A0A087YMW6_POEFO Loading...

Syntabulin (syntaxin-interacting)

AlphaFold DB , UniProt , Accession A0A087YMW6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 646 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M40.1Very low38.8Very low244 Ų244176.6 Ų176.6100%1.20286%0.858SS**  01360-78.4-63.2-84.300108.2
2G36Very low38.7Very low71 Ų71171 Ų17173%0.73285%0.85SS**  trans97.6145.2-171.700000112.6
3P54.3Low38.6Very low130 Ų130167.2 Ų167.284%0.84485%0.845SS**  -132.8176.7-120.539-23.2000116.8
4F41.8Very low38.7Very low190 Ų190168.4 Ų168.483%0.83385%0.846SS**  trans-58.6154.6167.1-80.3-112.3000113.2
5Q43.5Very low38.5Very low199 Ų199170.9 Ų170.993%0.9385%0.85SS**  trans-159144.5131.7-114.11625.300112.6
6E41.8Very low38.2Very low176 Ų176164.6 Ų164.682%0.82284%0.842SS**  trans-91.5161.9179.2-57.6158.4102.900111.6
7Y31.8Very low38Very low217 Ų217161.6 Ų161.685%0.85184%0.839SS**  -164.5134127.858.7-91.8000114.7
8E33.6Very low38.2Very low141 Ų141159.3 Ų159.366%0.65984%0.836SS**  trans43100.6139.3-71.1-86.1105.800120.4K10E8-K10 WeakPolarHBondContact OE2-CE 3.49Å
9E29Very low38.2Very low194 Ų194163.6 Ų163.691%0.90784%0.84SS**  trans-98.2123.1149.7-176.3174.9-163.300110.4K11E9-K11 PolarHBondContact O-N 3.29Å
10K34.7Very low38.1Very low169 Ų169161.2 Ų161.274%0.73584%0.838SS**  trans-89.3111.6-175.9-67-166174.6-171.90112.7E8E8-K10 WeakPolarHBondContact OE2-CE 3.49Å
11K40.8Very low38.6Very low212 Ų212164.7 Ų164.792%0.92284%0.84SS**  trans-54.8138.6170.8-66.8-179.2178.4178.20111.8E9E9-K11 PolarHBondContact O-N 3.29Å
12S36.7Very low39Very low109 Ų109160.4 Ų160.476%0.76282%0.821SS**  trans-138.8149.7159.762.50000109.6
13P38.2Very low39.1Very low122 Ų122162.3 Ų162.379%0.79282%0.82SS**  trans-85.4129.2-158.631-35.2000114.9
14E39.6Very low38.5Very low183 Ų183167.4 Ų167.486%0.85582%0.822SS**  trans5.7121.7141.7-171.1171.9-160.500118.3
15K36.3Very low38.2Very low207 Ų207166.5 Ų166.590%0.983%0.825SS**  trans-132.5123.6152-84.7-174.6174.8174.60109.6
16G32.6Very low38Very low70 Ų70162.3 Ų162.372%0.72281%0.813SS**  trans-66.1150.7-170.500000115
17S36.4Very low37.8Very low114 Ų114162 Ų16280%0.79782%0.816SS**  trans-76.1128.9177.7-176.90000111.9R19S17-R19 PolarHBondContact O-N 3.01Å
18P40.6Very low38Very low120 Ų120159 Ų15978%0.77981%0.81SS**  trans-73.4113.3176.129.4-32.7000110.9
19R37.9Very low38.3Very low241 Ų241158.1 Ų158.191%0.90982%0.816SS**  trans-59140.8175.4-80178.2166.6159.5-5.3111.8S17S17-R19 PolarHBondContact O-N 3.01Å
20S37Very low38.3Very low114 Ų114158.8 Ų158.880%0.79782%0.817SS**  trans-53140.4175.5-178.90000112.8
21R48.1Very low38.3Very low235 Ų235162.1 Ų162.189%0.88782%0.824SS**  trans-120127.3162.4-79.7-173.8173.4-178.3-1.6109
22I47.6Very low37.9Very low155 Ų155160 Ų16080%0.79582%0.823SS**PPolyproline II helixtrans-67.1131.1173.1-59.2169.8000108.6R24I22-R24 PolarHBondContact O-N 3.24Å
23P39.3Very low37.5Very low111 Ų111163.8 Ų163.872%0.72183%0.825SS**PPolyproline II helixtrans-66.5128.9173.3-18.431.7000111.1
24R41.8Very low37.1Very low236 Ų236165.1 Ų165.189%0.89183%0.825SS**PPolyproline II helixtrans-79.5125.9162.2-75.7-176.6168.8129.5-4.4108.5I22 V26I22-R24 PolarHBondContact O-N 3.24Å; R24-V26 PolarHBondContact O-N 3.46Å
25L35.3Very low36.7Very low171 Ų171165.6 Ų165.690%0.89583%0.825SS**PPolyproline II helixtrans-75.1119.4170.6-69.5172.4000108.9
26V38.8Very low36.3Very low112 Ų112159.6 Ų159.668%0.67982%0.821SS**  trans-97.1111.5172177.80000107.9R24 H28R24-V26 PolarHBondContact O-N 3.46Å; V26-H28 PolarHBondContact O-N 3.27Å
27L37.7Very low36.2Very low170 Ų170161.4 Ų161.489%0.8982%0.823SS**  trans-77.7106.9172.5-82.9162.5000109.6
28H36.5Very low36.3Very low153 Ų153161.8 Ų161.871%0.70882%0.823SS**PPolyproline II helixtrans-80.8129.9169.3-83-74.8000110.6V26 F30V26-H28 PolarHBondContact O-N 3.27Å; H28-F30 PolarHBondContact O-N 3.07Å
29P40Very low35.7Very low123 Ų123163.7 Ų163.780%0.79983%0.826SS**PPolyproline II helixtrans-63.2122.4169.5-22.133.8000111.2R31P29-R31 PolarHBondContact O-N 2.97Å
30F29.5Very low35.3Very low208 Ų208157.9 Ų157.991%0.91282%0.822SS**PPolyproline II helixtrans-70.9119.7170.5-85.3-100.4000109.8H28H28-F30 PolarHBondContact O-N 3.07Å
31R32.7Very low34.9Very low238 Ų238159.6 Ų159.690%0.89882%0.822SS**PPolyproline II helixtrans-78.2120.5159.1-84-164173.5-131.2-1.1109.2P29P29-R31 PolarHBondContact O-N 2.97Å
32L32.5Very low33.9Very low169 Ų169153.6 Ų153.689%0.88582%0.816SS**PPolyproline II helixtrans-59.9143.5161.3-140.674.3000108.7
33K28.5Very low32.9Very low188 Ų188154.4 Ų154.482%0.81782%0.821SS**  trans-133.2108.3-178.2-176.6173.3-177.8173.80109.9
34D30.5Very low32.2Very low149 Ų149157 Ų15780%0.79783%0.828SS**  trans-58.2145.6-179.2-67.9-61.4000113.1
35K31.9Very low31.5Very low194 Ų194151.5 Ų151.584%0.84383%0.826SS**  trans-10864.3-175.1-77.9-76.6-170.9165.30111
36G26.7Very low31.6Very low80 Ų80152 Ų15283%0.82582%0.824SS**  trans-65.2129.7161.700000110.5
37S30Very low31.3Very low108 Ų108156.2 Ų156.276%0.75584%0.836SS**  trans-126.8155.6173.8-69.20000109.5
38P38.7Very low31.2Very low122 Ų122156.1 Ų156.179%0.79283%0.831SS**  trans-92.9156.1-152.535-37.2000116.7
39L29.4Very low30.9Very low161 Ų161152 Ų15284%0.84383%0.83SS**  trans1.7142.5153.3-68.2161.3000120.6
40S28.4Very low30.6Very low119 Ų119154.2 Ų154.283%0.83283%0.827SS**  trans-150.1157.7148.9-70.80000109.1
41D28.4Very low30.6Very low149 Ų149152 Ų15280%0.79782%0.819SS**  trans-93.7153.6-152.2-71.8-70.9000118.3
42S27Very low30.4Very low110 Ų110145.7 Ų145.777%0.76981%0.81SS**  trans57.2122.3143.6-63.60000121.8
43L26.8Very low30.3Very low172 Ų172144 Ų14490%0.90180%0.802SS**  -159.1169.2116-109.3166.2000112.1
44L25Very low30.5Very low165 Ų165142.5 Ų142.586%0.86480%0.801SS**  trans-97.5146.1-166.9-61.7158.8000112.9
45S28.1Very low30.6Very low120 Ų120140.2 Ų140.284%0.83980%0.797SS**  trans-170.8159.6130.9-160.30000111.9
46E37Very low30.6Very low182 Ų182134.9 Ų134.985%0.8578%0.784SS**  trans-95.5151.6171.7-60.3152.610300110.9
47E32.7Very low30.8Very low201 Ų201137.6 Ų137.694%0.93978%0.78SS**  -171.5179.9122.5-130.9-168.2123.600112.7
48E34.8Very low30.9Very low168 Ų168139.3 Ų139.379%0.78578%0.776SS**  trans-129.1143.8-166.9-175.5-170.1135.100113.5
49G30.3Very low30.5Very low66 Ų66138.9 Ų138.968%0.6878%0.776SS**  trans88.3-178.9166.700000116
50K34Very low30.7Very low169 Ų169140.3 Ų140.374%0.73578%0.775SS**  cis-166.8144.6-18.6-119.1174.1-172.8166.10109.5
51E29.3Very low31.1Very low162 Ų162145.9 Ų145.976%0.75778%0.778SS**  trans45.7141.5155.6-75.7170.9112.800123.1
52C29Very low31.4Very low105 Ų105144.6 Ų144.671%0.70978%0.776SS**  trans68.6156.3144.7-71.80000119.5
53D29.7Very low31.8Very low134 Ų134147.7 Ų147.772%0.71778%0.782SS**  cis-154.3-172.5-15.5-133.9-52.1000113
54I33Very low32Very low156 Ų156143.8 Ų143.880%0.877%0.769SS**  trans-65.3150.1177.2-64.5156.1000114.4
55S32.7Very low32.4Very low102 Ų102141.5 Ų141.571%0.71376%0.762SS**  trans143.8126.3141.8-156.70000111.5
56S32.2Very low32.6Very low81 Ų81143.6 Ų143.657%0.56676%0.764SS**  50.1126.2103.6-143.80000114.6H58S56-H58 PolarHBondContact OG-CE1 3.26Å; S56-H58 PolarHBondContact OG-ND1 3.27Å
57D29.9Very low32.4Very low138 Ų138140.1 Ų140.174%0.73876%0.76SS**  -157.8-170.870.9-120.230.8000115.8
58H32.2Very low32.5Very low143 Ų143139.9 Ų139.966%0.66276%0.756SS**  trans-146.4123.1-152.736.8-96.4000115.9S56S56-H58 PolarHBondContact OG-CE1 3.26Å; S56-H58 PolarHBondContact OG-ND1 3.27Å
59S30.8Very low32.6Very low114 Ų114138 Ų13880%0.79776%0.76SS**  trans-165.7136.2164.5-169.10000110.2
60K34.2Very low33Very low191 Ų191139.6 Ų139.683%0.8376%0.76SS**  cis86.587.222.7-66-169.5175.5176.60118.1
61R36.1Very low33Very low235 Ų235139.1 Ų139.189%0.88777%0.766SS**  trans149.2130.9137-83.2180-176.7166.75.1110.5
62T34.9Very low33.1Very low122 Ų122138.2 Ų138.275%0.74877%0.767SS**  cis107.497.827.359.30000113.7
63I35.9Very low33.6Very low175 Ų175139.4 Ų139.490%0.89777%0.771SS**  trans-157.8146.9164.8-48.9179.6000107.5
64S30.4Very low33.9Very low91 Ų91136.6 Ų136.664%0.63677%0.774SS**  cis-162.7139.5-42.3-165.90000111.3
65T32.5Very low34.4Very low117 Ų117134.6 Ų134.672%0.71877%0.772SS**  trans33.3109.2148.455.50000122.6
66N32.1Very low34.7Very low164 Ų164136 Ų13688%0.87778%0.779SS**  175.2151.2128.1-94.4-16.2000109.6
67S34.3Very low34.7Very low109 Ų109137.7 Ų137.776%0.76279%0.786SS**  cis-153.7173.7-5.3500000110.8
68F35.2Very low35Very low195 Ų195135.7 Ų135.786%0.85578%0.783SS**  trans-63.2148.2-175.2-87.5-116.6000116.2
69C35.1Very low35Very low130 Ų130137.8 Ų137.888%0.87879%0.793SS**  -170.8169.2115.3-99.80000111.6
70S39.8Very low35.2Very low98 Ų98137.8 Ų137.869%0.68579%0.793SS**  trans-131.8170.1-171.1-55.10000112.6
71D33.4Very low35Very low159 Ų159134.3 Ų134.385%0.8579%0.787SS**  trans63.1157.3175.7-64.3-34000115.7
72D31.9Very low34.8Very low144 Ų144128.5 Ų128.577%0.7778%0.783SS**  cis-140.9173.821.1-164.3-1.4000112.6
73T40.3Very low35.6Very low129 Ų129128.1 Ų128.179%0.79178%0.782SS**  trans-88.2158.1-178.559.90000113.7
74G35.4Very low35.4Very low76 Ų76124.8 Ų124.878%0.78478%0.775SS**  trans-168.386.118000000114.9
75C42.7Very low35.5Very low114 Ų114129.3 Ų129.377%0.7778%0.783SS**  trans-80.2154.4169.6-600000111.8
76P40Very low35.7Very low132 Ų132129.6 Ų129.686%0.85779%0.785SS**  trans-104.9101.2148.533-25.1000109.9
77T32.2Very low36.1Very low116 Ų116128 Ų12871%0.71278%0.783SS**  trans-101.3116176-60.60000110.9
78S36.3Very low35.9Very low95 Ų95128.9 Ų128.966%0.66479%0.789SS**  trans38.3137.7148.5-51.20000121.2
79Q32.4Very low35.8Very low188 Ų188122.6 Ų122.688%0.87978%0.779SS**  -150.5110.8123.4-122.4164.88500113.9V81Q79-V81 HydrophobicContact CG-CG2 4.18Å
80S33.6Very low35.5Very low113 Ų113122.1 Ų122.179%0.7978%0.777SS**  trans-108.3121.7163.652.70000108.2
81V30.8Very low35.1Very low119 Ų119123.9 Ų123.972%0.72178%0.775SS**  trans-139132.7177-174.50000112Q79Q79-V81 HydrophobicContact CG-CG2 4.18Å
82S31.8Very low34.9Very low113 Ų113126.7 Ų126.779%0.7977%0.774SS**  trans-160.5154.7161.1-77.30000107.5
83P51.9Low34.9Very low113 Ų113125.1 Ų125.173%0.73477%0.774SS**  cis-135.6-172.7-29.938.8-22.3000113.2
84S30.4Very low34.5Very low106 Ų106123.4 Ų123.474%0.74177%0.773SS**  trans96151.1147.285.70000122.7
85K32.9Very low34.3Very low185 Ų185128.6 Ų128.680%0.80478%0.776SS**  trans74.395.3158.4-70.8-178.5177.5178.30122
86T36.3Very low33.6Very low124 Ų124127.6 Ų127.676%0.76178%0.776SS**  32.2135.8117.758.60000121.8
87P41.4Very low33.4Very low130 Ų130127.2 Ų127.284%0.84478%0.776SS**  trans-100.6156.8139.636.2-30.4000113.1
88S30.9Very low34Very low128 Ų128126.9 Ų126.990%0.89578%0.776SS**  trans-130.9150.3163.3179.50000106.1
89G31.7Very low33.6Very low62 Ų62128.8 Ų128.864%0.63978%0.784SS**  cis179.6-161.42.200000108
90S28.5Very low33.7Very low120 Ų120127.5 Ų127.584%0.83978%0.78SS**  trans68.5144.3171.7-930000116.5
91E31.3Very low34.1Very low136 Ų136127.6 Ų127.664%0.63678%0.778SS**  cis-146.3172.1-3.4-53.6-164.7159.500112.9
92R31.1Very low34Very low218 Ų218127 Ų12782%0.82377%0.768SS**  trans75.3106.7150.8-73163.9-150.8-87.3-12.3121.9
93S31.3Very low34.1Very low111 Ų111132.2 Ų132.278%0.77677%0.77SS**  trans-27.1142.5148.7-179.30000118.6
94A31.6Very low33.4Very low93 Ų93134 Ų13477%0.76977%0.766SS**  -159.5158.7125.600000112.1
95H31.8Very low33.5Very low185 Ų185133.7 Ų133.786%0.85677%0.77SS**  trans-76.9146.1175.3-57-109.7000112.2
96A26.5Very low33.6Very low93 Ų93135 Ų13577%0.76978%0.776SS**  167.5136120.300000113.6
97S36.2Very low33.6Very low123 Ų123134 Ų13486%0.8678%0.78SS**  trans-107.4140.5147.4-61.90000107.2
98P45.4Very low33.6Very low110 Ų110136.4 Ų136.471%0.71478%0.777SS**  -150.8138118.733.4-14.8000116.8
99T27Very low33.9Very low135 Ų135140 Ų14083%0.82877%0.771SS**  65.5122122.8-48.10000122.5
100M34.3Very low33.8Very low161 Ų161143.4 Ų143.479%0.79378%0.779SS**  trans-47159.1157.1-72.6-79.7-81.400113.6
101P42.1Very low34.1Very low115 Ų115147.9 Ų147.975%0.74778%0.778SS**  -161.7167.158.343.8-21.2000121.7
102E30.4Very low34.1Very low107 Ų107147.2 Ų147.250%0.578%0.782SS.*  trans23.6126.1137.5-162.8-149.3-131.200122.2K104E102-K104 WeakPolarHBondContact OE1-CE 3.43Å; E102-K104 IonicContact OE1-NZ 2.69Å; E102-K104 PolarHBondContact OE1-NZ 2.97Å; E102-K104 WeakPolarHBondContact OE2-CE 3.46Å; E102-K104 IonicContact OE2-NZ 3.82Å; E102-K104 PolarHBondContact OE2-NZ 3.19Å
103R34.1Very low34.2Very low222 Ų222142.6 Ų142.684%0.83878%0.778SS**  trans168.3158.6130.5-91.3146.6-164.6-150.46.9112.9
104K35.5Very low34.4Very low149 Ų149140.9 Ų140.965%0.64877%0.771SS**  cis-176115.9-39.7-116.9172.4-170.91530111E102E102-K104 WeakPolarHBondContact OE1-CE 3.43Å; E102-K104 IonicContact OE1-NZ 2.69Å; E102-K104 PolarHBondContact OE1-NZ 2.97Å; E102-K104 WeakPolarHBondContact OE2-CE 3.46Å; E102-K104 IonicContact OE2-NZ 3.82Å; E102-K104 PolarHBondContact OE2-NZ 3.19Å
105A33.5Very low34.4Very low101 Ų101144.8 Ų144.884%0.83577%0.773SS**  trans-173.5162.2161.400000113
106K34.1Very low34.4Very low211 Ų211141 Ų14192%0.91777%0.768SS**  -176.484.3-50.9-116.7-174.8177.7179.50111.5
107A37.4Very low34.5Very low103 Ų103140.3 Ų140.385%0.85177%0.769SS**  trans-166.3116.6161.400000108.2
108K41.3Very low34.2Very low181 Ų181138.1 Ų138.179%0.78777%0.766SS**  cis102.274.231.6-161.3-171.1173.3-172.40114.5
109R37.3Very low33.5Very low205 Ų205142.1 Ų142.177%0.77478%0.775SS**  82.4127.5125.7-172.2-167.6-63.9-165.4-2.7120.1
110V29.2Very low33.7Very low133 Ų133139.2 Ų139.281%0.80677%0.765SS**  trans161.6105.4137.51540000103.9
111R33.7Very low33.6Very low214 Ų214143.5 Ų143.581%0.80877%0.772SS**  cis64.7109.649.7-145.4-174.3-160.8-175.27111.6
112V32.4Very low33.1Very low121 Ų121142 Ų14273%0.73378%0.778SS**  -167.7123.984.9151.20000105.8
113V33.9Very low33.3Very low122 Ų122141.6 Ų141.674%0.73979%0.792SS**  62.3133.488167.90000111.7
114A35Very low34.2Very low74 Ų74136.3 Ų136.361%0.61279%0.787SS**  cis-142-170.219.400000111.3
115E30.6Very low34Very low176 Ų176140.5 Ų140.582%0.82280%0.799SS**  cis-155.5-161.1-1.8-149.3130-129.700111.5
116S32.7Very low34Very low106 Ų106143.5 Ų143.574%0.74180%0.795SS**  trans-46158174.853.90000116.1
117G28.8Very low33.9Very low77 Ų77141.6 Ų141.679%0.79479%0.787SS**  cis97.2131.321.100000111.3
118G29.9Very low33.8Very low78 Ų78146 Ų14680%0.80478%0.782SS**  trans12484.7176.900000116.1
119E29.6Very low33.5Very low193 Ų193143.7 Ų143.790%0.90277%0.773SS**  29.5155.9129.1-143.6168.6135.100124.6
120A31.3Very low33.2Very low74 Ų74139.9 Ų139.961%0.61277%0.766SS**  trans81.1112.4150.900000121.4
121R32.7Very low33.7Very low252 Ų252143.8 Ų143.895%0.95177%0.766SS**  trans47.9124.6131.1-57.7-179.9-176-96.62.1119.9
122G32.1Very low33.5Very low83 Ų83139.2 Ų139.286%0.85677%0.767SS**  trans177.5112.6157.100000113.1
123A33.5Very low33.6Very low98 Ų98138 Ų13881%0.8177%0.769SS**  trans-106-164.3173.900000110.4
124P54.3Low33.6Very low112 Ų112138.8 Ų138.873%0.72777%0.769SS**  -118.3164.5-93.737.8-25.6000113.3
125R31.7Very low33.7Very low237 Ų237145.9 Ų145.989%0.89478%0.78SS**  trans-162118.4157.7-106.4136.6-163.4-138.43.1116.9
126H31.9Very low34.1Very low163 Ų163141.4 Ų141.476%0.75577%0.773SS**  45.2127.6128.1-86.3-56.1000124.9
127K32.8Very low34.3Very low172 Ų172148.5 Ų148.575%0.74878%0.783SS**  trans64.3104.7131.4-86.5-178172.2178.70120.8
128R36.1Very low34.3Very low196 Ų196148.2 Ų148.274%0.7478%0.781SS**  73124.1101.3180-171.9-101.3-1219.1120
129E33.5Very low34.7Very low131 Ų131149.7 Ų149.761%0.61278%0.778SS**  trans71.4148.2156.5-70.7174.8114.400116.7
130M31.4Very low34.7Very low126 Ų126149.4 Ų149.462%0.62178%0.777SS**  cis-152.9165.10.6-109.5-92.8-179.900113.2
131R40.2Very low35Very low215 Ų215150.3 Ų150.381%0.81179%0.785SS**  trans-15.5153.3170.5-66.5172.8174.5120.5-6.1122.8
132S30.2Very low35Very low117 Ų117144.7 Ų144.782%0.81877%0.774SS**  trans-136129.2150-75.50000107.7
133A33.2Very low35.2Very low95 Ų95151.1 Ų151.179%0.78578%0.778SS**  77.3135.175.200000113.1
134L33.7Very low35.2Very low139 Ų139151.1 Ų151.173%0.72877%0.772SS**  cis-172.8140.2-3.1173.566.2000112.5
135R36.7Very low34.4Very low223 Ų223151.5 Ų151.584%0.84278%0.778SS**  trans66.7156.9161-75.2167.5-165.9-93.3-0.9119.1
136A39.2Very low34.6Very low82 Ų82145.4 Ų145.468%0.67877%0.771SS**  cis-167.2150.2-19.200000115.2
137R36.8Very low34.6Very low255 Ų255143.7 Ų143.796%0.96278%0.778SS**  trans49.8119134.8-169.8-172.1-167.11775.2120.6
138G29.9Very low34.9Very low72 Ų72140.9 Ų140.974%0.74278%0.78SS**  trans160.2146.3158.900000111.1
139S37.7Very low34.9Very low108 Ų108138.1 Ų138.176%0.75579%0.785SS**  trans-133174.3-176.5-56.70000111.3
140E30.6Very low34.8Very low187 Ų187135.3 Ų135.387%0.87479%0.792SS**  trans84.2154156.8-61.8163.1-127.700118.3
141A36.3Very low34.8Very low94 Ų94134.4 Ų134.478%0.77780%0.797SS**  trans66.4154.5-179.700000119
142D32.5Very low34.7Very low133 Ų133130.8 Ų130.871%0.71179%0.793SS**  -173.4142.7-50.5-114.8-42.4000109.6
143F37.1Very low34.8Very low218 Ų218133.6 Ų133.696%0.95679%0.791SS**  trans-154.1124158.1-90.4-67.9000110.8
144S33.3Very low34.9Very low98 Ų98134.2 Ų134.269%0.68579%0.785SS**  trans-114.3135.5-176.1-76.50000113.2
145S37.2Very low34.9Very low121 Ų121135.8 Ų135.885%0.84679%0.786SS**  trans-17298.6147.3-80.20000107.5
146S36.5Very low34.7Very low108 Ų108130.2 Ų130.276%0.75577%0.773SS**  75.5108.264.3-650000114.8
147S31.4Very low34.4Very low127 Ų127132.7 Ų132.789%0.88877%0.773SS**  trans-149.1137144.1-76.70000107.5
148S38.8Very low34.1Very low113 Ų113128 Ų12879%0.7977%0.766SS**  trans-91.3173.9-167.7-46.60000111.7
149T36.7Very low34.2Very low138 Ų138129.4 Ų129.485%0.84777%0.765SS**  -161.5147.553.750.90000114.4
150G31.2Very low33.8Very low73 Ų73129.5 Ų129.575%0.75377%0.766SS**  trans73.9114.8161.700000115.6
151S32.7Very low33.7Very low106 Ų106126 Ų12674%0.74176%0.762SS**  cis60.9125.443.3-1460000111.7
152L36.5Very low33.7Very low139 Ų139126.8 Ų126.873%0.72876%0.762SS**  cis-147.2140.649-72.6154.6000114.5
153K33.3Very low33.7Very low176 Ų176127.6 Ų127.677%0.76577%0.771SS**  50.6149.8129.5-62.1-166.7175.8-179.70121.9
154T35.6Very low33.5Very low108 Ų108120.1 Ų120.166%0.66376%0.756SS**  cis-174.3152.6-10.725.70000110.3
155K33.9Very low33.8Very low173 Ų173125.8 Ų125.875%0.75277%0.768SS**  trans65164.1143.9-74.5-168.9164.1-91.40119
156D32.3Very low33.8Very low106 Ų106129.6 Ų129.657%0.56777%0.769SS**  cis-165.5153-32.9-106.2-7.8000110.2
157I32.1Very low33.5Very low133 Ų133130.8 Ų130.868%0.68277%0.772SS**  trans58.1106.1139.4-59.8168000121
158L31.1Very low33.6Very low156 Ų156130.1 Ų130.182%0.81777%0.767SS**  50.7156.4125.4-49.4178.7000124.9
159S31.1Very low33.2Very low103 Ų103128.7 Ų128.772%0.7276%0.757SS**  trans9281.9143.6-61.10000122.7
160S30.2Very low33Very low110 Ų110133.3 Ų133.377%0.76976%0.759SS**  42.6116.3119.564.10000123.1
161S28.8Very low32.9Very low113 Ų113135.6 Ų135.679%0.7976%0.762SS**  -179.2149.3125.644.40000110
162S35.3Very low32.9Very low110 Ų110142.2 Ų142.277%0.76977%0.77SS**  cis118.978.2-2.9790000116.5
163V33.8Very low32.6Very low151 Ų151142.6 Ų142.692%0.91577%0.773SS**  trans-144.8137155.6-173.10000107.9
164G33Very low32.8Very low61 Ų61140.2 Ų140.263%0.62978%0.776SS**  cis151.5103.8-10.200000113.8
165K39.2Very low32.9Very low216 Ų216144.2 Ų144.294%0.93979%0.787SS**  trans-167.3150158.3-102.2146-172.5178.20110.4
166K35.8Very low33Very low202 Ų202143.6 Ų143.688%0.87879%0.79SS**  trans-106.7173.8-176.1-55175.8180175.70109.3
167V30.8Very low33Very low133 Ų133150.2 Ų150.281%0.80681%0.807SS**  cis-151152.125.9-179.90000111.5
168S33.1Very low33Very low112 Ų112150.1 Ų150.178%0.78381%0.813SS**  trans-10.3160.7155-127.30000121.2
169S30.6Very low33.2Very low83 Ų83150.6 Ų150.658%0.5882%0.816SS**  cis-163.2160.221.276.80000117.9
170R32.7Very low33.8Very low236 Ų236151.3 Ų151.389%0.89182%0.818SS**  trans90150.7145.7-130.1174.3-66.2-140.12.6119.7
171C28.5Very low33.8Very low120 Ų120153 Ų15381%0.81182%0.823SS**  trans-115.9164.9-152.2-22.50000114.8
172R33.3Very low34Very low245 Ų245156.9 Ų156.993%0.92583%0.826SS**  trans-159.4155.2134-84.8-147.7176.7-178.5-1.3111.8
173D29.7Very low33.8Very low147 Ų147161.1 Ų161.179%0.78683%0.831SS**PPolyproline II helixtrans-82.9158.1-179-46.5-87000114.4
174P38.2Very low34.5Very low126 Ų126159.6 Ų159.682%0.81882%0.824SS**PPolyproline II helixtrans-94.5120.7159.734-27000111.6
175Q36.7Very low34.2Very low192 Ų192162 Ų16290%0.89784%0.837SS**PPolyproline II helixtrans-99.7149.5170.7-77.4-170-15.200112.6
176I37Very low33.7Very low160 Ų160155.5 Ų155.582%0.82183%0.832SS**PPolyproline II helixtrans-79.4141.7-177.2-59.2161.9000111.1
177R33.1Very low33.6Very low246 Ų246152.4 Ų152.493%0.92883%0.83SS**  trans-151.8163.1154.1-117.9172.9-164-173.84.5114.1
178T32.1Very low34Very low131 Ų131151.7 Ų151.780%0.80483%0.828SS**  trans-110.3166.8-160.141.80000114.5
179L35.2Very low33.9Very low166 Ų166151.3 Ų151.387%0.86983%0.825SS**  trans-72.9149.3178.2-63.5167000113.2
180P41.9Very low34Very low117 Ų117154 Ų15476%0.7683%0.832SS**  trans-92.5169.3171.437-34.4000113.7
181V30.8Very low33.8Very low145 Ų145152.5 Ų152.588%0.87983%0.832SS**  trans-110.6146.8-177.3173.70000110.9
182F33.1Very low34.1Very low195 Ų195152.8 Ų152.886%0.85582%0.821SS**  trans-96.5144178.5-90.2-84.2000114.4
183K31.5Very low34Very low200 Ų200147.6 Ų147.687%0.8781%0.812SS**  trans-147.7165.8156.6-97-160.8173.7-172.90109.6
184P47.3Very low34.1Very low119 Ų119145.4 Ų145.477%0.77381%0.808SS**  trans-116.9-175.5-141.443.5-37.8000117.3
185A28.1Very low34Very low110 Ų110147.9 Ų147.991%0.90981%0.809SS**  trans96.1139.2160.500000118.8
186G27.9Very low34Very low80 Ų80146.1 Ų146.183%0.82580%0.804SS**  trans148.3128.8176.300000113
187V34.4Very low33.7Very low138 Ų138149.3 Ų149.384%0.83681%0.808SS**  trans-112164.5178.7-147.50000110
188P39.8Very low33.7Very low118 Ų118141.3 Ų141.377%0.76679%0.794SS**  -146.9153.9113.136.9-21.4000117.8
189S29.4Very low34Very low103 Ų103140.4 Ų140.472%0.7279%0.791SS**  trans0.6122.6161.458.80000123
190L33.1Very low34.4Very low140 Ų140143.6 Ų143.673%0.73379%0.793SS**  13.5139.4119.7-79.1159.3000120.3
191K27.7Very low34Very low205 Ų205149.8 Ų149.889%0.89180%0.801SS**  trans-142.5126132-142.3-168.5-175.8-162.60112.4
192H34.8Very low34.5Very low125 Ų125148.6 Ų148.658%0.57979%0.794SS**  trans-58.5162173.8-59.5-88000113.6
193D31.7Very low35.1Very low137 Ų137145.3 Ų145.373%0.73379%0.793SS**  cis-164.6-161-20.1-93-20.3000105.4
194S32.8Very low35.6Very low100 Ų100141.7 Ų141.770%0.69979%0.79SS**  cis-162.3-170.812.9-160.90000111.4
195E34.7Very low34.8Very low179 Ų179147.4 Ų147.484%0.83680%0.796SS**  trans65.9156.3166.9-66.9177.5-148.100119
196L38.6Very low35.1Very low154 Ų154146.7 Ų146.781%0.80679%0.79SS**  -163.4122.1-65.4-112.1171.5000109.5
197Y29.7Very low35.2Very low227 Ų227147.7 Ų147.789%0.8979%0.79SS**  trans66.7173.6155.1-152.9-112.4000120.3
198A33.9Very low35.1Very low78 Ų78146.5 Ų146.565%0.64579%0.788SS**  trans75.9153.3174.900000117.8
199P38.5Very low34.6Very low112 Ų112146.5 Ų146.573%0.72779%0.791SS**  trans-125.4170.4-136.136.4-20.2000117.5
200Y42.3Very low35Very low234 Ų234147.9 Ų147.992%0.91880%0.795SS**  trans23.793.2164.3-77.1-80.6000117.9
201R34.3Very low35.1Very low246 Ų246149.1 Ų149.193%0.92880%0.802SS**  trans-136.7154.7156.5-110.5-174.4-177.1-173.63.4113.1
202T40.9Very low35.2Very low120 Ų120145.2 Ų145.274%0.73680%0.8SS**  trans-55.3141.8-177.849.10000114.3
203P46Very low35.6Very low127 Ų127144.3 Ų144.383%0.82581%0.808SS**  trans-65.1134.2177-21.333000114
204P41.1Very low35.7Very low124 Ų124142.6 Ų142.681%0.80581%0.807SS**  trans-88.4112.3174.932.6-31.9000113A206P204-A206 PolarHBondContact O-N 2.95Å
205R30.7Very low35.8Very low238 Ų238142.9 Ų142.990%0.89881%0.808SS**  trans13.1101.5142.3-172.1-175.8-171.2-177.83.4117.3
206A34.3Very low36Very low96 Ų96140.9 Ų140.979%0.79380%0.803SS**PPolyproline II helixtrans-68.5154.3156.300000111.2P204P204-A206 PolarHBondContact O-N 2.95Å
207A31.6Very low35.8Very low100 Ų100139.2 Ų139.283%0.82680%0.803SS**PPolyproline II helixtrans-82150-175.500000113.3
208S31.1Very low36.3Very low114 Ų114133 Ų13380%0.79779%0.793SS**PPolyproline II helixtrans-73.6141-178.6-520000113.3
209S29.9Very low36.9Very low117 Ų117135.5 Ų135.582%0.81880%0.803SS**PPolyproline II helixtrans-99.3152.5137.758.10000109.2
210T37.1Very low37Very low132 Ų132134.8 Ų134.881%0.8180%0.797SS**PPolyproline II helixtrans-78133.4-166.2490000113.7
211L35.6Very low37.3Very low167 Ų167129.3 Ų129.387%0.87479%0.793SS**  trans17997.8137.4-99.8158.5000112.8
212S30.6Very low37.9Very low123 Ų123127.9 Ų127.986%0.8679%0.787SS**  trans168.8156137.746.40000112.2
213S42.4Very low38.1Very low106 Ų106133.3 Ų133.374%0.74179%0.794SS**  trans-82123.4-17950.50000112.7
214S34.2Very low38.3Very low101 Ų101133.7 Ų133.771%0.70679%0.794SS**  trans-86.1120.4169.7-168.30000111.6N216S214-N216 PolarHBondContact O-N 3.11Å; S214-N216 PolarHBondContact OG-OD1 3.11Å
215C34.3Very low38.3Very low106 Ų106133.5 Ų133.572%0.71680%0.796SS**  trans-9483.8178.3-62.90000111.4S217C215-S217 PolarHBondContact O-N 3.42Å
216N38.2Very low39.3Very low137 Ų137130.1 Ų130.173%0.73379%0.794SS**  trans-78.782.6179.8-69.91.7000112.2S214 S218S214-N216 PolarHBondContact O-N 3.11Å; S214-N216 PolarHBondContact OG-OD1 3.11Å; N216-S218 PolarHBondContact O-N 2.9Å
217S36.1Very low40.2Very low118 Ų118128.5 Ų128.583%0.82579%0.787SS**  trans-85.276.8177.8-64.80000113C215C215-S217 PolarHBondContact O-N 3.42Å
218S39.7Very low40.8Very low97 Ų97135 Ų13568%0.67879%0.79SS**  trans-80.7133.2171.3-63.60000112N216 T220N216-S218 PolarHBondContact O-N 2.9Å; S218-T220 PolarHBondContact O-N 3.28Å
219P46Very low41.7Very low131 Ų131140.7 Ų140.785%0.85180%0.796SS**  trans-75.590.2-175.730.7-35.1000111.7S221P219-S221 PolarHBondContact O-N 3.02Å
220T39.7Very low42.9Very low97 Ų97146.6 Ų146.660%0.59580%0.8SS**  trans-71.9101.3173.8-54.40000110.4S218 R222S218-T220 PolarHBondContact O-N 3.28Å; T220-R222 HydrophobicContact CG2-CG 4.37Å; T220-R222 PolarHBondContact O-N 3.26Å
221S49Very low43.4Very low119 Ų119145.6 Ų145.683%0.83280%0.799SS**  trans-61.7109.5168-178.40000110P219P219-S221 PolarHBondContact O-N 3.02Å
222R48.3Very low44.4Very low215 Ų215144 Ų14481%0.81180%0.8SS**  trans-120.1117168.2-98.8-171.4-78.7-118.52.1110.2T220T220-R222 HydrophobicContact CG2-CG 4.37Å; T220-R222 PolarHBondContact O-N 3.26Å
223R43.6Very low45.6Very low234 Ų234141.5 Ų141.588%0.88379%0.794SS**  trans-55.4140.3172.9-75175.9-113.4-164.5-5.1110.8S225R223-S225 PolarHBondContact O-N 3.28Å
224V51.7Low46Very low136 Ų136142.7 Ų142.782%0.82479%0.792SS**  trans0.5103.7150.6-173.20000114.8L226V224-L226 HydrophobicContact CG1-CB 4.21Å
225S40.6Very low47.3Very low120 Ų120144.8 Ų144.884%0.83980%0.795SS**  trans-111.276.4159.264.10000109R223R223-S225 PolarHBondContact O-N 3.28Å
226L51.7Low48.5Very low166 Ų166148.5 Ų148.587%0.86980%0.801SS**  trans-65.2141.1172.1-179.566000109.7V224V224-L226 HydrophobicContact CG1-CB 4.21Å
227G53.8Low49.4Very low62 Ų62145.1 Ų145.164%0.63980%0.799SS**  trans103.765.1162.600000117.7
228R43.8Very low50.6Low237 Ų237145.9 Ų145.989%0.89480%0.798SS**  trans-151.1133.7137.1-156.2157.1-67.2-132.60.5110.3R230R228-R230 PolarHBondContact O-N 3.48Å; R228-R230 VanDerWaalsContact O-N 3.17Å
229Y49.1Very low51.9Low234 Ų234151.7 Ų151.792%0.91881%0.806SS**  trans-57.9117.8178.8-90.2-110.2000110.4S231Y229-S231 PolarHBondContact O-N 2.93Å
230R55Low52.9Low240 Ų240149.9 Ų149.991%0.90679%0.794SS**  trans-78.9102.9161.8-78.7-74.4-169.4-174.42106.9R228R228-R230 PolarHBondContact O-N 3.48Å; R228-R230 VanDerWaalsContact O-N 3.17Å
231S49.2Very low54.2Low111 Ų111147.6 Ų147.678%0.77678%0.781SS**  trans-58.8138.1174.6-165.80000110.5Y229 G233Y229-S231 PolarHBondContact O-N 2.93Å; S231-G233 PolarHBondContact O-N 3.02Å; S231-G233 VanDerWaalsContact O-N 3.14Å
232C54.6Low54.9Low134 Ų134145.8 Ų145.891%0.90576%0.762SS**SBendtrans-69.3104.9168.9-59.30000108.3
233G57.7Low55.7Low70 Ų70140.2 Ų140.272%0.72275%0.753SS**  trans-17919.4-172.100000117.6S231S231-G233 PolarHBondContact O-N 3.02Å; S231-G233 VanDerWaalsContact O-N 3.14Å
234D50.7Low56.7Low131 Ų131134.8 Ų134.870%0.70174%0.738SS**  trans-147.8106.4169.8-172.10.5000110.3H236D234-H236 PolarHBondContact OD1-N 3.5Å
235N60.5Low57.5Low146 Ų146134.7 Ų134.778%0.78173%0.728SS**  trans-122.214.7-177.3-78.5-41.5000112.4
236H59.4Low58.8Low183 Ų183136.4 Ų136.485%0.84772%0.718SS**SBendtrans-131.348.4-169.9-60.2-44.1000113.1D234D234-H236 PolarHBondContact OD1-N 3.5Å
237G57Low60.1Low66 Ų66131.3 Ų131.368%0.6869%0.691SS**  trans-152.2-11.9177.500000116.6R239G237-R239 PolarHBondContact O-N 3.29Å
238V60.8Low61.8Low134 Ų134131.7 Ų131.781%0.81268%0.681SS**  trans-75.293.4176.4-1740000108.9
239R68.3Low64Low220 Ų220125 Ų12583%0.8367%0.668SS**  trans-44.1131.4163.9172.2-179.9172.1167.8-0.4108.3G237G237-R239 PolarHBondContact O-N 3.29Å
240P65.8Low66Low93 Ų93120.2 Ų120.260%0.60466%0.657SS**  trans-48.3128.3176.7-29.535.5000110.4
241P66.9Low67.8Low49 Ų49112.5 Ų112.532%0.31863%0.632SS.*  trans-44.3146.1170.7-30.433.1000111.6Q245 Y246P241-Q245 HydrophobicContact CB-CB 3.75Å; P241-Y246 HydrophobicContact CB-CD2 4.26Å; P241-Y246 HydrophobicContact CB-CE2 3.9Å; P241-Y246 WeakPolarHBondContact CD-OH 3.3Å; P241-Y246 HydrophobicContact CG-CE1 4.45Å; P241-Y246 HydrophobicContact CG-CE2 4.39Å; P241-Y246 VanDerWaalsContact O-CE2 3.26Å; P241-Y246 WeakPolarHBondContact O-CE2 3.45Å
242N64.6Low69.7Low81 Ų81111.2 Ų111.243%0.43361%0.614SS.*  trans-52.7135.3171177.618.7000107.8E244 Q245N242-E244 PolarHBondContact ND2-OE2 3.22Å; N242-E244 PolarHBondContact O-N 3.21Å; N242-Q245 HydrophobicContact CB-CG 4.2Å; N242-Q245 WeakPolarHBondContact O-CA 3.48Å; N242-Q245 VanDerWaalsContact O-CB 3.28Å; N242-Q245 WeakPolarHBondContact O-CB 3.47Å; N242-Q245 PolarHBondContact O-N 2.85Å
243P65.1Low71.6Confident98 Ų98111.7 Ų111.764%0.63660%0.6SS**G310 helixtrans-40.9-38.6-177.82.9-23.6000115.5Q245 Y246P243-Q245 VanDerWaalsContact C-N 3.27Å; P243-Q245 PolarHBondContact O-N 3.1Å; P243-Y246 PolarHBondContact O-N 3.03Å
244E64.6Low73.3Confident119 Ų119112.8 Ų112.856%0.55659%0.586SS**G310 helixtrans-59.7-30.5175.6-58.8174.4131.600114.1N242 Y246 L247 Q252N242-E244 PolarHBondContact ND2-OE2 3.22Å; N242-E244 PolarHBondContact O-N 3.21Å; E244-Y246 VanDerWaalsContact C-N 3.32Å; E244-Y246 PolarHBondContact O-N 3.46Å; E244-L247 WeakPolarHBondContact O-CB 3.36Å; E244-L247 PolarHBondContact O-N 2.81Å; E244-Q252 PolarHBondContact O-NE2 3.36Å
245Q68.3Low75.4Confident135 Ų135109.5 Ų109.563%0.63157%0.571SS**G310 helixtrans-77.3-11.7179.9-63.4177-46.600113.8P241 N242 P243P241-Q245 HydrophobicContact CB-CB 3.75Å; N242-Q245 HydrophobicContact CB-CG 4.2Å; N242-Q245 WeakPolarHBondContact O-CA 3.48Å; N242-Q245 VanDerWaalsContact O-CB 3.28Å; N242-Q245 WeakPolarHBondContact O-CB 3.47Å; N242-Q245 PolarHBondContact O-N 2.85Å; P243-Q245 VanDerWaalsContact C-N 3.27Å; P243-Q245 PolarHBondContact O-N 3.1Å
246Y67.1Low77.1Confident156 Ų156104.9 Ų104.961%0.61255%0.553SS**G310 helixtrans-84.3-18166.7-65.5-84.5000112.4P241 P243 E244P241-Y246 HydrophobicContact CB-CD2 4.26Å; P241-Y246 HydrophobicContact CB-CE2 3.9Å; P241-Y246 WeakPolarHBondContact CD-OH 3.3Å; P241-Y246 HydrophobicContact CG-CE1 4.45Å; P241-Y246 HydrophobicContact CG-CE2 4.39Å; P241-Y246 VanDerWaalsContact O-CE2 3.26Å; P241-Y246 WeakPolarHBondContact O-CE2 3.45Å; P243-Y246 PolarHBondContact O-N 3.03Å; E244-Y246 VanDerWaalsContact C-N 3.32Å; E244-Y246 PolarHBondContact O-N 3.46Å
247L80.1Confident78.8Confident59 Ų59101.5 Ų101.531%0.30954%0.54SS..SBendtrans-80.8133.5174.6-59.2179.4000109.5E244 Q251 Q252 V255E244-L247 WeakPolarHBondContact O-CB 3.36Å; E244-L247 PolarHBondContact O-N 2.81Å; L247-Q251 HydrophobicContact CB-CB 3.89Å; L247-Q251 HydrophobicContact CD2-CB 4.12Å; L247-Q251 HydrophobicContact CG-CB 4.45Å; L247-Q252 HydrophobicContact CB-CG 3.79Å; L247-V255 HydrophobicContact CD1-CG2 4.12Å
248T88.8Confident80.8Confident70 Ų70104.7 Ų104.743%0.42953%0.532SS..  trans-58155167.759.60000110.5L250 Q251 Q252T248-L250 PolarHBondContact O-N 3.48Å; T248-Q251 PolarHBondContact O-N 2.95Å; T248-Q251 WeakPolarHBondContact OG1-CG 3.47Å; T248-Q251 PolarHBondContact OG1-N 2.81Å; T248-Q251 PolarHBondContact OG1-OE1 3.4Å; T248-Q252 PolarHBondContact O-N 3.3Å
249P89.4Confident82.5Confident95 Ų95103.4 Ų103.462%0.61752%0.516SS*.Hα-helixtrans-57.1-17175.3-27.336.1000114.7K253P249-K253 WeakPolarHBondContact O-CD 3.37Å; P249-K253 VanDerWaalsContact O-CG 3.31Å; P249-K253 WeakPolarHBondContact O-CG 3.27Å
250L91.4Very high84Confident134 Ų13498.2 Ų98.270%0.70251%0.505SS*.Hα-helixtrans-76.8-50.7170.2-177.461.5000111.5T248 Q252 K253 E254T248-L250 PolarHBondContact O-N 3.48Å; L250-Q252 VanDerWaalsContact C-N 3.34Å; L250-Q252 PolarHBondContact O-N 3.29Å; L250-K253 WeakPolarHBondContact O-CB 3.31Å; L250-K253 PolarHBondContact O-N 3.03Å; L250-E254 PolarHBondContact O-N 2.93Å
251Q92.7Very high85.5Confident79 Ų79100.6 Ų100.637%0.36951%0.505SS..Hα-helixtrans-63.2-36.6177-71.7161.8-52.900112.5L247 T248 K253 E254 V255L247-Q251 HydrophobicContact CB-CB 3.89Å; L247-Q251 HydrophobicContact CD2-CB 4.12Å; L247-Q251 HydrophobicContact CG-CB 4.45Å; T248-Q251 PolarHBondContact O-N 2.95Å; T248-Q251 WeakPolarHBondContact OG1-CG 3.47Å; T248-Q251 PolarHBondContact OG1-N 2.81Å; T248-Q251 PolarHBondContact OG1-OE1 3.4Å; Q251-K253 PolarHBondContact O-N 2.86Å; Q251-E254 PolarHBondContact O-N 3.47Å; Q251-V255 WeakPolarHBondContact O-CG2 3.31Å; Q251-V255 PolarHBondContact O-N 3.47Å
252Q90.6Very high87Confident84 Ų84102.7 Ų102.739%0.39352%0.517SS..Hα-helixtrans-58-47.1172-70.3-179.9-9.400111.5E244 L247 T248 L250 E254 V255 A256E244-Q252 PolarHBondContact O-NE2 3.36Å; L247-Q252 HydrophobicContact CB-CG 3.79Å; T248-Q252 PolarHBondContact O-N 3.3Å; L250-Q252 VanDerWaalsContact C-N 3.34Å; L250-Q252 PolarHBondContact O-N 3.29Å; Q252-E254 VanDerWaalsContact C-N 3.35Å; Q252-V255 PolarHBondContact O-N 3.33Å; Q252-A256 WeakPolarHBondContact O-CB 3.46Å; Q252-A256 PolarHBondContact O-N 2.98Å
253K92.8Very high88.6Confident143 Ų143103.9 Ų103.962%0.62252%0.519SS*.Hα-helixtrans-63.4-40.3175.5-74.4174.8179.9-176.40111.8P249 L250 Q251 A256 I257P249-K253 WeakPolarHBondContact O-CD 3.37Å; P249-K253 VanDerWaalsContact O-CG 3.31Å; P249-K253 WeakPolarHBondContact O-CG 3.27Å; L250-K253 WeakPolarHBondContact O-CB 3.31Å; L250-K253 PolarHBondContact O-N 3.03Å; Q251-K253 PolarHBondContact O-N 2.86Å; K253-A256 PolarHBondContact O-N 2.91Å; K253-I257 WeakPolarHBondContact O-CB 3.39Å; K253-I257 WeakPolarHBondContact O-CD1 3.49Å; K253-I257 WeakPolarHBondContact O-CG1 3.43Å; K253-I257 PolarHBondContact O-N 2.93Å
254E95.1Very high90.2Very high93 Ų93104.4 Ų104.444%0.43552%0.516SS..Hα-helixtrans-63.3-44.2178.7-159-144.3125.700112.1L250 Q251 Q252 I257 R258L250-E254 PolarHBondContact O-N 2.93Å; Q251-E254 PolarHBondContact O-N 3.47Å; Q252-E254 VanDerWaalsContact C-N 3.35Å; E254-I257 PolarHBondContact O-N 2.92Å; E254-R258 WeakPolarHBondContact O-CG 3.25Å; E254-R258 PolarHBondContact O-N 3.47Å; E254-R258 IonicContact OE1-CZ 3.48Å; E254-R258 IonicContact OE1-NE 3.49Å; E254-R258 PolarHBondContact OE1-NE 3.37Å; E254-R258 IonicContact OE1-NH2 2.72Å; E254-R258 PolarHBondContact OE1-NH2 3.47Å; E254-R258 IonicContact OE2-NH2 2.77Å
255V94.7Very high91.8Very high63 Ų63102.5 Ų102.538%0.38251%0.508SS..Hα-helixtrans-63.3-42.8173.9172.40000111.1L247 Q251 Q252 R258 H259L247-V255 HydrophobicContact CD1-CG2 4.12Å; Q251-V255 WeakPolarHBondContact O-CG2 3.31Å; Q251-V255 PolarHBondContact O-N 3.47Å; Q252-V255 PolarHBondContact O-N 3.33Å; V255-R258 PolarHBondContact O-N 3.03Å; V255-H259 PolarHBondContact O-N 3.42Å
256A94.8Very high93.3Very high48 Ų48102.2 Ų102.240%0.39751%0.507SS..Hα-helixtrans-62.8-41.4175.600000112.4Q252 K253 H259 L260Q252-A256 WeakPolarHBondContact O-CB 3.46Å; Q252-A256 PolarHBondContact O-N 2.98Å; K253-A256 PolarHBondContact O-N 2.91Å; A256-H259 PolarHBondContact O-N 3.46Å; A256-L260 WeakPolarHBondContact O-CB 3.35Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 3.33Å; A256-L260 PolarHBondContact O-N 3.36Å
257I96.8Very high94.8Very high112 Ų11297.7 Ų97.757%0.57450%0.497SS*.Hα-helixtrans-63.7-43.7174.9-71.7162.2000110.6K253 E254 L260 K261K253-I257 WeakPolarHBondContact O-CB 3.39Å; K253-I257 WeakPolarHBondContact O-CD1 3.49Å; K253-I257 WeakPolarHBondContact O-CG1 3.43Å; K253-I257 PolarHBondContact O-N 2.93Å; E254-I257 PolarHBondContact O-N 2.92Å; I257-L260 PolarHBondContact O-N 3.27Å; I257-K261 WeakPolarHBondContact O-CB 3.5Å; I257-K261 PolarHBondContact O-N 2.76Å
258R97.2Very high95.7Very high134 Ų13499.1 Ų99.151%0.50650%0.503SS..Hα-helixtrans-60.2-45.5175-76.4-170-96.5120.2-11.7111.7E254 V255 K261 T262E254-R258 WeakPolarHBondContact O-CG 3.25Å; E254-R258 PolarHBondContact O-N 3.47Å; E254-R258 IonicContact OE1-CZ 3.48Å; E254-R258 IonicContact OE1-NE 3.49Å; E254-R258 PolarHBondContact OE1-NE 3.37Å; E254-R258 IonicContact OE1-NH2 2.72Å; E254-R258 PolarHBondContact OE1-NH2 3.47Å; E254-R258 IonicContact OE2-NH2 2.77Å; V255-R258 PolarHBondContact O-N 3.03Å; R258-K261 PolarHBondContact O-N 2.91Å; R258-T262 PolarHBondContact O-N 3.37Å; R258-T262 PolarHBondContact O-OG1 3Å; R258-T262 VanDerWaalsContact O-OG1 3.14Å
259H97.7Very high96.1Very high106 Ų106100 Ų10049%0.49151%0.505SS..Hα-helixtrans-62.6-44.2176.2-176.752.3000113.2V255 A256 K261 T262 K263V255-H259 PolarHBondContact O-N 3.42Å; A256-H259 PolarHBondContact O-N 3.46Å; H259-K261 VanDerWaalsContact C-N 3.35Å; H259-T262 PolarHBondContact O-N 3.13Å; H259-K263 PolarHBondContact NE2-NZ 3.38Å; H259-K263 PolarHBondContact O-N 3.01Å
260L98.6Very high96.6Very high112 Ų112101.5 Ų101.559%0.58650%0.502SS*.Hα-helixtrans-65.7-37.2176.4-71.5171000111.8A256 I257 K263 L264A256-L260 WeakPolarHBondContact O-CB 3.35Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 3.33Å; A256-L260 PolarHBondContact O-N 3.36Å; I257-L260 PolarHBondContact O-N 3.27Å; L260-K263 PolarHBondContact O-N 3.27Å; L260-L264 WeakPolarHBondContact O-CB 3.5Å; L260-L264 PolarHBondContact O-N 3.15Å
261K98.3Very high96.9Very high142 Ų14299.8 Ų99.862%0.61750%0.496SS*.Hα-helixtrans-63.4-46173.1-173177.4180-179.30111.4I257 R258 H259 K263 L264 M265I257-K261 WeakPolarHBondContact O-CB 3.5Å; I257-K261 PolarHBondContact O-N 2.76Å; R258-K261 PolarHBondContact O-N 2.91Å; H259-K261 VanDerWaalsContact C-N 3.35Å; K261-K263 VanDerWaalsContact C-N 3.34Å; K261-K263 PolarHBondContact O-N 2.83Å; K261-L264 PolarHBondContact O-N 3.44Å; K261-M265 WeakPolarHBondContact O-CG 3.1Å; K261-M265 PolarHBondContact O-N 2.97Å
262T98.4Very high97.2Very high93 Ų93101 Ų10157%0.57150%0.502SS*.Hα-helixtrans-58.7-45.2175.6-57.20000111.5R258 H259 L264 M265 E266R258-T262 PolarHBondContact O-N 3.37Å; R258-T262 PolarHBondContact O-OG1 3Å; R258-T262 VanDerWaalsContact O-OG1 3.14Å; H259-T262 PolarHBondContact O-N 3.13Å; T262-L264 VanDerWaalsContact C-N 3.34Å; T262-L264 PolarHBondContact O-N 3.44Å; T262-M265 PolarHBondContact O-N 2.69Å; T262-E266 WeakPolarHBondContact O-CB 3.32Å; T262-E266 PolarHBondContact O-N 2.85Å
263K98.4Very high97.6Very high107 Ų107102 Ų10247%0.46551%0.51SS..Hα-helixtrans-64.2-35.3176-79.2-178.4165.9-178.90113.7H259 L260 K261 S267H259-K263 PolarHBondContact NE2-NZ 3.38Å; H259-K263 PolarHBondContact O-N 3.01Å; L260-K263 PolarHBondContact O-N 3.27Å; K261-K263 VanDerWaalsContact C-N 3.34Å; K261-K263 PolarHBondContact O-N 2.83Å; K263-S267 WeakPolarHBondContact O-CB 3.34Å; K263-S267 PolarHBondContact O-N 3.17Å; K263-S267 PolarHBondContact O-OG 3.25Å
264L98.7Very high97.9Very high109 Ų109101.5 Ų101.557%0.57150%0.504SS*.Hα-helixtrans-63.6-51.5174.3-177.961.4000110.2L260 K261 T262 E266 S267 E268L260-L264 WeakPolarHBondContact O-CB 3.5Å; L260-L264 PolarHBondContact O-N 3.15Å; K261-L264 PolarHBondContact O-N 3.44Å; T262-L264 VanDerWaalsContact C-N 3.34Å; T262-L264 PolarHBondContact O-N 3.44Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 3.43Å; L264-S267 PolarHBondContact O-N 3.19Å; L264-S267 VanDerWaalsContact O-N 3.12Å; L264-S267 PolarHBondContact O-OG 3.04Å; L264-E268 WeakPolarHBondContact O-CB 3.44Å; L264-E268 PolarHBondContact O-N 3.48Å
265M98.6Very high98Very high79 Ų79101 Ų10139%0.38950%0.502SS..Hα-helixtrans-58.3-41.3175.9-60.9-53.6-44.500112.2K261 T262 S267 E268 N269K261-M265 WeakPolarHBondContact O-CG 3.1Å; K261-M265 PolarHBondContact O-N 2.97Å; T262-M265 PolarHBondContact O-N 2.69Å; M265-S267 PolarHBondContact O-N 2.85Å; M265-E268 VanDerWaalsContact CE-OE2 3.29Å; M265-E268 WeakPolarHBondContact CE-OE2 3.4Å; M265-E268 PolarHBondContact O-N 2.97Å; M265-N269 WeakPolarHBondContact O-CB 3.42Å; M265-N269 PolarHBondContact O-N 3Å; M265-N269 PolarHBondContact O-OD1 3.03Å
266E98.5Very high98.2Very high129 Ų129103.1 Ų103.160%0.60351%0.511SS*.Hα-helixtrans-60.8-43.7175.7-174.4-172.6-179.900111.5T262 L264 K270T262-E266 WeakPolarHBondContact O-CB 3.32Å; T262-E266 PolarHBondContact O-N 2.85Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 3.43Å; E266-K270 VanDerWaalsContact O-CB 3.29Å; E266-K270 WeakPolarHBondContact O-CB 3.18Å; E266-K270 PolarHBondContact O-N 2.93Å; E266-K270 VanDerWaalsContact O-N 3.12Å
267S98.5Very high98.4Very high60 Ų60105.9 Ų105.942%0.4252%0.515SS..Hα-helixtrans-69.4-3617771.80000113.1K263 L264 M265 V271K263-S267 WeakPolarHBondContact O-CB 3.34Å; K263-S267 PolarHBondContact O-N 3.17Å; K263-S267 PolarHBondContact O-OG 3.25Å; L264-S267 PolarHBondContact O-N 3.19Å; L264-S267 VanDerWaalsContact O-N 3.12Å; L264-S267 PolarHBondContact O-OG 3.04Å; M265-S267 PolarHBondContact O-N 2.85Å; S267-V271 WeakPolarHBondContact O-CG2 3.45Å; S267-V271 PolarHBondContact O-N 3.41Å; S267-V271 VanDerWaalsContact O-N 3.15Å
268E98.6Very high98.5Very high89 Ų89104 Ų10442%0.41651%0.506SS..Hα-helixtrans-68-47.8177.6178.8170.1-136.600111.3L264 M265 K270 V271 H272L264-E268 WeakPolarHBondContact O-CB 3.44Å; L264-E268 PolarHBondContact O-N 3.48Å; M265-E268 VanDerWaalsContact CE-OE2 3.29Å; M265-E268 WeakPolarHBondContact CE-OE2 3.4Å; M265-E268 PolarHBondContact O-N 2.97Å; E268-K270 VanDerWaalsContact C-N 3.32Å; E268-K270 PolarHBondContact O-N 3.41Å; E268-V271 PolarHBondContact O-N 3.24Å; E268-V271 VanDerWaalsContact O-N 3.12Å; E268-H272 PolarHBondContact O-N 3.02Å; E268-H272 PolarHBondContact O-ND1 3.48Å
269N98.5Very high98.6Very high89 Ų89102.3 Ų102.348%0.47650%0.504SS..Hα-helixtrans-57-46.9173.8-70.2-7.8000110.8M265 V271 H272 D273M265-N269 WeakPolarHBondContact O-CB 3.42Å; M265-N269 PolarHBondContact O-N 3Å; M265-N269 PolarHBondContact O-OD1 3.03Å; N269-V271 PolarHBondContact O-N 3.33Å; N269-H272 PolarHBondContact O-N 3.19Å; N269-D273 VanDerWaalsContact O-CG 3.26Å; N269-D273 PolarHBondContact O-N 3.46Å
270K98.7Very high98.6Very high127 Ų127103.6 Ų103.655%0.55251%0.51SS*.Hα-helixtrans-63.4-21.6178.5-176.6175.1179.4177.60114.3E266 E268E266-K270 VanDerWaalsContact O-CB 3.29Å; E266-K270 WeakPolarHBondContact O-CB 3.18Å; E266-K270 PolarHBondContact O-N 2.93Å; E266-K270 VanDerWaalsContact O-N 3.12Å; E268-K270 VanDerWaalsContact C-N 3.32Å; E268-K270 PolarHBondContact O-N 3.41Å
271V98.7Very high98.6Very high97 Ų97102.7 Ų102.759%0.58851%0.505SS*.Hα-helixtrans-82.3-42.3170.5168.60000110.8S267 E268 N269 R274 E275S267-V271 WeakPolarHBondContact O-CG2 3.45Å; S267-V271 PolarHBondContact O-N 3.41Å; S267-V271 VanDerWaalsContact O-N 3.15Å; E268-V271 PolarHBondContact O-N 3.24Å; E268-V271 VanDerWaalsContact O-N 3.12Å; N269-V271 PolarHBondContact O-N 3.33Å; V271-R274 WeakPolarHBondContact O-CB 3.36Å; V271-R274 PolarHBondContact O-N 3.37Å; V271-R274 VanDerWaalsContact O-N 3.15Å; V271-E275 PolarHBondContact O-N 3.12Å
272H98.8Very high98.7Very high106 Ų106100.2 Ų100.249%0.49149%0.494SS..Hα-helixtrans-61.4-43.6174.2-73.387.2000112.1E268 N269 R274 E275 N276E268-H272 PolarHBondContact O-N 3.02Å; E268-H272 PolarHBondContact O-ND1 3.48Å; N269-H272 PolarHBondContact O-N 3.19Å; H272-R274 PolarHBondContact O-N 3.12Å; H272-E275 PolarHBondContact O-N 3.49Å; H272-N276 WeakPolarHBondContact O-CB 3.31Å; H272-N276 PolarHBondContact O-N 2.95Å; H272-N276 PolarHBondContact O-ND2 3.45Å
273D98.7Very high98.7Very high103 Ų10398.1 Ų98.155%0.55148%0.483SS*.Hα-helixtrans-55.5-38.9173.4-66.6-29.4000111.8N269 E277N269-D273 VanDerWaalsContact O-CG 3.26Å; N269-D273 PolarHBondContact O-N 3.46Å; D273-E277 WeakPolarHBondContact O-CB 3.47Å; D273-E277 PolarHBondContact O-N 2.86Å
274R98.7Very high98.7Very high134 Ų13497.3 Ų97.351%0.50648%0.481SS..Hα-helixtrans-72.8-40.9177.6-85.5177.7157.553.320113.2V271 H272 N276 E277 I278V271-R274 WeakPolarHBondContact O-CB 3.36Å; V271-R274 PolarHBondContact O-N 3.37Å; V271-R274 VanDerWaalsContact O-N 3.15Å; H272-R274 PolarHBondContact O-N 3.12Å; R274-N276 VanDerWaalsContact C-N 3.28Å; R274-E277 PolarHBondContact O-N 2.84Å; R274-I278 VanDerWaalsContact O-CB 3.3Å; R274-I278 WeakPolarHBondContact O-CB 3.41Å; R274-I278 WeakPolarHBondContact O-CD1 3.36Å; R274-I278 WeakPolarHBondContact O-CG1 3.49Å; R274-I278 PolarHBondContact O-N 3.14Å
275E98.8Very high98.7Very high83 Ų8398 Ų9839%0.38849%0.485SS..Hα-helixtrans-66-37.2174.3-171.756.4-146.400110.2V271 H272 I278 Q279 K282V271-E275 PolarHBondContact O-N 3.12Å; H272-E275 PolarHBondContact O-N 3.49Å; E275-I278 CarbonylContact O-C 3.6Å; E275-I278 PolarHBondContact O-N 3.39Å; E275-Q279 HydrophobicContact CG-CG 4.33Å; E275-Q279 WeakPolarHBondContact O-CB 3.49Å; E275-Q279 WeakPolarHBondContact O-CG 3.42Å; E275-Q279 PolarHBondContact O-N 3.31Å; E275-Q279 PolarHBondContact OE1-NE2 3.2Å; E275-K282 IonicContact OE1-NZ 3.52Å; E275-K282 PolarHBondContact OE1-NZ 3.04Å
276N98.7Very high98.7Very high107 Ų10797.3 Ų97.357%0.57249%0.487SS*.Hα-helixtrans-60.4-48.6172.9-68.1-27.4000112.2H272 R274 I278 Q279 E280H272-N276 WeakPolarHBondContact O-CB 3.31Å; H272-N276 PolarHBondContact O-N 2.95Å; H272-N276 PolarHBondContact O-ND2 3.45Å; R274-N276 VanDerWaalsContact C-N 3.28Å; N276-I278 VanDerWaalsContact C-N 3.32Å; N276-I278 PolarHBondContact O-N 3.03Å; N276-Q279 PolarHBondContact O-N 2.98Å; N276-E280 PolarHBondContact O-N 3.35Å
277E98.8Very high98.7Very high105 Ų10597.7 Ų97.749%0.49148%0.483SS..Hα-helixtrans-57.4-44173.3-179.9179.6-15800111.4D273 R274 Q279 E280 L281D273-E277 WeakPolarHBondContact O-CB 3.47Å; D273-E277 PolarHBondContact O-N 2.86Å; R274-E277 PolarHBondContact O-N 2.84Å; E277-Q279 PolarHBondContact O-N 3.1Å; E277-E280 PolarHBondContact O-N 3.17Å; E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CB 3.28Å; E277-L281 VanDerWaalsContact O-CG 3.29Å; E277-L281 WeakPolarHBondContact O-CG 3.42Å; E277-L281 PolarHBondContact O-N 3.24Å
278I98.7Very high98.7Very high74 Ų74100 Ų10038%0.37949%0.489SS..Hα-helixtrans-63.9-38.1177-73.4166.3000111.5R274 E275 N276 K282R274-I278 VanDerWaalsContact O-CB 3.3Å; R274-I278 WeakPolarHBondContact O-CB 3.41Å; R274-I278 WeakPolarHBondContact O-CD1 3.36Å; R274-I278 WeakPolarHBondContact O-CG1 3.49Å; R274-I278 PolarHBondContact O-N 3.14Å; E275-I278 CarbonylContact O-C 3.6Å; E275-I278 PolarHBondContact O-N 3.39Å; N276-I278 VanDerWaalsContact C-N 3.32Å; N276-I278 PolarHBondContact O-N 3.03Å; I278-K282 HydrophobicContact CG2-CD 4Å; I278-K282 VanDerWaalsContact CG2-NZ 3.3Å; I278-K282 WeakPolarHBondContact O-CB 3.29Å; I278-K282 WeakPolarHBondContact O-CD 3.03Å; I278-K282 WeakPolarHBondContact O-CG 3.43Å; I278-K282 PolarHBondContact O-N 2.91Å
279Q98.8Very high98.7Very high98 Ų98102.5 Ų102.546%0.45849%0.494SS..Hα-helixtrans-72.7-37.2176.9-65.7-69.4-11.400112.3E275 N276 E277 K282 S283E275-Q279 HydrophobicContact CG-CG 4.33Å; E275-Q279 WeakPolarHBondContact O-CB 3.49Å; E275-Q279 WeakPolarHBondContact O-CG 3.42Å; E275-Q279 PolarHBondContact O-N 3.31Å; E275-Q279 PolarHBondContact OE1-NE2 3.2Å; N276-Q279 PolarHBondContact O-N 2.98Å; E277-Q279 PolarHBondContact O-N 3.1Å; Q279-K282 PolarHBondContact O-N 3.23Å; Q279-S283 PolarHBondContact O-N 3.43Å
280E98.8Very high98.8Very high133 Ų133102.3 Ų102.362%0.62149%0.49SS*.Hα-helixtrans-61.3-48.7170.7-175.6171.2-157.200110.6N276 E277 K282 S283 Q284N276-E280 PolarHBondContact O-N 3.35Å; E277-E280 PolarHBondContact O-N 3.17Å; E280-K282 PolarHBondContact O-N 3.26Å; E280-S283 WeakPolarHBondContact O-CB 3.37Å; E280-S283 PolarHBondContact O-N 2.71Å; E280-S283 VanDerWaalsContact O-N 3.08Å; E280-S283 PolarHBondContact O-OG 2.77Å; E280-Q284 PolarHBondContact O-N 3.23Å
281L98.8Very high98.8Very high92 Ų92100.5 Ų100.548%0.48249%0.487SS..Hα-helixtrans-63.8-37.4177.7-70.1172.3000112.9E277 Q284 L285E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CB 3.28Å; E277-L281 VanDerWaalsContact O-CG 3.29Å; E277-L281 WeakPolarHBondContact O-CG 3.42Å; E277-L281 PolarHBondContact O-N 3.24Å; L281-Q284 PolarHBondContact O-N 2.99Å; L281-L285 WeakPolarHBondContact O-CB 3.38Å; L281-L285 PolarHBondContact O-N 3.4Å
282K98.8Very high98.8Very high91 Ų91103.3 Ų103.340%0.39649%0.487SS..Hα-helixtrans-58.2-47.3169.3-76.1159.3-178.6161.90110.5E275 I278 Q279 E280 Q284 L285 C286E275-K282 IonicContact OE1-NZ 3.52Å; E275-K282 PolarHBondContact OE1-NZ 3.04Å; I278-K282 HydrophobicContact CG2-CD 4Å; I278-K282 VanDerWaalsContact CG2-NZ 3.3Å; I278-K282 WeakPolarHBondContact O-CB 3.29Å; I278-K282 WeakPolarHBondContact O-CD 3.03Å; I278-K282 WeakPolarHBondContact O-CG 3.43Å; I278-K282 PolarHBondContact O-N 2.91Å; Q279-K282 PolarHBondContact O-N 3.23Å; E280-K282 PolarHBondContact O-N 3.26Å; K282-Q284 VanDerWaalsContact C-N 3.31Å; K282-Q284 PolarHBondContact O-N 3.49Å; K282-L285 PolarHBondContact O-N 2.95Å; K282-C286 PolarHBondContact O-N 3.4Å; K282-C286 PolarHBondContact O-SG 3.22Å
283S98.8Very high98.8Very high48 Ų48101.7 Ų101.734%0.33648%0.481SS..Hα-helixtrans-65.6-31.117984.60000113.5Q279 E280 R287Q279-S283 PolarHBondContact O-N 3.43Å; E280-S283 WeakPolarHBondContact O-CB 3.37Å; E280-S283 PolarHBondContact O-N 2.71Å; E280-S283 VanDerWaalsContact O-N 3.08Å; E280-S283 PolarHBondContact O-OG 2.77Å; S283-R287 PolarHBondContact O-N 2.64Å; S283-R287 PolarHBondContact O-NE 3.43Å; S283-R287 PolarHBondContact OG-NH2 3.24Å
284Q98.9Very high98.8Very high91 Ų91102.4 Ų102.443%0.42548%0.481SS..Hα-helixtrans-72.8-42.5173.8-176.5179.8-13.200110.8E280 L281 K282 C286 R287 M288E280-Q284 PolarHBondContact O-N 3.23Å; L281-Q284 PolarHBondContact O-N 2.99Å; K282-Q284 VanDerWaalsContact C-N 3.31Å; K282-Q284 PolarHBondContact O-N 3.49Å; Q284-C286 VanDerWaalsContact C-N 3.33Å; Q284-C286 PolarHBondContact O-N 2.92Å; Q284-R287 PolarHBondContact O-N 2.83Å; Q284-M288 HydrophobicContact CG-CG 4.32Å; Q284-M288 HydrophobicContact CG-SD 3.93Å; Q284-M288 WeakPolarHBondContact O-CB 3.43Å; Q284-M288 WeakPolarHBondContact O-CG 3.31Å; Q284-M288 PolarHBondContact O-N 3.13Å
285L98.9Very high98.8Very high124 Ų124103 Ų10365%0.64949%0.489SS*.Hα-helixtrans-64.6-35.9177.6-178.661.3000112.4L281 K282 R289L281-L285 WeakPolarHBondContact O-CB 3.38Å; L281-L285 PolarHBondContact O-N 3.4Å; K282-L285 PolarHBondContact O-N 2.95Å; L285-R289 VanDerWaalsContact O-CB 3.23Å; L285-R289 WeakPolarHBondContact O-CB 3.46Å; L285-R289 PolarHBondContact O-N 3.06Å; L285-R289 VanDerWaalsContact O-N 3.08Å
286C98.8Very high98.7Very high64 Ų64102.2 Ų102.243%0.43249%0.486SS..Hα-helixtrans-57.7-62167.9-72.50000110.5K282 Q284 M288 R289 E290K282-C286 PolarHBondContact O-N 3.4Å; K282-C286 PolarHBondContact O-SG 3.22Å; Q284-C286 VanDerWaalsContact C-N 3.33Å; Q284-C286 PolarHBondContact O-N 2.92Å; C286-M288 PolarHBondContact O-N 3.44Å; C286-R289 CarbonylContact O-C 3.59Å; C286-R289 WeakPolarHBondContact O-CA 3.46Å; C286-R289 VanDerWaalsContact O-CB 3.31Å; C286-R289 WeakPolarHBondContact O-CB 3.29Å; C286-R289 PolarHBondContact O-N 3.16Å; C286-E290 WeakPolarHBondContact CB-OE2 3.31Å; C286-E290 PolarHBondContact O-N 3.13Å
287R98.8Very high98.7Very high136 Ų136100.1 Ų100.151%0.51348%0.479SS..Hα-helixtrans-50.8-50.9-180-74.8173.5-75.8177.9-1.4112.7S283 Q284 R289 E290 D291S283-R287 PolarHBondContact O-N 2.64Å; S283-R287 PolarHBondContact O-NE 3.43Å; S283-R287 PolarHBondContact OG-NH2 3.24Å; Q284-R287 PolarHBondContact O-N 2.83Å; R287-R289 PolarHBondContact O-N 2.81Å; R287-E290 CarbonylContact O-C 3.55Å; R287-E290 PolarHBondContact O-N 3.14Å; R287-D291 WeakPolarHBondContact O-CB 3.47Å; R287-D291 PolarHBondContact O-N 3.14Å
288M98.8Very high98.7Very high109 Ų109100.1 Ų100.154%0.53748%0.479SS..Hα-helixtrans-61.7-27.1177.5-69.9-179.863.400114.3Q284 C286 W292Q284-M288 HydrophobicContact CG-CG 4.32Å; Q284-M288 HydrophobicContact CG-SD 3.93Å; Q284-M288 WeakPolarHBondContact O-CB 3.43Å; Q284-M288 WeakPolarHBondContact O-CG 3.31Å; Q284-M288 PolarHBondContact O-N 3.13Å; C286-M288 PolarHBondContact O-N 3.44Å; M288-W292 VanDerWaalsContact O-CB 3.31Å; M288-W292 WeakPolarHBondContact O-CB 3.34Å; M288-W292 PolarHBondContact O-N 2.87Å
289R98.8Very high98.7Very high142 Ų142101.5 Ų101.554%0.53648%0.479SS..Hα-helixtrans-77.9-40.8173.1175.4-167.6166.5-77.3-8.8111.2L285 C286 R287 I293L285-R289 VanDerWaalsContact O-CB 3.23Å; L285-R289 WeakPolarHBondContact O-CB 3.46Å; L285-R289 PolarHBondContact O-N 3.06Å; L285-R289 VanDerWaalsContact O-N 3.08Å; C286-R289 CarbonylContact O-C 3.59Å; C286-R289 WeakPolarHBondContact O-CA 3.46Å; C286-R289 VanDerWaalsContact O-CB 3.31Å; C286-R289 WeakPolarHBondContact O-CB 3.29Å; C286-R289 PolarHBondContact O-N 3.16Å; R287-R289 PolarHBondContact O-N 2.81Å; R289-I293 HydrophobicContact CG-CD1 4.1Å; R289-I293 WeakPolarHBondContact O-CD1 3.38Å; R289-I293 VanDerWaalsContact O-CG1 3.24Å; R289-I293 WeakPolarHBondContact O-CG1 3.29Å; R289-I293 PolarHBondContact O-N 3.03Å
290E98.6Very high98.7Very high84 Ų84100.2 Ų100.239%0.39348%0.478SS..Hα-helixtrans-62.9-49.2173.6-81.281.6-103.200110.8C286 R287 W292 I293 E294C286-E290 WeakPolarHBondContact CB-OE2 3.31Å; C286-E290 PolarHBondContact O-N 3.13Å; R287-E290 CarbonylContact O-C 3.55Å; R287-E290 PolarHBondContact O-N 3.14Å; E290-W292 VanDerWaalsContact C-N 3.32Å; E290-W292 PolarHBondContact O-N 3.39Å; E290-I293 PolarHBondContact O-N 3.37Å; E290-I293 VanDerWaalsContact O-N 3.11Å; E290-E294 PolarHBondContact O-N 2.94Å
291D98.8Very high98.7Very high90 Ų9099.1 Ų99.148%0.48147%0.473SS..Hα-helixtrans-53.4-47.1174.7-58.2-28.8000111.2R287 I293 E294 E295R287-D291 WeakPolarHBondContact O-CB 3.47Å; R287-D291 PolarHBondContact O-N 3.14Å; D291-I293 PolarHBondContact O-N 3.04Å; D291-E294 PolarHBondContact O-N 2.92Å; D291-E295 PolarHBondContact O-N 3.44Å
292W98.8Very high98.7Very high156 Ų15697.5 Ų97.559%0.59147%0.473SS*.Hα-helixtrans-66.1-36179.117977.8000113.1M288 E290 E294 E296M288-W292 VanDerWaalsContact O-CB 3.31Å; M288-W292 WeakPolarHBondContact O-CB 3.34Å; M288-W292 PolarHBondContact O-N 2.87Å; E290-W292 VanDerWaalsContact C-N 3.32Å; E290-W292 PolarHBondContact O-N 3.39Å; W292-E294 VanDerWaalsContact C-N 3.34Å; W292-E296 VanDerWaalsContact O-CB 3.3Å; W292-E296 WeakPolarHBondContact O-CB 3.43Å; W292-E296 PolarHBondContact O-N 2.95Å
293I98.8Very high98.7Very high72 Ų7297.8 Ų97.837%0.36948%0.475SS..Hα-helixtrans-66.5-39.4174.4-72165.7000110.3R289 E290 D291 C297R289-I293 HydrophobicContact CG-CD1 4.1Å; R289-I293 WeakPolarHBondContact O-CD1 3.38Å; R289-I293 VanDerWaalsContact O-CG1 3.24Å; R289-I293 WeakPolarHBondContact O-CG1 3.29Å; R289-I293 PolarHBondContact O-N 3.03Å; E290-I293 PolarHBondContact O-N 3.37Å; E290-I293 VanDerWaalsContact O-N 3.11Å; D291-I293 PolarHBondContact O-N 3.04Å; I293-C297 VanDerWaalsContact O-CB 3.27Å; I293-C297 WeakPolarHBondContact O-CB 3.44Å; I293-C297 PolarHBondContact O-N 3.21Å
294E98.8Very high98.7Very high118 Ų118100.9 Ų100.955%0.55149%0.487SS*.Hα-helixtrans-68.4-43.7177.4-176.8168.6-159.400112.2E290 D291 W292 E296 C297 H298E290-E294 PolarHBondContact O-N 2.94Å; D291-E294 PolarHBondContact O-N 2.92Å; W292-E294 VanDerWaalsContact C-N 3.34Å; E294-E296 PolarHBondContact O-N 3.35Å; E294-C297 PolarHBondContact O-N 3.39Å; E294-H298 VanDerWaalsContact CG-CE1 3.46Å; E294-H298 WeakPolarHBondContact CG-CE1 3.5Å; E294-H298 PolarHBondContact O-N 3.4Å; E294-H298 PolarHBondContact O-ND1 3.34Å; E294-H298 IonicContact OE1-CE1 2.71Å
295E98.5Very high98.7Very high145 Ų14599.6 Ų99.668%0.67849%0.489SS*.Hα-helixtrans-59.7-44.8173.2-74.8-165.1162.400112.1D291 R299D291-E295 PolarHBondContact O-N 3.44Å; E295-R299 WeakPolarHBondContact O-CB 3.4Å; E295-R299 PolarHBondContact O-N 3.4Å
296E98.5Very high98.7Very high68 Ų6897.7 Ų97.732%0.31848%0.479SS..Hα-helixtrans-68.4-33.9179-178.363.3-17500112W292 E294 R299 V300W292-E296 VanDerWaalsContact O-CB 3.3Å; W292-E296 WeakPolarHBondContact O-CB 3.43Å; W292-E296 PolarHBondContact O-N 2.95Å; E294-E296 PolarHBondContact O-N 3.35Å; E296-R299 WeakPolarHBondContact O-CB 3.38Å; E296-R299 PolarHBondContact O-N 2.96Å; E296-R299 IonicContact OE1-CZ 2.68Å; E296-R299 IonicContact OE1-NE 3.98Å; E296-R299 PolarHBondContact OE1-NE 2.9Å; E296-R299 IonicContact OE1-NH2 3.15Å; E296-R299 PolarHBondContact OE1-NH2 2.94Å; E296-R299 IonicContact OE2-CZ 2.68Å; E296-R299 IonicContact OE2-NE 3.58Å; E296-R299 PolarHBondContact OE2-NE 2.86Å; E296-R299 IonicContact OE2-NH2 2.69Å; E296-V300 WeakPolarHBondContact O-CG2 3.36Å; E296-V300 PolarHBondContact O-N 3.17Å
297C98.7Very high98.7Very high62 Ų62101.2 Ų101.242%0.41949%0.487SS..Hα-helixtrans-62.3-55.7173.6-164.80000110.9I293 E294 R299 V300 E301I293-C297 VanDerWaalsContact O-CB 3.27Å; I293-C297 WeakPolarHBondContact O-CB 3.44Å; I293-C297 PolarHBondContact O-N 3.21Å; E294-C297 PolarHBondContact O-N 3.39Å; C297-R299 PolarHBondContact O-N 3.41Å; C297-V300 PolarHBondContact O-N 3.3Å; C297-E301 WeakPolarHBondContact O-CG 3.13Å; C297-E301 PolarHBondContact O-N 3.41Å
298H98.8Very high98.7Very high105 Ų105100.1 Ų100.149%0.48649%0.487SS..Hα-helixtrans-55.6-37.7175.7-71.5117.6000112.2E294 V300 E301 A302E294-H298 VanDerWaalsContact CG-CE1 3.46Å; E294-H298 WeakPolarHBondContact CG-CE1 3.5Å; E294-H298 PolarHBondContact O-N 3.4Å; E294-H298 PolarHBondContact O-ND1 3.34Å; E294-H298 IonicContact OE1-CE1 2.71Å; H298-V300 VanDerWaalsContact C-N 3.34Å; H298-V300 PolarHBondContact O-N 2.84Å; H298-E301 IonicContact CD2-OE2 2.64Å; H298-E301 PolarHBondContact O-N 2.97Å; H298-A302 WeakPolarHBondContact O-CB 3.37Å; H298-A302 PolarHBondContact O-N 3.39Å
299R98.8Very high98.7Very high103 Ų10396.8 Ų96.839%0.38948%0.478SS..Hα-helixtrans-63.3-36.9175.9-163.6-161.762.161.5-1.7112.6E295 E296 C297 Q303E295-R299 WeakPolarHBondContact O-CB 3.4Å; E295-R299 PolarHBondContact O-N 3.4Å; E296-R299 WeakPolarHBondContact O-CB 3.38Å; E296-R299 PolarHBondContact O-N 2.96Å; E296-R299 IonicContact OE1-CZ 2.68Å; E296-R299 IonicContact OE1-NE 3.98Å; E296-R299 PolarHBondContact OE1-NE 2.9Å; E296-R299 IonicContact OE1-NH2 3.15Å; E296-R299 PolarHBondContact OE1-NH2 2.94Å; E296-R299 IonicContact OE2-CZ 2.68Å; E296-R299 IonicContact OE2-NE 3.58Å; E296-R299 PolarHBondContact OE2-NE 2.86Å; E296-R299 IonicContact OE2-NH2 2.69Å; C297-R299 PolarHBondContact O-N 3.41Å; R299-Q303 VanDerWaalsContact NH1-NE2 3.17Å; R299-Q303 WeakPolarHBondContact O-CG 3.46Å; R299-Q303 PolarHBondContact O-N 2.93Å
300V98.8Very high98.7Very high72 Ų7296.1 Ų96.144%0.43648%0.475SS..Hα-helixtrans-77.5-39.9177.9170.60000111.5E296 C297 H298 A302 Q303 L304E296-V300 WeakPolarHBondContact O-CG2 3.36Å; E296-V300 PolarHBondContact O-N 3.17Å; C297-V300 PolarHBondContact O-N 3.3Å; H298-V300 VanDerWaalsContact C-N 3.34Å; H298-V300 PolarHBondContact O-N 2.84Å; V300-A302 PolarHBondContact O-N 2.84Å; V300-Q303 CarbonylContact O-C 3.57Å; V300-Q303 WeakPolarHBondContact O-CA 3.39Å; V300-Q303 WeakPolarHBondContact O-CB 3.3Å; V300-Q303 PolarHBondContact O-N 2.98Å; V300-L304 PolarHBondContact O-N 2.68Å
301E98.6Very high98.7Very high110 Ų11097.4 Ų97.451%0.51448%0.479SS..Hα-helixtrans-62.1-42.4175.5-69.1179.3161.400112.2C297 H298 Q303 L304 S305C297-E301 WeakPolarHBondContact O-CG 3.13Å; C297-E301 PolarHBondContact O-N 3.41Å; H298-E301 IonicContact CD2-OE2 2.64Å; H298-E301 PolarHBondContact O-N 2.97Å; E301-Q303 VanDerWaalsContact C-N 3.25Å; E301-Q303 PolarHBondContact O-N 2.71Å; E301-L304 PolarHBondContact O-N 2.94Å; E301-L304 VanDerWaalsContact O-N 3.17Å; E301-S305 PolarHBondContact O-N 3.29Å; E301-S305 PolarHBondContact O-OG 2.95Å
302A98.7Very high98.7Very high58 Ų5898.1 Ų98.148%0.47948%0.48SS..Hα-helixtrans-61.6-31.9172.100000112.7H298 V300 S305 L306H298-A302 WeakPolarHBondContact O-CB 3.37Å; H298-A302 PolarHBondContact O-N 3.39Å; V300-A302 PolarHBondContact O-N 2.84Å; A302-S305 WeakPolarHBondContact CA-OG 3.36Å; A302-S305 PolarHBondContact O-OG 3.4Å; A302-L306 VanDerWaalsContact O-CB 3.23Å; A302-L306 WeakPolarHBondContact O-CB 3.14Å; A302-L306 PolarHBondContact O-N 2.91Å
303Q98.7Very high98.7Very high96 Ų9695 Ų9545%0.44947%0.474SS..Hα-helixtrans-77.4-30.2174.1-76.6-176.1-19.300113.3R299 V300 E301 K307R299-Q303 VanDerWaalsContact NH1-NE2 3.17Å; R299-Q303 WeakPolarHBondContact O-CG 3.46Å; R299-Q303 PolarHBondContact O-N 2.93Å; V300-Q303 CarbonylContact O-C 3.57Å; V300-Q303 WeakPolarHBondContact O-CA 3.39Å; V300-Q303 WeakPolarHBondContact O-CB 3.3Å; V300-Q303 PolarHBondContact O-N 2.98Å; E301-Q303 VanDerWaalsContact C-N 3.25Å; E301-Q303 PolarHBondContact O-N 2.71Å; Q303-K307 VanDerWaalsContact O-CG 3.29Å; Q303-K307 WeakPolarHBondContact O-CG 3.49Å; Q303-K307 PolarHBondContact O-N 2.92Å
304L98.7Very high98.7Very high113 Ų11398.8 Ų98.859%0.59248%0.483SS*.Hα-helixtrans-73.6-51.8177.6-176.660000111.1V300 E301 L306 K307 E308V300-L304 PolarHBondContact O-N 2.68Å; E301-L304 PolarHBondContact O-N 2.94Å; E301-L304 VanDerWaalsContact O-N 3.17Å; L304-L306 VanDerWaalsContact C-N 3.29Å; L304-L306 PolarHBondContact O-N 2.97Å; L304-K307 WeakPolarHBondContact O-CA 3.42Å; L304-K307 WeakPolarHBondContact O-CB 3.48Å; L304-K307 PolarHBondContact O-N 3.46Å; L304-E308 PolarHBondContact O-N 3.08Å
305S98.8Very high98.7Very high65 Ų6598.1 Ų98.146%0.45548%0.48SS..Hα-helixtrans-57.2-39.5175.2510000112.4E301 A302 K307 E308 A309E301-S305 PolarHBondContact O-N 3.29Å; E301-S305 PolarHBondContact O-OG 2.95Å; A302-S305 WeakPolarHBondContact CA-OG 3.36Å; A302-S305 PolarHBondContact O-OG 3.4Å; S305-K307 PolarHBondContact O-N 2.81Å; S305-E308 PolarHBondContact O-N 3.4Å; S305-A309 WeakPolarHBondContact O-CB 3.46Å; S305-A309 PolarHBondContact O-N 3.03Å
306L98.8Very high98.7Very high83 Ų8396.5 Ų96.544%0.43548%0.476SS..Hα-helixtrans-64.8-34.7172.9-179.960.4000113.2A302 L304 R310A302-L306 VanDerWaalsContact O-CB 3.23Å; A302-L306 WeakPolarHBondContact O-CB 3.14Å; A302-L306 PolarHBondContact O-N 2.91Å; L304-L306 VanDerWaalsContact C-N 3.29Å; L304-L306 PolarHBondContact O-N 2.97Å; L306-R310 HydrophobicContact CD1-CG 4.44Å; L306-R310 WeakPolarHBondContact O-CB 3.49Å; L306-R310 VanDerWaalsContact O-CD 3.3Å; L306-R310 WeakPolarHBondContact O-CD 3.38Å; L306-R310 WeakPolarHBondContact O-CG 3.47Å; L306-R310 PolarHBondContact O-N 2.68Å; L306-R310 VanDerWaalsContact O-N 3.16Å
307K98.8Very high98.7Very high138 Ų138101.3 Ų101.360%0.649%0.491SS*.Hα-helixtrans-69.9-37.1174.4-76.9170179.8177.30111.6Q303 L304 S305 K311Q303-K307 VanDerWaalsContact O-CG 3.29Å; Q303-K307 WeakPolarHBondContact O-CG 3.49Å; Q303-K307 PolarHBondContact O-N 2.92Å; L304-K307 WeakPolarHBondContact O-CA 3.42Å; L304-K307 WeakPolarHBondContact O-CB 3.48Å; L304-K307 PolarHBondContact O-N 3.46Å; S305-K307 PolarHBondContact O-N 2.81Å; K307-K311 PolarHBondContact O-N 3.43Å; K307-K311 VanDerWaalsContact O-N 3.13Å
308E98.6Very high98.7Very high113 Ų113105 Ų10553%0.52850%0.502SS..Hα-helixtrans-67.8-53176.7-175.5154.8-127.200111.8L304 S305 R310 K311 E312L304-E308 PolarHBondContact O-N 3.08Å; S305-E308 PolarHBondContact O-N 3.4Å; E308-R310 PolarHBondContact O-N 3Å; E308-K311 WeakPolarHBondContact O-CA 3.28Å; E308-K311 VanDerWaalsContact O-CB 3.26Å; E308-K311 WeakPolarHBondContact O-CB 3.41Å; E308-K311 PolarHBondContact O-N 3.14Å; E308-E312 PolarHBondContact O-N 3.29Å
309A98.7Very high98.7Very high40 Ų40103.7 Ų103.733%0.33150%0.501SS..Hα-helixtrans-56.1-37.4174.500000112.3S305 K311 E312 I313S305-A309 WeakPolarHBondContact O-CB 3.46Å; S305-A309 PolarHBondContact O-N 3.03Å; A309-K311 VanDerWaalsContact C-N 3.32Å; A309-K311 PolarHBondContact O-N 3.41Å; A309-E312 PolarHBondContact O-N 2.9Å; A309-I313 WeakPolarHBondContact O-CB 3.43Å; A309-I313 WeakPolarHBondContact O-CD1 3.44Å; A309-I313 WeakPolarHBondContact O-CG1 3.48Å; A309-I313 PolarHBondContact O-N 3.43Å
310R98.7Very high98.7Very high127 Ų127103.4 Ų103.448%0.47951%0.511SS..Hα-helixtrans-65.7-29.5172.9-77.1169.8174.3176.7-3.8113.5L306 E308 R314L306-R310 HydrophobicContact CD1-CG 4.44Å; L306-R310 WeakPolarHBondContact O-CB 3.49Å; L306-R310 VanDerWaalsContact O-CD 3.3Å; L306-R310 WeakPolarHBondContact O-CD 3.38Å; L306-R310 WeakPolarHBondContact O-CG 3.47Å; L306-R310 PolarHBondContact O-N 2.68Å; L306-R310 VanDerWaalsContact O-N 3.16Å; E308-R310 PolarHBondContact O-N 3Å; R310-R314 WeakPolarHBondContact O-CG 3.49Å; R310-R314 VanDerWaalsContact O-CZ 3.29Å; R310-R314 PolarHBondContact O-N 2.91Å; R310-R314 PolarHBondContact O-NH1 3.25Å
311K98.7Very high98.6Very high111 Ų111103.8 Ų103.848%0.48351%0.508SS..Hα-helixtrans-73.2-46.6173.3179.1-167.2168.5-165.50110.4K307 E308 A309 I313 R314 Q315K307-K311 PolarHBondContact O-N 3.43Å; K307-K311 VanDerWaalsContact O-N 3.13Å; E308-K311 WeakPolarHBondContact O-CA 3.28Å; E308-K311 VanDerWaalsContact O-CB 3.26Å; E308-K311 WeakPolarHBondContact O-CB 3.41Å; E308-K311 PolarHBondContact O-N 3.14Å; A309-K311 VanDerWaalsContact C-N 3.32Å; A309-K311 PolarHBondContact O-N 3.41Å; K311-I313 PolarHBondContact O-N 3.27Å; K311-R314 PolarHBondContact O-N 3.46Å; K311-R314 VanDerWaalsContact O-N 3.14Å; K311-Q315 WeakPolarHBondContact O-CG 3.24Å; K311-Q315 PolarHBondContact O-N 2.84Å
312E98.5Very high98.6Very high106 Ų106102.5 Ų102.550%0.49551%0.508SS..Hα-helixtrans-58.8-46176.3-65.6-177.216100111.7E308 A309 R314 Q315 L316E308-E312 PolarHBondContact O-N 3.29Å; A309-E312 PolarHBondContact O-N 2.9Å; E312-R314 VanDerWaalsContact C-N 3.28Å; E312-R314 PolarHBondContact O-N 3.26Å; E312-Q315 PolarHBondContact O-N 2.95Å; E312-Q315 VanDerWaalsContact O-N 3.08Å; E312-L316 WeakPolarHBondContact O-CB 3.28Å; E312-L316 WeakPolarHBondContact O-CG 3.43Å; E312-L316 PolarHBondContact O-N 2.9Å
313I98.6Very high98.6Very high90 Ų90105.4 Ų105.446%0.46251%0.513SS..Hα-helixtrans-57.7-38.9176.1-71.1164.2000111.7A309 K311 R317A309-I313 WeakPolarHBondContact O-CB 3.43Å; A309-I313 WeakPolarHBondContact O-CD1 3.44Å; A309-I313 WeakPolarHBondContact O-CG1 3.48Å; A309-I313 PolarHBondContact O-N 3.43Å; K311-I313 PolarHBondContact O-N 3.27Å; I313-R317 WeakPolarHBondContact O-CB 3.32Å; I313-R317 VanDerWaalsContact O-CG 3.28Å; I313-R317 WeakPolarHBondContact O-CG 3.38Å; I313-R317 PolarHBondContact O-N 3.32Å
314R98.6Very high98.6Very high152 Ų152105.6 Ų105.657%0.57451%0.512SS*.Hα-helixtrans-67.6-42.2174.4-74-172.9-61.5-89.3-1.2112.1R310 K311 E312 R317 Q318R310-R314 WeakPolarHBondContact O-CG 3.49Å; R310-R314 VanDerWaalsContact O-CZ 3.29Å; R310-R314 PolarHBondContact O-N 2.91Å; R310-R314 PolarHBondContact O-NH1 3.25Å; K311-R314 PolarHBondContact O-N 3.46Å; K311-R314 VanDerWaalsContact O-N 3.14Å; E312-R314 VanDerWaalsContact C-N 3.28Å; E312-R314 PolarHBondContact O-N 3.26Å; R314-R317 PolarHBondContact O-N 3.38Å; R314-Q318 PolarHBondContact O-N 3.3Å
315Q98.6Very high98.5Very high103 Ų103104 Ų10448%0.48150%0.504SS..Hα-helixtrans-63.3-45177-68.2175.2-69.800111.3K311 E312 Q318 V319K311-Q315 WeakPolarHBondContact O-CG 3.24Å; K311-Q315 PolarHBondContact O-N 2.84Å; E312-Q315 PolarHBondContact O-N 2.95Å; E312-Q315 VanDerWaalsContact O-N 3.08Å; Q315-Q318 PolarHBondContact O-N 3.43Å; Q315-V319 WeakPolarHBondContact O-CG2 3.19Å; Q315-V319 PolarHBondContact O-N 3.29Å
316L98.8Very high98.5Very high112 Ų112103.2 Ų103.259%0.58650%0.499SS*.Hα-helixtrans-62.5-42.8175.7-69.5171.7000112.1E312 Q318 V319 V320E312-L316 WeakPolarHBondContact O-CB 3.28Å; E312-L316 WeakPolarHBondContact O-CG 3.43Å; E312-L316 PolarHBondContact O-N 2.9Å; L316-Q318 VanDerWaalsContact C-N 3.32Å; L316-Q318 PolarHBondContact O-N 2.88Å; L316-V319 PolarHBondContact O-N 3.31Å; L316-V320 WeakPolarHBondContact O-CG2 3.29Å; L316-V320 PolarHBondContact O-N 2.8Å
317R98.6Very high98.5Very high169 Ų169104 Ų10464%0.63850%0.503SS*.Hα-helixtrans-56.7-44.7172.2-79176.2178.6-166.5-0.2111.7I313 R314 V320 E321I313-R317 WeakPolarHBondContact O-CB 3.32Å; I313-R317 VanDerWaalsContact O-CG 3.28Å; I313-R317 WeakPolarHBondContact O-CG 3.38Å; I313-R317 PolarHBondContact O-N 3.32Å; R314-R317 PolarHBondContact O-N 3.38Å; R317-V320 PolarHBondContact O-N 2.79Å; R317-E321 WeakPolarHBondContact O-CB 3.13Å; R317-E321 PolarHBondContact O-N 3.17Å
318Q98.6Very high98.4Very high138 Ų138102.1 Ų102.165%0.64550%0.497SS*.Hα-helixtrans-69.3-35.2179.7-168.1167.89.800112.8R314 Q315 L316 E321 T322R314-Q318 PolarHBondContact O-N 3.3Å; Q315-Q318 PolarHBondContact O-N 3.43Å; L316-Q318 VanDerWaalsContact C-N 3.32Å; L316-Q318 PolarHBondContact O-N 2.88Å; Q318-E321 PolarHBondContact O-N 3.45Å; Q318-T322 WeakPolarHBondContact O-CG2 3.46Å; Q318-T322 PolarHBondContact O-N 3.38Å; Q318-T322 PolarHBondContact O-OG1 3.36Å; Q318-T322 VanDerWaalsContact O-OG1 3.13Å
319V98.6Very high98.3Very high79 Ų79103.6 Ų103.648%0.47950%0.504SS..Hα-helixtrans-63.8-46171.4172.40000110.9Q315 L316 E321 T322 M323Q315-V319 WeakPolarHBondContact O-CG2 3.19Å; Q315-V319 PolarHBondContact O-N 3.29Å; L316-V319 PolarHBondContact O-N 3.31Å; V319-E321 VanDerWaalsContact C-N 3.31Å; V319-E321 PolarHBondContact O-N 2.95Å; V319-T322 PolarHBondContact O-N 3.16Å; V319-T322 PolarHBondContact O-OG1 3.34Å; V319-M323 HydrophobicContact CG1-CG 4.49Å; V319-M323 HydrophobicContact CG1-SD 4.05Å; V319-M323 WeakPolarHBondContact O-CB 3.39Å; V319-M323 VanDerWaalsContact O-CG 3.31Å; V319-M323 WeakPolarHBondContact O-CG 3.26Å; V319-M323 PolarHBondContact O-N 3.25Å
320V98.6Very high98.2Very high97 Ų97108.2 Ų108.259%0.58852%0.517SS*.Hα-helixtrans-60.6-40.8175.5170.40000111.4L316 R317 M323 K324L316-V320 WeakPolarHBondContact O-CG2 3.29Å; L316-V320 PolarHBondContact O-N 2.8Å; R317-V320 PolarHBondContact O-N 2.79Å; V320-M323 PolarHBondContact O-N 3.36Å; V320-K324 WeakPolarHBondContact O-CB 3.36Å; V320-K324 PolarHBondContact O-N 3.36Å
321E98.4Very high98.2Very high80 Ų80105 Ų10537%0.37451%0.509SS..Hα-helixtrans-66.4-44.3178.7-176.856-151.600112.5R317 Q318 V319 K324 N325R317-E321 WeakPolarHBondContact O-CB 3.13Å; R317-E321 PolarHBondContact O-N 3.17Å; Q318-E321 PolarHBondContact O-N 3.45Å; V319-E321 VanDerWaalsContact C-N 3.31Å; V319-E321 PolarHBondContact O-N 2.95Å; E321-K324 WeakPolarHBondContact O-CB 3.44Å; E321-K324 PolarHBondContact O-N 2.93Å; E321-K324 VanDerWaalsContact OE1-CE 3.3Å; E321-K324 WeakPolarHBondContact OE1-CE 3.13Å; E321-K324 IonicContact OE1-NZ 3.77Å; E321-K324 PolarHBondContact OE1-NZ 3Å; E321-K324 WeakPolarHBondContact OE2-CE 3.44Å; E321-K324 IonicContact OE2-NZ 3.8Å; E321-K324 PolarHBondContact OE2-NZ 3.29Å; E321-N325 VanDerWaalsContact O-CG 3.27Å; E321-N325 PolarHBondContact O-N 2.82Å; E321-N325 PolarHBondContact O-ND2 3.49Å; E321-N325 VanDerWaalsContact O-ND2 3.17Å; E321-N325 PolarHBondContact OE1-ND2 2.99Å; E321-N325 PolarHBondContact OE1-OD1 3.49Å
322T98.2Very high98.1Very high83 Ų83106.4 Ų106.451%0.50952%0.515SS..Hα-helixtrans-64.8-39174.354.40000112.1Q318 V319 N325 S326Q318-T322 WeakPolarHBondContact O-CG2 3.46Å; Q318-T322 PolarHBondContact O-N 3.38Å; Q318-T322 PolarHBondContact O-OG1 3.36Å; Q318-T322 VanDerWaalsContact O-OG1 3.13Å; V319-T322 PolarHBondContact O-N 3.16Å; V319-T322 PolarHBondContact O-OG1 3.34Å; T322-N325 PolarHBondContact O-N 2.98Å; T322-S326 PolarHBondContact O-N 2.96Å
323M98.6Very high98Very high119 Ų119102.7 Ų102.759%0.58651%0.506SS*.Hα-helixtrans-61.9-47172.8-73.7179.967.500111.8V319 V320 N325 S326 L327V319-M323 HydrophobicContact CG1-CG 4.49Å; V319-M323 HydrophobicContact CG1-SD 4.05Å; V319-M323 WeakPolarHBondContact O-CB 3.39Å; V319-M323 VanDerWaalsContact O-CG 3.31Å; V319-M323 WeakPolarHBondContact O-CG 3.26Å; V319-M323 PolarHBondContact O-N 3.25Å; V320-M323 PolarHBondContact O-N 3.36Å; M323-N325 VanDerWaalsContact C-N 3.32Å; M323-N325 PolarHBondContact O-N 2.8Å; M323-S326 PolarHBondContact O-N 2.89Å; M323-S326 PolarHBondContact O-OG 3.19Å; M323-L327 PolarHBondContact O-N 2.84Å
324K98.3Very high98Very high100 Ų100102.4 Ų102.444%0.43550%0.504SS..Hα-helixtrans-55.2-47175.6-173-160.776.2-167.20111.1V320 E321 S326 L327 M328V320-K324 WeakPolarHBondContact O-CB 3.36Å; V320-K324 PolarHBondContact O-N 3.36Å; E321-K324 WeakPolarHBondContact O-CB 3.44Å; E321-K324 PolarHBondContact O-N 2.93Å; E321-K324 VanDerWaalsContact OE1-CE 3.3Å; E321-K324 WeakPolarHBondContact OE1-CE 3.13Å; E321-K324 IonicContact OE1-NZ 3.77Å; E321-K324 PolarHBondContact OE1-NZ 3Å; E321-K324 WeakPolarHBondContact OE2-CE 3.44Å; E321-K324 IonicContact OE2-NZ 3.8Å; E321-K324 PolarHBondContact OE2-NZ 3.29Å; K324-S326 PolarHBondContact O-N 2.83Å; K324-L327 WeakPolarHBondContact O-CB 3.38Å; K324-L327 PolarHBondContact O-N 3.46Å; K324-L327 VanDerWaalsContact O-N 3.14Å; K324-M328 WeakPolarHBondContact O-CG 3.22Å; K324-M328 PolarHBondContact O-N 2.95Å
325N97.8Very high98Very high79 Ų79101 Ų10142%0.42250%0.504SS..Hα-helixtrans-68.5-36.1-178.6-65.5-26.2000112E321 T322 M323 L327 M328 E329E321-N325 VanDerWaalsContact O-CG 3.27Å; E321-N325 PolarHBondContact O-N 2.82Å; E321-N325 PolarHBondContact O-ND2 3.49Å; E321-N325 VanDerWaalsContact O-ND2 3.17Å; E321-N325 PolarHBondContact OE1-ND2 2.99Å; E321-N325 PolarHBondContact OE1-OD1 3.49Å; T322-N325 PolarHBondContact O-N 2.98Å; M323-N325 VanDerWaalsContact C-N 3.32Å; M323-N325 PolarHBondContact O-N 2.8Å; N325-L327 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.29Å; N325-M328 PolarHBondContact O-N 3.13Å; N325-E329 PolarHBondContact O-N 3.18Å
326S97.8Very high97.9Very high49 Ų49101.7 Ų101.734%0.34351%0.506SS..Hα-helixtrans-67.9-26171.480.30000114T322 M323 K324 K330T322-S326 PolarHBondContact O-N 2.96Å; M323-S326 PolarHBondContact O-N 2.89Å; M323-S326 PolarHBondContact O-OG 3.19Å; K324-S326 PolarHBondContact O-N 2.83Å; S326-K330 WeakPolarHBondContact O-CG 3.33Å; S326-K330 PolarHBondContact O-N 2.92Å
327L98Very high97.9Very high100 Ų100103.8 Ų103.852%0.52451%0.507SS..Hα-helixtrans-76.8-46.3174.2-176.561.2000110.5M323 K324 N325 E329 K330 D331M323-L327 PolarHBondContact O-N 2.84Å; K324-L327 WeakPolarHBondContact O-CB 3.38Å; K324-L327 PolarHBondContact O-N 3.46Å; K324-L327 VanDerWaalsContact O-N 3.14Å; N325-L327 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.29Å; L327-E329 PolarHBondContact O-N 3.44Å; L327-K330 CarbonylContact O-C 3.58Å; L327-K330 WeakPolarHBondContact O-CA 3.46Å; L327-K330 WeakPolarHBondContact O-CB 3.29Å; L327-K330 PolarHBondContact O-N 3.38Å; L327-D331 PolarHBondContact O-N 2.97Å
328M96.7Very high97.9Very high98 Ų98102.7 Ų102.748%0.48351%0.507SS..Hα-helixtrans-57.3-32.4173.6-70.2-63.7-6000112.9K324 N325 K332K324-M328 WeakPolarHBondContact O-CG 3.22Å; K324-M328 PolarHBondContact O-N 2.95Å; N325-M328 PolarHBondContact O-N 3.13Å; M328-K332 WeakPolarHBondContact O-CG 3.26Å; M328-K332 PolarHBondContact O-N 3.04Å
329E96.9Very high97.9Very high144 Ų144100.9 Ų100.967%0.67350%0.501SS*.Hα-helixtrans-68.6-44.1172.4-175.1175.2-152.200112.2N325 L327 K332 G333N325-E329 PolarHBondContact O-N 3.18Å; L327-E329 PolarHBondContact O-N 3.44Å; E329-K332 PolarHBondContact O-N 3.16Å; E329-G333 PolarHBondContact O-N 2.95Å
330K97.1Very high97.9Very high136 Ų13699.7 Ų99.759%0.59149%0.492SS*.Hα-helixtrans-65.5-38.3175.3-72.9171.3-178.1172.70112.3S326 L327 K332 G333 I334S326-K330 WeakPolarHBondContact O-CG 3.33Å; S326-K330 PolarHBondContact O-N 2.92Å; L327-K330 CarbonylContact O-C 3.58Å; L327-K330 WeakPolarHBondContact O-CA 3.46Å; L327-K330 WeakPolarHBondContact O-CB 3.29Å; L327-K330 PolarHBondContact O-N 3.38Å; K330-K332 VanDerWaalsContact C-N 3.33Å; K330-K332 PolarHBondContact O-N 3.11Å; K330-G333 CarbonylContact O-C 3.54Å; K330-G333 WeakPolarHBondContact O-CA 3.43Å; K330-G333 PolarHBondContact O-N 2.9Å; K330-I334 WeakPolarHBondContact O-CG1 3.37Å; K330-I334 PolarHBondContact O-N 3.33Å
331D98.1Very high97.9Very high59 Ų5999.2 Ų99.232%0.31649%0.485SS..Hα-helixtrans-64.1-37.5177.3-71.5-13.9000111.6L327 G333 I334 Q335L327-D331 PolarHBondContact O-N 2.97Å; D331-G333 VanDerWaalsContact C-N 3.32Å; D331-G333 PolarHBondContact O-N 3.37Å; D331-I334 PolarHBondContact O-N 3.26Å; D331-Q335 WeakPolarHBondContact O-CB 3.49Å; D331-Q335 VanDerWaalsContact O-CG 3.29Å; D331-Q335 WeakPolarHBondContact O-CG 3.42Å; D331-Q335 PolarHBondContact O-N 3.04Å
332K97.4Very high97.8Very high141 Ų14199.7 Ų99.761%0.61349%0.49SS*.Hα-helixtrans-61.4-39.9169.2-70.5168.1-176.2179.10111.9M328 E329 K330 Q335 K336M328-K332 WeakPolarHBondContact O-CG 3.26Å; M328-K332 PolarHBondContact O-N 3.04Å; E329-K332 PolarHBondContact O-N 3.16Å; K330-K332 VanDerWaalsContact C-N 3.33Å; K330-K332 PolarHBondContact O-N 3.11Å; K332-Q335 PolarHBondContact O-N 3.3Å; K332-K336 PolarHBondContact O-N 2.93Å
333G97Very high97.8Very high29 Ų2999.4 Ų99.430%0.29948%0.484SS..Hα-helixtrans-61.2-43.4172.700000112.8E329 K330 D331 K336 Y337E329-G333 PolarHBondContact O-N 2.95Å; K330-G333 CarbonylContact O-C 3.54Å; K330-G333 WeakPolarHBondContact O-CA 3.43Å; K330-G333 PolarHBondContact O-N 2.9Å; D331-G333 VanDerWaalsContact C-N 3.32Å; D331-G333 PolarHBondContact O-N 3.37Å; G333-K336 WeakPolarHBondContact O-CB 3.4Å; G333-K336 PolarHBondContact O-N 3.3Å; G333-Y337 WeakPolarHBondContact O-CD2 3.37Å; G333-Y337 PolarHBondContact O-N 3.07Å; G333-Y337 VanDerWaalsContact O-N 3.12Å
334I97.7Very high97.8Very high84 Ų8499.5 Ų99.543%0.43148%0.483SS..Hα-helixtrans-64.6-45.4176.2-67.4164.9000110.9K330 D331 K336 Y337 F338K330-I334 WeakPolarHBondContact O-CG1 3.37Å; K330-I334 PolarHBondContact O-N 3.33Å; D331-I334 PolarHBondContact O-N 3.26Å; I334-K336 VanDerWaalsContact C-N 3.3Å; I334-K336 PolarHBondContact O-N 3.04Å; I334-Y337 PolarHBondContact O-N 3.35Å; I334-Y337 VanDerWaalsContact O-N 3.12Å; I334-F338 HydrophobicContact CG2-CD2 3.91Å; I334-F338 HydrophobicContact CG2-CE2 3.73Å; I334-F338 WeakPolarHBondContact O-CD2 3.22Å; I334-F338 PolarHBondContact O-N 3.4Å
335Q97.9Very high97.8Very high121 Ų12198.4 Ų98.457%0.56548%0.482SS*.Hα-helixtrans-58-41174.2-72.8171.99.200111.8D331 K332 Y337 F338 I339D331-Q335 WeakPolarHBondContact O-CB 3.49Å; D331-Q335 VanDerWaalsContact O-CG 3.29Å; D331-Q335 WeakPolarHBondContact O-CG 3.42Å; D331-Q335 PolarHBondContact O-N 3.04Å; K332-Q335 PolarHBondContact O-N 3.3Å; Q335-Y337 PolarHBondContact O-N 2.94Å; Q335-F338 PolarHBondContact O-N 3.07Å; Q335-I339 WeakPolarHBondContact O-CG1 3.46Å; Q335-I339 PolarHBondContact O-N 2.62Å
336K97.8Very high97.8Very high119 Ų119102.9 Ų102.952%0.51749%0.493SS..Hα-helixtrans-58.8-46.4173.5-168.7-168.2178.4-82.50111.6K332 G333 I334 F338 I339 D340K332-K336 PolarHBondContact O-N 2.93Å; G333-K336 WeakPolarHBondContact O-CB 3.4Å; G333-K336 PolarHBondContact O-N 3.3Å; I334-K336 VanDerWaalsContact C-N 3.3Å; I334-K336 PolarHBondContact O-N 3.04Å; K336-F338 VanDerWaalsContact C-N 3.33Å; K336-F338 PolarHBondContact O-N 3.39Å; K336-I339 PolarHBondContact O-N 3.45Å; K336-I339 VanDerWaalsContact O-N 3.14Å; K336-D340 IonicContact NZ-OD1 2.76Å; K336-D340 IonicContact NZ-OD2 3.61Å; K336-D340 PolarHBondContact NZ-OD2 2.91Å; K336-D340 PolarHBondContact O-N 3.45Å
337Y98.1Very high97.9Very high156 Ų156107.2 Ų107.261%0.61251%0.506SS*.Hα-helixtrans-61.5-38.8177.1-68.7-59.5000112.5G333 I334 Q335 I339 D340 I341G333-Y337 WeakPolarHBondContact O-CD2 3.37Å; G333-Y337 PolarHBondContact O-N 3.07Å; G333-Y337 VanDerWaalsContact O-N 3.12Å; I334-Y337 PolarHBondContact O-N 3.35Å; I334-Y337 VanDerWaalsContact O-N 3.12Å; Q335-Y337 PolarHBondContact O-N 2.94Å; Y337-I339 VanDerWaalsContact C-N 3.35Å; Y337-I339 PolarHBondContact O-N 2.96Å; Y337-D340 PolarHBondContact O-N 3Å; Y337-I341 WeakPolarHBondContact O-CB 3.24Å; Y337-I341 WeakPolarHBondContact O-CD1 3.3Å; Y337-I341 WeakPolarHBondContact O-CG1 3.36Å; Y337-I341 PolarHBondContact O-N 3.43Å
338F98.4Very high97.9Very high146 Ų146107.5 Ų107.564%0.6451%0.508SS*.Hα-helixtrans-61.8-40.3173-84.5-73.4000112.7I334 Q335 K336 N342I334-F338 HydrophobicContact CG2-CD2 3.91Å; I334-F338 HydrophobicContact CG2-CE2 3.73Å; I334-F338 WeakPolarHBondContact O-CD2 3.22Å; I334-F338 PolarHBondContact O-N 3.4Å; Q335-F338 PolarHBondContact O-N 3.07Å; K336-F338 VanDerWaalsContact C-N 3.33Å; K336-F338 PolarHBondContact O-N 3.39Å; F338-N342 VanDerWaalsContact O-CB 3.29Å; F338-N342 WeakPolarHBondContact O-CB 3.48Å; F338-N342 PolarHBondContact O-N 3.49Å
339I98.1Very high97.9Very high100 Ų100108.7 Ų108.751%0.51351%0.512SS..Hα-helixtrans-65.9-48.1175.8-66.6163.5000110.6Q335 K336 Y337 I341 N342 I343Q335-I339 WeakPolarHBondContact O-CG1 3.46Å; Q335-I339 PolarHBondContact O-N 2.62Å; K336-I339 PolarHBondContact O-N 3.45Å; K336-I339 VanDerWaalsContact O-N 3.14Å; Y337-I339 VanDerWaalsContact C-N 3.35Å; Y337-I339 PolarHBondContact O-N 2.96Å; I339-I341 PolarHBondContact O-N 3.32Å; I339-N342 PolarHBondContact O-N 2.93Å; I339-I343 HydrophobicContact CG2-CD1 3.76Å; I339-I343 HydrophobicContact CG2-CG1 4.5Å; I339-I343 VanDerWaalsContact O-CG1 3.31Å; I339-I343 WeakPolarHBondContact O-CG1 3.43Å; I339-I343 PolarHBondContact O-N 3.27Å
340D98.4Very high98Very high54 Ų54105.9 Ų105.929%0.28951%0.508SS..Hα-helixtrans-60.5-43179.5-72.3-27.5000111.4K336 Y337 I343 Q344K336-D340 IonicContact NZ-OD1 2.76Å; K336-D340 IonicContact NZ-OD2 3.61Å; K336-D340 PolarHBondContact NZ-OD2 2.91Å; K336-D340 PolarHBondContact O-N 3.45Å; Y337-D340 PolarHBondContact O-N 3Å; D340-I343 PolarHBondContact O-N 2.82Å; D340-Q344 WeakPolarHBondContact O-CG 3.47Å; D340-Q344 PolarHBondContact O-N 3.28Å
341I98.3Very high98Very high87 Ų87105 Ų10545%0.44651%0.509SS..Hα-helixtrans-64-44.6175.6-70.7165.1000111.1Y337 I339 I343 Q344 N345Y337-I341 WeakPolarHBondContact O-CB 3.24Å; Y337-I341 WeakPolarHBondContact O-CD1 3.3Å; Y337-I341 WeakPolarHBondContact O-CG1 3.36Å; Y337-I341 PolarHBondContact O-N 3.43Å; I339-I341 PolarHBondContact O-N 3.32Å; I341-I343 VanDerWaalsContact C-N 3.33Å; I341-I343 PolarHBondContact O-N 3.41Å; I341-Q344 PolarHBondContact O-N 2.82Å; I341-Q344 VanDerWaalsContact O-N 3.13Å; I341-N345 PolarHBondContact O-N 2.91Å
342N98.1Very high98Very high89 Ų89107.2 Ų107.248%0.47652%0.52SS..Hα-helixtrans-63.6-39.1178.6-168.43.3000111.6F338 I339 N345 R346F338-N342 VanDerWaalsContact O-CB 3.29Å; F338-N342 WeakPolarHBondContact O-CB 3.48Å; F338-N342 PolarHBondContact O-N 3.49Å; I339-N342 PolarHBondContact O-N 2.93Å; N342-N345 PolarHBondContact O-N 3.5Å; N342-R346 PolarHBondContact O-N 3.33Å
343I98.3Very high97.9Very high78 Ų78105.3 Ų105.340%0.451%0.514SS..Hα-helixtrans-64.7-37.9172.8-68.8167.4000111.4I339 D340 I341 K347I339-I343 HydrophobicContact CG2-CD1 3.76Å; I339-I343 HydrophobicContact CG2-CG1 4.5Å; I339-I343 VanDerWaalsContact O-CG1 3.31Å; I339-I343 WeakPolarHBondContact O-CG1 3.43Å; I339-I343 PolarHBondContact O-N 3.27Å; D340-I343 PolarHBondContact O-N 2.82Å; I341-I343 VanDerWaalsContact C-N 3.33Å; I341-I343 PolarHBondContact O-N 3.41Å; I343-K347 HydrophobicContact CG2-CD 4.36Å; I343-K347 VanDerWaalsContact O-CG 3.32Å; I343-K347 WeakPolarHBondContact O-CG 3.23Å; I343-K347 PolarHBondContact O-N 2.9Å
344Q98.4Very high97.9Very high120 Ų120107.6 Ų107.656%0.56153%0.525SS*.Hα-helixtrans-67.8-42.3174.6-74.2-178.9700112.1D340 I341 K347 L348D340-Q344 WeakPolarHBondContact O-CG 3.47Å; D340-Q344 PolarHBondContact O-N 3.28Å; I341-Q344 PolarHBondContact O-N 2.82Å; I341-Q344 VanDerWaalsContact O-N 3.13Å; Q344-K347 WeakPolarHBondContact O-CB 3.38Å; Q344-K347 PolarHBondContact O-N 3.01Å; Q344-K347 VanDerWaalsContact O-N 3.15Å; Q344-L348 WeakPolarHBondContact O-CG 3.3Å; Q344-L348 PolarHBondContact O-N 3.07Å
345N98Very high97.8Very high77 Ų77108.5 Ų108.541%0.41253%0.529SS..Hα-helixtrans-60.5-46.9176-71.8-5.3000111.5I341 N342 K347 L348 E349I341-N345 PolarHBondContact O-N 2.91Å; N342-N345 PolarHBondContact O-N 3.5Å; N345-K347 VanDerWaalsContact C-N 3.26Å; N345-K347 PolarHBondContact O-N 3.17Å; N345-L348 CarbonylContact O-C 3.59Å; N345-L348 WeakPolarHBondContact O-CA 3.45Å; N345-L348 WeakPolarHBondContact O-CB 3.48Å; N345-L348 PolarHBondContact O-N 3.23Å; N345-E349 WeakPolarHBondContact O-CG 3.47Å; N345-E349 PolarHBondContact O-N 3.35Å
346R98.1Very high97.6Very high173 Ų173107.4 Ų107.465%0.65352%0.523SS*.Hα-helixtrans-59-34.3174-77.1-175.2171.4-167.1-3.2113.8N342 S350N342-R346 PolarHBondContact O-N 3.33Å; R346-S350 VanDerWaalsContact O-CB 3.28Å; R346-S350 WeakPolarHBondContact O-CB 3.46Å; R346-S350 PolarHBondContact O-N 3.38Å
347K98.3Very high97.3Very high140 Ų140106.7 Ų106.761%0.60953%0.525SS*.Hα-helixtrans-69.5-37.4173.9-73.7170.4-179.8179.60111.9I343 Q344 N345 L351I343-K347 HydrophobicContact CG2-CD 4.36Å; I343-K347 VanDerWaalsContact O-CG 3.32Å; I343-K347 WeakPolarHBondContact O-CG 3.23Å; I343-K347 PolarHBondContact O-N 2.9Å; Q344-K347 WeakPolarHBondContact O-CB 3.38Å; Q344-K347 PolarHBondContact O-N 3.01Å; Q344-K347 VanDerWaalsContact O-N 3.15Å; N345-K347 VanDerWaalsContact C-N 3.26Å; N345-K347 PolarHBondContact O-N 3.17Å; K347-L351 VanDerWaalsContact O-CB 3.25Å; K347-L351 WeakPolarHBondContact O-CB 3.45Å; K347-L351 PolarHBondContact O-N 3.25Å
348L98.4Very high97Very high107 Ų107102.9 Ų102.956%0.5653%0.526SS*.Hα-helixtrans-68.7-43.2174.9-70.1165.8000111.6Q344 N345 L351 L352Q344-L348 WeakPolarHBondContact O-CG 3.3Å; Q344-L348 PolarHBondContact O-N 3.07Å; N345-L348 CarbonylContact O-C 3.59Å; N345-L348 WeakPolarHBondContact O-CA 3.45Å; N345-L348 WeakPolarHBondContact O-CB 3.48Å; N345-L348 PolarHBondContact O-N 3.23Å; L348-L351 PolarHBondContact O-N 3.41Å; L348-L352 VanDerWaalsContact O-CB 3.27Å; L348-L352 WeakPolarHBondContact O-CB 3.45Å; L348-L352 PolarHBondContact O-N 3.35Å
349E97.6Very high96.3Very high123 Ų123102.1 Ų102.158%0.57552%0.524SS*.Hα-helixtrans-58.1-49.5172.6-70.5163.3-178.700111.1N345 L351 L352 H353N345-E349 WeakPolarHBondContact O-CG 3.47Å; N345-E349 PolarHBondContact O-N 3.35Å; E349-L351 PolarHBondContact O-N 3.21Å; E349-L352 PolarHBondContact O-N 3.38Å; E349-H353 WeakPolarHBondContact O-CB 3.14Å; E349-H353 PolarHBondContact O-N 3.04Å
350S97.8Very high95.2Very high84 Ų84100.7 Ų100.759%0.58752%0.523SS*.Hα-helixtrans-64.5-37.5178179.50000113.1R346 S354R346-S350 VanDerWaalsContact O-CB 3.28Å; R346-S350 WeakPolarHBondContact O-CB 3.46Å; R346-S350 PolarHBondContact O-N 3.38Å; S350-S354 WeakPolarHBondContact O-CB 3.25Å; S350-S354 PolarHBondContact O-N 3.31Å
351L98.1Very high93.4Very high117 Ų117101.6 Ų101.661%0.61355%0.545SS*.Hα-helixtrans-67-42.9174.6176.962.7000111.4K347 L348 E349 S354 M355K347-L351 VanDerWaalsContact O-CB 3.25Å; K347-L351 WeakPolarHBondContact O-CB 3.45Å; K347-L351 PolarHBondContact O-N 3.25Å; L348-L351 PolarHBondContact O-N 3.41Å; E349-L351 PolarHBondContact O-N 3.21Å; L351-S354 PolarHBondContact O-N 2.84Å; L351-M355 WeakPolarHBondContact O-CB 3.26Å; L351-M355 PolarHBondContact O-N 3.08Å
352L97.1Very high91.2Very high106 Ų106102.6 Ų102.656%0.55556%0.56SS**Hα-helixtrans-65.6-43.3179.3-173.8139.5000111.2L348 E349 M355 E356L348-L352 VanDerWaalsContact O-CB 3.27Å; L348-L352 WeakPolarHBondContact O-CB 3.45Å; L348-L352 PolarHBondContact O-N 3.35Å; E349-L352 PolarHBondContact O-N 3.38Å; L352-M355 WeakPolarHBondContact O-CB 3.45Å; L352-M355 PolarHBondContact O-N 3.31Å; L352-E356 WeakPolarHBondContact O-CB 3.47Å; L352-E356 PolarHBondContact O-N 2.86Å
353H96.3Very high88.9Confident102 Ų102102.1 Ų102.147%0.47257%0.568SS.*Hα-helixtrans-67.3-35.5174.7-168.252.4000112.3E349 M355 E356 L357E349-H353 WeakPolarHBondContact O-CB 3.14Å; E349-H353 PolarHBondContact O-N 3.04Å; H353-M355 VanDerWaalsContact C-N 3.32Å; H353-M355 PolarHBondContact O-N 3.38Å; H353-E356 IonicContact CE1-OE2 2.68Å; H353-E356 IonicContact CG-OE2 2.96Å; H353-E356 IonicContact ND1-OE2 3.5Å; H353-E356 PolarHBondContact ND1-OE2 3.33Å; H353-E356 PolarHBondContact O-N 2.9Å; H353-L357 WeakPolarHBondContact O-CB 3.45Å; H353-L357 WeakPolarHBondContact O-CG 3.46Å; H353-L357 PolarHBondContact O-N 3.04Å
354S95.8Very high86.7Confident77 Ų77105.3 Ų105.354%0.53859%0.585SS.*Hα-helixtrans-66.1-33.6172.1-173.60000112.9S350 L351 A358S350-S354 WeakPolarHBondContact O-CB 3.25Å; S350-S354 PolarHBondContact O-N 3.31Å; L351-S354 PolarHBondContact O-N 2.84Å; S354-A358 WeakPolarHBondContact O-CB 3.27Å; S354-A358 PolarHBondContact O-N 2.9Å
355M95.9Very high84.2Confident103 Ų103107.6 Ų107.651%0.50760%0.596SS.*Hα-helixtrans-73-40.1174.9-178.1179.967.500111.4L351 L352 H353 A358 Q359L351-M355 WeakPolarHBondContact O-CB 3.26Å; L351-M355 PolarHBondContact O-N 3.08Å; L352-M355 WeakPolarHBondContact O-CB 3.45Å; L352-M355 PolarHBondContact O-N 3.31Å; H353-M355 VanDerWaalsContact C-N 3.32Å; H353-M355 PolarHBondContact O-N 3.38Å; M355-A358 PolarHBondContact O-N 2.77Å; M355-Q359 WeakPolarHBondContact O-CG 3.34Å; M355-Q359 PolarHBondContact O-N 3.21Å
356E94.2Very high81.8Confident97 Ų97110.7 Ų110.745%0.45361%0.612SS.*Hα-helixtrans-59.5-46.7173.2176.6-179.7-135.400111.7L352 H353 A358 Q359 S360L352-E356 WeakPolarHBondContact O-CB 3.47Å; L352-E356 PolarHBondContact O-N 2.86Å; H353-E356 IonicContact CE1-OE2 2.68Å; H353-E356 IonicContact CG-OE2 2.96Å; H353-E356 IonicContact ND1-OE2 3.5Å; H353-E356 PolarHBondContact ND1-OE2 3.33Å; H353-E356 PolarHBondContact O-N 2.9Å; E356-A358 VanDerWaalsContact C-N 3.33Å; E356-A358 PolarHBondContact O-N 3.25Å; E356-Q359 PolarHBondContact O-N 2.99Å; E356-S360 VanDerWaalsContact O-CB 3.31Å; E356-S360 WeakPolarHBondContact O-CB 3.4Å; E356-S360 PolarHBondContact O-N 2.97Å; E356-S360 PolarHBondContact O-OG 3.49Å
357L92.6Very high79.3Confident105 Ų105109.9 Ų109.955%0.5562%0.616SS.*Hα-helixtrans-62.4-38.9174.6-72170.3000112.1H353 Q359 S360 G361H353-L357 WeakPolarHBondContact O-CB 3.45Å; H353-L357 WeakPolarHBondContact O-CG 3.46Å; H353-L357 PolarHBondContact O-N 3.04Å; L357-Q359 VanDerWaalsContact C-N 3.32Å; L357-Q359 PolarHBondContact O-N 3.4Å; L357-S360 PolarHBondContact O-N 2.96Å; L357-G361 PolarHBondContact O-N 3.07Å
358A91.4Very high77.2Confident76 Ų76106 Ų10663%0.62862%0.616SS**Hα-helixtrans-68.2-28.5176.900000113.4S354 M355 E356S354-A358 WeakPolarHBondContact O-CB 3.27Å; S354-A358 PolarHBondContact O-N 2.9Å; M355-A358 PolarHBondContact O-N 2.77Å; E356-A358 VanDerWaalsContact C-N 3.33Å; E356-A358 PolarHBondContact O-N 3.25Å
359Q82.8Confident74.9Confident129 Ų129105.3 Ų105.360%0.60363%0.626SS**Hα-helixtrans-81.9-42.4173.1-70178.94.800111.7M355 E356 L357 G361 S362M355-Q359 WeakPolarHBondContact O-CG 3.34Å; M355-Q359 PolarHBondContact O-N 3.21Å; E356-Q359 PolarHBondContact O-N 2.99Å; L357-Q359 VanDerWaalsContact C-N 3.32Å; L357-Q359 PolarHBondContact O-N 3.4Å; Q359-G361 PolarHBondContact O-N 3.47Å; Q359-S362 WeakPolarHBondContact O-CB 3.46Å; Q359-S362 PolarHBondContact O-N 2.72Å
360S74.8Confident72.6Confident70 Ų70107.2 Ų107.249%0.4964%0.639SS.*Hα-helixtrans-58.9-31.7174.5-59.50000112.2E356 L357 S362 A363E356-S360 VanDerWaalsContact O-CB 3.31Å; E356-S360 WeakPolarHBondContact O-CB 3.4Å; E356-S360 PolarHBondContact O-N 2.97Å; E356-S360 PolarHBondContact O-OG 3.49Å; L357-S360 PolarHBondContact O-N 2.96Å; S360-S362 PolarHBondContact O-N 3.49Å; S360-A363 WeakPolarHBondContact O-CB 3.37Å; S360-A363 PolarHBondContact O-N 2.68Å
361G61.5Low70.2Confident73 Ų73109.7 Ų109.775%0.75365%0.646SS**THydrogen-bonded Turntrans-62.7-6.8172.100000115.7L357 Q359L357-G361 PolarHBondContact O-N 3.07Å; Q359-G361 PolarHBondContact O-N 3.47Å
362S52Low67.4Low109 Ų109113.2 Ų113.276%0.76266%0.657SS**THydrogen-bonded Turntrans-106.7-3.3171.2-171.60000113.5Q359 S360 L364Q359-S362 WeakPolarHBondContact O-CB 3.46Å; Q359-S362 PolarHBondContact O-N 2.72Å; S360-S362 PolarHBondContact O-N 3.49Å; S362-L364 PolarHBondContact O-N 3.2Å
363A50.7Low64.7Low79 Ų79114.3 Ų114.365%0.65366%0.662SS**  trans-88.587.7-178.700000110.6S360 Q365S360-A363 WeakPolarHBondContact O-CB 3.37Å; S360-A363 PolarHBondContact O-N 2.68Å; A363-Q365 PolarHBondContact O-N 3.18Å
364L51.8Low61.7Low144 Ų144115.6 Ų115.675%0.75468%0.68SS**  trans-69.5114.8173.3-133.7172.7000109.7S362 D366S362-L364 PolarHBondContact O-N 3.2Å; L364-D366 HydrophobicContact CD2-CB 3.55Å
365Q45.8Very low58.7Low169 Ų169118.9 Ų118.979%0.7969%0.692SS**  trans-121.7127.6150.1-72.9-175.6-19.900106.1A363 E367A363-Q365 PolarHBondContact O-N 3.18Å; Q365-E367 HydrophobicContact CG-CB 4.35Å
366D46.1Very low56Low141 Ų141117.3 Ų117.375%0.75470%0.702SS**  cis37.660.8-9-14129.3000118.5L364L364-D366 HydrophobicContact CD2-CB 3.55Å
367E45.9Very low53.8Low156 Ų156118.1 Ų118.173%0.72972%0.716SS**  trans-123.377143.7-113.2-66.7163.300106.1Q365Q365-E367 HydrophobicContact CG-CB 4.35Å
368G54.9Low51.2Low60 Ų60122.5 Ų122.562%0.61973%0.734SS**  trans-96.4115.7-178.800000111.4
369A50.1Low48.5Very low92 Ų92122.9 Ų122.976%0.7675%0.745SS**  trans63.6103.7167.800000117.7
370L49.5Very low46.2Very low162 Ų162119.8 Ų119.885%0.84875%0.748SS**  -147.5114.6129.9-117166.9000111.4
371D46.1Very low44.4Very low137 Ų137123.8 Ų123.873%0.73376%0.763SS**  trans-62.4140.9166.2-66.2-72.8000110.6
372F39.2Very low43.7Very low191 Ų191129.1 Ų129.184%0.83877%0.766SS**  trans-153.380.3143.9-123.9-74000113.9
373I41.3Very low43.1Very low129 Ų129133.4 Ų133.466%0.66277%0.771SS**  19.5118.3129.2-52.1166.5000116.4
374C34.3Very low42.5Very low128 Ų128136.4 Ų136.487%0.86578%0.775SS**  trans-154.2147.2133.7-151.90000110.7
375D32.5Very low41.5Very low146 Ų146137.9 Ų137.978%0.78178%0.78SS**  trans-80.5174.1-169.6-60.4-86.7000115
376G37.8Very low40.9Very low70 Ų70133 Ų13372%0.72278%0.775SS**  trans-75.4-158.416600000113.3
377P49.3Very low40.4Very low115 Ų115132.4 Ų132.475%0.74778%0.776SS**  cis-142.8178.134.242.4-23.4000117.4
378E36.8Very low40.1Very low196 Ų196133.4 Ų133.492%0.91678%0.781SS**  trans46.1137.9143.8-71.9179.811600124.4
379G35.9Very low39Very low85 Ų85136 Ų13688%0.87678%0.781SS**  trans129.998148.200000116
380G35Very low38.1Very low63 Ų63142.3 Ų142.365%0.64979%0.785SS**  cis174.2160.9-4.500000113.2
381D36.7Very low37.2Very low154 Ų154137.2 Ų137.282%0.82477%0.772SS**  trans61.3151.4168-41.3-33000118.2
382K45.2Very low37Very low186 Ų186138.7 Ų138.781%0.80978%0.779SS**  cis-149.1129.224.4-67.2163.7-179128.40112
383K39.3Very low36.7Very low199 Ų199137.8 Ų137.887%0.86578%0.777SS**  54.2136.6130-163.7-177.5-172.3177.60119.9
384L39Very low36.4Very low142 Ų142140.3 Ų140.374%0.74379%0.788SS**  cis178.2153.7-12.1-178.882.2000107.8
385M31.1Very low36.3Very low175 Ų175137.5 Ų137.586%0.86278%0.781SS**  trans85131.6153.4-134.876.2168.600120.4
386G32.9Very low36.7Very low65 Ų65138 Ų13867%0.6778%0.784SS**  trans113103.1170.200000114.3
387V36.6Very low37.2Very low129 Ų129140.3 Ų140.378%0.78279%0.786SS**  cis71.9107.535.8-170.80000108.9
388E38.1Very low36.3Very low177 Ų177138 Ų13883%0.82778%0.784SS**  cis-143146.720.3-51.2-173.3149.600111.2
389D31.5Very low36.8Very low115 Ų115133.9 Ų133.962%0.61578%0.783SS**  78.4133.593-169.439000118.6
390R32.8Very low37.1Very low224 Ų224137.9 Ų137.985%0.84578%0.779SS**  trans55.5154.4174.7-87167.7-83.7-148.8-4.7118.1
391G29.8Very low38Very low56 Ų56139.8 Ų139.858%0.57779%0.788SS**  cis163.8171.1-3.400000111.2
392L42Very low38.6Very low168 Ų168140.5 Ų140.588%0.8879%0.789SS**  trans69.1122.3-175.2-42.2178.2000112.8
393E31.9Very low38.6Very low171 Ų171136 Ų13680%0.79979%0.787SS**  cis81.5128.429.6-154-170.6166.500115.3
394M36Very low38.6Very low182 Ų182133.3 Ų133.390%0.89778%0.781SS**  trans76.5144.3162.4-146.459.4143.600119.1
395G32.3Very low38.8Very low70 Ų70132.2 Ų132.272%0.72279%0.786SS**  trans12069.8152.100000119.8
396N40.6Very low39.5Very low155 Ų155127.3 Ų127.383%0.82978%0.78SS**  trans-81.9150.2138.7-17241.3000106.6
397P48.3Very low39.7Very low119 Ų119131.4 Ų131.477%0.77379%0.785SS**  cis-138.1-166.913.344.6-25.9000115.5
398G31.3Very low40.2Very low68 Ų68133.3 Ų133.370%0.70179%0.79SS**  trans132.8122.2166.100000111.4
399A46.3Very low40.6Very low108 Ų108130.1 Ų130.189%0.89378%0.783SS**  cis80.181.238.300000114
400E42.1Very low41.3Very low170 Ų170129.7 Ų129.779%0.79478%0.781SS**  trans-123.1137.1162.3-70.2-163.7173.200110.9
401A54Low42Very low103 Ų103126.2 Ų126.285%0.85178%0.779SS**  trans-110.4127.2163.100000107.5
402M49.9Very low43.1Very low169 Ų169131.3 Ų131.383%0.83379%0.788SS**  trans-123.7156.5169.4-70.1-144.6-177.600110.7
403A44.3Very low43.6Very low92 Ų92130 Ų13076%0.7678%0.778SS**  trans-97.7177.4-155.800000114.5
404D39Very low44.6Very low141 Ų141125.1 Ų125.175%0.75477%0.768SS**  trans13.9125.1147.5-169.610.7000118.3G406D404-G406 PolarHBondContact OD1-N 3.18Å
405S44.1Very low45.2Very low120 Ų120121.2 Ų121.284%0.83975%0.75SS**  trans-148.674.6156.7-73.50000109.7L407S405-L407 PolarHBondContact O-N 2.87Å
406G45.9Very low46.3Very low71 Ų71125.5 Ų125.573%0.73275%0.745SS**  trans-58.6131.2161.800000111.3D404D404-G406 PolarHBondContact OD1-N 3.18Å
407L36.7Very low47Very low151 Ų151122.9 Ų122.979%0.79173%0.727SS**  trans-138.4125.6171-162.8150.2000110.3S405 V409S405-L407 PolarHBondContact O-N 2.87Å; L407-V409 HydrophobicContact CD2-CG2 3.87Å; L407-V409 PolarHBondContact O-N 3.1Å
408L48Very low47.5Very low169 Ų169122.4 Ų122.489%0.88572%0.718SS**  trans-74.9113.8-172.1-61.9167.3000111.4
409V46.9Very low48.9Very low110 Ų110123.4 Ų123.467%0.66771%0.707SS**  trans-143.1110.2165.2-1740000109.3L407L407-V409 HydrophobicContact CD2-CG2 3.87Å; L407-V409 PolarHBondContact O-N 3.1Å
410N44.7Very low49.3Very low107 Ų107125 Ų12557%0.57269%0.693SS**  trans162.4-4.6137.3-87.9-61.3000115.8E412 M413N410-E412 PolarHBondContact O-N 3.43Å; N410-E412 VanDerWaalsContact O-N 3.07Å; N410-M413 PolarHBondContact O-N 3.38Å; N410-M413 VanDerWaalsContact O-N 3.11Å
411D47Very low50.2Low150 Ų150121.9 Ų121.980%0.80268%0.679SS**THydrogen-bonded Turntrans-60.8-19.9178.1-71.2-25.2000114.2M413 A414D411-M413 VanDerWaalsContact C-N 3.28Å; D411-M413 PolarHBondContact O-N 3.1Å; D411-A414 PolarHBondContact O-N 2.67Å
412E54.1Low50.2Low164 Ų164122.8 Ų122.877%0.76667%0.666SS**Hα-helixtrans-66.1-27.9176.5-163.4177.9171.600113N410 A414N410-E412 PolarHBondContact O-N 3.43Å; N410-E412 VanDerWaalsContact O-N 3.07Å; E412-A414 VanDerWaalsContact C-N 3.29Å; E412-A414 PolarHBondContact O-N 2.86Å
413M52.9Low50.8Low140 Ų140118.8 Ų118.869%0.6965%0.651SS**Hα-helixtrans-91.624.4179.4-57.6-150.4-53.800114N410 D411N410-M413 PolarHBondContact O-N 3.38Å; N410-M413 VanDerWaalsContact O-N 3.11Å; D411-M413 VanDerWaalsContact C-N 3.28Å; D411-M413 PolarHBondContact O-N 3.1Å
414A52.3Low51.4Low69 Ų69121.7 Ų121.757%0.5765%0.646SS**Hα-helixtrans-120-3116300000111.9D411 E412D411-A414 PolarHBondContact O-N 2.67Å; E412-A414 VanDerWaalsContact C-N 3.29Å; E412-A414 PolarHBondContact O-N 2.86Å
415N49.4Very low52.2Low99 Ų99121.6 Ų121.653%0.52964%0.643SS.*Hα-helixtrans-73.7-33179.4-171.516.3000112.6E417 D418 I419N415-E417 VanDerWaalsContact C-N 3.3Å; N415-E417 PolarHBondContact O-N 3.43Å; N415-D418 PolarHBondContact O-N 3.45Å; N415-I419 WeakPolarHBondContact O-CD1 3.3Å; N415-I419 VanDerWaalsContact O-CG1 3.26Å; N415-I419 WeakPolarHBondContact O-CG1 3.24Å; N415-I419 PolarHBondContact O-N 3.06Å; N415-I419 VanDerWaalsContact O-N 3.08Å
416R54.4Low52.4Low161 Ų161119.3 Ų119.361%0.60863%0.627SS**Hα-helixtrans-65.4-33.8-174.8-173.6172.9-175.3-113.93.5112.9F420R416-F420 WeakPolarHBondContact O-CD2 3.39Å
417E56.3Low52.7Low100 Ų100121.7 Ų121.747%0.46763%0.627SS.*Hα-helixtrans-73.2-42.9-179.5-69.556.3-130.700110.6N415 F420 E421N415-E417 VanDerWaalsContact C-N 3.3Å; N415-E417 PolarHBondContact O-N 3.43Å; E417-F420 PolarHBondContact O-N 3.27Å; E417-E421 PolarHBondContact O-N 2.86Å
418D57.5Low53Low108 Ų108118.7 Ų118.758%0.57863%0.625SS**Hα-helixtrans-67.5-39.7179.6-146.927.4000111.3N415 F420 E421 Q422N415-D418 PolarHBondContact O-N 3.45Å; D418-F420 PolarHBondContact O-N 2.86Å; D418-E421 PolarHBondContact O-N 3.08Å; D418-Q422 VanDerWaalsContact O-CB 3.25Å; D418-Q422 WeakPolarHBondContact O-CB 3.41Å; D418-Q422 PolarHBondContact O-N 3.22Å
419I61.3Low53Low89 Ų89114.5 Ų114.546%0.45661%0.614SS.*Hα-helixtrans-55.4-35.7172.5-71.4164.8000112.1N415 V423N415-I419 WeakPolarHBondContact O-CD1 3.3Å; N415-I419 VanDerWaalsContact O-CG1 3.26Å; N415-I419 WeakPolarHBondContact O-CG1 3.24Å; N415-I419 PolarHBondContact O-N 3.06Å; N415-I419 VanDerWaalsContact O-N 3.08Å; I419-V423 WeakPolarHBondContact O-CB 3.49Å; I419-V423 VanDerWaalsContact O-CG2 3.28Å; I419-V423 WeakPolarHBondContact O-CG2 3.49Å; I419-V423 PolarHBondContact O-N 2.92Å; I419-V423 VanDerWaalsContact O-N 3.1Å
420F55.3Low52.2Low141 Ų141116.9 Ų116.962%0.61862%0.623SS**Hα-helixtrans-75-38180-95.4-77.6000113.5R416 E417 D418 F424R416-F420 WeakPolarHBondContact O-CD2 3.39Å; E417-F420 PolarHBondContact O-N 3.27Å; D418-F420 PolarHBondContact O-N 2.86Å; F420-F424 PolarHBondContact O-N 3.19Å
421E59.7Low51.5Low106 Ų106122.1 Ų122.150%0.49564%0.641SS.*Hα-helixtrans-72-39.9172.4-73.4-69.7174.100111.1E417 D418 V423 F424 M425E417-E421 PolarHBondContact O-N 2.86Å; D418-E421 PolarHBondContact O-N 3.08Å; E421-V423 VanDerWaalsContact C-N 3.3Å; E421-V423 PolarHBondContact O-N 2.79Å; E421-F424 WeakPolarHBondContact O-CA 3.28Å; E421-F424 WeakPolarHBondContact O-CB 3.5Å; E421-F424 PolarHBondContact O-N 3.24Å; E421-M425 WeakPolarHBondContact O-CG 3.28Å; E421-M425 PolarHBondContact O-N 3.35Å
422Q54Low50.8Low121 Ų121120.4 Ų120.457%0.56564%0.641SS**Hα-helixtrans-54-45.5173.7-172.678.559.800111.1D418 M425 S426D418-Q422 VanDerWaalsContact O-CB 3.25Å; D418-Q422 WeakPolarHBondContact O-CB 3.41Å; D418-Q422 PolarHBondContact O-N 3.22Å; Q422-M425 PolarHBondContact O-N 3.04Å; Q422-S426 VanDerWaalsContact O-CB 3.28Å; Q422-S426 WeakPolarHBondContact O-CB 3.47Å; Q422-S426 PolarHBondContact O-N 3.06Å; Q422-S426 PolarHBondContact O-OG 3.48Å
423V61.9Low49.9Very low85 Ų85121 Ų12152%0.51564%0.644SS.*Hα-helixtrans-67.4-36.8176.5167.80000112.2I419 E421 T427I419-V423 WeakPolarHBondContact O-CB 3.49Å; I419-V423 VanDerWaalsContact O-CG2 3.28Å; I419-V423 WeakPolarHBondContact O-CG2 3.49Å; I419-V423 PolarHBondContact O-N 2.92Å; I419-V423 VanDerWaalsContact O-N 3.1Å; E421-V423 VanDerWaalsContact C-N 3.3Å; E421-V423 PolarHBondContact O-N 2.79Å; V423-T427 PolarHBondContact O-N 3.11Å; V423-T427 PolarHBondContact O-OG1 3.05Å
424F58.4Low48.7Very low153 Ų153121 Ų12167%0.67165%0.647SS**Hα-helixtrans-66.2-38175.6-121.2-85000112.6F420 E421F420-F424 PolarHBondContact O-N 3.19Å; E421-F424 WeakPolarHBondContact O-CA 3.28Å; E421-F424 WeakPolarHBondContact O-CB 3.5Å; E421-F424 PolarHBondContact O-N 3.24Å
425M56.1Low47.6Very low139 Ų139122.4 Ų122.469%0.68565%0.652SS**Hα-helixtrans-75.1-40.9175.9-68.2-175.666.700112.5E421 Q422 T427 A428E421-M425 WeakPolarHBondContact O-CG 3.28Å; E421-M425 PolarHBondContact O-N 3.35Å; Q422-M425 PolarHBondContact O-N 3.04Å; M425-T427 PolarHBondContact O-N 3.22Å; M425-A428 PolarHBondContact O-N 2.97Å; M425-A428 VanDerWaalsContact O-N 3.1Å
426S48.3Very low46.6Very low72 Ų72122.5 Ų122.550%0.50366%0.661SS.*Hα-helixtrans-64-23.8-178-580000113.1Q422 A428Q422-S426 VanDerWaalsContact O-CB 3.28Å; Q422-S426 WeakPolarHBondContact O-CB 3.47Å; Q422-S426 PolarHBondContact O-N 3.06Å; Q422-S426 PolarHBondContact O-OG 3.48Å; S426-A428 PolarHBondContact O-N 3.49Å
427T50.4Low45.3Very low121 Ų121121.1 Ų121.174%0.74267%0.674SS**THydrogen-bonded Turntrans-73.5-3177.6-51.60000113.2V423 M425V423-T427 PolarHBondContact O-N 3.11Å; V423-T427 PolarHBondContact O-OG1 3.05Å; M425-T427 PolarHBondContact O-N 3.22Å
428A44.2Very low43.9Very low89 Ų89127.9 Ų127.974%0.73670%0.695SS**THydrogen-bonded Turntrans-108.1-0.3-178.200000115.1M425 S426M425-A428 PolarHBondContact O-N 2.97Å; M425-A428 VanDerWaalsContact O-N 3.1Å; S426-A428 PolarHBondContact O-N 3.49Å
429A47Very low42.6Very low80 Ų80132.2 Ų132.266%0.66171%0.712SS**  trans-126.458.4-165.600000113.9
430D30.8Very low40.9Very low160 Ų160131.5 Ų131.586%0.85673%0.727SS**  trans-107.954177.5-137.1-4.8000111.7
431F30.9Very low40.1Very low218 Ų218130.7 Ų130.796%0.95674%0.736SS**  trans-143.5119.7165-83.5-75.6000109.4
432S32.6Very low38.5Very low113 Ų113133 Ų13379%0.7975%0.75SS**  trans-142.4151.7179.5-169.50000106.2
433Q35Very low37.3Very low176 Ų176133.5 Ų133.582%0.82276%0.762SS**  cis-124.9-178.125.8-70.1165.8-46.500110.1
434D26.1Very low35.8Very low141 Ų141137.6 Ų137.675%0.75478%0.775SS**  cis-151.2171.924.5-160.5-4.4000113.2
435S29.8Very low34.3Very low98 Ų98136.5 Ų136.569%0.68578%0.781SS**  trans-68176.8175.266.30000113.5
436S28.4Very low32.8Very low101 Ų101138.7 Ų138.771%0.70679%0.79SS**  cis-162.5149.720.3-175.50000112
437C26.9Very low31.8Very low132 Ų132140 Ų14089%0.89280%0.804SS**  trans-155.1140.6155-119.80000111
438R26.6Very low30.7Very low243 Ų243138 Ų13892%0.91781%0.808SS**  trans-89.7161.1-173.8-76.5177.3166.9-107.42.7113.5
439Q30.9Very low30.1Very low199 Ų199141.7 Ų141.793%0.9381%0.81SS**  trans-97.7143.6172.9-72.9178.7-30.900113.7
440G26Very low29.5Very low74 Ų74143.9 Ų143.976%0.76382%0.818SS**  trans82.4172149.600000118.8
441P38.2Very low29.4Very low124 Ų124141.2 Ų141.281%0.80581%0.807SS**  cis-138.5169.7-3.143-26.8000117
442L25.2Very low29.3Very low153 Ų153137.7 Ų137.780%0.80180%0.797SS**  trans61.5129.8143.2-164.469.8000122.1
443V29.2Very low29.1Very low133 Ų133137 Ų13781%0.80679%0.792SS**  173.6155.3122.41540000110.4
444E30.2Very low28.9Very low171 Ų171135.8 Ų135.880%0.79979%0.787SS**  trans-89.7171.1-170.5-47.5179.9143.100114.2
445T27.3Very low29.1Very low130 Ų130133.8 Ų133.880%0.79878%0.776SS**  174.2111.3124.1-67.80000112.7
446E25.3Very low29.1Very low185 Ų185138.1 Ų138.186%0.86478%0.778SS**  trans38.8149.8133.5-130.4-179.8-17200126.4
447A27.8Very low29.1Very low98 Ų98140.3 Ų140.381%0.8178%0.776SS**  trans85.4129.5141.600000123.2
448G26.4Very low29.2Very low79 Ų79142 Ų14281%0.81478%0.776SS**  trans126.390137.900000119.9
449Q31.3Very low29.2Very low167 Ų167134.3 Ų134.378%0.7877%0.765SS**  trans-104.7157.4148.2-83.3-139.7-79.600110
450P35.5Very low29Very low127 Ų127135.1 Ų135.183%0.82576%0.759SS**  -140.4-174.2109.737.9-24.1000114.6
451V27.8Very low29.1Very low104 Ų104138.7 Ų138.763%0.6376%0.756SS**  trans-149163.8-163.4159.80000110.6
452L29.2Very low28.5Very low144 Ų144138 Ų13875%0.75475%0.754SS**  trans71.8159.9173.5-81160.3000116.1E454L452-E454 HydrophobicContact CD2-CG 3.9Å
453S29.1Very low28.5Very low98 Ų98135.5 Ų135.569%0.68575%0.749SS**  cis-139.8-166.114.5-77.60000110.8
454E30.3Very low29.3Very low150 Ų150135 Ų13570%0.70175%0.749SS**  -170.8175.3-51-84.3165.293.200105.5L452L452-E454 HydrophobicContact CD2-CG 3.9Å
455D29.3Very low29.2Very low100 Ų100131.2 Ų131.254%0.53575%0.747SS.*  cis-155.21772.1-167.22.6000108.6
456R30.8Very low29.3Very low189 Ų189131.2 Ų131.271%0.71375%0.747SS**  trans75.5125.8154.8-75.4148.1-162.7-92.7-14.5120.6
457Q28.3Very low29.4Very low146 Ų146129.1 Ų129.168%0.68274%0.741SS**  cis85.2146.744.1-70.4171.710.800114.3
458L29Very low29.5Very low167 Ų167131.3 Ų131.387%0.87474%0.738SS**  cis-172.5174.7-32.9-118.8177.7000109.4
459A26.6Very low29.7Very low83 Ų83134.1 Ų134.169%0.68674%0.735SS**  trans77.5126.3175.700000117
460R25.4Very low29.5Very low215 Ų215129.1 Ų129.181%0.81172%0.722SS**  78130.259-87.9-175.779.6-173.41.5112.3
461E28.5Very low29.1Very low149 Ų149130.9 Ų130.970%0.69672%0.723SS**  cis-134.5-164.212.8-64.5-145.4108.100111.7
462S26.7Very low29.2Very low109 Ų109130.7 Ų130.776%0.76273%0.727SS**  cis-154.2-122.217620000115.9
463S25.2Very low29.1Very low101 Ų101129.3 Ų129.371%0.70673%0.729SS**  trans-146.6-175.3-150.4-32.50000113
464P45.6Very low28.9Very low122 Ų122130.6 Ų130.679%0.79273%0.733SS**  cis-137.7158.3-12.338.8-21.7000116.9
465A28.7Very low28.9Very low92 Ų92129.2 Ų129.276%0.7674%0.735SS**  trans173.8137.7145.100000109
466T27.5Very low28.6Very low130 Ų130131.1 Ų131.180%0.79875%0.75SS**  cis80.8118.125.2-50.50000113.8
467L27.6Very low28.6Very low141 Ų141129.4 Ų129.474%0.73875%0.754SS**  cis-172.7162.6-17.7-124-175.4000108.7
468L31.7Very low28.3Very low144 Ų144128.4 Ų128.475%0.75476%0.762SS**  trans64168158.6-62.3173.1000119
469N29.7Very low28.2Very low139 Ų139125.1 Ų125.174%0.74375%0.754SS**  cis-165.7166.7-49.7-150.9-2.1000111.6
470A26.3Very low28.4Very low62 Ų62129 Ų12951%0.51276%0.763SS.*  trans29.3138.4146.600000123.6
471L28.6Very low28.4Very low163 Ų163123 Ų12385%0.85376%0.759SS**  -178.1126.1109.5-107.877.7000106.2
472S28.7Very low29.1Very low101 Ų101121.7 Ų121.771%0.70676%0.763SS**  cis8714648.6-63.70000114.8
473S27.4Very low29Very low115 Ų115122.7 Ų122.780%0.80477%0.769SS**  trans79.1148.4174-56.40000117.1
474T24.1Very low29.1Very low125 Ų125125.8 Ų125.877%0.76777%0.772SS**  cis-160.2160.8-14.3-1000000111.7
475V30.2Very low28.3Very low121 Ų121129.1 Ų129.173%0.73378%0.777SS**  trans-48.2145.5174.41750000115.4
476T24.8Very low28.1Very low140 Ų140131.6 Ų131.686%0.85978%0.778SS**  trans-154.6143.8139.2-5.80000112.4
477I29.7Very low28.3Very low153 Ų153131.3 Ų131.379%0.78578%0.776SS**  trans-98.5145.3167.2-64.8168.6000107.2
478S23.2Very low28.3Very low124 Ų124131.5 Ų131.587%0.86778%0.778SS**  trans-131.3130.6162.5-170.30000110.1
479S27Very low28.3Very low99 Ų99132.1 Ų132.169%0.69278%0.781SS**  trans-129.9139.2171.3177.70000107.3
480N28.9Very low28.5Very low164 Ų164135.5 Ų135.588%0.87779%0.79SS**  trans-171.5155.2151-95.6-24.7000110.1
481A27.2Very low28.6Very low88 Ų88140.9 Ų140.973%0.72780%0.804SS**  trans-128.2-158.517500000108.2
482P41.3Very low28.7Very low122 Ų122138.3 Ų138.379%0.79280%0.795SS**  -114.7173.2-6435.7-25.6000111.4
483C25Very low28.5Very low130 Ų130141.2 Ų141.288%0.87880%0.797SS**  trans-156.8159.7152.2-123.80000114.8
484H28.3Very low28.7Very low166 Ų166140.8 Ų140.877%0.76979%0.79SS**  trans-92.9153.1177-66.9-114.8000112
485Q28.8Very low28.8Very low192 Ų192141.7 Ų141.790%0.89779%0.79SS**  -160.4154128.7-113.8148.589.900111.9
486N24.8Very low28.9Very low145 Ų145145.7 Ų145.778%0.77580%0.798SS**  trans-101.4157.4173.4-35.9-75.1000109.1
487T30.3Very low29.6Very low124 Ų124144.8 Ų144.876%0.76180%0.795SS**  -177.9124.8126.632.50000110.6
488D29.1Very low29.8Very low145 Ų145143.2 Ų143.278%0.77580%0.797SS**  trans26.7144.1138.5-48.9-63.6000122.8
489D31.6Very low30.5Very low156 Ų156143.4 Ų143.483%0.83479%0.787SS**  trans-61.6145.6175.9-46.1-100.8000114.1
490K33.9Very low31.4Very low211 Ų211142.6 Ų142.692%0.91778%0.781SS**  trans-152.5145.6135.2-82.8-134174.7-165.90114.6
491E28.2Very low32.6Very low175 Ų175138 Ų13882%0.81877%0.767SS**  trans-49.1155.3178.2-87.9177.810100120.1
492V29.3Very low34Very low109 Ų109139.6 Ų139.666%0.66176%0.763SS**  trans92.9116.7136.6162.80000121.5
493Q26.1Very low34.9Very low161 Ų161138.9 Ų138.975%0.75275%0.752SS**  trans79.7130.1147.6-91.9178.4-88.500124
494T30.7Very low36.6Very low107 Ų107139.1 Ų139.166%0.65674%0.74SS**  trans57.7139148.638.50000118.7
495D26.7Very low38Very low143 Ų143134.5 Ų134.577%0.76572%0.724SS**  cis-145.6169.335.1-93.1-52.1000114.8
496F32.5Very low39.7Very low205 Ų205130 Ų13090%0.89971%0.705SS**PPolyproline II helixtrans-90.3125.1168-75.9-94.2000111.4
497P38.9Very low41.6Very low122 Ų122128.1 Ų128.179%0.79270%0.695SS**PPolyproline II helixtrans-70.2134.5165.729.4-32.6000110.5
498S34Very low43.2Very low120 Ų120127.9 Ų127.984%0.83969%0.688SS**PPolyproline II helixtrans-70.9140.4-17543.90000113.3
499I38.2Very low44.8Very low128 Ų128127.3 Ų127.366%0.65668%0.681SS**PPolyproline II helixtrans-67.4131.9171.1-68.8172.8000109L503I499-L503 HydrophobicContact CG2-CB 4.12Å; I499-L503 HydrophobicContact CG2-CD1 4.09Å
500S46.4Very low46Very low81 Ų81125.2 Ų125.257%0.56667%0.669SS**PPolyproline II helixtrans-55.3137.3178.8-179.30000112.1D502 L503S500-D502 PolarHBondContact O-N 3.45Å; S500-D502 VanDerWaalsContact O-N 3.11Å; S500-D502 PolarHBondContact OG-N 2.93Å; S500-L503 PolarHBondContact O-N 2.91Å; S500-L503 VanDerWaalsContact O-N 3.11Å
501A53.4Low47.3Very low69 Ų69121 Ų12157%0.5766%0.656SS**THydrogen-bonded Turntrans-57.3-25.5176.700000113L503 Q504 T505A501-L503 PolarHBondContact O-N 3.44Å; A501-Q504 WeakPolarHBondContact O-CB 3.4Å; A501-Q504 PolarHBondContact O-N 2.66Å; A501-T505 PolarHBondContact O-N 3.24Å
502D55.8Low48.4Very low121 Ų121121.1 Ų121.165%0.64765%0.653SS**Hα-helixtrans-70.4-14-179.2-156.137.6000113.8S500 T505S500-D502 PolarHBondContact O-N 3.45Å; S500-D502 VanDerWaalsContact O-N 3.11Å; S500-D502 PolarHBondContact OG-N 2.93Å; D502-T505 VanDerWaalsContact C-OG1 3.28Å; D502-T505 VanDerWaalsContact CA-OG1 3.3Å; D502-T505 WeakPolarHBondContact CA-OG1 3.31Å; D502-T505 PolarHBondContact O-OG1 2.91Å; D502-T505 PolarHBondContact OD1-OG1 2.72Å
503L60.9Low49.4Very low106 Ų106122.4 Ų122.456%0.55566%0.656SS**Hα-helixtrans-80.7-26.4170.2-124.8171.4000111.9I499 S500 A501 L507I499-L503 HydrophobicContact CG2-CB 4.12Å; I499-L503 HydrophobicContact CG2-CD1 4.09Å; S500-L503 PolarHBondContact O-N 2.91Å; S500-L503 VanDerWaalsContact O-N 3.11Å; A501-L503 PolarHBondContact O-N 3.44Å; L503-L507 WeakPolarHBondContact O-CB 3.17Å; L503-L507 PolarHBondContact O-N 2.97Å
504Q60.4Low50.4Low136 Ų136123.4 Ų123.464%0.63666%0.66SS**Hα-helixtrans-80.5-37179.7-58.6-175.31.200111.6A501 L507 L508A501-Q504 WeakPolarHBondContact O-CB 3.4Å; A501-Q504 PolarHBondContact O-N 2.66Å; Q504-L507 PolarHBondContact O-N 2.95Å; Q504-L508 WeakPolarHBondContact O-CB 3.37Å; Q504-L508 PolarHBondContact O-N 3.47Å
505T58.1Low51.2Low69 Ų69121.5 Ų121.542%0.42366%0.662SS.*Hα-helixtrans-59.4-47.8171.147.80000111.2A501 D502 L507 L508 Q509A501-T505 PolarHBondContact O-N 3.24Å; D502-T505 VanDerWaalsContact C-OG1 3.28Å; D502-T505 VanDerWaalsContact CA-OG1 3.3Å; D502-T505 WeakPolarHBondContact CA-OG1 3.31Å; D502-T505 PolarHBondContact O-OG1 2.91Å; D502-T505 PolarHBondContact OD1-OG1 2.72Å; T505-L507 PolarHBondContact O-N 2.89Å; T505-L508 PolarHBondContact O-N 3.39Å; T505-Q509 WeakPolarHBondContact O-CG 3.46Å; T505-Q509 PolarHBondContact O-N 3.33Å
506L64.8Low51.6Low97 Ų97119.9 Ų119.951%0.50866%0.662SS.*Hα-helixtrans-59.5-46.6178.5-161.686.1000112.2L508 Q509 L510L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 3.3Å; L506-Q509 PolarHBondContact O-N 3.45Å; L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 3.27Å
507L64.1Low51.5Low106 Ų106115.6 Ų115.656%0.55566%0.657SS**Hα-helixtrans-65.1-38.4179.4-165.2153000111.5L503 Q504 T505 L510 L511L503-L507 WeakPolarHBondContact O-CB 3.17Å; L503-L507 PolarHBondContact O-N 2.97Å; Q504-L507 PolarHBondContact O-N 2.95Å; T505-L507 PolarHBondContact O-N 2.89Å; L507-L510 PolarHBondContact O-N 3.08Å; L507-L511 HydrophobicContact CD2-CD1 4.27Å; L507-L511 PolarHBondContact O-N 2.88Å
508L63.8Low51.2Low119 Ų119118.3 Ų118.362%0.62366%0.664SS**Hα-helixtrans-69.1-34.9176-167.166.2000112.5Q504 T505 L506 K512Q504-L508 WeakPolarHBondContact O-CB 3.37Å; Q504-L508 PolarHBondContact O-N 3.47Å; T505-L508 PolarHBondContact O-N 3.39Å; L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 3.3Å; L508-K512 VanDerWaalsContact O-CB 3.31Å; L508-K512 WeakPolarHBondContact O-CB 3.23Å; L508-K512 PolarHBondContact O-N 2.96Å; L508-K512 VanDerWaalsContact O-N 3.1Å
509Q63.6Low51Low133 Ų133115.9 Ų115.962%0.62166%0.658SS**Hα-helixtrans-66-41.2171.7-74.7-177.8-85.800112.1T505 L506 K512 L513T505-Q509 WeakPolarHBondContact O-CG 3.46Å; T505-Q509 PolarHBondContact O-N 3.33Å; L506-Q509 PolarHBondContact O-N 3.45Å; Q509-K512 PolarHBondContact O-N 2.89Å; Q509-L513 PolarHBondContact O-N 2.82Å
510L56.5Low50.7Low111 Ų111117.9 Ų117.958%0.58167%0.67SS**Hα-helixtrans-64.6-42.5177.3-73.1167.9000112.2L506 L507 K512 L513L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 3.27Å; L507-L510 PolarHBondContact O-N 3.08Å; L510-K512 VanDerWaalsContact C-N 3.29Å; L510-K512 PolarHBondContact O-N 3.26Å; L510-L513 PolarHBondContact O-N 3.38Å
511L61.8Low50Low124 Ų124118.6 Ų118.665%0.64968%0.681SS**Hα-helixtrans-59.9-40.5172.1-116.574000111.9L507 L513 H514L507-L511 HydrophobicContact CD2-CD1 4.27Å; L507-L511 PolarHBondContact O-N 2.88Å; L511-L513 VanDerWaalsContact C-N 3.33Å; L511-L513 PolarHBondContact O-N 2.89Å; L511-H514 PolarHBondContact O-N 3.46Å
512K50.3Low48.9Very low176 Ų176120.1 Ų120.177%0.76569%0.693SS**Hα-helixtrans-71.8-24.8-177.3-164.8168.3-174.8174.50113.5L508 Q509 L510 H514L508-K512 VanDerWaalsContact O-CB 3.31Å; L508-K512 WeakPolarHBondContact O-CB 3.23Å; L508-K512 PolarHBondContact O-N 2.96Å; L508-K512 VanDerWaalsContact O-N 3.1Å; Q509-K512 PolarHBondContact O-N 2.89Å; L510-K512 VanDerWaalsContact C-N 3.29Å; L510-K512 PolarHBondContact O-N 3.26Å; K512-H514 VanDerWaalsContact C-N 3.33Å
513L51.1Low48.6Very low136 Ų136119.6 Ų119.671%0.71270%0.697SS**Hα-helixtrans-73.3-24.4176.2-165.867000112.7Q509 L510 L511 G515Q509-L513 PolarHBondContact O-N 2.82Å; L510-L513 PolarHBondContact O-N 3.38Å; L511-L513 VanDerWaalsContact C-N 3.33Å; L511-L513 PolarHBondContact O-N 2.89Å; L513-G515 VanDerWaalsContact C-N 3.31Å; L513-G515 PolarHBondContact O-N 3.18Å
514H45.8Very low47.7Very low183 Ų183120.3 Ų120.385%0.84771%0.708SS**THydrogen-bonded Turntrans-88.36.6-176.7-133.3-80.5000114.1L511 K512L511-H514 PolarHBondContact O-N 3.46Å; K512-H514 VanDerWaalsContact C-N 3.33Å
515G47.4Very low46.3Very low66 Ų66119.2 Ų119.268%0.6872%0.715SS**  trans-119.827.2-165.500000116.4L513L513-G515 VanDerWaalsContact C-N 3.31Å; L513-G515 PolarHBondContact O-N 3.18Å
516S34.9Very low44.9Very low110 Ų110119.6 Ų119.677%0.76973%0.732SS**  trans-129.475.3-175.664.50000114.4
517S31.2Very low43.1Very low114 Ų114122.7 Ų122.780%0.79775%0.748SS**SBendtrans-154.497.2159.6179.40000111.6
518L31.8Very low41.6Very low180 Ų180125.1 Ų125.194%0.94276%0.761SS**  trans31.2114.1148.3-162.673.2000118.6
519G31.4Very low39.7Very low69 Ų69127.8 Ų127.871%0.71177%0.77SS**  cis169.5173.9-3.200000113.9
520D31.2Very low38.1Very low169 Ų169128 Ų12890%0.90478%0.78SS**  trans55.895.9161.6-156.219.6000121.4
521A30.7Very low37.1Very low97 Ų97127.1 Ų127.180%0.80278%0.781SS**  trans-170.6142.9136.900000110.1
522A31.3Very low35.2Very low100 Ų100130.3 Ų130.383%0.82679%0.79SS**  trans-99.2147.8-175.700000114.2
523P49Very low34.1Very low111 Ų111129.6 Ų129.672%0.72179%0.794SS**  trans-97.8168.6-179.339.2-36.7000114.2
524P42.4Very low33.2Very low121 Ų121128.6 Ų128.679%0.78680%0.795SS**  -125.5138.7124.334.9-27.8000111
525S32Very low32.1Very low113 Ų113125.5 Ų125.579%0.7979%0.789SS**  cis93.3120.442.1-69.40000113.4
526G27.1Very low31Very low76 Ų76126.9 Ų126.978%0.78479%0.789SS**  trans92.4152.218000000113.8
527L28.6Very low30.5Very low162 Ų162127.4 Ų127.485%0.84879%0.787SS**  cis-156.8-169-11.6-132.7169.1000108.9
528L31.6Very low30.4Very low157 Ų157127.4 Ų127.482%0.82278%0.782SS**  trans-53.1148.1171.1-68.1159000111.9
529E24.2Very low30.1Very low175 Ų175125.8 Ų125.882%0.81878%0.775SS**  174.2148.6106.6-173158.9-167.800112
530V29.6Very low29.8Very low137 Ų137130.2 Ų130.283%0.8378%0.777SS**  trans-117.7120.2167167.20000105.3
531P36.5Very low29.6Very low93 Ų93125.9 Ų125.960%0.60476%0.76SS**  -156.9175.899.142.1-24.1000118
532K22.1Very low29.4Very low192 Ų192126.1 Ų126.184%0.83576%0.755SS**  trans77.4118.4151.6-82170.4-180174.70120.4
533L25.3Very low29.3Very low161 Ų161130 Ų13084%0.84375%0.754SS**  trans-51.7143.5145.2-155.376.5000110.3
534P33.7Very low28.3Very low114 Ų114128.4 Ų128.474%0.7475%0.745SS**  -134.2163.1102.611.210.8000116.2
535T22.2Very low27.8Very low118 Ų118128.3 Ų128.372%0.72474%0.743SS**  trans-23.5144.5166.128.50000122.4
536S24.1Very low27.5Very low96 Ų96129.6 Ų129.667%0.67174%0.741SS**  89.1152.9124.672.20000122.4
537T24.7Very low27.8Very low120 Ų120131.3 Ų131.374%0.73674%0.741SS**  trans64107.315843.80000116.7
538V28.6Very low27.6Very low114 Ų114127 Ų12769%0.69174%0.735SS**  95.7136.359.3157.90000110.1
539D25Very low27.3Very low146 Ų146125.6 Ų125.678%0.78174%0.737SS**  trans67.4146.2169.1-65.7-13.1000117.2
540E27.1Very low27.7Very low163 Ų163121.7 Ų121.776%0.76273%0.729SS**  cis-156.2178.6-7.6-135.1-144.7140.900112.9
541S26.6Very low27.6Very low78 Ų78121 Ų12155%0.54572%0.72SS.*  trans46.6100137.1-148.30000118.5
542S27Very low27.4Very low101 Ų101121.5 Ų121.571%0.70672%0.718SS**  83.5170.495.889.20000113.5
543K28.9Very low27.7Very low181 Ų181118.7 Ų118.779%0.78772%0.718SS**  cis-144.5-176.96.3-147.9-178.7176.3178.70110.7
544S27.4Very low28.2Very low78 Ų78119.6 Ų119.655%0.54571%0.714SS.*  trans-20.1163.6157.765.30000117.3
545T31.5Very low28Very low119 Ų119119.3 Ų119.373%0.7372%0.715SS**  -177.5169.650-16.50000106.2
546D26Very low28.5Very low141 Ų141118.2 Ų118.275%0.75471%0.713SS**  cis-161179.40.9-156.9-5.5000108.7
547S33Very low28.9Very low112 Ų112121.8 Ų121.878%0.78372%0.719SS**  trans62.4132.8145-160.60000119.9
548G25Very low29Very low70 Ų70125 Ų12572%0.72272%0.723SS**  cis-178.4161.80.400000114.9
549C24.9Very low29Very low128 Ų128126.8 Ų126.887%0.86573%0.725SS**  trans-63.4163.4169.6-83.80000112.9
550S32.1Very low29.5Very low94 Ų94126.7 Ų126.766%0.65773%0.725SS**  cis-175.2-156.6-5.946.30000109.9
551D28.6Very low29.8Very low121 Ų121126.8 Ų126.865%0.64773%0.725SS**  trans94147.8151.9-80.251.3000120.8
552N31.5Very low30.1Very low105 Ų105129 Ų12956%0.56173%0.73SS**  cis178.6124.1-36.9-105.6-20.1000111.4
553T29.6Very low30.5Very low133 Ų133130 Ų13082%0.81673%0.728SS**  trans-164117.615613.70000107.8
554K34.2Very low30.6Very low179 Ų179128.7 Ų128.778%0.77872%0.722SS**  63.1129.959.6-57.3170.2-178.3168.70110.8
555S30.1Very low30.8Very low109 Ų109130.6 Ų130.676%0.76273%0.731SS**  cis-153.5141.325.546.50000111.5
556S32.9Very low30.6Very low95 Ų95132.1 Ų132.166%0.66474%0.74SS**  68.2143.690.8-112.90000115.4
557Q32.1Very low30.6Very low170 Ų170133 Ų13379%0.79474%0.74SS**  cis-170.3-163.9-2.7-135.9167.1-16.400111.5
558F26.4Very low30.8Very low187 Ų187135 Ų13582%0.8274%0.737SS**  trans87.2128.5175.7-76.8-115.5000116.6
559M29.4Very low30.9Very low152 Ų152141 Ų14175%0.74975%0.746SS**  cis-143.4145.3-22-72.1-164.2-48.400106.1
560D35.4Very low31.2Very low145 Ų145143.4 Ų143.478%0.77574%0.742SS**  cis89.9109.636.3-166.117.1000114.5
561E33.1Very low31Very low165 Ų165144.3 Ų144.377%0.77174%0.744SS**  trans-174.8124.4130.3-102.2-168.5140.900112.5
562L32.2Very low30.8Very low123 Ų123148.3 Ų148.364%0.64476%0.755SS**  trans60.9115.8147.6-54.1162.9000119F564L562-F564 HydrophobicContact CD2-CE2 3.84Å; L562-F564 HydrophobicContact CD2-CZ 4.29Å
563D35.8Very low30.6Very low124 Ų124151.5 Ų151.566%0.66377%0.767SS**  cis78.3140.230.5-133.213.5000113.9
564F31.6Very low30.4Very low152 Ų152150.3 Ų150.367%0.66776%0.764SS**  cis-153.1146.246.3-73.5-84.7000118.2L562L562-F564 HydrophobicContact CD2-CE2 3.84Å; L562-F564 HydrophobicContact CD2-CZ 4.29Å
565T31Very low30.2Very low119 Ų119147.6 Ų147.673%0.7376%0.763SS**  trans51141.3139.4630000125.1
566T27.4Very low30.3Very low150 Ų150153.6 Ų153.692%0.9277%0.769SS**  trans-142.2149.9136.4-38.30000110
567Q27.4Very low30.1Very low160 Ų160157.1 Ų157.175%0.74878%0.775SS**  trans-114.1160.2-171.5-174.7173.5-3.600114.2
568E36.1Very low30.2Very low153 Ų153156.2 Ų156.272%0.71577%0.77SS**  trans-22.7144.8171.3-54.61669700119.8
569E28.1Very low30.6Very low196 Ų196155.4 Ų155.492%0.91677%0.774SS**  trans-145.7161.8137-166.9159.8-153.200111.1
570K29.4Very low31.1Very low180 Ų180153.5 Ų153.578%0.78377%0.77SS**  trans-110.5149.7-175.1-83.9172.5176.8160.30113.4
571T28.4Very low31.3Very low113 Ų113152.7 Ų152.769%0.69377%0.766SS**  trans30.5115.8142.9-48.30000119.5
572F24.8Very low31.9Very low204 Ų204152.5 Ų152.590%0.89576%0.763SS**  -158.5167.2127.5-104-64.7000111.8
573E26.6Very low33Very low173 Ų173155.6 Ų155.681%0.80877%0.766SS**  trans-95.5161.2-163.2-61178.8102.300115.5
574S27.2Very low34Very low108 Ų108159.1 Ų159.176%0.75577%0.771SS**  trans55.9120.4156.6-159.30000117.4
575T28.8Very low35Very low122 Ų122159.5 Ų159.575%0.74877%0.768SS**  -164.8155.861.5-57.40000111
576R32.3Very low36.4Very low235 Ų235156.5 Ų156.589%0.88775%0.752SS**  trans-48139.4171.7-59158.7104.9143.41110
577Q28.9Very low38Very low168 Ų168156.2 Ų156.279%0.78575%0.745SS**  -174150.778.4175151.9-31.900112.7
578E33.5Very low39.6Very low151 Ų151151.8 Ų151.871%0.70673%0.732SS**  trans63.982.3153.8-164.4161.1-171.700119.5V580E578-V580 HydrophobicContact CG-CG2 4.3Å
579L35.5Very low40.9Very low170 Ų170151.2 Ų151.289%0.8973%0.727SS**  trans-124.798.8144.9-131.6173.1000107.8D581L579-D581 PolarHBondContact O-N 3.43Å
580V38.9Very low42.6Very low112 Ų112148.1 Ų148.168%0.67972%0.716SS**  trans-78.892.1-177.5-179.20000109.6E578E578-V580 HydrophobicContact CG-CG2 4.3Å
581D40.4Very low44.6Very low129 Ų129144 Ų14469%0.6971%0.706SS**  trans-65.9132.3172.6-173.223.4000111.1L579 R583L579-D581 PolarHBondContact O-N 3.43Å; D581-R583 PolarHBondContact O-N 2.88Å
582K45.5Very low46.6Very low161 Ų161140 Ų14070%0.768%0.68SS**  trans-84.379.7-165.4-76.3-177.8177.6174.60111.8Y584K582-Y584 HydrophobicContact CB-CE2 4.18Å; K582-Y584 WeakPolarHBondContact O-CD2 3.2Å; K582-Y584 WeakPolarHBondContact O-CE2 3.45Å; K582-Y584 PolarHBondContact O-N 3.45Å
583R54.6Low48.9Very low187 Ų187134.1 Ų134.171%0.70666%0.658SS**  trans-69113.2169.8-61.1-177.8-175.6-175.90.1110.2D581 W585D581-R583 PolarHBondContact O-N 2.88Å; R583-W585 PolarHBondContact O-N 2.92Å
584Y57.8Low51Low199 Ų199130.2 Ų130.278%0.7865%0.646SS**  trans-83.36.9176.2-73.1-87.2000114K582K582-Y584 HydrophobicContact CB-CE2 4.18Å; K582-Y584 WeakPolarHBondContact O-CD2 3.2Å; K582-Y584 WeakPolarHBondContact O-CE2 3.45Å; K582-Y584 PolarHBondContact O-N 3.45Å
585W51.9Low53.2Low159 Ų159128.3 Ų128.360%0.60264%0.637SS**SBendtrans-130150.5-175.8-65.477.1000108.9R583 D592R583-W585 PolarHBondContact O-N 2.92Å; W585-D592 WeakPolarHBondContact CA-OD2 3.38Å; W585-D592 WeakPolarHBondContact CB-OD2 3.17Å; W585-D592 HydrophobicContact CE3-CB 3.54Å; W585-D592 HydrophobicContact CZ3-CB 3.75Å
586S61.5Low55.2Low56 Ų56126.8 Ų126.839%0.39263%0.627SS.*  trans-72.1163.5178.680.20000111.4S588 D592S586-S588 PolarHBondContact O-N 3.22Å; S586-S588 PolarHBondContact OG-N 3.29Å; S586-S588 PolarHBondContact OG-O 3.38Å; S586-D592 VanDerWaalsContact CB-OD1 3.3Å; S586-D592 WeakPolarHBondContact CB-OD1 3.31Å; S586-D592 PolarHBondContact N-OD2 2.88Å; S586-D592 VanDerWaalsContact OG-CG 3.29Å; S586-D592 PolarHBondContact OG-OD1 2.93Å; S586-D592 PolarHBondContact OG-OD2 3.32Å
587N61Low56.7Low145 Ų145117.2 Ų117.278%0.77560%0.598SS**SBendtrans-7119.9173.7-74.2-26.2000113.1
588S60.4Low58.8Low66 Ų66111.7 Ų111.746%0.46258%0.581SS.*  trans-146.584.5-179.4-70.50000110.5S586 L590 V591 D592S586-S588 PolarHBondContact O-N 3.22Å; S586-S588 PolarHBondContact OG-N 3.29Å; S586-S588 PolarHBondContact OG-O 3.38Å; S588-L590 PolarHBondContact O-N 3.45Å; S588-V591 WeakPolarHBondContact O-CB 3.37Å; S588-V591 PolarHBondContact O-N 3.42Å; S588-D592 PolarHBondContact O-N 3.03Å
589F63.6Low60.2Low142 Ų142106.7 Ų106.762%0.62356%0.562SS**Hα-helixtrans-46.9-33.6179.3176.4-104.4000114V591 D592 L593F589-V591 PolarHBondContact O-N 3.12Å; F589-D592 PolarHBondContact O-N 3.21Å; F589-L593 HydrophobicContact CE1-CB 4.47Å; F589-L593 HydrophobicContact CE1-CD2 3.91Å; F589-L593 HydrophobicContact CZ-CD2 4.35Å; F589-L593 WeakPolarHBondContact O-CB 3.4Å; F589-L593 PolarHBondContact O-N 3.27Å
590L63.4Low61.8Low130 Ų130101.9 Ų101.968%0.68154%0.539SS*.Hα-helixtrans-64.4-35.7175.7-65.1176.2000113.5S588 V594S588-L590 PolarHBondContact O-N 3.45Å; L590-V594 VanDerWaalsContact O-CB 3.29Å; L590-V594 WeakPolarHBondContact O-CB 3.41Å; L590-V594 WeakPolarHBondContact O-CG2 3.29Å; L590-V594 PolarHBondContact O-N 2.84Å
591V71Confident63.3Low94 Ų94102 Ų10257%0.5754%0.535SS*.Hα-helixtrans-68.8-45.5177.3178.60000109.9S588 F589 V594 A595S588-V591 WeakPolarHBondContact O-CB 3.37Å; S588-V591 PolarHBondContact O-N 3.42Å; F589-V591 PolarHBondContact O-N 3.12Å; V591-V594 PolarHBondContact O-N 2.98Å; V591-A595 WeakPolarHBondContact O-CB 3.38Å; V591-A595 PolarHBondContact O-N 2.82Å
592D71.5Confident64.6Low29 Ų2999.6 Ų99.616%0.15553%0.527CS..Hα-helixtrans-70.4-38.7-179.5-61.57.7000111.2W585 S586 S588 F589 A595 V596W585-D592 WeakPolarHBondContact CA-OD2 3.38Å; W585-D592 WeakPolarHBondContact CB-OD2 3.17Å; W585-D592 HydrophobicContact CE3-CB 3.54Å; W585-D592 HydrophobicContact CZ3-CB 3.75Å; S586-D592 VanDerWaalsContact CB-OD1 3.3Å; S586-D592 WeakPolarHBondContact CB-OD1 3.31Å; S586-D592 PolarHBondContact N-OD2 2.88Å; S586-D592 VanDerWaalsContact OG-CG 3.29Å; S586-D592 PolarHBondContact OG-OD1 2.93Å; S586-D592 PolarHBondContact OG-OD2 3.32Å; S588-D592 PolarHBondContact O-N 3.03Å; F589-D592 PolarHBondContact O-N 3.21Å; D592-A595 PolarHBondContact O-N 2.97Å; D592-V596 WeakPolarHBondContact O-CG2 3.46Å; D592-V596 PolarHBondContact O-N 3.41Å
593L72.1Confident65.5Low80 Ų8093 Ų9342%0.41950%0.5SS..Hα-helixtrans-62.9-42.5172.8-179.663.3000111.5F589 V596 A597F589-L593 HydrophobicContact CE1-CB 4.47Å; F589-L593 HydrophobicContact CE1-CD2 3.91Å; F589-L593 HydrophobicContact CZ-CD2 4.35Å; F589-L593 WeakPolarHBondContact O-CB 3.4Å; F589-L593 PolarHBondContact O-N 3.27Å; L593-V596 PolarHBondContact O-N 3.27Å; L593-A597 WeakPolarHBondContact O-CB 3.48Å; L593-A597 PolarHBondContact O-N 3.36Å
594V70.9Confident66Low92 Ų9287 Ų8756%0.55848%0.484SS*.Hα-helixtrans-67.3-37.9174.4167.60000111.2L590 V591 V596 A597 A598L590-V594 VanDerWaalsContact O-CB 3.29Å; L590-V594 WeakPolarHBondContact O-CB 3.41Å; L590-V594 WeakPolarHBondContact O-CG2 3.29Å; L590-V594 PolarHBondContact O-N 2.84Å; V591-V594 PolarHBondContact O-N 2.98Å; V594-V596 VanDerWaalsContact C-N 3.28Å; V594-V596 PolarHBondContact O-N 3.46Å; V594-A597 PolarHBondContact O-N 3.15Å; V594-A598 HydrophobicContact CG1-CB 4.44Å; V594-A598 WeakPolarHBondContact O-CB 3.4Å; V594-A598 PolarHBondContact O-N 2.99Å
595A72.9Confident66.6Low68 Ų6880.1 Ų80.156%0.56247%0.469SS*.Hα-helixtrans-63.2-33.1175.200000112.8V591 D592 P599V591-A595 WeakPolarHBondContact O-CB 3.38Å; V591-A595 PolarHBondContact O-N 2.82Å; D592-A595 PolarHBondContact O-N 2.97Å; A595-P599 VanDerWaalsContact O-CD 3.24Å; A595-P599 WeakPolarHBondContact O-CD 3.3Å; A595-P599 WeakPolarHBondContact O-CG 3.16Å
596V70.8Confident67.4Low89 Ų8977.9 Ų77.954%0.53946%0.46SS..Hα-helixtrans-81.7-37.5174.4172.90000112.4D592 L593 V594 V600D592-V596 WeakPolarHBondContact O-CG2 3.46Å; D592-V596 PolarHBondContact O-N 3.41Å; L593-V596 PolarHBondContact O-N 3.27Å; V594-V596 VanDerWaalsContact C-N 3.28Å; V594-V596 PolarHBondContact O-N 3.46Å; V596-V600 WeakPolarHBondContact O-CG2 3.46Å
597A65.5Low67.6Low35 Ų3579.2 Ų79.229%0.28946%0.462SS..Hα-helixtrans-84.7-35.9-174.200000114L593 V594 V600 L601L593-A597 WeakPolarHBondContact O-CB 3.48Å; L593-A597 PolarHBondContact O-N 3.36Å; V594-A597 PolarHBondContact O-N 3.15Å; A597-V600 WeakPolarHBondContact O-CA 3.37Å; A597-V600 PolarHBondContact O-N 2.89Å; A597-L601 WeakPolarHBondContact O-CG 3.49Å; A597-L601 PolarHBondContact O-N 3.12Å
598A72.1Confident67.5Low52 Ų5281 Ų8143%0.4346%0.46SS..THydrogen-bonded Turntrans-60.4-35.2-177.400000114.4V594 V600 P602V594-A598 HydrophobicContact CG1-CB 4.44Å; V594-A598 WeakPolarHBondContact O-CB 3.4Å; V594-A598 PolarHBondContact O-N 2.99Å; A598-V600 VanDerWaalsContact C-N 3.33Å; A598-P602 WeakPolarHBondContact O-CD 3.39Å
599P62.9Low67.4Low46 Ų4682.5 Ų82.530%0.29947%0.47SS..THydrogen-bonded Turntrans-70.7-25.5170-19.933.8000113.9A595A595-P599 VanDerWaalsContact O-CD 3.24Å; A595-P599 WeakPolarHBondContact O-CD 3.3Å; A595-P599 WeakPolarHBondContact O-CG 3.16Å
600V68.1Low67Low69 Ų6980.6 Ų80.642%0.41846%0.458SS..THydrogen-bonded Turntrans-84.7-40.5-175.7175.50000111.5V596 A597 A598 T603 V604V596-V600 WeakPolarHBondContact O-CG2 3.46Å; A597-V600 WeakPolarHBondContact O-CA 3.37Å; A597-V600 PolarHBondContact O-N 2.89Å; A598-V600 VanDerWaalsContact C-N 3.33Å; V600-T603 PolarHBondContact O-N 3.18Å; V600-T603 PolarHBondContact O-OG1 2.74Å; V600-V604 HydrophobicContact CG1-CG2 3.71Å; V600-V604 PolarHBondContact O-N 3.33Å
601L71Confident66.3Low114 Ų11482.6 Ų82.660%0.59746%0.464SS*.Hα-helixtrans-49.6-44.8-177.9-74.8168.2000114.3A597 T603 V604 A605A597-L601 WeakPolarHBondContact O-CG 3.49Å; A597-L601 PolarHBondContact O-N 3.12Å; L601-T603 VanDerWaalsContact C-N 3.33Å; L601-T603 PolarHBondContact O-N 2.84Å; L601-V604 PolarHBondContact O-N 3.35Å; L601-A605 VanDerWaalsContact O-CB 3.29Å; L601-A605 WeakPolarHBondContact O-CB 3.41Å; L601-A605 PolarHBondContact O-N 3.49Å
602P67.8Low65.5Low79 Ų7981.7 Ų81.751%0.51347%0.473SS..Hα-helixtrans-61.8-37175.7-24.534.9000113.6A598 W606A598-P602 WeakPolarHBondContact O-CD 3.39Å; P602-W606 VanDerWaalsContact O-CB 3.31Å; P602-W606 WeakPolarHBondContact O-CB 3.29Å; P602-W606 PolarHBondContact O-N 3.12Å
603T64Low64.8Low23 Ų2385.9 Ų85.914%0.14150%0.5CS..Hα-helixtrans-73.8-36.118062.90000112.3V600 L601 L607 L625 I626V600-T603 PolarHBondContact O-N 3.18Å; V600-T603 PolarHBondContact O-OG1 2.74Å; L601-T603 VanDerWaalsContact C-N 3.33Å; L601-T603 PolarHBondContact O-N 2.84Å; T603-L607 WeakPolarHBondContact O-CB 3.44Å; T603-L607 PolarHBondContact O-N 3.33Å; T603-L607 VanDerWaalsContact O-N 3.13Å; T603-L625 HydrophobicContact CG2-CD2 4.37Å; T603-I626 HydrophobicContact CG2-CG1 4.45Å
604V65.9Low63.8Low61 Ų6187 Ų8737%0.3751%0.506SS..Hα-helixtrans-70.3-45.4174.1175.40000110.7V600 L601 W606 L607 Y608V600-V604 HydrophobicContact CG1-CG2 3.71Å; V600-V604 PolarHBondContact O-N 3.33Å; L601-V604 PolarHBondContact O-N 3.35Å; V604-W606 PolarHBondContact O-N 2.97Å; V604-L607 WeakPolarHBondContact O-CB 3.29Å; V604-L607 PolarHBondContact O-N 2.85Å; V604-L607 VanDerWaalsContact O-N 3.14Å; V604-Y608 HydrophobicContact CG1-CD2 3.81Å; V604-Y608 HydrophobicContact CG1-CE2 3.78Å; V604-Y608 WeakPolarHBondContact O-CD2 3.38Å; V604-Y608 PolarHBondContact O-N 2.98Å
605A69.9Low63Low54 Ų5486.9 Ų86.945%0.44652%0.524SS..Hα-helixtrans-58.2-47176.500000111.7L601 L607 Y608 S609L601-A605 VanDerWaalsContact O-CB 3.29Å; L601-A605 WeakPolarHBondContact O-CB 3.41Å; L601-A605 PolarHBondContact O-N 3.49Å; A605-L607 VanDerWaalsContact C-N 3.3Å; A605-L607 PolarHBondContact O-N 3.14Å; A605-Y608 PolarHBondContact O-N 3.15Å; A605-S609 PolarHBondContact O-N 3.32Å; A605-S609 PolarHBondContact O-OG 2.89Å; A605-S609 VanDerWaalsContact O-OG 3.1Å
606W69.4Low61.8Low112 Ų11290.2 Ų90.242%0.42453%0.532SS..Hα-helixtrans-60.4-37175.6-177.685.6000113.1P602 V604 R610P602-W606 VanDerWaalsContact O-CB 3.31Å; P602-W606 WeakPolarHBondContact O-CB 3.29Å; P602-W606 PolarHBondContact O-N 3.12Å; V604-W606 PolarHBondContact O-N 2.97Å; W606-R610 PolarHBondContact O-N 3.49Å
607L64.4Low60.8Low84 Ų8490.1 Ų90.144%0.4454%0.541SS..Hα-helixtrans-64.2-46.1176.5-161.577.1000111.4T603 V604 A605 R610 H611 I622T603-L607 WeakPolarHBondContact O-CB 3.44Å; T603-L607 PolarHBondContact O-N 3.33Å; T603-L607 VanDerWaalsContact O-N 3.13Å; V604-L607 WeakPolarHBondContact O-CB 3.29Å; V604-L607 PolarHBondContact O-N 2.85Å; V604-L607 VanDerWaalsContact O-N 3.14Å; A605-L607 VanDerWaalsContact C-N 3.3Å; A605-L607 PolarHBondContact O-N 3.14Å; L607-R610 PolarHBondContact O-N 3.39Å; L607-H611 PolarHBondContact O-N 2.99Å; L607-I622 HydrophobicContact CD1-CD1 4.15Å
608Y59.7Low60.2Low183 Ų18391.1 Ų91.172%0.71854%0.544SS*.Hα-helixtrans-65.5-42.6176-84.3-76.7000112.3V604 A605 R610 H611V604-Y608 HydrophobicContact CG1-CD2 3.81Å; V604-Y608 HydrophobicContact CG1-CE2 3.78Å; V604-Y608 WeakPolarHBondContact O-CD2 3.38Å; V604-Y608 PolarHBondContact O-N 2.98Å; A605-Y608 PolarHBondContact O-N 3.15Å; Y608-R610 PolarHBondContact O-N 3.44Å; Y608-R610 VanDerWaalsContact O-N 3.17Å; Y608-H611 PolarHBondContact O-N 3.41Å
609S58.2Low59.2Low96 Ų9695.4 Ų95.467%0.67157%0.565SS**Hα-helixtrans-60-25.4176.8-62.10000113.7A605A605-S609 PolarHBondContact O-N 3.32Å; A605-S609 PolarHBondContact O-OG 2.89Å; A605-S609 VanDerWaalsContact O-OG 3.1Å
610R55.3Low58.9Low102 Ų102102 Ų10239%0.38559%0.585SS.*Hα-helixtrans-91.2-13.5-179.3-155.7170.5-171.71703.9114.2W606 L607 Y608 G612W606-R610 PolarHBondContact O-N 3.49Å; L607-R610 PolarHBondContact O-N 3.39Å; Y608-R610 PolarHBondContact O-N 3.44Å; Y608-R610 VanDerWaalsContact O-N 3.17Å; R610-G612 PolarHBondContact O-N 3.46Å
611H49.6Very low58.4Low173 Ų173104.4 Ų104.480%0.80160%0.596SS**THydrogen-bonded Turntrans-74.3-4.9-172.7-154.363.4000114.7L607 Y608L607-H611 PolarHBondContact O-N 2.99Å; Y608-H611 PolarHBondContact O-N 3.41Å
612G53Low58Low74 Ų74103 Ų10376%0.76359%0.588SS**THydrogen-bonded Turntrans-116.72.6-176.300000116.9R610R610-G612 PolarHBondContact O-N 3.46Å
613V56.3Low57.7Low118 Ų118100.6 Ų100.672%0.71558%0.577SS**THydrogen-bonded Turntrans-119.1-44.6-171.2-179.30000113.8
614D51.3Low57.7Low102 Ų102102.1 Ų102.155%0.54559%0.592SS.*  trans-126.7119.9179.8-73-63000110.8N616D614-N616 PolarHBondContact O-N 2.9Å
615G54.2Low57.7Low91 Ų91103.9 Ų103.994%0.93860%0.599SS**  trans-70.310.817800000115.7
616N49Very low57.7Low137 Ų137104.6 Ų104.673%0.73360%0.595SS**SBendtrans-100.7120.5-179.8-80-30.7000110.8D614D614-N616 PolarHBondContact O-N 2.9Å
617A50Low58Low88 Ų88107.2 Ų107.273%0.72761%0.605SS**  trans-57.7122.9176.300000110.9V619A617-V619 PolarHBondContact O-N 3.2Å; A617-V619 VanDerWaalsContact O-N 3.16Å
618P52.4Low58.6Low55 Ų55104.7 Ų104.736%0.35760%0.599SS.*  trans-71.8114.2-174.427.1-33.6000110.8Y620P618-Y620 PolarHBondContact O-N 3.35Å
619V50.8Low58.9Low142 Ų14298.1 Ų98.186%0.86158%0.579SS**  trans-76.855.2176.9-165.70000111.1A617A617-V619 PolarHBondContact O-N 3.2Å; A617-V619 VanDerWaalsContact O-N 3.16Å
620Y56.3Low59.5Low184 Ų18496.3 Ų96.372%0.72257%0.565SS**SBendtrans-124.5122.4170.3-73.5-79.8000108.6P618 I622P618-Y620 PolarHBondContact O-N 3.35Å; Y620-I622 PolarHBondContact O-N 2.89Å
621N58.9Low60.4Low120 Ų12096.9 Ų96.964%0.64258%0.575SS**  trans-67.5104.2-168.2-161.1-47.6000110G623 A624 L625N621-G623 PolarHBondContact O-N 3.37Å; N621-G623 VanDerWaalsContact O-N 3.17Å; N621-G623 PolarHBondContact OD1-N 2.9Å; N621-A624 HydrophobicContact CB-CB 4.18Å; N621-A624 WeakPolarHBondContact O-CA 3.43Å; N621-A624 VanDerWaalsContact O-CB 3.28Å; N621-A624 WeakPolarHBondContact O-CB 3.42Å; N621-A624 PolarHBondContact O-N 2.77Å; N621-L625 PolarHBondContact O-N 3.47Å
622I61.6Low61.4Low86 Ų8695.5 Ų95.544%0.44157%0.571SS.*Hα-helixtrans-56.1-36.7-175.5-63170.7000110.8L607 Y620 A624 L625 I626L607-I622 HydrophobicContact CD1-CD1 4.15Å; Y620-I622 PolarHBondContact O-N 2.89Å; I622-A624 PolarHBondContact O-N 2.94Å; I622-L625 PolarHBondContact O-N 3.34Å; I622-L625 VanDerWaalsContact O-N 3.16Å; I622-I626 HydrophobicContact CG2-CD1 3.81Å; I622-I626 HydrophobicContact CG2-CG1 4.31Å; I622-I626 WeakPolarHBondContact O-CG1 3.43Å; I622-I626 PolarHBondContact O-N 3.25Å
623G61.3Low62.2Low27 Ų2793.5 Ų93.528%0.27855%0.55SS.*Hα-helixtrans-65.7-17.7174.400000114.7N621 R627N621-G623 PolarHBondContact O-N 3.37Å; N621-G623 VanDerWaalsContact O-N 3.17Å; N621-G623 PolarHBondContact OD1-N 2.9Å; G623-R627 WeakPolarHBondContact O-CB 3.44Å; G623-R627 WeakPolarHBondContact O-CG 3.38Å; G623-R627 PolarHBondContact O-N 2.93Å; G623-R627 PolarHBondContact O-NE 2.69Å
624A65.1Low62.8Low56 Ų5692.2 Ų92.246%0.46354%0.539SS..Hα-helixtrans-81.6-40.9169.700000111.6N621 I622 R627 G628N621-A624 HydrophobicContact CB-CB 4.18Å; N621-A624 WeakPolarHBondContact O-CA 3.43Å; N621-A624 VanDerWaalsContact O-CB 3.28Å; N621-A624 WeakPolarHBondContact O-CB 3.42Å; N621-A624 PolarHBondContact O-N 2.77Å; I622-A624 PolarHBondContact O-N 2.94Å; A624-R627 PolarHBondContact O-N 3.38Å; A624-G628 PolarHBondContact O-N 3.44Å
625L65.2Low63.3Low97 Ų9792 Ų9251%0.50854%0.535SS..Hα-helixtrans-64.1-44.7176.5-169.170.2000111.5T603 N621 I622 G628 C629T603-L625 HydrophobicContact CG2-CD2 4.37Å; N621-L625 PolarHBondContact O-N 3.47Å; I622-L625 PolarHBondContact O-N 3.34Å; I622-L625 VanDerWaalsContact O-N 3.16Å; L625-G628 PolarHBondContact O-N 3.18Å; L625-C629 WeakPolarHBondContact O-CB 3.39Å; L625-C629 PolarHBondContact O-N 3Å
626I69.3Low63.6Low69 Ų6990.7 Ų90.735%0.35451%0.511SS..Hα-helixtrans-61-45.2174.2-66.8171.5000110.6T603 I622 G628 C629 C630T603-I626 HydrophobicContact CG2-CG1 4.45Å; I622-I626 HydrophobicContact CG2-CD1 3.81Å; I622-I626 HydrophobicContact CG2-CG1 4.31Å; I622-I626 WeakPolarHBondContact O-CG1 3.43Å; I622-I626 PolarHBondContact O-N 3.25Å; I626-G628 VanDerWaalsContact C-N 3.35Å; I626-G628 PolarHBondContact O-N 2.82Å; I626-C629 PolarHBondContact O-N 3.44Å; I626-C630 WeakPolarHBondContact O-CB 3.19Å; I626-C630 PolarHBondContact O-N 3.29Å; I626-C630 PolarHBondContact O-SG 2.91Å
627R75.5Confident64.1Low168 Ų16889.7 Ų89.763%0.63451%0.505SS*.Hα-helixtrans-61.2-41.3176.3-84.1179.9-83.1-159.2-4.6112.2G623 A624 I631G623-R627 WeakPolarHBondContact O-CB 3.44Å; G623-R627 WeakPolarHBondContact O-CG 3.38Å; G623-R627 PolarHBondContact O-N 2.93Å; G623-R627 PolarHBondContact O-NE 2.69Å; A624-R627 PolarHBondContact O-N 3.38Å; R627-I631 WeakPolarHBondContact O-CB 3.41Å; R627-I631 WeakPolarHBondContact O-CD1 3.46Å; R627-I631 WeakPolarHBondContact O-CG1 3.15Å; R627-I631 PolarHBondContact O-N 2.95Å
628G77.3Confident64.6Low31 Ų3193.4 Ų93.432%0.3250%0.5SS..Hα-helixtrans-60.8-47.5173.300000112.8A624 L625 I626 I631 M632A624-G628 PolarHBondContact O-N 3.44Å; L625-G628 PolarHBondContact O-N 3.18Å; I626-G628 VanDerWaalsContact C-N 3.35Å; I626-G628 PolarHBondContact O-N 2.82Å; G628-I631 PolarHBondContact O-N 3.31Å; G628-M632 WeakPolarHBondContact O-CG 3.5Å; G628-M632 PolarHBondContact O-N 3.49Å
629C66.8Low64.7Low44 Ų4497.9 Ų97.930%0.29751%0.51SS..Hα-helixtrans-60-47.8177.3-171.20000111.9L625 I626 I631 M632 G633L625-C629 WeakPolarHBondContact O-CB 3.39Å; L625-C629 PolarHBondContact O-N 3Å; I626-C629 PolarHBondContact O-N 3.44Å; C629-I631 PolarHBondContact O-N 2.76Å; C629-M632 PolarHBondContact O-N 2.91Å; C629-G633 PolarHBondContact O-N 2.91Å
630C69.5Low64.8Low58 Ų5895.4 Ų95.439%0.39250%0.495SS..Hα-helixtrans-61.4-41176.8-680000112.5I626 G633 L634I626-C630 WeakPolarHBondContact O-CB 3.19Å; I626-C630 PolarHBondContact O-N 3.29Å; I626-C630 PolarHBondContact O-SG 2.91Å; C630-G633 PolarHBondContact O-N 3.29Å; C630-L634 WeakPolarHBondContact O-CB 3.46Å; C630-L634 VanDerWaalsContact O-CG 3.24Å; C630-L634 WeakPolarHBondContact O-CG 3.28Å; C630-L634 PolarHBondContact O-N 3.21Å
631I74.8Confident64.5Low114 Ų11489.3 Ų89.359%0.58548%0.482SS*.Hα-helixtrans-63.1-45.7175.8-71.2165.1000110.7R627 G628 C629 H635R627-I631 WeakPolarHBondContact O-CB 3.41Å; R627-I631 WeakPolarHBondContact O-CD1 3.46Å; R627-I631 WeakPolarHBondContact O-CG1 3.15Å; R627-I631 PolarHBondContact O-N 2.95Å; G628-I631 PolarHBondContact O-N 3.31Å; C629-I631 PolarHBondContact O-N 2.76Å; I631-H635 VanDerWaalsContact O-CB 3.26Å; I631-H635 WeakPolarHBondContact O-CB 3.4Å; I631-H635 PolarHBondContact O-N 2.79Å
632M71.3Confident64Low144 Ų14494.1 Ų94.171%0.70949%0.491SS*.Hα-helixtrans-65.3-41.2177.6-71.6-176.469.900112.5G628 C629 H635 S636G628-M632 WeakPolarHBondContact O-CG 3.5Å; G628-M632 PolarHBondContact O-N 3.49Å; C629-M632 PolarHBondContact O-N 2.91Å; M632-H635 CarbonylContact O-C 3.6Å; M632-H635 PolarHBondContact O-N 2.95Å; M632-S636 PolarHBondContact O-N 3.2Å
633G69.3Low63.3Low32 Ų32100.1 Ų100.133%0.3351%0.508SS..Hα-helixtrans-60.7-50.8175.600000112.3C629 C630 H635 S636 L637C629-G633 PolarHBondContact O-N 2.91Å; C630-G633 PolarHBondContact O-N 3.29Å; G633-H635 VanDerWaalsContact C-N 3.28Å; G633-H635 PolarHBondContact O-N 2.73Å; G633-S636 WeakPolarHBondContact O-CB 3.41Å; G633-S636 PolarHBondContact O-N 2.85Å; G633-L637 WeakPolarHBondContact O-CG 3.31Å; G633-L637 PolarHBondContact O-N 3.43Å
634L68.1Low62.5Low92 Ų92106.6 Ų106.648%0.48253%0.531SS..Hα-helixtrans-61.3-35.2175.3-70169.4000112.5C630 S636 R638C630-L634 WeakPolarHBondContact O-CB 3.46Å; C630-L634 VanDerWaalsContact O-CG 3.24Å; C630-L634 WeakPolarHBondContact O-CG 3.28Å; C630-L634 PolarHBondContact O-N 3.21Å; L634-S636 VanDerWaalsContact C-N 3.34Å; L634-R638 WeakPolarHBondContact O-CG 3.43Å; L634-R638 PolarHBondContact O-N 3.48Å
635H62.9Low61.6Low98 Ų98111.2 Ų111.245%0.45455%0.549SS..Hα-helixtrans-74.4-22.3175.6-162.9-103.5000113.3I631 M632 G633 R639I631-H635 VanDerWaalsContact O-CB 3.26Å; I631-H635 WeakPolarHBondContact O-CB 3.4Å; I631-H635 PolarHBondContact O-N 2.79Å; M632-H635 CarbonylContact O-C 3.6Å; M632-H635 PolarHBondContact O-N 2.95Å; G633-H635 VanDerWaalsContact C-N 3.28Å; G633-H635 PolarHBondContact O-N 2.73Å; H635-R639 VanDerWaalsContact ND1-CZ 3.32Å; H635-R639 PolarHBondContact ND1-NH2 2.94Å; H635-R639 PolarHBondContact O-NE 3.06Å
636S61.2Low60.2Low63 Ų63113.9 Ų113.944%0.44158%0.584SS.*Hα-helixtrans-76.5-50.3168.8-147.20000110.8M632 G633 L634 R638 R639 V640M632-S636 PolarHBondContact O-N 3.2Å; G633-S636 WeakPolarHBondContact O-CB 3.41Å; G633-S636 PolarHBondContact O-N 2.85Å; L634-S636 VanDerWaalsContact C-N 3.34Å; S636-R638 VanDerWaalsContact C-N 3.34Å; S636-R638 PolarHBondContact O-N 3.01Å; S636-R639 WeakPolarHBondContact O-CA 3.26Å; S636-R639 PolarHBondContact O-N 3.41Å; S636-V640 PolarHBondContact O-N 3.2Å
637L58.6Low59.8Low116 Ų116116.1 Ų116.161%0.60760%0.596SS**Hα-helixtrans-55.6-43.4178.4-73.6164.6000112.6G633 R639 V640 A641G633-L637 WeakPolarHBondContact O-CG 3.31Å; G633-L637 PolarHBondContact O-N 3.43Å; L637-R639 VanDerWaalsContact C-N 3.26Å; L637-R639 PolarHBondContact O-N 3.07Å; L637-V640 PolarHBondContact O-N 2.96Å; L637-A641 WeakPolarHBondContact O-CB 3.4Å; L637-A641 PolarHBondContact O-N 3.3Å
638R61.2Low58.9Low166 Ų166113.4 Ų113.463%0.62659%0.594SS**Hα-helixtrans-63.3-27.1175.1-75.3-179.2-172.9143.84.3114.2L634 S636 R642L634-R638 WeakPolarHBondContact O-CG 3.43Å; L634-R638 PolarHBondContact O-N 3.48Å; S636-R638 VanDerWaalsContact C-N 3.34Å; S636-R638 PolarHBondContact O-N 3.01Å; R638-R642 WeakPolarHBondContact O-CB 3.28Å; R638-R642 WeakPolarHBondContact O-CG 3.46Å; R638-R642 PolarHBondContact O-N 3.37Å
639R54Low57.9Low149 Ų149117.9 Ų117.956%0.56261%0.609SS**Hα-helixtrans-84.3-27.3177-74.9-177.7-71.2-178.35.5112.7H635 S636 L637H635-R639 VanDerWaalsContact ND1-CZ 3.32Å; H635-R639 PolarHBondContact ND1-NH2 2.94Å; H635-R639 PolarHBondContact O-NE 3.06Å; S636-R639 WeakPolarHBondContact O-CA 3.26Å; S636-R639 PolarHBondContact O-N 3.41Å; L637-R639 VanDerWaalsContact C-N 3.26Å; L637-R639 PolarHBondContact O-N 3.07Å
640V52.6Low57.4Low90 Ų90122.3 Ų122.355%0.54563%0.627SS.*Hα-helixtrans-73.6-46.8169.9178.20000110.7S636 L637 R642 R643S636-V640 PolarHBondContact O-N 3.2Å; L637-V640 PolarHBondContact O-N 2.96Å; V640-R642 VanDerWaalsContact C-N 3.34Å; V640-R642 PolarHBondContact O-N 2.95Å; V640-R643 WeakPolarHBondContact O-CB 3.46Å; V640-R643 PolarHBondContact O-N 3.14Å
641A50.6Low56.7Low55 Ų55126.3 Ų126.346%0.45564%0.642SS.*Hα-helixtrans-58.8-42.6178.500000112.5L637 R643 Q644L637-A641 WeakPolarHBondContact O-CB 3.4Å; L637-A641 PolarHBondContact O-N 3.3Å; A641-R643 PolarHBondContact O-N 3.17Å; A641-Q644 PolarHBondContact O-N 3.35Å
642R48.7Very low55.4Low221 Ų221127.1 Ų127.183%0.83465%0.646SS**THydrogen-bonded Turntrans-68.95.1173.9-78.3-171.9171.1-161.1-2.6115.2R638 V640R638-R642 WeakPolarHBondContact O-CB 3.28Å; R638-R642 WeakPolarHBondContact O-CG 3.46Å; R638-R642 PolarHBondContact O-N 3.37Å; V640-R642 VanDerWaalsContact C-N 3.34Å; V640-R642 PolarHBondContact O-N 2.95Å
643R45.3Very low54.3Low212 Ų212125.9 Ų125.980%0.864%0.641SS**THydrogen-bonded Turntrans-112.34.8178-118.4-176.2-176.2-172.40.9113.7V640 A641V640-R643 WeakPolarHBondContact O-CB 3.46Å; V640-R643 PolarHBondContact O-N 3.14Å; A641-R643 PolarHBondContact O-N 3.17Å
644Q44.4Very low53.2Low163 Ų163133.2 Ų133.276%0.76267%0.665SS**SBendtrans-99.8-9.4174.4-63.4-169.5-86.900113.7A641A641-Q644 PolarHBondContact O-N 3.35Å
645D46.8Very low51.9Low154 Ų154136.6 Ų136.682%0.82468%0.68SS**  trans-10345.2175.1-60-47.3000111.4
646A36.6Very low50.9Low152 Ų152140.1 Ų140.1100%1.25670%0.701SS**  trans-147.60-17900000111.8

Retrieved 646 of 646 residues in 254.3 ms (Link to these results)