWaalsContact O-N 3.13Å; E287-R291 IonicContact OE1-CZ 3.56Å; E287-R291 IonicContact OE1-NE 3.83Å; E287-R291 PolarHBondContact OE1-NE 2.67Å; E287-R291 IonicContact OE1-NH2 3.44Å; E287-R291 PolarHBondContact OE1-NH2 3.26Å; S288-R291 PolarHBondContact O-N 3.07Å; E289-R291 PolarHBondContact O-N 3.48Å; R291-R295 PolarHBondContact O-NH1 3.05Å
292L98.7Very high98.6Very high99 Ų99106.5 Ų106.552%0.51851%0.512SS..Hα-helixtrans-76.3-49.9171.1-178.9146.8000109.1S288 E289 R290 E294 R295 E296S288-L292 WeakPolarHBondContact O-CB 3.3Å; S288-L292 PolarHBondContact O-N 3.09Å; E289-L292 PolarHBondContact O-N 3.03Å; R290-L292 VanDerWaalsContact C-N 3.26Å; R290-L292 PolarHBondContact O-N 3.49Å; L292-E294 VanDerWaalsContact C-N 3.33Å; L292-E294 PolarHBondContact O-N 2.85Å; L292-R295 CarbonylContact O-C 3.58Å; L292-R295 WeakPolarHBondContact O-CA 3.34Å; L292-R295 WeakPolarHBondContact O-CB 3.32Å; L292-R295 PolarHBondContact O-N 3.21Å; L292-E296 HydrophobicContact CD2-CG 4.11Å; L292-E296 WeakPolarHBondContact CD2-OE1 3.39Å; L292-E296 WeakPolarHBondContact O-CG 3.29Å; L292-E296 PolarHBondContact O-N 3.44Å
293H98.7Very high98.7Very high124 Ų124106.5 Ų106.557%0.57451%0.513SS*.Hα-helixtrans-64.1-35.1179.1-162.654.6000113.7E289 R290 R295 E296 S297E289-H293 PolarHBondContact O-N 3.29Å; R290-H293 PolarHBondContact O-N 3.47Å; H293-R295 VanDerWaalsContact C-N 3.34Å; H293-R295 PolarHBondContact O-N 3.03Å; H293-E296 WeakPolarHBondContact CA-OE2 3.39Å; H293-E296 IonicContact CE1-OE2 3.88Å; H293-E296 IonicContact CG-OE2 3.58Å; H293-E296 IonicContact ND1-OE2 3.48Å; H293-E296 PolarHBondContact ND1-OE2 3.31Å; H293-E296 WeakPolarHBondContact O-CB 3.44Å; H293-E296 PolarHBondContact O-N 2.89Å; H293-S297 PolarHBondContact O-N 3.25Å
294E98.6Very high98.7Very high118 Ų118104.6 Ų104.655%0.55150%0.503SS*.Hα-helixtrans-54.7-47.8168.8-178.6178.7-133.800111.2R290 L292 S297 E298R290-E294 WeakPolarHBondContact O-CB 3.44Å; R290-E294 PolarHBondContact O-N 2.8Å; L292-E294 VanDerWaalsContact C-N 3.33Å; L292-E294 PolarHBondContact O-N 2.85Å; E294-S297 PolarHBondContact O-N 3.03Å; E294-S297 PolarHBondContact O-OG 2.94Å; E294-E298 PolarHBondContact O-N 3.18Å
295R98.8Very high98.7Very high135 Ų135102.8 Ų102.851%0.50950%0.496SS..Hα-helixtrans-69.4-34.6175.7-76.5172178.964.712.6113.4R291 L292 H293 S297 E298 I299R291-R295 PolarHBondContact O-NH1 3.05Å; L292-R295 CarbonylContact O-C 3.58Å; L292-R295 WeakPolarHBondContact O-CA 3.34Å; L292-R295 WeakPolarHBondContact O-CB 3.32Å; L292-R295 PolarHBondContact O-N 3.21Å; H293-R295 VanDerWaalsContact C-N 3.34Å; H293-R295 PolarHBondContact O-N 3.03Å; R295-S297 VanDerWaalsContact C-N 3.29Å; R295-S297 PolarHBondContact O-N 3.45Å; R295-E298 PolarHBondContact O-N 3.34Å; R295-I299 VanDerWaalsContact O-CB 3.31Å; R295-I299 WeakPolarHBondContact O-CB 3.34Å; R295-I299 WeakPolarHBondContact O-CD1 3.32Å; R295-I299 WeakPolarHBondContact O-CG1 3.46Å; R295-I299 PolarHBondContact O-N 3.32Å
296E98.8Very high98.7Very high96 Ų96101.3 Ų101.345%0.44949%0.489SS..Hα-helixtrans-60-43.5172.2-68.2175.5149.300110.5L292 H293 I299 V300L292-E296 HydrophobicContact CD2-CG 4.11Å; L292-E296 WeakPolarHBondContact CD2-OE1 3.39Å; L292-E296 WeakPolarHBondContact O-CG 3.29Å; L292-E296 PolarHBondContact O-N 3.44Å; H293-E296 WeakPolarHBondContact CA-OE2 3.39Å; H293-E296 IonicContact CE1-OE2 3.88Å; H293-E296 IonicContact CG-OE2 3.58Å; H293-E296 IonicContact ND1-OE2 3.48Å; H293-E296 PolarHBondContact ND1-OE2 3.31Å; H293-E296 WeakPolarHBondContact O-CB 3.44Å; H293-E296 PolarHBondContact O-N 2.89Å; E296-I299 PolarHBondContact O-N 2.96Å; E296-V300 WeakPolarHBondContact O-CG2 3.3Å; E296-V300 PolarHBondContact O-N 3.05Å
297S98.6Very high98.7Very high71 Ų7197.8 Ų97.850%0.49748%0.48SS..Hα-helixtrans-65.9-42.3176.573.80000112.7H293 E294 R295 I299 V300 E301H293-S297 PolarHBondContact O-N 3.25Å; E294-S297 PolarHBondContact O-N 3.03Å; E294-S297 PolarHBondContact O-OG 2.94Å; R295-S297 VanDerWaalsContact C-N 3.29Å; R295-S297 PolarHBondContact O-N 3.45Å; S297-I299 PolarHBondContact O-N 3.42Å; S297-V300 PolarHBondContact O-N 3.32Å; S297-E301 PolarHBondContact O-N 3.09Å
298E98.8Very high98.7Very high105 Ų105100.9 Ų100.949%0.49149%0.489SS..Hα-helixtrans-60.9-43.2173.4-176.2-176.8-163.800111.5E294 R295 V300 E301 L302E294-E298 PolarHBondContact O-N 3.18Å; R295-E298 PolarHBondContact O-N 3.34Å; E298-V300 VanDerWaalsContact C-N 3.33Å; E298-V300 PolarHBondContact O-N 2.88Å; E298-E301 PolarHBondContact O-N 3.13Å; E298-L302 HydrophobicContact CG-CD1 3.94Å; E298-L302 HydrophobicContact CG-CG 4.41Å; E298-L302 WeakPolarHBondContact O-CB 3.44Å; E298-L302 VanDerWaalsContact O-CG 3.27Å; E298-L302 WeakPolarHBondContact O-CG 3.4Å; E298-L302 PolarHBondContact O-N 3.27Å
299I98.7Very high98.7Very high87 Ų87102.6 Ų102.645%0.44649%0.491SS..Hα-helixtrans-64.4-37.6176.7-72.2164.3000111.2R295 E296 S297 K303R295-I299 VanDerWaalsContact O-CB 3.31Å; R295-I299 WeakPolarHBondContact O-CB 3.34Å; R295-I299 WeakPolarHBondContact O-CD1 3.32Å; R295-I299 WeakPolarHBondContact O-CG1 3.46Å; R295-I299 PolarHBondContact O-N 3.32Å; E296-I299 PolarHBondContact O-N 2.96Å; S297-I299 PolarHBondContact O-N 3.42Å; I299-K303 HydrophobicContact CG2-CD 4.08Å; I299-K303 VanDerWaalsContact O-CB 3.29Å; I299-K303 WeakPolarHBondContact O-CB 3.44Å; I299-K303 WeakPolarHBondContact O-CD 3.24Å; I299-K303 WeakPolarHBondContact O-CG 3.33Å; I299-K303 PolarHBondContact O-N 2.85Å
300V98.8Very high98.7Very high100 Ų100102.3 Ų102.361%0.60649%0.485SS*.Hα-helixtrans-69.4-43175.1169.80000111.2E296 S297 E298 K303 S304E296-V300 WeakPolarHBondContact O-CG2 3.3Å; E296-V300 PolarHBondContact O-N 3.05Å; S297-V300 PolarHBondContact O-N 3.32Å; E298-V300 VanDerWaalsContact C-N 3.33Å; E298-V300 PolarHBondContact O-N 2.88Å; V300-K303 PolarHBondContact O-N 2.88Å; V300-S304 PolarHBondContact O-N 3.25Å
301E98.8Very high98.7Very high127 Ų127101 Ų10159%0.59349%0.485SS*.Hα-helixtrans-62.2-49175.9-175.5173.7-170.900111.3S297 E298 K303 S304 Q305S297-E301 PolarHBondContact O-N 3.09Å; E298-E301 PolarHBondContact O-N 3.13Å; E301-K303 VanDerWaalsContact C-N 3.32Å; E301-K303 PolarHBondContact O-N 3.4Å; E301-S304 CarbonylContact O-C 3.57Å; E301-S304 WeakPolarHBondContact O-CA 3.35Å; E301-S304 WeakPolarHBondContact O-CB 3.48Å; E301-S304 PolarHBondContact O-N 2.93Å; E301-S304 PolarHBondContact O-OG 2.94Å; E301-Q305 PolarHBondContact O-N 3.15Å
302L98.8Very high98.7Very high91 Ų9199.1 Ų99.148%0.47649%0.485SS..Hα-helixtrans-63.6-34.8178-70.1174.2000112.4E298 Q305 L306E298-L302 HydrophobicContact CG-CD1 3.94Å; E298-L302 HydrophobicContact CG-CG 4.41Å; E298-L302 WeakPolarHBondContact O-CB 3.44Å; E298-L302 VanDerWaalsContact O-CG 3.27Å; E298-L302 WeakPolarHBondContact O-CG 3.4Å; E298-L302 PolarHBondContact O-N 3.27Å; L302-Q305 PolarHBondContact O-N 3.03Å; L302-L306 WeakPolarHBondContact O-CB 3.36Å; L302-L306 PolarHBondContact O-N 3.18Å
303K98.8Very high98.7Very high138 Ų138102 Ų10260%0.649%0.489SS*.Hα-helixtrans-63.4-42.5169.3-79.4171.4179.2-179.40111.7I299 V300 E301 Q305 L306 A307I299-K303 HydrophobicContact CG2-CD 4.08Å; I299-K303 VanDerWaalsContact O-CB 3.29Å; I299-K303 WeakPolarHBondContact O-CB 3.44Å; I299-K303 WeakPolarHBondContact O-CD 3.24Å; I299-K303 WeakPolarHBondContact O-CG 3.33Å; I299-K303 PolarHBondContact O-N 2.85Å; V300-K303 PolarHBondContact O-N 2.88Å; E301-K303 VanDerWaalsContact C-N 3.32Å; E301-K303 PolarHBondContact O-N 3.4Å; K303-Q305 VanDerWaalsContact C-N 3.28Å; K303-Q305 PolarHBondContact O-N 3.17Å; K303-L306 PolarHBondContact O-N 3.46Å; K303-A307 PolarHBondContact O-N 3.37Å
304S98.7Very high98.7Very high51 Ų51100.8 Ų100.836%0.35749%0.486SS..Hα-helixtrans-64.9-31.5175.687.70000112.9V300 E301 R308V300-S304 PolarHBondContact O-N 3.25Å; E301-S304 CarbonylContact O-C 3.57Å; E301-S304 WeakPolarHBondContact O-CA 3.35Å; E301-S304 WeakPolarHBondContact O-CB 3.48Å; E301-S304 PolarHBondContact O-N 2.93Å; E301-S304 PolarHBondContact O-OG 2.94Å; S304-R308 WeakPolarHBondContact O-CG 3.28Å; S304-R308 PolarHBondContact O-N 3.1Å; S304-R308 PolarHBondContact O-NE 3.5Å
305Q98.9Very high98.7Very high80 Ų80100.9 Ų100.937%0.37449%0.486SS..Hα-helixtrans-75.2-42.3175.1-177177.8-12.500111.3E301 L302 K303 A307 R308 M309E301-Q305 PolarHBondContact O-N 3.15Å; L302-Q305 PolarHBondContact O-N 3.03Å; K303-Q305 VanDerWaalsContact C-N 3.28Å; K303-Q305 PolarHBondContact O-N 3.17Å; Q305-A307 VanDerWaalsContact C-N 3.3Å; Q305-A307 PolarHBondContact O-N 3.09Å; Q305-R308 PolarHBondContact O-N 3.3Å; Q305-M309 HydrophobicContact CG-CG 4.34Å; Q305-M309 HydrophobicContact CG-SD 3.94Å; Q305-M309 WeakPolarHBondContact O-CB 3.4Å; Q305-M309 WeakPolarHBondContact O-CG 3.44Å; Q305-M309 PolarHBondContact O-N 3.32Å
306L98.8Very high98.7Very high84 Ų84101.3 Ų101.344%0.4449%0.494SS..Hα-helixtrans-64.8-34.1176.3-179.961.1000112.3L302 K303 R310L302-L306 WeakPolarHBondContact O-CB 3.36Å; L302-L306 PolarHBondContact O-N 3.18Å; K303-L306 PolarHBondContact O-N 3.46Å; L306-R310 WeakPolarHBondContact O-CD 3.43Å; L306-R310 VanDerWaalsContact O-CG 3.22Å; L306-R310 WeakPolarHBondContact O-CG 3.17Å; L306-R310 PolarHBondContact O-N 2.95Å
307A98.6Very high98.7Very high38 Ų38100 Ų10031%0.31449%0.487SS..Hα-helixtrans-60-64168.900000110K303 Q305 M309 R310 E311K303-A307 PolarHBondContact O-N 3.37Å; Q305-A307 VanDerWaalsContact C-N 3.3Å; Q305-A307 PolarHBondContact O-N 3.09Å; A307-M309 VanDerWaalsContact C-N 3.28Å; A307-M309 PolarHBondContact O-N 3.46Å; A307-M309 VanDerWaalsContact O-N 3.1Å; A307-R310 WeakPolarHBondContact O-CA 3.26Å; A307-R310 VanDerWaalsContact O-CB 3.31Å; A307-R310 WeakPolarHBondContact O-CB 3.35Å; A307-R310 PolarHBondContact O-N 3.33Å; A307-E311 VanDerWaalsContact C-CD 3.49Å; A307-E311 WeakPolarHBondContact CB-OE2 3.49Å; A307-E311 PolarHBondContact O-N 2.96Å; A307-E311 VanDerWaalsContact O-OE1 3.08Å
308R98.8Very high98.7Very high127 Ų12799.6 Ų99.648%0.47948%0.484SS..Hα-helixtrans-49.6-45.8179.5-72.8176.7-71.1117.8-9.9113.3S304 Q305 R310 E311 D312S304-R308 WeakPolarHBondContact O-CG 3.28Å; S304-R308 PolarHBondContact O-N 3.1Å; S304-R308 PolarHBondContact O-NE 3.5Å; Q305-R308 PolarHBondContact O-N 3.3Å; R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 2.89Å; R308-E311 PolarHBondContact N-OE2 3.31Å; R308-E311 PolarHBondContact O-N 3.27Å; R308-D312 WeakPolarHBondContact O-CB 3.37Å; R308-D312 PolarHBondContact O-N 2.85Å
309M98.8Very high98.7Very high100 Ų10099.2 Ų99.249%0.49348%0.482SS..Hα-helixtrans-66.3-20.7177.5-71.1-179.163.800114.9Q305 A307 W313Q305-M309 HydrophobicContact CG-CG 4.34Å; Q305-M309 HydrophobicContact CG-SD 3.94Å; Q305-M309 WeakPolarHBondContact O-CB 3.4Å; Q305-M309 WeakPolarHBondContact O-CG 3.44Å; Q305-M309 PolarHBondContact O-N 3.32Å; A307-M309 VanDerWaalsContact C-N 3.28Å; A307-M309 PolarHBondContact O-N 3.46Å; A307-M309 VanDerWaalsContact O-N 3.1Å; M309-W313 WeakPolarHBondContact O-CB 3.44Å; M309-W313 PolarHBondContact O-N 2.91Å
310R98.8Very high98.7Very high113 Ų11399.9 Ų99.943%0.42648%0.479SS..Hα-helixtrans-81.1-44.2169.4-73.8167174.5-158.8-3.7111.1L306 A307 R308 W313 I314 L577L306-R310 WeakPolarHBondContact O-CD 3.43Å; L306-R310 VanDerWaalsContact O-CG 3.22Å; L306-R310 WeakPolarHBondContact O-CG 3.17Å; L306-R310 PolarHBondContact O-N 2.95Å; A307-R310 WeakPolarHBondContact O-CA 3.26Å; A307-R310 VanDerWaalsContact O-CB 3.31Å; A307-R310 WeakPolarHBondContact O-CB 3.35Å; A307-R310 PolarHBondContact O-N 3.33Å; R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 2.89Å; R310-W313 PolarHBondContact O-N 3.09Å; R310-I314 WeakPolarHBondContact O-CB 3.4Å; R310-I314 WeakPolarHBondContact O-CD1 3.42Å; R310-I314 VanDerWaalsContact O-CG1 3.23Å; R310-I314 WeakPolarHBondContact O-CG1 3.46Å; R310-I314 PolarHBondContact O-N 3.41Å; R310-L577 VanDerWaalsContact NH2-CD2 3.26Å
311E98.6Very high98.7Very high106 Ų10698.5 Ų98.550%0.49547%0.471SS..Hα-helixtrans-60-48.2174.9-76.682.6-99.400111.2A307 R308 W313 I314 E315A307-E311 VanDerWaalsContact C-CD 3.49Å; A307-E311 WeakPolarHBondContact CB-OE2 3.49Å; A307-E311 PolarHBondContact O-N 2.96Å; A307-E311 VanDerWaalsContact O-OE1 3.08Å; R308-E311 PolarHBondContact N-OE2 3.31Å; R308-E311 PolarHBondContact O-N 3.27Å; E311-W313 VanDerWaalsContact C-N 3.3Å; E311-W313 PolarHBondContact O-N 3.47Å; E311-I314 PolarHBondContact O-N 3.3Å; E311-E315 PolarHBondContact O-N 2.92Å
312D98.7Very high98.7Very high91 Ų9197.8 Ų97.849%0.48747%0.467SS..Hα-helixtrans-53.3-45.9173.3-62.3-28.5000111.1R308 E315 E316R308-D312 WeakPolarHBondContact O-CB 3.37Å; R308-D312 PolarHBondContact O-N 2.85Å; D312-E315 PolarHBondContact O-N 2.86Å; D312-E316 PolarHBondContact O-N 2.94Å
313W98.8Very high98.7Very high159 Ų15996.4 Ų96.460%0.60247%0.469SS*.Hα-helixtrans-69.5-37-179.9178.677.1000113.2M309 R310 E311 E315 E317M309-W313 WeakPolarHBondContact O-CB 3.44Å; M309-W313 PolarHBondContact O-N 2.91Å; R310-W313 PolarHBondContact O-N 3.09Å; E311-W313 VanDerWaalsContact C-N 3.3Å; E311-W313 PolarHBondContact O-N 3.47Å; W313-E315 VanDerWaalsContact C-N 3.33Å; W313-E317 VanDerWaalsContact O-CB 3.32Å; W313-E317 WeakPolarHBondContact O-CB 3.2Å; W313-E317 PolarHBondContact O-N 2.9Å
314I98.7Very high98.7Very high100 Ų10094.4 Ų94.451%0.51346%0.462SS..Hα-helixtrans-65-39.8174-70.3163.3000110R310 E311 C318R310-I314 WeakPolarHBondContact O-CB 3.4Å; R310-I314 WeakPolarHBondContact O-CD1 3.42Å; R310-I314 VanDerWaalsContact O-CG1 3.23Å; R310-I314 WeakPolarHBondContact O-CG1 3.46Å; R310-I314 PolarHBondContact O-N 3.41Å; E311-I314 PolarHBondContact O-N 3.3Å; I314-C318 WeakPolarHBondContact O-CB 3.45Å; I314-C318 PolarHBondContact O-N 3.35Å
315E98.7Very high98.7Very high119 Ų11997.1 Ų97.156%0.55647%0.472SS*.Hα-helixtrans-67.7-43.7176.8-174.6172.9170.600112.1E311 D312 W313 C318 H319E311-E315 PolarHBondContact O-N 2.92Å; D312-E315 PolarHBondContact O-N 2.86Å; W313-E315 VanDerWaalsContact C-N 3.33Å; E315-C318 PolarHBondContact O-N 3.49Å; E315-H319 VanDerWaalsContact CG-CE1 3.5Å; E315-H319 WeakPolarHBondContact CG-CE1 3.3Å; E315-H319 PolarHBondContact O-N 2.93Å; E315-H319 PolarHBondContact O-ND1 2.9Å; E315-H319 IonicContact OE1-CE1 3.53Å; E315-H319 PolarHBondContact OE1-CE1 3.47Å
316E98.5Very high98.7Very high144 Ų14496 Ų9667%0.67348%0.476SS*.Hα-helixtrans-60.4-45.4173.4-75.9-170.5170.600112.2D312 R320D312-E316 PolarHBondContact O-N 2.94Å; E316-R320 WeakPolarHBondContact O-CB 2.98Å; E316-R320 PolarHBondContact O-N 2.87Å
317E98.4Very high98.7Very high68 Ų6896 Ų9632%0.31848%0.476SS..Hα-helixtrans-68.8-34179.1-178.164-17500112.1W313 R320 V321W313-E317 VanDerWaalsContact O-CB 3.32Å; W313-E317 WeakPolarHBondContact O-CB 3.2Å; W313-E317 PolarHBondContact O-N 2.9Å; E317-R320 WeakPolarHBondContact O-CB 3.49Å; E317-R320 PolarHBondContact O-N 3.15Å; E317-R320 IonicContact OE1-CZ 3.72Å; E317-R320 IonicContact OE1-NE 3.48Å; E317-R320 PolarHBondContact OE1-NE 3.1Å; E317-R320 IonicContact OE1-NH2 3.5Å; E317-R320 PolarHBondContact OE1-NH2 3.46Å; E317-R320 WeakPolarHBondContact OE2-CD 3.34Å; E317-R320 IonicContact OE2-CZ 2.69Å; E317-R320 IonicContact OE2-NE 2.72Å; E317-R320 PolarHBondContact OE2-NE 2.92Å; E317-R320 IonicContact OE2-NH2 2.76Å; E317-V321 WeakPolarHBondContact O-CG2 3.44Å; E317-V321 PolarHBondContact O-N 3.29Å; E317-V321 VanDerWaalsContact O-N 3.08Å
318C98.7Very high98.7Very high63 Ų63100.5 Ų100.543%0.42649%0.489SS..Hα-helixtrans-60.8-56.9172.4-171.20000111I314 E315 R320 V321 E322I314-C318 WeakPolarHBondContact O-CB 3.45Å; I314-C318 PolarHBondContact O-N 3.35Å; E315-C318 PolarHBondContact O-N 3.49Å; C318-R320 PolarHBondContact O-N 3.49Å; C318-V321 WeakPolarHBondContact O-CA 3.44Å; C318-V321 PolarHBondContact O-N 2.95Å; C318-E322 PolarHBondContact O-N 2.93Å
319H98.8Very high98.7Very high98 Ų9899.5 Ų99.545%0.45449%0.489SS..Hα-helixtrans-55.1-37.4176.5-72.6118.5000112.3E315 V321 E322 A323E315-H319 VanDerWaalsContact CG-CE1 3.5Å; E315-H319 WeakPolarHBondContact CG-CE1 3.3Å; E315-H319 PolarHBondContact O-N 2.93Å; E315-H319 PolarHBondContact O-ND1 2.9Å; E315-H319 IonicContact OE1-CE1 3.53Å; E315-H319 PolarHBondContact OE1-CE1 3.47Å; H319-V321 VanDerWaalsContact C-N 3.34Å; H319-V321 PolarHBondContact O-N 2.79Å; H319-E322 IonicContact CD2-OE2 3.21Å; H319-A323 WeakPolarHBondContact O-CB 3.48Å; H319-A323 PolarHBondContact O-N 3.47Å
320R98.9Very high98.7Very high101 Ų10196.5 Ų96.538%0.38148%0.481SS..Hα-helixtrans-64.2-35175.8-163.4-157.759.459.4-5112.8E316 E317 C318 Q324E316-R320 WeakPolarHBondContact O-CB 2.98Å; E316-R320 PolarHBondContact O-N 2.87Å; E317-R320 WeakPolarHBondContact O-CB 3.49Å; E317-R320 PolarHBondContact O-N 3.15Å; E317-R320 IonicContact OE1-CZ 3.72Å; E317-R320 IonicContact OE1-NE 3.48Å; E317-R320 PolarHBondContact OE1-NE 3.1Å; E317-R320 IonicContact OE1-NH2 3.5Å; E317-R320 PolarHBondContact OE1-NH2 3.46Å; E317-R320 WeakPolarHBondContact OE2-CD 3.34Å; E317-R320 IonicContact OE2-CZ 2.69Å; E317-R320 IonicContact OE2-NE 2.72Å; E317-R320 PolarHBondContact OE2-NE 2.92Å; E317-R320 IonicContact OE2-NH2 2.76Å; C318-R320 PolarHBondContact O-N 3.49Å; R320-Q324 VanDerWaalsContact NH1-NE2 3.19Å; R320-Q324 WeakPolarHBondContact O-CG 3.38Å; R320-Q324 PolarHBondContact O-N 2.76Å
321V98.8Very high98.7Very high70 Ų7098.7 Ų98.742%0.42449%0.489SS..Hα-helixtrans-79.1-41.9177.1170.50000111.4E317 C318 H319 A323 Q324 L325E317-V321 WeakPolarHBondContact O-CG2 3.44Å; E317-V321 PolarHBondContact O-N 3.29Å; E317-V321 VanDerWaalsContact O-N 3.08Å; C318-V321 WeakPolarHBondContact O-CA 3.44Å; C318-V321 PolarHBondContact O-N 2.95Å; H319-V321 VanDerWaalsContact C-N 3.34Å; H319-V321 PolarHBondContact O-N 2.79Å; V321-A323 PolarHBondContact O-N 3.02Å; V321-Q324 CarbonylContact O-C 3.58Å; V321-Q324 WeakPolarHBondContact O-CB 3.26Å; V321-Q324 PolarHBondContact O-N 2.72Å; V321-Q324 VanDerWaalsContact O-N 3.12Å; V321-L325 PolarHBondContact O-N 2.95Å
322E98.6Very high98.7Very high112 Ų112100.3 Ų100.352%0.52349%0.494SS..Hα-helixtrans-58.6-48175.3-70-175.9149.700111.7C318 H319 Q324 L325 A326C318-E322 PolarHBondContact O-N 2.93Å; H319-E322 IonicContact CD2-OE2 3.21Å; E322-Q324 PolarHBondContact O-N 3.48Å; E322-L325 WeakPolarHBondContact O-CA 3.33Å; E322-L325 WeakPolarHBondContact O-CB 3.5Å; E322-L325 PolarHBondContact O-N 3.09Å; E322-A326 PolarHBondContact O-N 3.37Å
323A98.7Very high98.7Very high63 Ų63100.9 Ų100.952%0.52149%0.494SS..Hα-helixtrans-59.2-34.9175.400000112.4H319 V321 L327H319-A323 WeakPolarHBondContact O-CB 3.48Å; H319-A323 PolarHBondContact O-N 3.47Å; V321-A323 PolarHBondContact O-N 3.02Å; A323-L327 WeakPolarHBondContact O-CB 3.23Å; A323-L327 PolarHBondContact O-N 2.9Å; A323-L327 VanDerWaalsContact O-N 3.13Å
324Q98.7Very high98.7Very high96 Ų9697.9 Ų97.945%0.44949%0.489SS..Hα-helixtrans-72.6-28173.6-77.9-176.2-14.500113.4R320 V321 E322 K328R320-Q324 VanDerWaalsContact NH1-NE2 3.19Å; R320-Q324 WeakPolarHBondContact O-CG 3.38Å; R320-Q324 PolarHBondContact O-N 2.76Å; V321-Q324 CarbonylContact O-C 3.58Å; V321-Q324 WeakPolarHBondContact O-CB 3.26Å; V321-Q324 PolarHBondContact O-N 2.72Å; V321-Q324 VanDerWaalsContact O-N 3.12Å; E322-Q324 PolarHBondContact O-N 3.48Å; Q324-K328 WeakPolarHBondContact O-CD 3.46Å; Q324-K328 VanDerWaalsContact O-CG 3.23Å; Q324-K328 WeakPolarHBondContact O-CG 3.45Å; Q324-K328 PolarHBondContact O-N 3Å
325L98.7Very high98.7Very high108 Ų108100.5 Ų100.557%0.56550%0.497SS*.Hα-helixtrans-75.1-51.8176.3-168155000110.5V321 E322 L327 K328 E329V321-L325 PolarHBondContact O-N 2.95Å; E322-L325 WeakPolarHBondContact O-CA 3.33Å; E322-L325 WeakPolarHBondContact O-CB 3.5Å; E322-L325 PolarHBondContact O-N 3.09Å; L325-L327 VanDerWaalsContact C-N 3.27Å; L325-L327 PolarHBondContact O-N 3.47Å; L325-K328 CarbonylContact O-C 3.6Å; L325-K328 WeakPolarHBondContact O-CA 3.39Å; L325-K328 WeakPolarHBondContact O-CB 3.25Å; L325-K328 PolarHBondContact O-N 3.5Å; L325-E329 PolarHBondContact O-N 3.45Å
326A98.8Very high98.6Very high55 Ų55100.4 Ų100.446%0.45550%0.496SS..Hα-helixtrans-57.1-40175.800000112.1E322 K328 E329 A330E322-A326 PolarHBondContact O-N 3.37Å; A326-K328 VanDerWaalsContact C-N 3.34Å; A326-K328 PolarHBondContact O-N 2.93Å; A326-E329 PolarHBondContact O-N 3.46Å; A326-A330 WeakPolarHBondContact O-CB 3.47Å; A326-A330 PolarHBondContact O-N 3.19Å
327L98.8Very high98.7Very high85 Ų8598.6 Ų98.645%0.44549%0.49SS..Hα-helixtrans-68.2-28.2174.5174.1148.4000113.4A323 L325 R331A323-L327 WeakPolarHBondContact O-CB 3.23Å; A323-L327 PolarHBondContact O-N 2.9Å; A323-L327 VanDerWaalsContact O-N 3.13Å; L325-L327 VanDerWaalsContact C-N 3.27Å; L325-L327 PolarHBondContact O-N 3.47Å; L327-R331 VanDerWaalsContact CD2-CZ 3.49Å; L327-R331 WeakPolarHBondContact O-CB 3.28Å; L327-R331 VanDerWaalsContact O-CD 3.27Å; L327-R331 WeakPolarHBondContact O-CD 3.35Å; L327-R331 WeakPolarHBondContact O-CG 3.45Å; L327-R331 PolarHBondContact O-N 3.27Å
328K98.8Very high98.7Very high133 Ų133102.3 Ų102.358%0.57851%0.506SS*.Hα-helixtrans-74.6-34.4170.5-77.1166.9-177.8173.20111.7Q324 L325 A326 K332Q324-K328 WeakPolarHBondContact O-CD 3.46Å; Q324-K328 VanDerWaalsContact O-CG 3.23Å; Q324-K328 WeakPolarHBondContact O-CG 3.45Å; Q324-K328 PolarHBondContact O-N 3Å; L325-K328 CarbonylContact O-C 3.6Å; L325-K328 WeakPolarHBondContact O-CA 3.39Å; L325-K328 WeakPolarHBondContact O-CB 3.25Å; L325-K328 PolarHBondContact O-N 3.5Å; A326-K328 VanDerWaalsContact C-N 3.34Å; A326-K328 PolarHBondContact O-N 2.93Å; K328-K332 PolarHBondContact O-N 3.31Å
329E98.6Very high98.7Very high105 Ų105105.8 Ų105.849%0.49152%0.515SS..Hα-helixtrans-69.2-53.9178-175.8155.9-125.300111.9L325 A326 R331 K332 E333L325-E329 PolarHBondContact O-N 3.45Å; A326-E329 PolarHBondContact O-N 3.46Å; E329-R331 PolarHBondContact O-N 2.9Å; E329-R331 VanDerWaalsContact O-N 3.1Å; E329-K332 WeakPolarHBondContact O-CA 3.34Å; E329-K332 VanDerWaalsContact O-CB 3.32Å; E329-K332 WeakPolarHBondContact O-CB 3.48Å; E329-K332 PolarHBondContact O-N 2.91Å; E329-E333 PolarHBondContact O-N 2.87Å
330A98.7Very high98.6Very high38 Ų38104.7 Ų104.731%0.31452%0.515SS..Hα-helixtrans-55.4-32.4173.500000112.5A326 E333 I334A326-A330 WeakPolarHBondContact O-CB 3.47Å; A326-A330 PolarHBondContact O-N 3.19Å; A330-E333 PolarHBondContact O-N 2.89Å; A330-I334 WeakPolarHBondContact O-CB 3.27Å; A330-I334 WeakPolarHBondContact O-CD1 3.32Å; A330-I334 WeakPolarHBondContact O-CG1 3.47Å; A330-I334 PolarHBondContact O-N 2.87Å
331R98.6Very high98.6Very high158 Ų158105.1 Ų105.160%0.59652%0.524SS*.Hα-helixtrans-70.6-23.3173-78.5173178.5-176.5-1.2114.2L327 E329 K335L327-R331 VanDerWaalsContact CD2-CZ 3.49Å; L327-R331 WeakPolarHBondContact O-CB 3.28Å; L327-R331 VanDerWaalsContact O-CD 3.27Å; L327-R331 WeakPolarHBondContact O-CD 3.35Å; L327-R331 WeakPolarHBondContact O-CG 3.45Å; L327-R331 PolarHBondContact O-N 3.27Å; E329-R331 PolarHBondContact O-N 2.9Å; E329-R331 VanDerWaalsContact O-N 3.1Å; R331-K335 WeakPolarHBondContact O-CG 3.22Å
332K98.7Very high98.6Very high140 Ų140106 Ų10661%0.60952%0.524SS*.Hα-helixtrans-77.5-46.9169.2-66.5171.8-178.7176.70110.3K328 E329 I334 K335 Q336K328-K332 PolarHBondContact O-N 3.31Å; E329-K332 WeakPolarHBondContact O-CA 3.34Å; E329-K332 VanDerWaalsContact O-CB 3.32Å; E329-K332 WeakPolarHBondContact O-CB 3.48Å; E329-K332 PolarHBondContact O-N 2.91Å; K332-I334 PolarHBondContact O-N 3.03Å; K332-K335 WeakPolarHBondContact O-CA 3.11Å; K332-K335 WeakPolarHBondContact O-CB 3.21Å; K332-K335 PolarHBondContact O-N 3.3Å; K332-Q336 PolarHBondContact O-N 3.42Å
333E98.4Very high98.6Very high103 Ų103104.4 Ų104.448%0.48152%0.522SS..Hα-helixtrans-57.4-47.5177.5-64.9178.2166.400111.5E329 A330 K335 Q336 L337E329-E333 PolarHBondContact O-N 2.87Å; A330-E333 PolarHBondContact O-N 2.89Å; E333-K335 PolarHBondContact O-N 3.27Å; E333-Q336 PolarHBondContact O-N 3.02Å; E333-Q336 VanDerWaalsContact O-N 3.1Å; E333-L337 WeakPolarHBondContact O-CB 3.35Å; E333-L337 WeakPolarHBondContact O-CG 3.29Å; E333-L337 PolarHBondContact O-N 3.43Å
334I98.5Very high98.6Very high96 Ų96107.1 Ų107.149%0.49253%0.525SS..Hα-helixtrans-59.3-34176-70.9164.8000111.8A330 K332 K338A330-I334 WeakPolarHBondContact O-CB 3.27Å; A330-I334 WeakPolarHBondContact O-CD1 3.32Å; A330-I334 WeakPolarHBondContact O-CG1 3.47Å; A330-I334 PolarHBondContact O-N 2.87Å; K332-I334 PolarHBondContact O-N 3.03Å; I334-K338 WeakPolarHBondContact O-CB 3.32Å; I334-K338 VanDerWaalsContact O-CG 3.29Å; I334-K338 WeakPolarHBondContact O-CG 3.38Å; I334-K338 PolarHBondContact O-N 3.07Å
335K98.6Very high98.5Very high156 Ų156110.1 Ų110.168%0.67853%0.532SS*.Hα-helixtrans-70.9-43.3174.2-74.9178176.8-166.80111.8R331 K332 E333 K338 Q339R331-K335 WeakPolarHBondContact O-CG 3.22Å; K332-K335 WeakPolarHBondContact O-CA 3.11Å; K332-K335 WeakPolarHBondContact O-CB 3.21Å; K332-K335 PolarHBondContact O-N 3.3Å; E333-K335 PolarHBondContact O-N 3.27Å; K335-K338 PolarHBondContact O-N 3.01Å; K335-Q339 PolarHBondContact O-N 2.79Å
336Q98.6Very high98.5Very high116 Ų116107.7 Ų107.754%0.54252%0.524SS..Hα-helixtrans-62.8-45.6176.2-70.3168.2-41.600111.2K332 E333 K338 Q339 V340K332-Q336 PolarHBondContact O-N 3.42Å; E333-Q336 PolarHBondContact O-N 3.02Å; E333-Q336 VanDerWaalsContact O-N 3.1Å; Q336-K338 PolarHBondContact O-N 3.16Å; Q336-Q339 WeakPolarHBondContact O-CB 3.39Å; Q336-Q339 PolarHBondContact O-N 3.25Å; Q336-Q339 VanDerWaalsContact O-N 3.15Å; Q336-V340 WeakPolarHBondContact O-CG2 3.37Å; Q336-V340 PolarHBondContact O-N 2.82Å
337L98.8Very high98.4Very high106 Ų106107.3 Ų107.356%0.55552%0.519SS*.Hα-helixtrans-62-41.3175.5-69.3172.5000111.9E333 Q339 V340 I341E333-L337 WeakPolarHBondContact O-CB 3.35Å; E333-L337 WeakPolarHBondContact O-CG 3.29Å; E333-L337 PolarHBondContact O-N 3.43Å; L337-Q339 PolarHBondContact O-N 2.91Å; L337-V340 PolarHBondContact O-N 3.03Å; L337-I341 WeakPolarHBondContact O-CB 3.11Å; L337-I341 VanDerWaalsContact O-CG1 3.26Å; L337-I341 WeakPolarHBondContact O-CG1 3.5Å; L337-I341 PolarHBondContact O-N 3.46Å
338K98.5Very high98.3Very high147 Ų147108 Ų10864%0.63952%0.522SS*.Hα-helixtrans-60.5-42.3171.8-80.7-175.9175.5-162.70112.3I334 K335 Q336 I341 E342I334-K338 WeakPolarHBondContact O-CB 3.32Å; I334-K338 VanDerWaalsContact O-CG 3.29Å; I334-K338 WeakPolarHBondContact O-CG 3.38Å; I334-K338 PolarHBondContact O-N 3.07Å; K335-K338 PolarHBondContact O-N 3.01Å; Q336-K338 PolarHBondContact O-N 3.16Å; K338-I341 PolarHBondContact O-N 3.02Å; K338-E342 WeakPolarHBondContact O-CB 3.38Å; K338-E342 PolarHBondContact O-N 3.02Å
339Q98.5Very high98.2Very high135 Ų135103.6 Ų103.663%0.63151%0.511SS*.Hα-helixtrans-64.7-42.3176.4-173.8178.52.300112K335 Q336 L337 E342 T343K335-Q339 PolarHBondContact O-N 2.79Å; Q336-Q339 WeakPolarHBondContact O-CB 3.39Å; Q336-Q339 PolarHBondContact O-N 3.25Å; Q336-Q339 VanDerWaalsContact O-N 3.15Å; L337-Q339 PolarHBondContact O-N 2.91Å; Q339-E342 PolarHBondContact O-N 3.29Å; Q339-T343 WeakPolarHBondContact O-CG2 3.1Å; Q339-T343 PolarHBondContact O-N 3.38Å; Q339-T343 PolarHBondContact O-OG1 3.32Å
340V98.6Very high98.1Very high75 Ų75102.9 Ų102.946%0.45551%0.51SS..Hα-helixtrans-61.9-49175.3171.60000110.6Q336 L337 E342 T343 M344Q336-V340 WeakPolarHBondContact O-CG2 3.37Å; Q336-V340 PolarHBondContact O-N 2.82Å; L337-V340 PolarHBondContact O-N 3.03Å; V340-E342 VanDerWaalsContact C-N 3.27Å; V340-E342 PolarHBondContact O-N 3.1Å; V340-T343 PolarHBondContact O-N 3.36Å; V340-T343 PolarHBondContact O-OG1 3.12Å; V340-M344 HydrophobicContact CG1-CG 4.46Å; V340-M344 HydrophobicContact CG1-SD 4.02Å; V340-M344 WeakPolarHBondContact O-CG 3.14Å; V340-M344 PolarHBondContact O-N 3.24Å
341I98.5Very high98Very high110 Ų110107.3 Ų107.356%0.56452%0.522SS*.Hα-helixtrans-56.8-41.7175.7-70164.8000111L337 K338 M344 R345L337-I341 WeakPolarHBondContact O-CB 3.11Å; L337-I341 VanDerWaalsContact O-CG1 3.26Å; L337-I341 WeakPolarHBondContact O-CG1 3.5Å; L337-I341 PolarHBondContact O-N 3.46Å; K338-I341 PolarHBondContact O-N 3.02Å; I341-M344 PolarHBondContact O-N 3.38Å; I341-R345 WeakPolarHBondContact O-CB 3.32Å; I341-R345 PolarHBondContact O-N 2.92Å
342E98.4Very high97.9Very high88 Ų88103.7 Ų103.741%0.41152%0.515SS..Hα-helixtrans-67.7-42.9179.3-173.357.6-161.600112.7K338 Q339 V340 M344 R345 S346K338-E342 WeakPolarHBondContact O-CB 3.38Å; K338-E342 PolarHBondContact O-N 3.02Å; Q339-E342 PolarHBondContact O-N 3.29Å; V340-E342 VanDerWaalsContact C-N 3.27Å; V340-E342 PolarHBondContact O-N 3.1Å; E342-M344 VanDerWaalsContact C-N 3.32Å; E342-M344 PolarHBondContact O-N 3.21Å; E342-R345 VanDerWaalsContact CD-NH2 3.27Å; E342-R345 WeakPolarHBondContact O-CB 3.17Å; E342-R345 PolarHBondContact O-N 3.44Å; E342-R345 IonicContact OE1-CZ 2.67Å; E342-R345 IonicContact OE1-NE 3.02Å; E342-R345 PolarHBondContact OE1-NE 3.2Å; E342-R345 IonicContact OE1-NH2 3.28Å; E342-R345 PolarHBondContact OE1-NH2 2.86Å; E342-R345 IonicContact OE2-CZ 2.79Å; E342-R345 VanDerWaalsContact OE2-CZ 3.28Å; E342-R345 IonicContact OE2-NE 2.82Å; E342-R345 PolarHBondContact OE2-NE 3.29Å; E342-R345 IonicContact OE2-NH2 2.9Å; E342-R345 PolarHBondContact OE2-NH2 3.3Å; E342-S346 PolarHBondContact O-N 3.34Å; E342-S346 PolarHBondContact O-OG 3.42Å
343T98.1Very high97.8Very high79 Ų79102.9 Ų102.949%0.48551%0.511SS..Hα-helixtrans-66.6-32.6174580000112.8Q339 V340 S346 S347Q339-T343 WeakPolarHBondContact O-CG2 3.1Å; Q339-T343 PolarHBondContact O-N 3.38Å; Q339-T343 PolarHBondContact O-OG1 3.32Å; V340-T343 PolarHBondContact O-N 3.36Å; V340-T343 PolarHBondContact O-OG1 3.12Å; T343-S346 PolarHBondContact O-OG 3.01Å; T343-S346 VanDerWaalsContact O-OG 3.13Å; T343-S347 VanDerWaalsContact O-CB 3.32Å; T343-S347 WeakPolarHBondContact O-CB 3.34Å; T343-S347 PolarHBondContact O-N 3.45Å; T343-S347 VanDerWaalsContact O-N 3.09Å; T343-S347 PolarHBondContact O-OG 3.21Å
344M98.5Very high97.7Very high121 Ų12199.3 Ų99.360%0.59650%0.503SS*.Hα-helixtrans-66.6-42.8170.6-71.8179.267.700110.9V340 I341 E342 S347 L348V340-M344 HydrophobicContact CG1-CG 4.46Å; V340-M344 HydrophobicContact CG1-SD 4.02Å; V340-M344 WeakPolarHBondContact O-CG 3.14Å; V340-M344 PolarHBondContact O-N 3.24Å; I341-M344 PolarHBondContact O-N 3.38Å; E342-M344 VanDerWaalsContact C-N 3.32Å; E342-M344 PolarHBondContact O-N 3.21Å; M344-S347 PolarHBondContact O-N 3.08Å; M344-S347 PolarHBondContact O-OG 2.95Å; M344-L348 WeakPolarHBondContact O-CB 3.47Å; M344-L348 PolarHBondContact O-N 3.49Å
345R98.1Very high97.6Very high158 Ų15898.9 Ų98.960%0.59650%0.5SS*.Hα-helixtrans-61.6-46.2178.8-171173.476.7115.32.4112.3I341 E342 L348 A349I341-R345 WeakPolarHBondContact O-CB 3.32Å; I341-R345 PolarHBondContact O-N 2.92Å; E342-R345 VanDerWaalsContact CD-NH2 3.27Å; E342-R345 WeakPolarHBondContact O-CB 3.17Å; E342-R345 PolarHBondContact O-N 3.44Å; E342-R345 IonicContact OE1-CZ 2.67Å; E342-R345 IonicContact OE1-NE 3.02Å; E342-R345 PolarHBondContact OE1-NE 3.2Å; E342-R345 IonicContact OE1-NH2 3.28Å; E342-R345 PolarHBondContact OE1-NH2 2.86Å; E342-R345 IonicContact OE2-CZ 2.79Å; E342-R345 VanDerWaalsContact OE2-CZ 3.28Å; E342-R345 IonicContact OE2-NE 2.82Å; E342-R345 PolarHBondContact OE2-NE 3.29Å; E342-R345 IonicContact OE2-NH2 2.9Å; E342-R345 PolarHBondContact OE2-NH2 3.3Å; R345-L348 PolarHBondContact O-N 3.32Å; R345-A349 PolarHBondContact O-N 3.45Å
346S97.3Very high97.6Very high57 Ų5797.8 Ų97.840%0.39950%0.498SS..Hα-helixtrans-64.7-44.6174.260.10000111.8E342 T343 L348 A349 D350E342-S346 PolarHBondContact O-N 3.34Å; E342-S346 PolarHBondContact O-OG 3.42Å; T343-S346 PolarHBondContact O-OG 3.01Å; T343-S346 VanDerWaalsContact O-OG 3.13Å; S346-L348 PolarHBondContact O-N 3.39Å; S346-A349 PolarHBondContact O-N 2.93Å; S346-A349 VanDerWaalsContact O-N 3.15Å; S346-D350 PolarHBondContact O-N 3.37Å
347S97.3Very high97.5Very high48 Ų4898.7 Ų98.734%0.33650%0.5SS..Hα-helixtrans-62.6-24.6177.284.40000114T343 M344 K351T343-S347 VanDerWaalsContact O-CB 3.32Å; T343-S347 WeakPolarHBondContact O-CB 3.34Å; T343-S347 PolarHBondContact O-N 3.45Å; T343-S347 VanDerWaalsContact O-N 3.09Å; T343-S347 PolarHBondContact O-OG 3.21Å; M344-S347 PolarHBondContact O-N 3.08Å; M344-S347 PolarHBondContact O-OG 2.95Å; S347-K351 VanDerWaalsContact O-CD 3.32Å; S347-K351 WeakPolarHBondContact O-CD 3.46Å; S347-K351 VanDerWaalsContact O-CG 3.29Å; S347-K351 WeakPolarHBondContact O-CG 3.44Å; S347-K351 PolarHBondContact O-N 2.81Å
348L97.1Very high97.5Very high98 Ų98101.2 Ų101.251%0.51350%0.503SS..Hα-helixtrans-78.9-47.6173.6-174.762.4000110.5M344 R345 S346 D350 K351 D352M344-L348 WeakPolarHBondContact O-CB 3.47Å; M344-L348 PolarHBondContact O-N 3.49Å; R345-L348 PolarHBondContact O-N 3.32Å; S346-L348 PolarHBondContact O-N 3.39Å; L348-D350 PolarHBondContact O-N 3.04Å; L348-K351 CarbonylContact O-C 3.56Å; L348-K351 WeakPolarHBondContact O-CA 3.4Å; L348-K351 WeakPolarHBondContact O-CB 3.48Å; L348-K351 PolarHBondContact O-N 3.32Å; L348-D352 PolarHBondContact O-N 3.33Å
349A96.6Very high97.4Very high42 Ų42101.1 Ų101.135%0.34750%0.503SS..Hα-helixtrans-57.8-33.5175.500000112.8R345 S346 D352 K353R345-A349 PolarHBondContact O-N 3.45Å; S346-A349 PolarHBondContact O-N 2.93Å; S346-A349 VanDerWaalsContact O-N 3.15Å; A349-D352 PolarHBondContact O-N 3.23Å; A349-K353 VanDerWaalsContact O-CG 3.3Å; A349-K353 WeakPolarHBondContact O-CG 3.5Å; A349-K353 PolarHBondContact O-N 3.46Å
350D95.9Very high97.4Very high90 Ų9098.3 Ų98.348%0.48150%0.495SS..Hα-helixtrans-72.9-32.4173.9-69.9-32.1000113.3S346 L348 K353 G354S346-D350 PolarHBondContact O-N 3.37Å; L348-D350 PolarHBondContact O-N 3.04Å; D350-K353 IonicContact OD1-NZ 2.7Å; D350-K353 PolarHBondContact OD1-NZ 2.87Å; D350-G354 PolarHBondContact O-N 2.94Å
351K96.5Very high97.4Very high130 Ų13097.6 Ų97.657%0.56549%0.489SS*.Hα-helixtrans-69-39.1169.8-71.6163.3-172.8161.70111.4S347 L348 K353 G354 I355S347-K351 VanDerWaalsContact O-CD 3.32Å; S347-K351 WeakPolarHBondContact O-CD 3.46Å; S347-K351 VanDerWaalsContact O-CG 3.29Å; S347-K351 WeakPolarHBondContact O-CG 3.44Å; S347-K351 PolarHBondContact O-N 2.81Å; L348-K351 CarbonylContact O-C 3.56Å; L348-K351 WeakPolarHBondContact O-CA 3.4Å; L348-K351 WeakPolarHBondContact O-CB 3.48Å; L348-K351 PolarHBondContact O-N 3.32Å; K351-K353 PolarHBondContact O-N 2.93Å; K351-G354 CarbonylContact O-C 3.56Å; K351-G354 WeakPolarHBondContact O-CA 3.41Å; K351-G354 PolarHBondContact O-N 2.9Å; K351-I355 WeakPolarHBondContact O-CG1 3.47Å; K351-I355 PolarHBondContact O-N 3.2Å
352D97.5Very high97.4Very high83 Ų8396.5 Ų96.544%0.44448%0.483SS..Hα-helixtrans-64.3-39177.8-66.1-25.3000111.4L348 A349 G354 I355 Q356L348-D352 PolarHBondContact O-N 3.33Å; A349-D352 PolarHBondContact O-N 3.23Å; D352-G354 VanDerWaalsContact C-N 3.31Å; D352-G354 PolarHBondContact O-N 2.92Å; D352-I355 PolarHBondContact O-N 3.4Å; D352-Q356 WeakPolarHBondContact O-CB 3.5Å; D352-Q356 PolarHBondContact O-N 3.13Å
353K96.3Very high97.3Very high122 Ų12296.5 Ų96.553%0.5349%0.486SS..Hα-helixtrans-58.8-41.3168.3-67.7165-156.51680111.9A349 D350 K351 Q356 K357A349-K353 VanDerWaalsContact O-CG 3.3Å; A349-K353 WeakPolarHBondContact O-CG 3.5Å; A349-K353 PolarHBondContact O-N 3.46Å; D350-K353 IonicContact OD1-NZ 2.7Å; D350-K353 PolarHBondContact OD1-NZ 2.87Å; K351-K353 PolarHBondContact O-N 2.93Å; K353-Q356 PolarHBondContact O-N 2.62Å; K353-K357 PolarHBondContact O-N 3.3Å
354G95.9Very high97.3Very high29 Ų2996.4 Ų96.430%0.29948%0.482SS..Hα-helixtrans-61.9-45.4174.400000112.7D350 K351 D352 K357 Y358D350-G354 PolarHBondContact O-N 2.94Å; K351-G354 CarbonylContact O-C 3.56Å; K351-G354 WeakPolarHBondContact O-CA 3.41Å; K351-G354 PolarHBondContact O-N 2.9Å; D352-G354 VanDerWaalsContact C-N 3.31Å; D352-G354 PolarHBondContact O-N 2.92Å; G354-K357 WeakPolarHBondContact O-CB 3.19Å; G354-K357 PolarHBondContact O-N 2.97Å; G354-Y358 WeakPolarHBondContact O-CD2 3.15Å; G354-Y358 PolarHBondContact O-N 3.48Å
355I97Very high97.3Very high86 Ų8696.9 Ų96.944%0.44148%0.482SS..Hα-helixtrans-62.8-45.4175.5-67.7164.3000110.6K351 D352 K357 Y358 F359K351-I355 WeakPolarHBondContact O-CG1 3.47Å; K351-I355 PolarHBondContact O-N 3.2Å; D352-I355 PolarHBondContact O-N 3.4Å; I355-K357 VanDerWaalsContact C-N 3.31Å; I355-K357 PolarHBondContact O-N 2.87Å; I355-Y358 PolarHBondContact O-N 3.46Å; I355-Y358 VanDerWaalsContact O-N 3.12Å; I355-F359 HydrophobicContact CG2-CD2 3.88Å; I355-F359 HydrophobicContact CG2-CE2 3.69Å; I355-F359 WeakPolarHBondContact O-CD2 3.38Å; I355-F359 PolarHBondContact O-N 3.29Å
356Q97.4Very high97.3Very high134 Ų13493.1 Ų93.163%0.62647%0.474SS*.Hα-helixtrans-60.2-40.1176.1-170.4179.718.800111.6D352 K353 F359 V360D352-Q356 WeakPolarHBondContact O-CB 3.5Å; D352-Q356 PolarHBondContact O-N 3.13Å; K353-Q356 PolarHBondContact O-N 2.62Å; Q356-F359 PolarHBondContact O-N 2.82Å; Q356-V360 WeakPolarHBondContact O-CG2 3.43Å; Q356-V360 PolarHBondContact O-N 3.46Å
357K97.1Very high97.3Very high134 Ų13496.5 Ų96.558%0.58348%0.481SS*.Hα-helixtrans-59.9-47.3172.2-172.1-165.4169.8-169.20111.4K353 G354 I355 F359 V360 D361K353-K357 PolarHBondContact O-N 3.3Å; G354-K357 WeakPolarHBondContact O-CB 3.19Å; G354-K357 PolarHBondContact O-N 2.97Å; I355-K357 VanDerWaalsContact C-N 3.31Å; I355-K357 PolarHBondContact O-N 2.87Å; K357-F359 VanDerWaalsContact C-N 3.3Å; K357-F359 PolarHBondContact O-N 3.46Å; K357-V360 PolarHBondContact O-N 3.05Å; K357-V360 VanDerWaalsContact O-N 3.07Å; K357-D361 VanDerWaalsContact CE-OD2 3.29Å; K357-D361 WeakPolarHBondContact CE-OD2 3.27Å; K357-D361 PolarHBondContact O-N 2.99Å
358Y97.8Very high97.4Very high159 Ų159100.9 Ų100.962%0.62450%0.495SS*.Hα-helixtrans-59.8-38.7176.8-69.8-60.4000112.5G354 I355 V360 D361 I362G354-Y358 WeakPolarHBondContact O-CD2 3.15Å; G354-Y358 PolarHBondContact O-N 3.48Å; I355-Y358 PolarHBondContact O-N 3.46Å; I355-Y358 VanDerWaalsContact O-N 3.12Å; Y358-V360 PolarHBondContact O-N 3.34Å; Y358-D361 PolarHBondContact O-N 2.72Å; Y358-I362 WeakPolarHBondContact O-CB 3.41Å; Y358-I362 WeakPolarHBondContact O-CD1 3.42Å; Y358-I362 WeakPolarHBondContact O-CG1 3.42Å; Y358-I362 PolarHBondContact O-N 3.16Å
359F98.1Very high97.4Very high146 Ų146101.1 Ų101.164%0.6450%0.496SS*.Hα-helixtrans-62.2-39.8172.7-83.9-71.4000112.9I355 Q356 K357 N363I355-F359 HydrophobicContact CG2-CD2 3.88Å; I355-F359 HydrophobicContact CG2-CE2 3.69Å; I355-F359 WeakPolarHBondContact O-CD2 3.38Å; I355-F359 PolarHBondContact O-N 3.29Å; Q356-F359 PolarHBondContact O-N 2.82Å; K357-F359 VanDerWaalsContact C-N 3.3Å; K357-F359 PolarHBondContact O-N 3.46Å; F359-N363 VanDerWaalsContact O-CB 3.29Å; F359-N363 WeakPolarHBondContact O-CB 3.41Å; F359-N363 PolarHBondContact O-N 3Å
360V97.9Very high97.5Very high76 Ų76104.8 Ų104.846%0.46151%0.506SS..Hα-helixtrans-66.6-45.9174.9172.10000111.2Q356 K357 Y358 I362 N363 I364Q356-V360 WeakPolarHBondContact O-CG2 3.43Å; Q356-V360 PolarHBondContact O-N 3.46Å; K357-V360 PolarHBondContact O-N 3.05Å; K357-V360 VanDerWaalsContact O-N 3.07Å; Y358-V360 PolarHBondContact O-N 3.34Å; V360-I362 PolarHBondContact O-N 2.8Å; V360-N363 PolarHBondContact O-N 2.89Å; V360-I364 HydrophobicContact CG1-CD1 3.77Å; V360-I364 HydrophobicContact CG1-CG1 4.48Å; V360-I364 VanDerWaalsContact O-CG1 3.3Å; V360-I364 WeakPolarHBondContact O-CG1 3.33Å; V360-I364 PolarHBondContact O-N 2.92Å
361D98.1Very high97.5Very high60 Ų60104 Ų10432%0.32151%0.507SS..Hα-helixtrans-61.6-42.6178.4-72.9-26.4000111.5K357 Y358 I364 Q365K357-D361 VanDerWaalsContact CE-OD2 3.29Å; K357-D361 WeakPolarHBondContact CE-OD2 3.27Å; K357-D361 PolarHBondContact O-N 2.99Å; Y358-D361 PolarHBondContact O-N 2.72Å; D361-I364 PolarHBondContact O-N 3.17Å; D361-Q365 WeakPolarHBondContact O-CG 3.32Å; D361-Q365 PolarHBondContact O-N 3.08Å
362I98.1Very high97.6Very high87 Ų87103 Ų10345%0.44651%0.508SS..Hα-helixtrans-63.8-44.3174.6-70.1164.3000111.1Y358 V360 I364 Q365 N366Y358-I362 WeakPolarHBondContact O-CB 3.41Å; Y358-I362 WeakPolarHBondContact O-CD1 3.42Å; Y358-I362 WeakPolarHBondContact O-CG1 3.42Å; Y358-I362 PolarHBondContact O-N 3.16Å; V360-I362 PolarHBondContact O-N 2.8Å; I362-I364 VanDerWaalsContact C-N 3.33Å; I362-I364 PolarHBondContact O-N 3.47Å; I362-Q365 PolarHBondContact O-N 3.01Å; I362-Q365 VanDerWaalsContact O-N 3.15Å; I362-N366 PolarHBondContact O-N 2.97Å
363N97.8Very high97.6Very high87 Ų87103.4 Ų103.447%0.46551%0.509SS..Hα-helixtrans-62.5-39.9177.4-171.44.4000111.5F359 V360 N366 K367F359-N363 VanDerWaalsContact O-CB 3.29Å; F359-N363 WeakPolarHBondContact O-CB 3.41Å; F359-N363 PolarHBondContact O-N 3Å; V360-N363 PolarHBondContact O-N 2.89Å; N363-N366 PolarHBondContact O-N 2.94Å; N363-K367 WeakPolarHBondContact O-CG 3.28Å; N363-K367 PolarHBondContact O-N 3.12Å
364I98Very high97.5Very high78 Ų78103.4 Ų103.440%0.451%0.511SS..Hα-helixtrans-64.9-38.2173.6-68.8166.3000111.4V360 D361 I362 K368V360-I364 HydrophobicContact CG1-CD1 3.77Å; V360-I364 HydrophobicContact CG1-CG1 4.48Å; V360-I364 VanDerWaalsContact O-CG1 3.3Å; V360-I364 WeakPolarHBondContact O-CG1 3.33Å; V360-I364 PolarHBondContact O-N 2.92Å; D361-I364 PolarHBondContact O-N 3.17Å; I362-I364 VanDerWaalsContact C-N 3.33Å; I362-I364 PolarHBondContact O-N 3.47Å; I364-K368 HydrophobicContact CG2-CD 4.36Å; I364-K368 VanDerWaalsContact O-CG 3.32Å; I364-K368 WeakPolarHBondContact O-CG 3.48Å; I364-K368 PolarHBondContact O-N 3.46Å; I364-K368 VanDerWaalsContact O-N 3.12Å
365Q98.1Very high97.5Very high130 Ų130105.2 Ų105.261%0.60752%0.519SS*.Hα-helixtrans-67.7-42.5174.7-73.9-178.46.400112.2D361 I362 K368 L369D361-Q365 WeakPolarHBondContact O-CG 3.32Å; D361-Q365 PolarHBondContact O-N 3.08Å; I362-Q365 PolarHBondContact O-N 3.01Å; I362-Q365 VanDerWaalsContact O-N 3.15Å; Q365-K368 WeakPolarHBondContact O-CB 3.5Å; Q365-K368 PolarHBondContact O-N 3.18Å; Q365-L369 PolarHBondContact O-N 3.49Å
366N97.7Very high97.4Very high80 Ų80106.5 Ų106.543%0.42853%0.525SS..Hα-helixtrans-61.4-45.5175.5-72.3-5.7000111.4I362 N363 K368 L369 E370I362-N366 PolarHBondContact O-N 2.97Å; N363-N366 PolarHBondContact O-N 2.94Å; N366-K368 VanDerWaalsContact C-N 3.28Å; N366-K368 PolarHBondContact O-N 3.27Å; N366-L369 CarbonylContact O-C 3.54Å; N366-L369 WeakPolarHBondContact O-CA 3.39Å; N366-L369 VanDerWaalsContact O-CB 3.31Å; N366-L369 WeakPolarHBondContact O-CB 3.44Å; N366-L369 PolarHBondContact O-N 3.21Å; N366-E370 WeakPolarHBondContact O-CG 3.34Å; N366-E370 PolarHBondContact O-N 3.07Å
367K97.9Very high97.2Very high127 Ų127106.3 Ų106.355%0.55252%0.524SS*.Hα-helixtrans-61.8-33.1174.9-73.2-174.8177.2-167.90113.8N363 S371N363-K367 WeakPolarHBondContact O-CG 3.28Å; N363-K367 PolarHBondContact O-N 3.12Å; K367-S371 VanDerWaalsContact O-CB 3.27Å; K367-S371 WeakPolarHBondContact O-CB 3.21Å; K367-S371 PolarHBondContact O-N 2.73Å
368K98.1Very high96.9Very high141 Ų141106 Ų10661%0.61353%0.526SS*.Hα-helixtrans-68.8-37.1171.5-73.8170.7-179.61790111.8I364 Q365 N366 L372I364-K368 HydrophobicContact CG2-CD 4.36Å; I364-K368 VanDerWaalsContact O-CG 3.32Å; I364-K368 WeakPolarHBondContact O-CG 3.48Å; I364-K368 PolarHBondContact O-N 3.46Å; I364-K368 VanDerWaalsContact O-N 3.12Å; Q365-K368 WeakPolarHBondContact O-CB 3.5Å; Q365-K368 PolarHBondContact O-N 3.18Å; N366-K368 VanDerWaalsContact C-N 3.28Å; N366-K368 PolarHBondContact O-N 3.27Å; K368-L372 VanDerWaalsContact O-CB 3.25Å; K368-L372 WeakPolarHBondContact O-CB 3.23Å; K368-L372 PolarHBondContact O-N 3.32Å
369L98.3Very high96.5Very high103 Ų103102.1 Ų102.154%0.53953%0.526SS..Hα-helixtrans-66.7-46.8174.5-163.682.4000111.3Q365 N366 L372 L373Q365-L369 PolarHBondContact O-N 3.49Å; N366-L369 CarbonylContact O-C 3.54Å; N366-L369 WeakPolarHBondContact O-CA 3.39Å; N366-L369 VanDerWaalsContact O-CB 3.31Å; N366-L369 WeakPolarHBondContact O-CB 3.44Å; N366-L369 PolarHBondContact O-N 3.21Å; L369-L372 PolarHBondContact O-N 3.19Å; L369-L373 HydrophobicContact CD2-CD1 4.41Å; L369-L373 HydrophobicContact CG-CD1 4.21Å; L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.25Å; L369-L373 WeakPolarHBondContact O-CG 3.17Å; L369-L373 PolarHBondContact O-N 2.95Å
370E97.2Very high95.5Very high118 Ų118102 Ų10255%0.55153%0.527SS*.Hα-helixtrans-56.9-49.1174.6-70.8162.7-175.100111.2N366 L372 L373 Q374N366-E370 WeakPolarHBondContact O-CG 3.34Å; N366-E370 PolarHBondContact O-N 3.07Å; E370-L372 PolarHBondContact O-N 3.13Å; E370-L373 PolarHBondContact O-N 3.39Å; E370-Q374 WeakPolarHBondContact O-CB 3.15Å; E370-Q374 PolarHBondContact O-N 2.88Å
371S97.5Very high94Very high73 Ų73100.8 Ų100.851%0.5152%0.522SS..Hα-helixtrans-64-37.7177.1-179.30000112.7K367 S375K367-S371 VanDerWaalsContact O-CB 3.27Å; K367-S371 WeakPolarHBondContact O-CB 3.21Å; K367-S371 PolarHBondContact O-N 2.73Å; S371-S375 WeakPolarHBondContact O-CB 3.43Å; S371-S375 PolarHBondContact O-N 2.87Å
372L97.8Very high92.2Very high111 Ų111100.5 Ų100.558%0.58153%0.534SS*.Hα-helixtrans-65.5-48.1174.8177.962.7000111.3K368 L369 E370 Q374 S375 M376K368-L372 VanDerWaalsContact O-CB 3.25Å; K368-L372 WeakPolarHBondContact O-CB 3.23Å; K368-L372 PolarHBondContact O-N 3.32Å; L369-L372 PolarHBondContact O-N 3.19Å; E370-L372 PolarHBondContact O-N 3.13Å; L372-Q374 VanDerWaalsContact C-N 3.35Å; L372-Q374 PolarHBondContact O-N 3.48Å; L372-S375 PolarHBondContact O-N 3.33Å; L372-S375 PolarHBondContact O-OG 2.93Å; L372-M376 PolarHBondContact O-N 3.19Å
373L96.6Very high90.1Very high90 Ų90100.7 Ų100.747%0.47154%0.543SS..Hα-helixtrans-58.9-45.5176.3-72.1168.8000111.2L369 E370 S375 M376 E377L369-L373 HydrophobicContact CD2-CD1 4.41Å; L369-L373 HydrophobicContact CG-CD1 4.21Å; L369-L373 WeakPolarHBondContact O-CB 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.25Å; L369-L373 WeakPolarHBondContact O-CG 3.17Å; L369-L373 PolarHBondContact O-N 2.95Å; E370-L373 PolarHBondContact O-N 3.39Å; L373-S375 PolarHBondContact O-N 2.99Å; L373-M376 HydrophobicContact CD2-CE 3.93Å; L373-M376 WeakPolarHBondContact O-CB 3.49Å; L373-M376 PolarHBondContact O-N 3.4Å; L373-E377 WeakPolarHBondContact O-CB 3.23Å; L373-E377 PolarHBondContact O-N 2.72Å
374Q95.9Very high87.9Confident123 Ų123102.5 Ų102.558%0.57555%0.552SS**Hα-helixtrans-64-39176.2-168177.833.800111.9E370 L372 M376 E377 M378E370-Q374 WeakPolarHBondContact O-CB 3.15Å; E370-Q374 PolarHBondContact O-N 2.88Å; L372-Q374 VanDerWaalsContact C-N 3.35Å; L372-Q374 PolarHBondContact O-N 3.48Å; Q374-M376 VanDerWaalsContact C-N 3.32Å; Q374-M376 PolarHBondContact O-N 3.02Å; Q374-E377 PolarHBondContact O-N 3.4Å; Q374-M378 WeakPolarHBondContact O-CB 3.42Å; Q374-M378 VanDerWaalsContact O-CG 3.26Å; Q374-M378 WeakPolarHBondContact O-CG 3.3Å; Q374-M378 PolarHBondContact O-N 3.05Å
375S95.3Very high85.8Confident66 Ų66106.3 Ų106.346%0.46256%0.561SS.*Hα-helixtrans-65.5-35.7175.876.60000112.6S371 L372 L373 A379S371-S375 WeakPolarHBondContact O-CB 3.43Å; S371-S375 PolarHBondContact O-N 2.87Å; L372-S375 PolarHBondContact O-N 3.33Å; L372-S375 PolarHBondContact O-OG 2.93Å; L373-S375 PolarHBondContact O-N 2.99Å; S375-A379 WeakPolarHBondContact O-CB 3.5Å; S375-A379 PolarHBondContact O-N 2.87Å
376M95.1Very high83.3Confident114 Ų114107 Ų10756%0.56257%0.569SS**Hα-helixtrans-70-41.8174.6-175.7179.970.100111.1L372 L373 Q374 A379 H380L372-M376 PolarHBondContact O-N 3.19Å; L373-M376 HydrophobicContact CD2-CE 3.93Å; L373-M376 WeakPolarHBondContact O-CB 3.49Å; L373-M376 PolarHBondContact O-N 3.4Å; Q374-M376 VanDerWaalsContact C-N 3.32Å; Q374-M376 PolarHBondContact O-N 3.02Å; M376-A379 PolarHBondContact O-N 2.67Å; M376-H380 WeakPolarHBondContact O-CB 3.32Å; M376-H380 PolarHBondContact O-N 3.03Å
377E93.1Very high81.1Confident130 Ų130112 Ų11261%0.60759%0.59SS**Hα-helixtrans-61.4-42.9173.6-178.2177.2-157.500111.8L373 Q374 H380 S381L373-E377 WeakPolarHBondContact O-CB 3.23Å; L373-E377 PolarHBondContact O-N 2.72Å; Q374-E377 PolarHBondContact O-N 3.4Å; E377-H380 PolarHBondContact O-N 3Å; E377-S381 VanDerWaalsContact O-CB 3.3Å; E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 3.38Å; E377-S381 PolarHBondContact O-OG 3.23Å
378M90.7Very high79Confident128 Ų128112 Ų11263%0.63160%0.595SS**Hα-helixtrans-65.2-39.8175.5-70.2-63.1-67.400112.1Q374 H380 S381 G382Q374-M378 WeakPolarHBondContact O-CB 3.42Å; Q374-M378 VanDerWaalsContact O-CG 3.26Å; Q374-M378 WeakPolarHBondContact O-CG 3.3Å; Q374-M378 PolarHBondContact O-N 3.05Å; M378-H380 VanDerWaalsContact C-N 3.31Å; M378-H380 PolarHBondContact O-N 3.18Å; M378-S381 WeakPolarHBondContact CA-OG 3.46Å; M378-S381 PolarHBondContact O-OG 2.98Å; M378-G382 PolarHBondContact O-N 2.89Å
379A89.8Confident76.6Confident76 Ų76110.2 Ų110.263%0.62860%0.599SS**Hα-helixtrans-64-35.9173.500000112.4S375 M376S375-A379 WeakPolarHBondContact O-CB 3.5Å; S375-A379 PolarHBondContact O-N 2.87Å; M376-A379 PolarHBondContact O-N 2.67Å
380H77.6Confident74.5Confident143 Ų143112.6 Ų112.666%0.66261%0.612SS**Hα-helixtrans-81.9-35.9-178.4-138.6-53.6000113.4M376 E377 M378 S383M376-H380 WeakPolarHBondContact O-CB 3.32Å; M376-H380 PolarHBondContact O-N 3.03Å; E377-H380 PolarHBondContact O-N 3Å; M378-H380 VanDerWaalsContact C-N 3.31Å; M378-H380 PolarHBondContact O-N 3.18Å; H380-S383 PolarHBondContact O-N 3.48Å
381S66.4Low71.8Confident51 Ų51114.5 Ų114.536%0.35763%0.626SS.*Hα-helixtrans-78.3-29.7177.556.80000112.8E377 M378 S383 L384 R385E377-S381 VanDerWaalsContact O-CB 3.3Å; E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 3.38Å; E377-S381 PolarHBondContact O-OG 3.23Å; M378-S381 WeakPolarHBondContact CA-OG 3.46Å; M378-S381 PolarHBondContact O-OG 2.98Å; S381-S383 PolarHBondContact O-N 3.24Å; S381-L384 PolarHBondContact O-N 2.78Å; S381-R385 PolarHBondContact O-N 3.17Å
382G59.9Low69Low55 Ų55120.1 Ų120.157%0.56764%0.641SS**Hα-helixtrans-57.5-29.3167.600000113.2M378M378-G382 PolarHBondContact O-N 2.89Å
383S53Low66.4Low91 Ų91120.2 Ų120.264%0.63665%0.649SS**THydrogen-bonded Turntrans-81.2-11.6174.5-170.50000114.5H380 S381H380-S383 PolarHBondContact O-N 3.48Å; S381-S383 PolarHBondContact O-N 3.24Å
384L51.1Low64Low124 Ų124121 Ų12165%0.64966%0.661SS**THydrogen-bonded Turntrans-110.9-11.2-172.7-161.1138.2000113.1S381S381-L384 PolarHBondContact O-N 2.78Å
385R54Low60.8Low159 Ų159122.5 Ų122.560%0.667%0.672SS**SBendtrans-78.5-21.6172.7-80.8-82.479.4-1415.8114S381S381-R385 PolarHBondContact O-N 3.17Å
386D47.4Very low58.3Low143 Ų143124.9 Ų124.977%0.76569%0.689SS**G310 helixtrans-80.4-30.7-174.4-14135.2000113.1
387E50.7Low55.9Low186 Ų186124.6 Ų124.687%0.86970%0.696SS**G310 helixtrans-85.92.6174.9-77.2-150.4141.600114.8
388L53.1Low52.8Low126 Ų126126.4 Ų126.466%0.6670%0.704SS**G310 helixtrans-118.837.9177-138.281.5000112.7
389C48.5Very low50.3Low104 Ų104129.6 Ų129.670%0.70372%0.715SS**SBendtrans-106.9-0.1178.3-155.80000113.2
390L54.8Low47.6Very low154 Ų154131 Ų13181%0.80672%0.72SS**  trans-135.390.7179-68.5174.4000110.9
391D40.2Very low45.5Very low157 Ų157131.4 Ų131.484%0.8473%0.726SS**  -167157.1116.4-107.2-28000114
392F37.5Very low43.7Very low191 Ų191133.7 Ų133.784%0.83874%0.738SS**  trans-75173.5-172.5-78.4-113.4000114.1
393P43.8Very low42.5Very low113 Ų113139.2 Ų139.273%0.73475%0.754SS**  cis-132.9-169-24.332.5-11.4000113.6
394C45.4Very low41.7Very low107 Ų107141 Ų14172%0.72376%0.756SS**  trans-48.2132.9165.8-172.50000114.6
395D29.3Very low41.8Very low154 Ų154140.1 Ų140.182%0.82476%0.758SS**  -172.7154114.5-96.4-16.2000112.7
396S42.1Very low41.7Very low116 Ų116138.1 Ų138.181%0.81177%0.765SS**  trans-137.3123.1172177.90000110
397P46.3Very low40.9Very low108 Ų108138.5 Ų138.570%0.70177%0.767SS**  trans-134130.215034.3-20.6000114.1
398E28.1Very low39.9Very low168 Ų168136 Ų13679%0.78576%0.759SS**  46.6102.7129.5-51.9-160.8108.600121.2
399K37.3Very low39.1Very low195 Ų195134.3 Ų134.385%0.84876%0.755SS**  31114.5116.8-61170.9-178.7167.90118.6
400S33.2Very low38.4Very low107 Ų107137.7 Ų137.775%0.74876%0.762SS**  178.6158.8128.952.10000108.9
401L33.6Very low37.3Very low150 Ų150134.7 Ų134.779%0.78576%0.76SS**  cis-131.7123.210.7-72.4163.9000108.1
402T29.4Very low36.7Very low100 Ų100135.3 Ų135.361%0.61376%0.763SS**  61.7113.179.265.10000117.1
403L33.6Very low36.4Very low170 Ų170128.8 Ų128.889%0.8975%0.75SS**  trans-178.3124.5147.4-102.2153.4000110.3
404N36.7Very low35.9Very low128 Ų128131.6 Ų131.668%0.68476%0.758SS**  cis-155.9167.4-40.9-108.8-9.5000110.5
405P53.2Low35Very low107 Ų107131.3 Ų131.370%0.69576%0.757SS**  trans-96.3-155.7-170.644.5-40.8000111.3
406P50.9Low35.1Very low116 Ų116131 Ų13175%0.75376%0.755SS**  cis-141.4-178.1-0.743.5-24.9000117.3
407L31.1Very low34.6Very low152 Ų152133 Ų13380%0.79675%0.751SS**  15896.7123.5-16270.7000109.3
408D30Very low33.7Very low132 Ų132135.2 Ų135.271%0.70675%0.752SS**  90.4145.694.1-132.348.3000112.5
409T36.6Very low33.7Very low92 Ų92134.6 Ų134.656%0.56475%0.749SS**  cis-156.3155.63.5-17.80000112.6
410M33.8Very low33.2Very low174 Ų174130.9 Ų130.986%0.85774%0.743SS**  trans70.8146.1154.6-59.8-44.9177.600125
411A32.1Very low33.1Very low92 Ų92130.6 Ų130.676%0.7675%0.746SS**  trans65.8124.1160.300000118.9
412D26.8Very low33Very low169 Ų169126.7 Ų126.790%0.90474%0.743SS**  cis79.9119.539.8-165.645.3000113.1
413G31.3Very low33.1Very low55 Ų55131.9 Ų131.957%0.56776%0.76SS**  cis-178.6177.9-2.700000111.7
414L32.6Very low32.9Very low171 Ų171126.8 Ų126.890%0.89575%0.749SS**  trans66.7138177.1-49.5179.7000115.2
415S26.8Very low32.6Very low102 Ų102127.1 Ų127.171%0.71376%0.755SS**  cis115.3139.48.273.30000113.4
416L32.4Very low31.5Very low147 Ų147127.5 Ų127.577%0.7775%0.751SS**  trans106138.9156.6-163.162.7000118.7
417E29.8Very low30.7Very low157 Ų157131 Ų13173%0.73475%0.75SS**  trans52139.3167.5-72.5162.7126.700118.6
418E27.7Very low30.6Very low155 Ų155130.7 Ų130.772%0.72474%0.744SS**  cis98.3125.424.8-169.7170.9166.100115.3
419Q28.8Very low30.5Very low156 Ų156131.3 Ų131.373%0.72975%0.746SS**  trans70136.3160.5-84-173.271.200122.8
420V27.3Very low30.4Very low117 Ų117134 Ų13471%0.70976%0.756SS**  trans72.4108.3135174.80000121.2
421A30.5Very low30.2Very low100 Ų100132.3 Ų132.383%0.82676%0.756SS**  trans59.5168.2134.900000122
422G31.1Very low30.1Very low69 Ų69131.3 Ų131.371%0.71176%0.755SS**  trans90.4108.8-171.600000110.8
423E32.4Very low30.4Very low208 Ų208130.1 Ų130.197%0.97275%0.748SS**  cis71.1120.849-165.1179.3-166.200113.8
424G29.1Very low30.5Very low63 Ų63132.3 Ų132.365%0.64976%0.755SS**  trans127.7132.5154.600000117.9
425V31Very low31.2Very low136 Ų136131.9 Ų131.982%0.82475%0.752SS**  trans59.888147-163.20000116.4
426D28.8Very low31.8Very low115 Ų115131 Ų13162%0.61575%0.751SS**  61.5140.273.6-161.821.5000114.9
427R34.6Very low31.9Very low189 Ų189132 Ų13271%0.71376%0.757SS**  trans72154.2175.3-65.5-171.317261.324119.8
428E28.7Very low32Very low146 Ų146127 Ų12768%0.68275%0.748SS**  cis-176.9125.2-23.7-178.8177.9155.500108.1
429L29.3Very low32.5Very low144 Ų144126.3 Ų126.375%0.75475%0.754SS**  trans172.7117.5135.9-113.987.8000114.5
430L33.4Very low32.8Very low148 Ų148126.4 Ų126.478%0.77576%0.76SS**  57138.4122-92.2170.7000125.1
431V30.2Very low33.1Very low139 Ų139127.5 Ų127.584%0.84276%0.761SS**  trans72129.8162.5-172.10000116.9
432G29.4Very low33.4Very low72 Ų72132.9 Ų132.974%0.74277%0.766SS**  trans-173.3-35.8176.700000116.5
433D33.4Very low33.9Very low143 Ų143137.4 Ų137.477%0.76577%0.774SS**  trans62.8131.8162.2-129.765.8000120.9
434S34.3Very low34.2Very low102 Ų102134.5 Ų134.571%0.71376%0.761SS**  trans70.1146.4142.8-81.40000119.9
435I46.3Very low34.4Very low162 Ų162139.5 Ų139.583%0.83177%0.769SS**  cis-132.3153.62.6-59.5-177.1000109.9
436A38.8Very low34.7Very low83 Ų83140.3 Ų140.369%0.68677%0.774SS**  trans-71.6160.2175.800000115.5
437D34.4Very low34.8Very low168 Ų168137.6 Ų137.690%0.89876%0.762SS**  -168.5150.2108.8-123.79.8000110.2
438G32.2Very low34.5Very low53 Ų53133.2 Ų133.255%0.54677%0.766SS.*  cis139.662.8-5.100000114.5
439T37.8Very low34.4Very low140 Ų140132.1 Ų132.186%0.85977%0.769SS**  trans-157.2148.8163.6-2.30000112
440D36.3Very low34.2Very low158 Ų158130.8 Ų130.885%0.84577%0.767SS**  trans68.165.7175.3-65.95000119.1
441L33.7Very low33.9Very low139 Ų139129.4 Ų129.473%0.72877%0.765SS**  trans-148.679.9139.1-166.668.3000112.6
442F37.2Very low33.7Very low214 Ų214131 Ų13194%0.93976%0.764SS**SBendtrans-142.451168.3-73.4-62.7000112.6
443D40.4Very low33.5Very low164 Ų164133.6 Ų133.688%0.87777%0.77SS**SBendtrans-158.733.2152.7-148.719.3000115.5
444E38.9Very low33.1Very low147 Ų147130.2 Ų130.269%0.68777%0.769SS**  trans-146.973.4171.9-142.3175.3156.800114.9T447E444-T447 HydrophobicContact CG-CG2 3.9Å; E444-T447 WeakPolarHBondContact O-CG2 3.4Å
445M33.2Very low32.7Very low167 Ų167132.4 Ų132.482%0.82377%0.773SS**  trans-132.762.8150.9-171.2149.3-160.700111.9T447M445-T447 WeakPolarHBondContact CG-OG1 3.4Å
446V37.6Very low31.9Very low153 Ų153132.2 Ų132.293%0.92777%0.772SS**SBendtrans-110.566.3139.3-175.40000106
447T31.8Very low31.3Very low59 Ų59136.3 Ų136.336%0.36278%0.778SS.*  trans-117.2141.1-166.945.20000113.3E444 M445E444-T447 HydrophobicContact CG-CG2 3.9Å; E444-T447 WeakPolarHBondContact O-CG2 3.4Å; M445-T447 WeakPolarHBondContact CG-OG1 3.4Å
448A26.5Very low30.9Very low97 Ų97136.2 Ų136.280%0.80278%0.776SS**  trans65.1158.7166.900000115.5
449T26.8Very low30.7Very low123 Ų123140 Ų14076%0.75579%0.788SS**  cis-132.7154.318.552.70000109
450T25.3Very low30.3Very low116 Ų116141.2 Ų141.271%0.71278%0.784SS**  cis177.6174.7723.60000105.6
451T27.7Very low29.8Very low119 Ų119139.4 Ų139.473%0.7378%0.783SS**  trans-8.7143.9149.4-60000116.8
452E25.6Very low29.5Very low173 Ų173139 Ų13981%0.80879%0.787SS**  cis-165.8143.339.363.1-151.1157.900112.6
453S24.5Very low29.7Very low126 Ų126134.8 Ų134.888%0.88178%0.781SS**  77124.193.6-162.40000117
454G26.3Very low29Very low72 Ų72130.6 Ų130.674%0.74278%0.777SS**  trans117.796.4179.700000112
455D25.3Very low28.6Very low147 Ų147127.8 Ų127.879%0.78678%0.779SS**  81.1106.657.9-170.436000114.3
456L30.1Very low28.4Very low158 Ų158127 Ų12783%0.82778%0.778SS**  -177.5158.5117.7-103.6172.6000114.4
457E26.5Very low28Very low170 Ų170125.5 Ų125.579%0.79477%0.769SS**  trans-86.2161.1175.2-70.8-165.8121.600114.9V459E457-V459 PolarHBondContact O-N 3.26Å
458L26Very low27.8Very low165 Ų165129.6 Ų129.686%0.86479%0.788SS**  trans-28.9108.9154.2178.678.4000116.1
459V27.3Very low27.9Very low133 Ų133132.4 Ų132.481%0.80678%0.784SS**  trans-141.1149.7155.7-170.80000110.8E457E457-V459 PolarHBondContact O-N 3.26Å
460H29.1Very low28Very low165 Ų165133.8 Ų133.876%0.76479%0.786SS**  trans-79.2144.4-177.4-57.2-110.9000113.9
461S25.9Very low27.9Very low120 Ų120136 Ų13684%0.83979%0.792SS**  158.9151.7119.2-69.80000115.5
462T27.5Very low28.4Very low132 Ų132135.5 Ų135.581%0.8179%0.792SS**  trans-89.3-179170.639.70000112.3
463P41.8Very low28.3Very low125 Ų125135.6 Ų135.681%0.81279%0.794SS**  cis-131.7174.8-33.433.9-16.8000113.7
464G26.1Very low28.4Very low76 Ų76136.2 Ų136.278%0.78479%0.792SS**  trans17796.4167.400000120.7
465A29.2Very low28.4Very low88 Ų88141.6 Ų141.673%0.72780%0.801SS**  trans24.8126.9140.700000124.8
466N29.7Very low28.5Very low150 Ų150137.7 Ų137.780%0.80279%0.794SS**  90125.3125.4-68.3-0.7000125.1
467V29Very low28.5Very low121 Ų121137.4 Ų137.473%0.73379%0.793SS**  87.5121.7128.4165.20000122
468L28.1Very low28.6Very low146 Ų146137.6 Ų137.676%0.76479%0.794SS**  trans39.7158145.7-82.475.1000121.6
469E27.6Very low28.8Very low156 Ų156138.8 Ų138.873%0.72980%0.795SS**  cis-175.4-173.5-21.9-157.3178.4-163.300108
470L29.1Very low28.9Very low151 Ų151136.1 Ų136.179%0.79179%0.794SS**  trans81.3132164-88.569.3000121.8
471L24.4Very low28.8Very low162 Ų162133.8 Ų133.885%0.84880%0.797SS**  trans-98.6-179.2156.3-83.6169.9000108.4
472P36.6Very low29.2Very low110 Ų110134.3 Ų134.371%0.71479%0.794SS**  cis-159.7-157.937.846.2-21.4000118.8
473M25.4Very low29.4Very low175 Ų175134.7 Ų134.786%0.86280%0.796SS**  trans72.2132.5162.3-93.4170.2173.400119.3
474V24.6Very low29Very low139 Ų139134 Ų13484%0.84279%0.79SS**  cis105.7106.16.9-176.70000117.7
475M27.2Very low29.3Very low185 Ų185139.4 Ų139.491%0.91180%0.795SS**  trans-157.2169150.9-87.7-179.371.500106.6
476G27.7Very low29.4Very low64 Ų64145.1 Ų145.166%0.6680%0.797SS**  cis114.4125.9600000111.5
477L29.4Very low30.1Very low153 Ų153142.7 Ų142.780%0.80180%0.798SS**  cis-165.1154.90.7174.963.2000109.9
478E29Very low30.2Very low174 Ų174142.6 Ų142.681%0.81380%0.797SS**  trans163.4159.4143.9-88.2-59.7104.500111.9
479E30.1Very low30.2Very low190 Ų190143.5 Ų143.589%0.88880%0.798SS**  trans-116.8157.3-161.2-65.2-17394.800117.2
480G29.8Very low30.5Very low76 Ų76142.3 Ų142.378%0.78480%0.801SS**  trans-166.188.8176.700000117.3
481S26.4Very low30.6Very low117 Ų117141.4 Ų141.482%0.81880%0.797SS**  trans51.770.9154.4-169.40000120.4V483S481-V483 PolarHBondContact O-N 3.36Å
482V33.7Very low31.5Very low130 Ų130139.6 Ų139.679%0.78879%0.793SS**  trans22.890.4142.7-166.90000118.4
483V32.9Very low31.6Very low140 Ų140140.1 Ų140.185%0.84879%0.793SS**  trans-132.9117.4131176.30000106.5S481S481-V483 PolarHBondContact O-N 3.36Å
484V32.2Very low32.5Very low111 Ų111137 Ų13767%0.67379%0.786SS**  trans-103.489-173.1-179.70000110.3R486V484-R486 HydrophobicContact CG1-CB 4.08Å; V484-R486 PolarHBondContact O-N 2.98Å
485E33.2Very low33Very low190 Ų190138.7 Ų138.789%0.88878%0.779SS**  trans-90.492.9162.8-170.1163.3-14000108.7A487E485-A487 PolarHBondContact O-N 2.77Å
486R32.1Very low33.7Very low208 Ų208132.9 Ų132.979%0.78576%0.756SS**  trans-88.797.3-172.5-162.6178.7-164.31200.7110.6V484 V488V484-R486 HydrophobicContact CG1-CB 4.08Å; V484-R486 PolarHBondContact O-N 2.98Å; R486-V488 PolarHBondContact O-N 3.27Å
487A43.9Very low34.9Very low99 Ų99133.9 Ų133.982%0.81875%0.751SS**  trans-57.9119.2165.500000109.8E485E485-A487 PolarHBondContact O-N 2.77Å
488V29.9Very low36.2Very low119 Ų119129.4 Ų129.472%0.72174%0.736SS**  trans-104.695.9174.3-179.80000108.8R486R486-V488 PolarHBondContact O-N 3.27Å
489Q28.6Very low37.4Very low164 Ų164125.3 Ų125.377%0.76672%0.719SS**  trans31108.5130.1-166.5164.3-1.300116.3D491Q489-D491 PolarHBondContact O-N 3.23Å
490T35.4Very low38.5Very low132 Ų132118.5 Ų118.581%0.8169%0.693SS**  trans-61.3103166.149.10000109.7V492T490-V492 PolarHBondContact O-N 3.42Å
491D29.8Very low40Very low132 Ų132120.4 Ų120.471%0.70668%0.681SS**  trans-75.3108-177-159.412.1000110.5Q489 V493Q489-D491 PolarHBondContact O-N 3.23Å; D491-V493 VanDerWaalsContact C-N 3.34Å; D491-V493 PolarHBondContact O-N 3.09Å
492V43.8Very low41.6Very low124 Ų124120.2 Ų120.275%0.75267%0.67SS**  trans-7988.5177178.70000107.4T490 P494T490-V492 PolarHBondContact O-N 3.42Å; V492-P494 WeakPolarHBondContact O-CD 3.5Å; V492-P494 VanDerWaalsContact O-N 3.14Å
493V38Very low43.1Very low120 Ų120118.3 Ų118.373%0.72766%0.655SS**PPolyproline II helixtrans-53118.6-177.7179.90000110.1D491D491-V493 VanDerWaalsContact C-N 3.34Å; D491-V493 PolarHBondContact O-N 3.09Å
494P44.1Very low44.6Very low110 Ų110117.8 Ų117.871%0.71464%0.643SS**PPolyproline II helixtrans-67.5138.6179.726.9-33.8000110.7V492 S496V492-P494 WeakPolarHBondContact O-CD 3.5Å; V492-P494 VanDerWaalsContact O-N 3.14Å; P494-S496 PolarHBondContact O-N 2.88Å
495Y36.9Very low45.7Very low175 Ų175117.4 Ų117.469%0.68664%0.637SS**PPolyproline II helixtrans-64124179.9-158.2-89000110.4P497Y495-P497 VanDerWaalsContact O-CD 3.3Å; Y495-P497 WeakPolarHBondContact O-CD 3.41Å
496S40.1Very low47.2Very low62 Ų62112.2 Ų112.243%0.43462%0.618SS.*PPolyproline II helixtrans-66.7118.2-176.6-178.60000111.6P494 A498 I499P494-S496 PolarHBondContact O-N 2.88Å; S496-A498 PolarHBondContact O-N 3.07Å; S496-A498 VanDerWaalsContact O-N 3.13Å; S496-I499 PolarHBondContact O-N 3.38Å
497P53.7Low48.6Very low86 Ų86107 Ų10756%0.55861%0.606SS**Hα-helixtrans-59-29.1-176.7-26.535.9000114Y495 I499 S500 E501Y495-P497 VanDerWaalsContact O-CD 3.3Å; Y495-P497 WeakPolarHBondContact O-CD 3.41Å; P497-I499 PolarHBondContact O-N 3.19Å; P497-I499 VanDerWaalsContact O-N 3.16Å; P497-S500 WeakPolarHBondContact CA-OG 3.04Å; P497-S500 PolarHBondContact O-N 2.94Å; P497-S500 VanDerWaalsContact O-N 3.17Å; P497-S500 PolarHBondContact O-OG 3.42Å; P497-E501 PolarHBondContact O-N 3.35Å
498A57.6Low49.4Very low59 Ų59108 Ų10849%0.48859%0.593SS.*Hα-helixtrans-60.9-24.3-17900000113.8S496 L502S496-A498 PolarHBondContact O-N 3.07Å; S496-A498 VanDerWaalsContact O-N 3.13Å; A498-L502 VanDerWaalsContact O-CB 3.28Å; A498-L502 WeakPolarHBondContact O-CB 3.48Å; A498-L502 PolarHBondContact O-N 2.68Å
499I52.9Low50.5Low87 Ų87111 Ų11145%0.44660%0.597SS.*Hα-helixtrans-80.1-40.9177.8-58.9178.4000110.5S496 P497 L502 I503S496-I499 PolarHBondContact O-N 3.38Å; P497-I499 PolarHBondContact O-N 3.19Å; P497-I499 VanDerWaalsContact O-N 3.16Å; I499-L502 PolarHBondContact O-N 3.03Å; I499-I503 HydrophobicContact CG2-CD1 4.06Å; I499-I503 VanDerWaalsContact O-CG1 3.32Å; I499-I503 WeakPolarHBondContact O-CG1 3.45Å; I499-I503 PolarHBondContact O-N 2.89Å
500S54.3Low51.6Low48 Ų48110.1 Ų110.134%0.33660%0.596SS.*Hα-helixtrans-62.5-42.4171.827.60000112.2P497 I503 Q504P497-S500 WeakPolarHBondContact CA-OG 3.04Å; P497-S500 PolarHBondContact O-N 2.94Å; P497-S500 VanDerWaalsContact O-N 3.17Å; P497-S500 PolarHBondContact O-OG 3.42Å; S500-I503 PolarHBondContact O-N 2.89Å; S500-Q504 WeakPolarHBondContact O-CB 3.48Å; S500-Q504 WeakPolarHBondContact O-CG 3.43Å; S500-Q504 PolarHBondContact O-N 3.1Å
501E60Low52.1Low116 Ų116110.6 Ų110.654%0.54259%0.589SS.*Hα-helixtrans-64.7-39174.8-71178.5170.600112P497 Q504 N505P497-E501 PolarHBondContact O-N 3.35Å; E501-Q504 PolarHBondContact O-N 3.46Å; E501-N505 WeakPolarHBondContact O-CB 3.38Å; E501-N505 PolarHBondContact O-N 3.06Å; E501-N505 PolarHBondContact O-ND2 2.94Å
502L61.4Low52.1Low113 Ų113110.6 Ų110.659%0.59259%0.589SS**Hα-helixtrans-63.1-43.8175.3-17863.2000111.7A498 I499 N505 V506A498-L502 VanDerWaalsContact O-CB 3.28Å; A498-L502 WeakPolarHBondContact O-CB 3.48Å; A498-L502 PolarHBondContact O-N 2.68Å; I499-L502 PolarHBondContact O-N 3.03Å; L502-N505 PolarHBondContact O-N 3.4Å; L502-V506 WeakPolarHBondContact O-CG2 3.22Å; L502-V506 PolarHBondContact O-N 3.34Å
503I64.8Low51.8Low90 Ų90109.9 Ų109.946%0.46259%0.587SS.*Hα-helixtrans-65.6-43.2177.8-68.2165.8000110.9I499 S500 V506 L507I499-I503 HydrophobicContact CG2-CD1 4.06Å; I499-I503 VanDerWaalsContact O-CG1 3.32Å; I499-I503 WeakPolarHBondContact O-CG1 3.45Å; I499-I503 PolarHBondContact O-N 2.89Å; S500-I503 PolarHBondContact O-N 2.89Å; I503-V506 PolarHBondContact O-N 2.97Å; I503-L507 HydrophobicContact CG2-CD1 4.34Å; I503-L507 PolarHBondContact O-N 3.46Å
504Q63Low51.5Low129 Ų129110.3 Ų110.360%0.60359%0.594SS**Hα-helixtrans-64.1-44.5175.8-74.5179.8-4.200111.9S500 E501 V506 L507 Q508S500-Q504 WeakPolarHBondContact O-CB 3.48Å; S500-Q504 WeakPolarHBondContact O-CG 3.43Å; S500-Q504 PolarHBondContact O-N 3.1Å; E501-Q504 PolarHBondContact O-N 3.46Å; Q504-V506 VanDerWaalsContact C-N 3.27Å; Q504-V506 PolarHBondContact O-N 2.86Å; Q504-L507 PolarHBondContact O-N 3.31Å; Q504-Q508 WeakPolarHBondContact O-CB 3.31Å; Q504-Q508 PolarHBondContact O-N 3.08Å
505N55.3Low51Low103 Ų103110.7 Ų110.755%0.55160%0.597SS**Hα-helixtrans-62.8-31.2176.3-83.1-72.3000113.2E501 L502 K509E501-N505 WeakPolarHBondContact O-CB 3.38Å; E501-N505 PolarHBondContact O-N 3.06Å; E501-N505 PolarHBondContact O-ND2 2.94Å; L502-N505 PolarHBondContact O-N 3.4Å; N505-K509 WeakPolarHBondContact O-CB 3.37Å; N505-K509 WeakPolarHBondContact O-CG 3.36Å; N505-K509 PolarHBondContact O-N 2.82Å
506V66.3Low50.7Low81 Ų81108 Ų10849%0.49160%0.604SS.*Hα-helixtrans-73.4-44.1173.2170.40000111.2L502 I503 Q504 K509 L510L502-V506 WeakPolarHBondContact O-CG2 3.22Å; L502-V506 PolarHBondContact O-N 3.34Å; I503-V506 PolarHBondContact O-N 2.97Å; Q504-V506 VanDerWaalsContact C-N 3.27Å; Q504-V506 PolarHBondContact O-N 2.86Å; V506-K509 PolarHBondContact O-N 2.88Å; V506-L510 HydrophobicContact CG1-CD1 4.42Å; V506-L510 VanDerWaalsContact O-CD1 3.27Å; V506-L510 WeakPolarHBondContact O-CD1 3.34Å; V506-L510 PolarHBondContact O-N 3.28Å
507L60.9Low50Low99 Ų99109.7 Ų109.752%0.51862%0.615SS.*Hα-helixtrans-62.8-43.5175.5-101.366.3000112.2I503 Q504 K509 L510 Q511I503-L507 HydrophobicContact CG2-CD1 4.34Å; I503-L507 PolarHBondContact O-N 3.46Å; Q504-L507 PolarHBondContact O-N 3.31Å; L507-K509 VanDerWaalsContact C-N 3.32Å; L507-K509 PolarHBondContact O-N 3.48Å; L507-L510 CarbonylContact O-C 3.6Å; L507-L510 PolarHBondContact O-N 3.49Å; L507-Q511 PolarHBondContact O-N 3.24Å
508Q59.9Low48.8Very low119 Ų119113.4 Ų113.456%0.55663%0.63SS**Hα-helixtrans-58.2-45.3177.5-159.67639.500110.8Q504 L510 Q511Q504-Q508 WeakPolarHBondContact O-CB 3.31Å; Q504-Q508 PolarHBondContact O-N 3.08Å; Q508-L510 PolarHBondContact O-N 2.69Å; Q508-L510 VanDerWaalsContact O-N 3.16Å; Q508-Q511 PolarHBondContact O-N 3.29Å
509K54.7Low47.3Very low183 Ų183115.1 Ų115.180%0.79664%0.644SS**THydrogen-bonded Turntrans-66.9-9.7175.7-80.9-172.3172.3-174.80115.2N505 V506 L507N505-K509 WeakPolarHBondContact O-CB 3.37Å; N505-K509 WeakPolarHBondContact O-CG 3.36Å; N505-K509 PolarHBondContact O-N 2.82Å; V506-K509 PolarHBondContact O-N 2.88Å; L507-K509 VanDerWaalsContact C-N 3.32Å; L507-K509 PolarHBondContact O-N 3.48Å
510L50.1Low46.1Very low145 Ų145116.2 Ų116.276%0.75966%0.659SS**THydrogen-bonded Turntrans-103.30.4171.9-90.278000112.9V506 L507 Q508V506-L510 HydrophobicContact CG1-CD1 4.42Å; V506-L510 VanDerWaalsContact O-CD1 3.27Å; V506-L510 WeakPolarHBondContact O-CD1 3.34Å; V506-L510 PolarHBondContact O-N 3.28Å; L507-L510 CarbonylContact O-C 3.6Å; L507-L510 PolarHBondContact O-N 3.49Å; Q508-L510 PolarHBondContact O-N 2.69Å; Q508-L510 VanDerWaalsContact O-N 3.16Å
511Q45.8Very low45.7Very low142 Ų142119 Ų11966%0.66468%0.676SS**SBendtrans-12417.2-174.1-72.8-164.6-13.400115.6L507 Q508 P513L507-Q511 PolarHBondContact O-N 3.24Å; Q508-Q511 PolarHBondContact O-N 3.29Å; Q511-P513 VanDerWaalsContact C-CD 3.43Å; Q511-P513 WeakPolarHBondContact O-CD 3.44Å
512D30.3Very low44.1Very low131 Ų131120 Ų12070%0.70169%0.685SS**  trans-98.489.2167.6-81-34.9000112
513P37.4Very low42.6Very low110 Ų110122.3 Ų122.371%0.71469%0.693SS**  trans-74.1134.1158.131.9-31.9000109.6Q511 P515Q511-P513 VanDerWaalsContact C-CD 3.43Å; Q511-P513 WeakPolarHBondContact O-CD 3.44Å; P513-P515 WeakPolarHBondContact O-CD 3.38Å
514C32.9Very low41Very low128 Ų128123.4 Ų123.487%0.86571%0.709SS**  trans-61.2126.9177.8-57.10000111.3S516C514-S516 PolarHBondContact O-N 2.94Å
515P33.2Very low39.4Very low119 Ų119125.9 Ų125.977%0.77372%0.72SS**  trans-85.6111.8-175.431.6-33.9000113P513P513-P515 WeakPolarHBondContact O-CD 3.38Å
516S29.4Very low39.1Very low119 Ų119126 Ų12683%0.83273%0.727SS**  trans66.7155.7154.6-51.80000117.1C514C514-S516 PolarHBondContact O-N 2.94Å
517S26.1Very low37.2Very low97 Ų97129.2 Ų129.268%0.67874%0.741SS**  cis-153.3168.39.9-152.40000112.1
518L29Very low35.7Very low164 Ų164129.5 Ų129.586%0.85975%0.751SS**  trans6.7136.3152.9-64.4160.5000118.1
519A26.6Very low34.3Very low95 Ų95131.4 Ų131.479%0.78576%0.762SS**  cis-161.1179.641.200000114.9
520S27.7Very low33.1Very low109 Ų109130.8 Ų130.876%0.76276%0.762SS**  trans-88.5-175.2175.261.10000112.7
521P43.9Very low31.9Very low107 Ų107129.5 Ų129.570%0.69577%0.765SS**  cis-136.5-1560.440.7-19.3000114.7
522D27.9Very low31.1Very low138 Ų138132.1 Ų132.174%0.73878%0.775SS**  trans92.6112.3152.1-78.722.6000123
523E30.3Very low31.8Very low160 Ų160130.9 Ų130.975%0.74877%0.774SS**  69.1141.4129.8-59.8-60.584.800125.1
524S30.8Very low31.3Very low114 Ų114132.5 Ų132.580%0.79777%0.772SS**  trans83.9119.8150.8660000122.1
525E28.4Very low31.2Very low181 Ų181131.4 Ų131.485%0.84677%0.766SS**  trans-66.8172.2147.3-87.9-171.512400112
526P49.7Very low31Very low106 Ų106132.8 Ų132.869%0.68877%0.766SS**  cis-140.2-171.8-27.534.8-14.2000114.1
527D26Very low31Very low147 Ų147132.6 Ų132.679%0.78676%0.764SS**  trans87.9153.4138.8-140.3-7.7000122.7
528S28.9Very low31.1Very low105 Ų105131.9 Ų131.973%0.73477%0.765SS**  trans81.5168.5153.9-76.90000123.2
529M32.3Very low31.1Very low160 Ų160132 Ų13279%0.78877%0.765SS**  trans-99.9174-148.5-65.8179.355.900117.1
530E28.8Very low31.3Very low169 Ų169133.3 Ų133.379%0.7976%0.763SS**  trans66.5119.4151.6-80.2179164.200120.3
531S24.7Very low31.5Very low119 Ų119133.9 Ų133.983%0.83276%0.762SS**  170.2154.3102.247.20000114.5
532F29.5Very low30.6Very low196 Ų196135.3 Ų135.386%0.8676%0.763SS**  trans-87.9177.6158.6-68.8-82.4000108.3
533P43.5Very low30.7Very low105 Ų105135.7 Ų135.768%0.68277%0.765SS**  cis-156.5-16229.238.8-11.8000118.4
534E28.7Very low30.9Very low145 Ų145134.1 Ų134.168%0.67877%0.766SS**  trans100.9150.1136.2-128.959-103.700122.3
535S29.6Very low31.6Very low104 Ų104134.7 Ų134.773%0.72777%0.767SS**  trans78.4110.3176-45.20000115.2
536L29.3Very low31.5Very low149 Ų149138.2 Ų138.278%0.7877%0.773SS**  cis62.5137.824.5-56.2175.6000113.4
537S29.4Very low30.9Very low114 Ų114140.4 Ų140.480%0.79778%0.779SS**  cis-160.1-1659.5-152.10000112.9
538A27.8Very low32.2Very low83 Ų83137.8 Ų137.869%0.68677%0.77SS**  trans83.8137.9166.700000117.9
539L28.9Very low32Very low165 Ų165139.9 Ų139.986%0.86477%0.773SS**  cis-150.6168.8-4.5-145.995.3000112.1
540V30.5Very low32Very low123 Ų123137.8 Ų137.875%0.74577%0.774SS**  trans-98.1174.9175.6-93.30000112
541V31.9Very low32.1Very low122 Ų122134 Ų13474%0.73977%0.771SS**  cis-142.7-161.225.2-132.40000109.7
542D25.2Very low32.5Very low136 Ų136135.5 Ų135.573%0.72777%0.768SS**  cis-156.6-170.612.5-140.9-52000112.6
543L29.9Very low32.5Very low147 Ų147133.3 Ų133.377%0.7777%0.765SS**  trans-98.1-174.7175.7-55.4177.1000111.7
544T36.1Very low31.8Very low127 Ų127136.1 Ų136.178%0.77977%0.773SS**  cis-152.41636.4-6.70000109.3
545P43.6Very low31.6Very low125 Ų125134 Ų13481%0.81277%0.774SS**  trans-95.6163-169.337.5-35.7000116
546R26.9Very low32.3Very low255 Ų255134.4 Ų134.496%0.96277%0.774SS**  trans-143.6153166-162.5168.3-177.4167.41.3112.1
547N36.6Very low32.2Very low153 Ų153132.5 Ų132.582%0.81877%0.769SS**  trans-88.7-176.4-167.4-135.1-0.1000113.1
548P54.6Low32.1Very low91 Ų91135.4 Ų135.459%0.59177%0.77SS**  -124.5-150.7-126.142.2-21.7000113.7
549N25.3Very low32Very low150 Ų150137.8 Ų137.880%0.80278%0.776SS**  trans10867.5163.9-55.2-58.8000118.9
550S31.7Very low32.9Very low116 Ų116135.1 Ų135.181%0.81177%0.768SS**  trans-161125.8139.346.90000107.8
551A29.9Very low32.5Very low88 Ų88134.8 Ų134.873%0.72777%0.772SS**  cis87.6121.726.300000115.1
552I32.8Very low32.1Very low152 Ų152133 Ų13378%0.77977%0.77SS**  trans87.9115.3147.8-66.6166000118.9
553L30.1Very low32.2Very low150 Ų150133.9 Ų133.979%0.78577%0.774SS**  trans70.4154.6158.7-63.7168.9000117.4
554L28.3Very low32.2Very low164 Ų164132.8 Ų132.886%0.85977%0.774SS**  cis-135.4165.125.9-71.8156.7000115.1
555S25.9Very low31.9Very low100 Ų100134 Ų13470%0.69978%0.775SS**  trans-123.8-176152.677.70000107.6
556P42.7Very low31.2Very low112 Ų112132.3 Ų132.373%0.72777%0.772SS**  cis-123.6-166.525.321.66.6000112.7
557V28Very low31.3Very low110 Ų110127.8 Ų127.867%0.66776%0.762SS**  -179.2115.672.1139.10000108.1
558E27.9Very low31.1Very low175 Ų175127.5 Ų127.582%0.81877%0.765SS**  103.2167.9100.4-69.4-177.815200115.3
559T25.7Very low30.1Very low133 Ų133128.5 Ų128.582%0.81676%0.762SS**  trans-151.7-168.1-16066.30000110.2
560P47.6Very low30.5Very low108 Ų108124.7 Ų124.770%0.70175%0.751SS**  cis-138.4-161.3-8.441.5-21.7000115.2
561S21.2Very low30.9Very low117 Ų117127 Ų12782%0.81876%0.755SS**  trans97.3148.4160.279.50000119.1
562A25.2Very low31.3Very low85 Ų85132.2 Ų132.270%0.70276%0.756SS**  cis-168.5144-29.100000111
563N25.6Very low31.5Very low153 Ų153132.5 Ų132.582%0.81876%0.758SS**  trans156.7113.5157.3-83.7-22.8000108.3
564V31.4Very low31.7Very low125 Ų125134.6 Ų134.676%0.75877%0.766SS**  54118.172-173.40000110.5
565D28.3Very low32.3Very low151 Ų151136.3 Ų136.381%0.80776%0.761SS**  cis-158.5-171.223.7-144-22.1000114.8
566A29.2Very low32.9Very low91 Ų91139.1 Ų139.175%0.75276%0.763SS**  trans84.4109.7148.200000120.8
567E28.9Very low32.7Very low160 Ų160139.7 Ų139.775%0.74876%0.759SS**  trans-87.3141.9166.6167.9-178.5-159.400112H569E567-H569 HydrophobicContact CG-CB 4.38Å
568V32.5Very low32.9Very low146 Ų146142.4 Ų142.489%0.88577%0.77SS**  trans-133.2107.3150.6-179.80000109.9
569H34.2Very low33.2Very low112 Ų112142.7 Ų142.752%0.51977%0.769SS.*  trans-88.9113.6178.9-176.997.7000111.9E567E567-H569 HydrophobicContact CG-CB 4.38Å
570A33.4Very low33.6Very low70 Ų70141.2 Ų141.258%0.57977%0.77SS**  trans-140.1158.2166.400000111
571N40.2Very low32.8Very low166 Ų166140.8 Ų140.889%0.88878%0.776SS**SBendtrans7120.5171.7-50.7-33.4000118.1
572R38.4Very low33.4Very low197 Ų197141.5 Ų141.574%0.74378%0.779SS**  trans-91.3-3.1169.4-153-174.9165.4163.8-2.8115
573L37.5Very low33.7Very low158 Ų158143.8 Ų143.883%0.82778%0.784SS**SBendtrans-1051.5-169.6-65.2176.2000116.4
574M34.1Very low33.9Very low193 Ų193145.4 Ų145.495%0.95179%0.787SS**SBendtrans-116.839.6177.8-62.6-137.8-57.500113.1
575R41.2Very low34.1Very low201 Ų201146.2 Ų146.276%0.75878%0.782SS**SBendtrans-142.725.9-174.3-147.1-176-170.5167.22.9115.3
576E37.1Very low34.4Very low159 Ų159148.9 Ų148.974%0.74378%0.781SS**SBendtrans-135.228.7-169.9-152.8159-127.800112.7
577L39.3Very low34.5Very low123 Ų123152.9 Ų152.964%0.64479%0.789SS**  trans-118.7-8.8178.9-111.787.2000115.8R310 F579R310-L577 VanDerWaalsContact NH2-CD2 3.26Å; L577-F579 PolarHBondContact O-N 3.49Å
578D31.9Very low34.6Very low167 Ų167152.9 Ų152.989%0.89379%0.794SS**  trans-86.792.8174.5-81.8-43000111.1
579F34.7Very low34.5Very low181 Ų181148.6 Ų148.679%0.79478%0.78SS**  trans-114.468.3166-75.6-81.3000110.3L577L577-F579 PolarHBondContact O-N 3.49Å
580A34.6Very low34.4Very low102 Ų102149.9 Ų149.984%0.84380%0.795SS**PPolyproline II helixtrans-80.8122.5161.400000108.9
581A30.2Very low34.6Very low99 Ų99153.8 Ų153.882%0.81881%0.805SS**PPolyproline II helixtrans-88.1164.6-172.900000113.6
582C33.4Very low34.4Very low132 Ų132151.7 Ų151.789%0.89280%0.8SS**PPolyproline II helixtrans-71.6143.5-170.5-51.70000115.4
583V30.7Very low34.2Very low133 Ų133150.2 Ų150.281%0.80681%0.806SS**  trans-150.8133.4159.6175.50000105.3
584E31.3Very low34.1Very low187 Ų187147.3 Ų147.387%0.87481%0.805SS**  cis-141.9-164.8-5-142-178.1137.100110.8
585E35.3Very low34Very low143 Ų143149.9 Ų149.967%0.66880%0.804SS**  trans-84.4152.3-172.6-135.1-165.6101.800114.6
586R34Very low33.7Very low206 Ų206144.3 Ų144.378%0.77781%0.809SS**  trans70104.7134.5-166.6-170.2-155.3106-1.5120.3
587L31.4Very low33.3Very low176 Ų176140 Ų14092%0.92181%0.807SS**  -150167.1124.1-114.8172.4000111.9
588D30.6Very low33.2Very low159 Ų159141.3 Ų141.385%0.8582%0.82SS**  trans-93.2160.1-154.7-159.6-0.9000114.5
589G31Very low33.8Very low57 Ų57139.4 Ų139.459%0.58881%0.814SS**  trans109.5123154.800000120
590V32.1Very low34.2Very low139 Ų139137.4 Ų137.484%0.84280%0.801SS**  trans74.5121.2153.2-169.20000119.1
591I37Very low34.9Very low152 Ų152141 Ų14178%0.77980%0.8SS**  trans-104.4138.8166.3-64.7166.9000108.9
592P36.9Very low36.2Very low121 Ų121144 Ų14479%0.78679%0.792SS**  trans-114.3138.6134.2-8.527.8000112.2A594P592-A594 PolarHBondContact O-N 3.33Å
593L34.6Very low36.9Very low167 Ų167144.4 Ų144.487%0.87477%0.774SS**  trans-84.2109.7-178179.369.1000111.3
594A33.9Very low38.2Very low97 Ų97140.8 Ų140.880%0.80276%0.755SS**  trans-105138.9167.200000110.9P592P592-A594 PolarHBondContact O-N 3.33Å
595R33.3Very low39.6Very low247 Ų247138 Ų13893%0.93276%0.756SS**  trans-110.7120.2-165.7-178.4178.2-176.7152.60.5112.7
596G33.8Very low40.8Very low83 Ų83134 Ų13486%0.85674%0.744SS**SBendtrans67.587.1152.200000116.8
597G30.3Very low42.1Very low68 Ų68130.5 Ų130.570%0.70174%0.735SS**  trans161.191168.600000112.2V599G597-V599 PolarHBondContact O-N 2.88Å
598V35.8Very low43.7Very low151 Ų151128.6 Ų128.692%0.91573%0.725SS**  trans-76.877.3171.5-175.20000108.5R600V598-R600 PolarHBondContact O-N 3.45Å; V598-R600 VanDerWaalsContact O-N 3.09Å
599V44.6Very low45.6Very low127 Ų127125.3 Ų125.377%0.7771%0.71SS**  trans-63.4109.1162.21770000106.3G597 Q601G597-V599 PolarHBondContact O-N 2.88Å; V599-Q601 PolarHBondContact O-N 3.4Å
600R43.5Very low47.3Very low139 Ų139124 Ų12453%0.52569%0.69SS.*  trans-61.3100178.5178.7176.6174.5-1592.8108.8V598 Y602V598-R600 PolarHBondContact O-N 3.45Å; V598-R600 VanDerWaalsContact O-N 3.09Å; R600-Y602 HydrophobicContact CB-CE2 4.08Å; R600-Y602 HydrophobicContact CG-CD2 4.18Å; R600-Y602 HydrophobicContact CG-CE1 4.44Å; R600-Y602 HydrophobicContact CG-CE2 3.87Å; R600-Y602 VanDerWaalsContact NH1-CE1 3.33Å; R600-Y602 PolarHBondContact NH1-OH 2.85Å; R600-Y602 WeakPolarHBondContact O-CD2 3.41Å; R600-Y602 WeakPolarHBondContact O-CE2 3.33Å; R600-Y602 PolarHBondContact O-N 2.99Å
601Q49.9Very low49.1Very low178 Ų178121.2 Ų121.283%0.83267%0.67SS**  trans-65.8117.5168.4-73.5174.9-42.900107.9V599 W603V599-Q601 PolarHBondContact O-N 3.4Å; Q601-W603 VanDerWaalsContact C-N 3.28Å
602Y57.6Low50.7Low163 Ų163119.1 Ų119.164%0.63966%0.66SS**  trans-89.85.9177.1-73.8-93.8000112.6R600R600-Y602 HydrophobicContact CB-CE2 4.08Å; R600-Y602 HydrophobicContact CG-CD2 4.18Å; R600-Y602 HydrophobicContact CG-CE1 4.44Å; R600-Y602 HydrophobicContact CG-CE2 3.87Å; R600-Y602 VanDerWaalsContact NH1-CE1 3.33Å; R600-Y602 PolarHBondContact NH1-OH 2.85Å; R600-Y602 WeakPolarHBondContact O-CD2 3.41Å; R600-Y602 WeakPolarHBondContact O-CE2 3.33Å; R600-Y602 PolarHBondContact O-N 2.99Å
603W47.6Very low52.3Low139 Ų139116.6 Ų116.653%0.52765%0.649SS.*SBendtrans-126.8145.7-169.5-62.178.8000109.6Q601 D610 V614Q601-W603 VanDerWaalsContact C-N 3.28Å; W603-D610 WeakPolarHBondContact CA-OD2 3.36Å; W603-D610 WeakPolarHBondContact CB-OD2 3.4Å; W603-D610 HydrophobicContact CE3-CB 3.35Å; W603-D610 HydrophobicContact CZ3-CB 3.56Å; W603-V614 HydrophobicContact CH2-CG2 4.39Å
604S58.8Low53.9Low57 Ų57112.5 Ų112.540%0.39963%0.631SS.*  trans-71.7170176.879.50000111.7S606 D610S604-S606 PolarHBondContact O-N 3.23Å; S604-S606 PolarHBondContact OG-N 3.49Å; S604-S606 PolarHBondContact OG-O 2.88Å; S604-D610 WeakPolarHBondContact CB-OD1 3.29Å; S604-D610 PolarHBondContact N-OD2 3.48Å; S604-D610 PolarHBondContact OG-OD1 3.12Å
605S59.5Low55.2Low129 Ų129109.4 Ų109.490%0.90261%0.605SS**SBendtrans-65.4-5.1173.355.70000113.9
606S60.8Low57Low59 Ų59100.1 Ų100.141%0.41358%0.581SS.*  trans-122.579.4-178-64.80000110.7S604 L608 V609 D610S604-S606 PolarHBondContact O-N 3.23Å; S604-S606 PolarHBondContact OG-N 3.49Å; S604-S606 PolarHBondContact OG-O 2.88Å; S606-L608 PolarHBondContact O-N 3.26Å; S606-V609 WeakPolarHBondContact O-CB 3.5Å; S606-V609 PolarHBondContact O-N 3.41Å; S606-D610 PolarHBondContact O-N 2.85Å
607F61Low58.2Low132 Ų132100 Ų10058%0.57957%0.565SS**Hα-helixtrans-46-34.8178.6175.5-105.2000114.1V609 L611F607-V609 VanDerWaalsContact C-N 3.35Å; F607-V609 PolarHBondContact O-N 2.95Å; F607-L611 HydrophobicContact CE1-CD2 3.86Å; F607-L611 HydrophobicContact CZ-CD2 4.18Å; F607-L611 WeakPolarHBondContact O-CB 3.27Å; F607-L611 PolarHBondContact O-N 3.09Å
608L64.9Low59.9Low136 Ų136100.3 Ų100.371%0.71255%0.554SS**Hα-helixtrans-63.9-33.5176.2-66174000113.9S606 L612S606-L608 PolarHBondContact O-N 3.26Å; L608-L612 WeakPolarHBondContact O-CB 3.34Å; L608-L612 PolarHBondContact O-N 3.12Å
609V71.2Confident61.4Low90 Ų9097.4 Ų97.455%0.54554%0.536SS..Hα-helixtrans-72.1-47.3179.1177.20000109.8S606 F607 L612 A613S606-V609 WeakPolarHBondContact O-CB 3.5Å; S606-V609 PolarHBondContact O-N 3.41Å; F607-V609 VanDerWaalsContact C-N 3.35Å; F607-V609 PolarHBondContact O-N 2.95Å; V609-L612 PolarHBondContact O-N 3.38Å; V609-A613 WeakPolarHBondContact O-CB 3.17Å; V609-A613 PolarHBondContact O-N 3Å
610D67.2Low62.3Low30 Ų3093 Ų9316%0.1651%0.51CS..Hα-helixtrans-67.9-41.7179.2-61.917000111.3W603 S604 S606 L612 A613 V614W603-D610 WeakPolarHBondContact CA-OD2 3.36Å; W603-D610 WeakPolarHBondContact CB-OD2 3.4Å; W603-D610 HydrophobicContact CE3-CB 3.35Å; W603-D610 HydrophobicContact CZ3-CB 3.56Å; S604-D610 WeakPolarHBondContact CB-OD1 3.29Å; S604-D610 PolarHBondContact N-OD2 3.48Å; S604-D610 PolarHBondContact OG-OD1 3.12Å; S606-D610 PolarHBondContact O-N 2.85Å; D610-L612 VanDerWaalsContact C-N 3.31Å; D610-L612 PolarHBondContact O-N 3.5Å; D610-A613 PolarHBondContact O-N 3.38Å; D610-V614 WeakPolarHBondContact O-CG2 3.38Å; D610-V614 PolarHBondContact O-N 2.86Å
611L68.2Low63.2Low81 Ų8190.6 Ų90.642%0.42451%0.51SS..Hα-helixtrans-61.2-40.2173.6-17963000111.1F607 V614 A615F607-L611 HydrophobicContact CE1-CD2 3.86Å; F607-L611 HydrophobicContact CZ-CD2 4.18Å; F607-L611 WeakPolarHBondContact O-CB 3.27Å; F607-L611 PolarHBondContact O-N 3.09Å; L611-V614 PolarHBondContact O-N 3.47Å; L611-A615 WeakPolarHBondContact O-CB 3.15Å; L611-A615 PolarHBondContact O-N 3.46Å
612L70.6Confident63.9Low108 Ų10885.3 Ų85.357%0.56549%0.49SS*.Hα-helixtrans-67.7-38.1174.7-176.362.2000111.9L608 V609 D610 V614 A615 A616L608-L612 WeakPolarHBondContact O-CB 3.34Å; L608-L612 PolarHBondContact O-N 3.12Å; V609-L612 PolarHBondContact O-N 3.38Å; D610-L612 VanDerWaalsContact C-N 3.31Å; D610-L612 PolarHBondContact O-N 3.5Å; L612-V614 VanDerWaalsContact C-N 3.33Å; L612-V614 PolarHBondContact O-N 3.28Å; L612-A615 PolarHBondContact O-N 3.27Å; L612-A616 WeakPolarHBondContact O-CB 3.46Å; L612-A616 PolarHBondContact O-N 3.24Å
613A71Confident64.4Low67 Ų6782.5 Ų82.555%0.55449%0.486SS*.Hα-helixtrans-65.8-33.317600000112.8V609 D610 P617V609-A613 WeakPolarHBondContact O-CB 3.17Å; V609-A613 PolarHBondContact O-N 3Å; D610-A613 PolarHBondContact O-N 3.38Å; A613-P617 WeakPolarHBondContact O-CD 3.48Å; A613-P617 WeakPolarHBondContact O-CG 3.34Å
614V67.5Low65.4Low82 Ų8283.1 Ų83.150%0.49749%0.488SS..Hα-helixtrans-82-35.6174.2174.80000112W603 D610 L611 L612 V618W603-V614 HydrophobicContact CH2-CG2 4.39Å; D610-V614 WeakPolarHBondContact O-CG2 3.38Å; D610-V614 PolarHBondContact O-N 2.86Å; L611-V614 PolarHBondContact O-N 3.47Å; L612-V614 VanDerWaalsContact C-N 3.33Å; L612-V614 PolarHBondContact O-N 3.28Å; V614-V618 WeakPolarHBondContact O-CG2 3.33Å
615A63.1Low65.6Low32 Ų3282.7 Ų82.726%0.26449%0.488SS..Hα-helixtrans-77.1-39.1-178.400000113.3L611 L612 V618 V619L611-A615 WeakPolarHBondContact O-CB 3.15Å; L611-A615 PolarHBondContact O-N 3.46Å; L612-A615 PolarHBondContact O-N 3.27Å; A615-V618 PolarHBondContact O-N 3.03Å; A615-V619 HydrophobicContact CB-CG2 4.34Å; A615-V619 WeakPolarHBondContact O-CB 3.31Å; A615-V619 WeakPolarHBondContact O-CG2 3.49Å; A615-V619 PolarHBondContact O-N 3.38Å
616A69.4Low65.7Low51 Ų5183.1 Ų83.142%0.42147%0.474SS..Hα-helixtrans-59.5-36.2-175.200000114.5L612 P620L612-A616 WeakPolarHBondContact O-CB 3.46Å; L612-A616 PolarHBondContact O-N 3.24Å; A616-P620 WeakPolarHBondContact O-CD 3.49Å
617P59.3Low65.4Low81 Ų8183.5 Ų83.553%0.52648%0.477SS..Hα-helixtrans-77.8-27.5171.2-16.832.5000114.2A613 T621A613-P617 WeakPolarHBondContact O-CD 3.48Å; A613-P617 WeakPolarHBondContact O-CG 3.34Å; P617-T621 PolarHBondContact O-OG1 3.06Å; P617-T621 VanDerWaalsContact O-OG1 3.07Å
618V65.8Low65.1Low75 Ų7581.1 Ų81.146%0.45547%0.473SS..Hα-helixtrans-87.6-39.8-171.7173.80000112.2V614 A615 T621 V622V614-V618 WeakPolarHBondContact O-CG2 3.33Å; A615-V618 PolarHBondContact O-N 3.03Å; V618-T621 WeakPolarHBondContact O-CB 3.29Å; V618-T621 PolarHBondContact O-N 2.89Å; V618-T621 VanDerWaalsContact O-N 3.09Å; V618-V622 HydrophobicContact CG1-CG2 3.75Å; V618-V622 WeakPolarHBondContact O-CG2 3.43Å; V618-V622 PolarHBondContact O-N 3.38Å
619V68.3Low64.6Low90 Ų9082.4 Ų82.455%0.54548%0.475SS..Hα-helixtrans-55.7-44.6-178.4168.10000113.5A615 T621 V622 L623A615-V619 HydrophobicContact CB-CG2 4.34Å; A615-V619 WeakPolarHBondContact O-CB 3.31Å; A615-V619 WeakPolarHBondContact O-CG2 3.49Å; A615-V619 PolarHBondContact O-N 3.38Å; V619-T621 VanDerWaalsContact C-N 3.31Å; V619-T621 PolarHBondContact O-N 3.4Å; V619-V622 PolarHBondContact O-N 3.18Å; V619-L623 VanDerWaalsContact O-CB 3.24Å; V619-L623 WeakPolarHBondContact O-CB 3.47Å; V619-L623 PolarHBondContact O-N 3.32Å
620P62.6Low63.6Low34 Ų3489.2 Ų89.222%0.22149%0.491CS..Hα-helixtrans-61.4-40175.9-21.532.5000112.7A616 L623 W624 I639 L643A616-P620 WeakPolarHBondContact O-CD 3.49Å; P620-L623 PolarHBondContact O-N 3.22Å; P620-W624 WeakPolarHBondContact O-CB 3.49Å; P620-W624 PolarHBondContact O-N 2.91Å; P620-I639 HydrophobicContact CB-CG2 4.43Å; P620-L643 HydrophobicContact CG-CD2 3.97Å
621T61.8Low63Low88 Ų8891.2 Ų91.254%0.5452%0.519SS..Hα-helixtrans-69-41.8-177.5-42.50000111.3P617 V618 V619 A625P617-T621 PolarHBondContact O-OG1 3.06Å; P617-T621 VanDerWaalsContact O-OG1 3.07Å; V618-T621 WeakPolarHBondContact O-CB 3.29Å; V618-T621 PolarHBondContact O-N 2.89Å; V618-T621 VanDerWaalsContact O-N 3.09Å; V619-T621 VanDerWaalsContact C-N 3.31Å; V619-T621 PolarHBondContact O-N 3.4Å; T621-A625 WeakPolarHBondContact O-CB 3.41Å; T621-A625 PolarHBondContact O-N 3.24Å
622V64.7Low61.8Low67 Ų6790.4 Ų90.441%0.40653%0.53SS..Hα-helixtrans-69.3-42.3175.3172.30000111.3V618 V619 W624 A625 F626V618-V622 HydrophobicContact CG1-CG2 3.75Å; V618-V622 WeakPolarHBondContact O-CG2 3.43Å; V618-V622 PolarHBondContact O-N 3.38Å; V619-V622 PolarHBondContact O-N 3.18Å; V622-W624 VanDerWaalsContact C-N 3.32Å; V622-W624 PolarHBondContact O-N 2.67Å; V622-A625 PolarHBondContact O-N 3.18Å; V622-F626 HydrophobicContact CG1-CD2 3.68Å; V622-F626 HydrophobicContact CG1-CE2 3.55Å; V622-F626 VanDerWaalsContact O-CD2 3.3Å; V622-F626 WeakPolarHBondContact O-CD2 3.34Å; V622-F626 PolarHBondContact O-N 3.14Å
623L69.6Low60.9Low105 Ų10591.8 Ų91.855%0.5554%0.543SS..Hα-helixtrans-64-37.3176.5-175.161.4000111.9V619 P620 S627V619-L623 VanDerWaalsContact O-CB 3.24Å; V619-L623 WeakPolarHBondContact O-CB 3.47Å; V619-L623 PolarHBondContact O-N 3.32Å; P620-L623 PolarHBondContact O-N 3.22Å; L623-S627 WeakPolarHBondContact O-CB 3.26Å; L623-S627 PolarHBondContact O-N 3.31Å; L623-S627 PolarHBondContact O-OG 3.13Å
624W67.6Low59.9Low151 Ų15195.1 Ų95.157%0.57255%0.552SS**Hα-helixtrans-64.5-45.5172.5179.980000111.9P620 V622 F626 S627 T628P620-W624 WeakPolarHBondContact O-CB 3.49Å; P620-W624 PolarHBondContact O-N 2.91Å; V622-W624 VanDerWaalsContact C-N 3.32Å; V622-W624 PolarHBondContact O-N 2.67Å; W624-F626 PolarHBondContact O-N 3.27Å; W624-S627 WeakPolarHBondContact O-CB 3.37Å; W624-S627 PolarHBondContact O-N 3.19Å; W624-T628 HydrophobicContact CZ2-CG2 4.31Å; W624-T628 PolarHBondContact O-N 3.33Å
625A64.5Low59.1Low48 Ų4895.3 Ų95.340%0.39756%0.555SS.*Hα-helixtrans-63.4-36.3177.500000113.6T621 V622 S627 T628T621-A625 WeakPolarHBondContact O-CB 3.41Å; T621-A625 PolarHBondContact O-N 3.24Å; V622-A625 PolarHBondContact O-N 3.18Å; A625-S627 VanDerWaalsContact C-N 3.35Å; A625-T628 PolarHBondContact O-OG1 3.05Å; A625-T628 VanDerWaalsContact O-OG1 3.05Å
626F60.5Low58.6Low139 Ų13999.6 Ų99.661%0.6158%0.577SS**Hα-helixtrans-72.9-25.8171.4-79.4-61.5000113.3V622 W624V622-F626 HydrophobicContact CG1-CD2 3.68Å; V622-F626 HydrophobicContact CG1-CE2 3.55Å; V622-F626 VanDerWaalsContact O-CD2 3.3Å; V622-F626 WeakPolarHBondContact O-CD2 3.34Å; V622-F626 PolarHBondContact O-N 3.14Å; W624-F626 PolarHBondContact O-N 3.27Å
627S55.6Low58Low67 Ų67106.7 Ų106.747%0.46959%0.594SS.*Hα-helixtrans-72.5-40176.5-59.70000112L623 W624 A625 Q629 R630L623-S627 WeakPolarHBondContact O-CB 3.26Å; L623-S627 PolarHBondContact O-N 3.31Å; L623-S627 PolarHBondContact O-OG 3.13Å; W624-S627 WeakPolarHBondContact O-CB 3.37Å; W624-S627 PolarHBondContact O-N 3.19Å; A625-S627 VanDerWaalsContact C-N 3.35Å; S627-Q629 VanDerWaalsContact C-N 3.34Å; S627-Q629 PolarHBondContact O-N 3.48Å; S627-R630 PolarHBondContact O-N 3.13Å
628T54.6Low58Low82 Ų82109 Ų10950%0.50360%0.602SS.*Hα-helixtrans-68.2-31.3178.955.40000112.7W624 A625 R630 G631W624-T628 HydrophobicContact CZ2-CG2 4.31Å; W624-T628 PolarHBondContact O-N 3.33Å; A625-T628 PolarHBondContact O-OG1 3.05Å; A625-T628 VanDerWaalsContact O-OG1 3.05Å; T628-R630 PolarHBondContact O-N 2.78Å; T628-R630 VanDerWaalsContact O-N 3.14Å; T628-G631 PolarHBondContact O-N 3.13Å
629Q54.1Low57.7Low162 Ų162109 Ų10976%0.75760%0.599SS**THydrogen-bonded Turntrans-62.6-15173.9-86.7-170.1-6.700114.7S627S627-Q629 VanDerWaalsContact C-N 3.34Å; S627-Q629 PolarHBondContact O-N 3.48Å
630R49.6Very low57.4Low234 Ų234106.3 Ų106.388%0.88359%0.59SS**THydrogen-bonded Turntrans-111.613.9-177.6-137.5177.5-167.5116.13115.2S627 T628 G632S627-R630 PolarHBondContact O-N 3.13Å; T628-R630 PolarHBondContact O-N 2.78Å; T628-R630 VanDerWaalsContact O-N 3.14Å; R630-G632 PolarHBondContact O-N 2.86Å
631G54.1Low57.4Low72 Ų72107.4 Ų107.474%0.74260%0.602SS**THydrogen-bonded Turntrans69.222.3165.200000116.4T628T628-G631 PolarHBondContact O-N 3.13Å
632G43.2Very low57.5Low64 Ų64109.4 Ų109.466%0.6661%0.609SS**  trans-85.9131.5175.300000112.6R630R630-G632 PolarHBondContact O-N 2.86Å
633T52.7Low57.5Low136 Ų136109.7 Ų109.783%0.83461%0.607SS**  trans-77.6136.1175.650.20000112.6
634D48.9Very low57.7Low138 Ų138113.8 Ų113.874%0.73862%0.615SS**  trans49.8112.5161.3-154.425.5000118.2V636D634-V636 PolarHBondContact O-N 3.2Å
635P51.6Low57.9Low85 Ų85108.3 Ų108.355%0.55261%0.606SS**  trans-7491.8-178.731-35.4000112.4Y637P635-Y637 PolarHBondContact O-N 2.91Å
636V52.7Low58Low122 Ų122109.9 Ų109.974%0.73961%0.613SS**  trans-54.8-12.9175.8178.60000114D634D634-V636 PolarHBondContact O-N 3.2Å
637Y55.9Low58.3Low200 Ų200106.9 Ų106.978%0.78461%0.608SS**SBendtrans-103.5112.9175.5-63-75.6000112P635 I639P635-Y637 PolarHBondContact O-N 2.91Å; Y637-I639 PolarHBondContact O-N 2.83Å
638N59.8Low59Low129 Ų129108.2 Ų108.269%0.6961%0.614SS**  trans-54.9108.3178.7-113.8-82.8000111.7G640 A641 L642N638-G640 PolarHBondContact O-N 3.09Å; N638-A641 HydrophobicContact CB-CB 3.87Å; N638-A641 WeakPolarHBondContact O-CA 3.41Å; N638-A641 WeakPolarHBondContact O-CB 3.23Å; N638-A641 PolarHBondContact O-N 2.94Å; N638-L642 PolarHBondContact O-N 3.31Å; N638-L642 VanDerWaalsContact O-N 3.09Å
639I60.4Low59.8Low75 Ų75108.7 Ų108.739%0.38562%0.616SS.*Hα-helixtrans-56.7-37.2177.5-60.3169.5000110.4P620 Y637 A641 L642 L643P620-I639 HydrophobicContact CB-CG2 4.43Å; Y637-I639 PolarHBondContact O-N 2.83Å; I639-A641 VanDerWaalsContact C-N 3.25Å; I639-A641 PolarHBondContact O-N 3.33Å; I639-L642 PolarHBondContact O-N 2.7Å; I639-L643 HydrophobicContact CG2-CD1 4.03Å; I639-L643 HydrophobicContact CG2-CG 4.41Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 WeakPolarHBondContact O-CG 3.3Å; I639-L643 PolarHBondContact O-N 2.79Å
640G60.3Low60.5Low34 Ų34102.8 Ų102.835%0.35160%0.595SS.*Hα-helixtrans-66.8-17.7174.100000115.2N638 R644N638-G640 PolarHBondContact O-N 3.09Å; G640-R644 VanDerWaalsContact O-CD 3.26Å; G640-R644 WeakPolarHBondContact O-CD 3.44Å; G640-R644 WeakPolarHBondContact O-CG 3.45Å; G640-R644 PolarHBondContact O-NE 2.69Å; G640-R644 VanDerWaalsContact O-NE 3.17Å
641A63.5Low61.3Low58 Ų5896.4 Ų96.448%0.47958%0.578SS.*Hα-helixtrans-87-41170.400000111.1N638 I639 L643 R644 G645N638-A641 HydrophobicContact CB-CB 3.87Å; N638-A641 WeakPolarHBondContact O-CA 3.41Å; N638-A641 WeakPolarHBondContact O-CB 3.23Å; N638-A641 PolarHBondContact O-N 2.94Å; I639-A641 VanDerWaalsContact C-N 3.25Å; I639-A641 PolarHBondContact O-N 3.33Å; A641-L643 VanDerWaalsContact C-N 3.35Å; A641-L643 PolarHBondContact O-N 3.5Å; A641-R644 PolarHBondContact O-N 3.36Å; A641-G645 PolarHBondContact O-N 2.89Å
642L63.3Low61.6Low130 Ų13097.3 Ų97.368%0.68156%0.563SS**Hα-helixtrans-60.9-43.2175.2-165.476.2000111.6N638 I639 G645 C646N638-L642 PolarHBondContact O-N 3.31Å; N638-L642 VanDerWaalsContact O-N 3.09Å; I639-L642 PolarHBondContact O-N 2.7Å; L642-G645 PolarHBondContact O-N 3.29Å; L642-C646 WeakPolarHBondContact O-CB 3.42Å; L642-C646 PolarHBondContact O-N 3.27Å
643L66.4Low62.4Low73 Ų7397.2 Ų97.238%0.38255%0.552SS.*Hα-helixtrans-62.3-45.1174.9-76169.7000112.2P620 I639 A641 G645 C646 C647P620-L643 HydrophobicContact CG-CD2 3.97Å; I639-L643 HydrophobicContact CG2-CD1 4.03Å; I639-L643 HydrophobicContact CG2-CG 4.41Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 WeakPolarHBondContact O-CG 3.3Å; I639-L643 PolarHBondContact O-N 2.79Å; A641-L643 VanDerWaalsContact C-N 3.35Å; A641-L643 PolarHBondContact O-N 3.5Å; L643-G645 VanDerWaalsContact C-N 3.33Å; L643-G645 PolarHBondContact O-N 2.92Å; L643-C646 PolarHBondContact O-N 3.49Å; L643-C647 WeakPolarHBondContact O-CB 3.45Å; L643-C647 PolarHBondContact O-N 2.89Å; L643-C647 PolarHBondContact O-SG 2.82Å
644R73.1Confident62.7Low190 Ų19096.1 Ų96.172%0.71754%0.541SS*.Hα-helixtrans-61.1-42.7174.9-72.1171.3-154.9-134.33.7111.4G640 A641 C647 V648G640-R644 VanDerWaalsContact O-CD 3.26Å; G640-R644 WeakPolarHBondContact O-CD 3.44Å; G640-R644 WeakPolarHBondContact O-CG 3.45Å; G640-R644 PolarHBondContact O-NE 2.69Å; G640-R644 VanDerWaalsContact O-NE 3.17Å; A641-R644 PolarHBondContact O-N 3.36Å; R644-C647 PolarHBondContact O-N 2.9Å; R644-V648 WeakPolarHBondContact O-CB 3.32Å; R644-V648 VanDerWaalsContact O-CG2 3.28Å; R644-V648 WeakPolarHBondContact O-CG2 3.47Å; R644-V648 PolarHBondContact O-N 2.82Å
645G70.8Confident63.2Low36 Ų3697.9 Ų97.937%0.37154%0.537SS..Hα-helixtrans-59.6-48.7174.400000112.4A641 L642 L643 C647 V648 V649A641-G645 PolarHBondContact O-N 2.89Å; L642-G645 PolarHBondContact O-N 3.29Å; L643-G645 VanDerWaalsContact C-N 3.33Å; L643-G645 PolarHBondContact O-N 2.92Å; G645-C647 PolarHBondContact O-N 3.44Å; G645-V648 PolarHBondContact O-N 2.93Å; G645-V649 WeakPolarHBondContact O-CG2 3.45Å; G645-V649 PolarHBondContact O-N 2.89Å
646C66.4Low63.2Low82 Ų82101.8 Ų101.855%0.55454%0.541SS*.Hα-helixtrans-59.4-47.6177.4-170.20000111.9L642 L643 V648 V649 A650L642-C646 WeakPolarHBondContact O-CB 3.42Å; L642-C646 PolarHBondContact O-N 3.27Å; L643-C646 PolarHBondContact O-N 3.49Å; C646-V648 PolarHBondContact O-N 3.28Å; C646-V649 PolarHBondContact O-N 3.39Å; C646-A650 WeakPolarHBondContact O-CB 3.49Å; C646-A650 PolarHBondContact O-N 2.9Å
647C66.6Low63Low75 Ų75100.5 Ų100.551%0.50753%0.533SS..Hα-helixtrans-61.8-41.3176.2-67.90000112.5L643 R644 G645 A650 L651L643-C647 WeakPolarHBondContact O-CB 3.45Å; L643-C647 PolarHBondContact O-N 2.89Å; L643-C647 PolarHBondContact O-SG 2.82Å; R644-C647 PolarHBondContact O-N 2.9Å; G645-C647 PolarHBondContact O-N 3.44Å; C647-A650 PolarHBondContact O-N 3.38Å; C647-L651 WeakPolarHBondContact O-CB 3.48Å; C647-L651 VanDerWaalsContact O-CG 3.23Å; C647-L651 WeakPolarHBondContact O-CG 3.27Å; C647-L651 PolarHBondContact O-N 2.83Å
648V71.1Confident62.6Low96 Ų9694.1 Ų94.158%0.58252%0.521SS*.Hα-helixtrans-66.3-41.1176.7168.50000111.5R644 G645 C646 L651 H652R644-V648 WeakPolarHBondContact O-CB 3.32Å; R644-V648 VanDerWaalsContact O-CG2 3.28Å; R644-V648 WeakPolarHBondContact O-CG2 3.47Å; R644-V648 PolarHBondContact O-N 2.82Å; G645-V648 PolarHBondContact O-N 2.93Å; C646-V648 PolarHBondContact O-N 3.28Å; V648-L651 PolarHBondContact O-N 3.29Å; V648-H652 VanDerWaalsContact O-CB 3.25Å; V648-H652 WeakPolarHBondContact O-CB 3.29Å; V648-H652 PolarHBondContact O-N 2.86Å
649V70.9Confident62.1Low91 Ų9196.7 Ų96.755%0.55253%0.527SS*.Hα-helixtrans-65.4-43.8175.4170.90000111.1G645 C646 H652 S653G645-V649 WeakPolarHBondContact O-CG2 3.45Å; G645-V649 PolarHBondContact O-N 2.89Å; C646-V649 PolarHBondContact O-N 3.39Å; V649-H652 PolarHBondContact O-N 2.91Å; V649-S653 PolarHBondContact O-N 3.21Å; V649-S653 PolarHBondContact O-OG 3.38Å
650A68.9Low61.3Low38 Ų38100.4 Ų100.431%0.31454%0.542SS..Hα-helixtrans-61.6-45.517600000112.1C646 C647 H652 S653 L654C646-A650 WeakPolarHBondContact O-CB 3.49Å; C646-A650 PolarHBondContact O-N 2.9Å; C647-A650 PolarHBondContact O-N 3.38Å; A650-H652 VanDerWaalsContact C-N 3.34Å; A650-H652 PolarHBondContact O-N 3.48Å; A650-S653 PolarHBondContact O-N 3.29Å; A650-L654 WeakPolarHBondContact O-CB 3.39Å; A650-L654 WeakPolarHBondContact O-CG 3.4Å; A650-L654 PolarHBondContact O-N 2.91Å
651L66.7Low60.4Low100 Ų100105.9 Ų105.952%0.52456%0.562SS.*Hα-helixtrans-64.4-35.9175.3-73168.8000112.6C647 V648 R655C647-L651 WeakPolarHBondContact O-CB 3.48Å; C647-L651 VanDerWaalsContact O-CG 3.23Å; C647-L651 WeakPolarHBondContact O-CG 3.27Å; C647-L651 PolarHBondContact O-N 2.83Å; V648-L651 PolarHBondContact O-N 3.29Å; L651-R655 WeakPolarHBondContact O-CB 3.25Å; L651-R655 VanDerWaalsContact O-CG 3.28Å; L651-R655 WeakPolarHBondContact O-CG 3.34Å; L651-R655 PolarHBondContact O-N 3.37Å
652H61.5Low59.3Low91 Ų91111.9 Ų111.942%0.42158%0.577SS.*Hα-helixtrans-69-39.6174.5172.6-112.4000111.9V648 V649 A650 R655 R656V648-H652 VanDerWaalsContact O-CB 3.25Å; V648-H652 WeakPolarHBondContact O-CB 3.29Å; V648-H652 PolarHBondContact O-N 2.86Å; V649-H652 PolarHBondContact O-N 2.91Å; A650-H652 VanDerWaalsContact C-N 3.34Å; A650-H652 PolarHBondContact O-N 3.48Å; H652-R655 PolarHBondContact O-N 2.75Å; H652-R656 PolarHBondContact CE1-NE 2.88Å; H652-R656 PolarHBondContact CE1-NH2 3.35Å; H652-R656 VanDerWaalsContact CE1-NH2 3.33Å; H652-R656 PolarHBondContact NE2-NE 3.29Å; H652-R656 PolarHBondContact NE2-NH2 2.77Å; H652-R656 WeakPolarHBondContact O-CG 3.48Å; H652-R656 PolarHBondContact O-N 3.3Å
653S58.8Low57.9Low62 Ų62115.3 Ų115.343%0.43460%0.604SS.*Hα-helixtrans-64.6-45.2173-66.80000112.2V649 A650 R655 R656 T657V649-S653 PolarHBondContact O-N 3.21Å; V649-S653 PolarHBondContact O-OG 3.38Å; A650-S653 PolarHBondContact O-N 3.29Å; S653-R655 VanDerWaalsContact C-N 3.29Å; S653-R655 PolarHBondContact O-N 2.98Å; S653-R656 PolarHBondContact O-N 3.18Å; S653-R656 VanDerWaalsContact O-N 3.09Å; S653-T657 PolarHBondContact O-N 2.92Å; S653-T657 PolarHBondContact O-OG1 2.97Å
654L58.7Low57.5Low114 Ų114117.5 Ų117.560%0.59762%0.615SS**Hα-helixtrans-59.3-37.8174-77.2163.3000112.5A650 T657 A658A650-L654 WeakPolarHBondContact O-CB 3.39Å; A650-L654 WeakPolarHBondContact O-CG 3.4Å; A650-L654 PolarHBondContact O-N 2.91Å; L654-T657 PolarHBondContact O-OG1 2.73Å; L654-T657 VanDerWaalsContact O-OG1 3.08Å; L654-A658 WeakPolarHBondContact O-CB 3.45Å; L654-A658 PolarHBondContact O-N 3.47Å
655R59.1Low56.7Low175 Ų175113.6 Ų113.666%0.6661%0.61SS**Hα-helixtrans-69.1-37.6173.3-74.5173.2179.6-171.2-0.7112.1L651 H652 S653 F659L651-R655 WeakPolarHBondContact O-CB 3.25Å; L651-R655 VanDerWaalsContact O-CG 3.28Å; L651-R655 WeakPolarHBondContact O-CG 3.34Å; L651-R655 PolarHBondContact O-N 3.37Å; H652-R655 PolarHBondContact O-N 2.75Å; S653-R655 VanDerWaalsContact C-N 3.29Å; S653-R655 PolarHBondContact O-N 2.98Å; R655-F659 WeakPolarHBondContact O-CD2 3.5Å; R655-F659 PolarHBondContact O-N 3.34Å
656R53Low55.9Low167 Ų167117.9 Ų117.963%0.6362%0.623SS**Hα-helixtrans-71-35.5176.8-74.2-167.6-174.4-145.92.6113.5H652 S653 F659 H660H652-R656 PolarHBondContact CE1-NE 2.88Å; H652-R656 PolarHBondContact CE1-NH2 3.35Å; H652-R656 VanDerWaalsContact CE1-NH2 3.33Å; H652-R656 PolarHBondContact NE2-NE 3.29Å; H652-R656 PolarHBondContact NE2-NH2 2.77Å; H652-R656 WeakPolarHBondContact O-CG 3.48Å; H652-R656 PolarHBondContact O-N 3.3Å; S653-R656 PolarHBondContact O-N 3.18Å; S653-R656 VanDerWaalsContact O-N 3.09Å; R656-F659 PolarHBondContact O-N 2.87Å; R656-H660 PolarHBondContact O-N 3.06Å
657T48.2Very low55.3Low95 Ų95120.1 Ų120.158%0.58363%0.627SS**Hα-helixtrans-68.2-36.7174.151.40000111.8S653 L654 F659 H660S653-T657 PolarHBondContact O-N 2.92Å; S653-T657 PolarHBondContact O-OG1 2.97Å; L654-T657 PolarHBondContact O-OG1 2.73Å; L654-T657 VanDerWaalsContact O-OG1 3.08Å; T657-F659 PolarHBondContact O-N 2.96Å; T657-H660 PolarHBondContact O-N 3.18Å; T657-H660 VanDerWaalsContact O-N 3.12Å
658A48Very low54.6Low65 Ų65122.9 Ų122.954%0.53764%0.635SS.*Hα-helixtrans-60.4-29.8172.900000113.6L654L654-A658 WeakPolarHBondContact O-CB 3.45Å; L654-A658 PolarHBondContact O-N 3.47Å
659F48.6Very low53.5Low183 Ų183124.7 Ų124.780%0.80364%0.638SS**THydrogen-bonded Turntrans-92.68.2176.1-70.7-60.4000114.9R655 R656 T657R655-F659 WeakPolarHBondContact O-CD2 3.5Å; R655-F659 PolarHBondContact O-N 3.34Å; R656-F659 PolarHBondContact O-N 2.87Å; T657-F659 PolarHBondContact O-N 2.96Å
660H44.2Very low52.3Low153 Ų153127.1 Ų127.171%0.70864%0.644SS**THydrogen-bonded Turntrans-114.717.5175.7-146.9-61.8000113.7R656 T657 K662R656-H660 PolarHBondContact O-N 3.06Å; T657-H660 PolarHBondContact O-N 3.18Å; T657-H660 VanDerWaalsContact O-N 3.12Å; H660-K662 PolarHBondContact O-N 3.06Å
661I41.5Very low51Low150 Ų150133.9 Ų133.977%0.76967%0.67SS**SBendtrans-71.6113.9159.5-62.4177.9000106.9
662K38.6Very low49.7Very low183 Ų183136.8 Ų136.880%0.79668%0.682SS**  trans-82.7135.6-163.8-164.4-179.5-179.2-174.90111.5H660H660-K662 PolarHBondContact O-N 3.06Å
663T35.8Very low48.6Very low203 Ų203140.9 Ų140.9100%1.24571%0.706SS**  trans-71.80161.555.20000111.1

Retrieved 663 of 663 residues in 186.3 ms (Link to these results)