A0A2K5ZD31_MANLE Loading...

Transcription factor binding to IGHM enhancer 3

AlphaFold DB , UniProt , Accession A0A2K5ZD31, Species MANLE (Mandrillus leucophaeus, Drill), Gene TFE3, Length 575 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.6Very low39.3Very low231 Ų231146.5 Ų146.5100%1.13885%0.845SS**  0142.80-72.3151.768.400107.3
2S40.7Very low38.8Very low127 Ų127144.8 Ų144.889%0.88884%0.839SS**  trans61.7107.3-177-49.90000114.9
3H36.2Very low38.3Very low187 Ų187147.8 Ų147.887%0.86684%0.841SS**  trans-116.9163.8177.1-95.7-93.1000110.4
4A36.3Very low38Very low99 Ų99143.2 Ų143.282%0.81883%0.83SS**  trans70.1154149.400000117.7
5A35.9Very low37.7Very low98 Ų98142.4 Ų142.481%0.8184%0.835SS**  cis-161-177.6-14.700000110.7
6E37Very low37.9Very low186 Ų186139.4 Ų139.487%0.86983%0.832SS**PPolyproline II helixtrans-64168.7177.3-100-159.2117.300116.1
7P53.9Low37.8Very low105 Ų105139.5 Ų139.568%0.68282%0.822SS**PPolyproline II helixtrans-89.2164.7-175.137.5-37.2000114.6
8P46.5Very low37.9Very low125 Ų125134.7 Ų134.781%0.81281%0.807SS**PPolyproline II helixtrans-90.8167.8168.936.4-33.8000113.6
9R40.4Very low38.1Very low224 Ų224134.7 Ų134.785%0.84581%0.81SS**  trans-129.4171.5172.3-75.4-172.7173.4-164.20.3111.2
10D36.2Very low38.2Very low159 Ų159137.5 Ų137.585%0.8581%0.806SS**  trans69.6145.9160.8-54.1-31.2000118.1
11G31.4Very low38.2Very low70 Ų70134.4 Ų134.472%0.72280%0.796SS**  trans159.642.4177.600000120.7
12V33.7Very low38.2Very low127 Ų127129.5 Ų129.577%0.7778%0.779SS**  trans42134.3137.1-177.40000121.9
13E32.2Very low38.1Very low184 Ų184131.9 Ų131.986%0.8677%0.773SS**  trans65.4163.4161.7-76-177.4123.300119.4
14A34.1Very low38.2Very low83 Ų83128.3 Ų128.369%0.68677%0.765SS**  cis-169.5173.3-36.400000111.6
15S33.3Very low38.2Very low131 Ų131131 Ų13192%0.91676%0.764SS**  trans77.3158.7162.2-1500000117.9
16A40.6Very low38.2Very low95 Ų95133.7 Ų133.779%0.78576%0.764SS**  trans-107.9145.6-168.100000112.3
17E37.3Very low38.1Very low140 Ų140133.7 Ų133.765%0.65476%0.764SS**  trans-133.8134.5154.7-146-177149.400109.1R20E17-R20 VanDerWaalsContact CD-NH2 3.31Å; E17-R20 IonicContact OE1-CZ 3.15Å; E17-R20 IonicContact OE1-NE 2.69Å; E17-R20 PolarHBondContact OE1-NE 2.77Å; E17-R20 IonicContact OE1-NH2 2.77Å; E17-R20 PolarHBondContact OE1-NH2 2.69Å; E17-R20 IonicContact OE2-CZ 3.87Å; E17-R20 IonicContact OE2-NE 3.91Å; E17-R20 IonicContact OE2-NH2 3.03Å; E17-R20 PolarHBondContact OE2-NH2 3Å
18G39.8Very low37.1Very low53 Ų53137.4 Ų137.455%0.54677%0.772SS.*  trans-76.5170.6179.600000112.6R20G18-R20 PolarHBondContact O-N 3.03Å
19P41.8Very low36.6Very low135 Ų135142.5 Ų142.588%0.87778%0.775SS**  trans-61.9110.3175.326.2-33.6000110.4A21P19-A21 PolarHBondContact O-N 3.21Å
20R40.2Very low36.5Very low191 Ų191142.6 Ų142.672%0.72178%0.776SS**  trans-62105.2177.3-71.2-174.9177.5-178.83.9110.4E17 G18 V22E17-R20 VanDerWaalsContact CD-NH2 3.31Å; E17-R20 IonicContact OE1-CZ 3.15Å; E17-R20 IonicContact OE1-NE 2.69Å; E17-R20 PolarHBondContact OE1-NE 2.77Å; E17-R20 IonicContact OE1-NH2 2.77Å; E17-R20 PolarHBondContact OE1-NH2 2.69Å; E17-R20 IonicContact OE2-CZ 3.87Å; E17-R20 IonicContact OE2-NE 3.91Å; E17-R20 IonicContact OE2-NH2 3.03Å; E17-R20 PolarHBondContact OE2-NH2 3Å; G18-R20 PolarHBondContact O-N 3.03Å; R20-V22 PolarHBondContact O-N 3.02Å
21A38.1Very low36.5Very low72 Ų72141 Ų14160%0.59577%0.774SS**  trans-70.7108.6170.800000109.8P19 F23P19-A21 PolarHBondContact O-N 3.21Å; A21-F23 HydrophobicContact CB-CD2 4.37Å; A21-F23 HydrophobicContact CB-CE2 3.81Å; A21-F23 HydrophobicContact CB-CZ 4.21Å; A21-F23 WeakPolarHBondContact O-CD2 3.36Å; A21-F23 PolarHBondContact O-N 3.27Å
22V37.4Very low36.8Very low129 Ų129141.8 Ų141.878%0.78277%0.774SS**  trans-80.4101.2173.41800000108.7R20 V24R20-V22 PolarHBondContact O-N 3.02Å; V22-V24 HydrophobicContact CG1-CG2 4.49Å; V22-V24 PolarHBondContact O-N 3.26Å
23F38.9Very low36.8Very low177 Ų177143.2 Ų143.278%0.77678%0.777SS**  trans-77.8103.7173.5-68-87.1000110A21 L25A21-F23 HydrophobicContact CB-CD2 4.37Å; A21-F23 HydrophobicContact CB-CE2 3.81Å; A21-F23 HydrophobicContact CB-CZ 4.21Å; A21-F23 WeakPolarHBondContact O-CD2 3.36Å; A21-F23 PolarHBondContact O-N 3.27Å; F23-L25 PolarHBondContact O-N 3.28Å
24V38.2Very low37Very low112 Ų112139.5 Ų139.568%0.67977%0.771SS**  trans-79.1103.8167.1-177.10000108V22 L26V22-V24 HydrophobicContact CG1-CG2 4.49Å; V22-V24 PolarHBondContact O-N 3.26Å; V24-L26 HydrophobicContact CG1-CD1 4Å; V24-L26 PolarHBondContact O-N 3.31Å
25L35.3Very low36.9Very low156 Ų156140.7 Ų140.782%0.81778%0.781SS**  trans-71.9111.4163.6-73.890.9000108.1F23 E27F23-L25 PolarHBondContact O-N 3.28Å; L25-E27 PolarHBondContact O-N 3.31Å
26L36.2Very low36.9Very low153 Ų153142.6 Ų142.680%0.80178%0.776SS**  trans-77.6104.3159.1-79.689000107.5V24 E28V24-L26 HydrophobicContact CG1-CD1 4Å; V24-L26 PolarHBondContact O-N 3.31Å; L26-E28 PolarHBondContact O-N 3.01Å
27E35.1Very low36.6Very low186 Ų186146.6 Ų146.687%0.86978%0.783SS**  trans-72.790.2173.7-173170.8-158.500109.6L25 R29L25-E27 PolarHBondContact O-N 3.31Å; E27-R29 PolarHBondContact O-N 2.95Å
28E33.3Very low36.3Very low183 Ų183147 Ų14786%0.85579%0.788SS**  trans-71.395.7177.9-170.1168.6-141.700110.3L26 R30L26-E28 PolarHBondContact O-N 3.01Å; E28-R30 PolarHBondContact O-N 3.21Å
29R35.5Very low35.9Very low233 Ų233149.4 Ų149.488%0.87980%0.797SS**  trans-63.988-178.1-174.8-178.7-177.1159.82.1111.5E27 P31E27-R29 PolarHBondContact O-N 2.95Å; R29-P31 VanDerWaalsContact O-CD 3.28Å; R29-P31 WeakPolarHBondContact O-CD 3.41Å
30R37.1Very low35.5Very low226 Ų226150 Ų15085%0.85379%0.792SS**PPolyproline II helixtrans-55.2121.6170.6-75.4-168.1-74.6149.5-6.4111.1E28E28-R30 PolarHBondContact O-N 3.21Å
31P36.7Very low35.1Very low124 Ų124148.1 Ų148.181%0.80580%0.796SS**PPolyproline II helixtrans-75.8128.7150.632.3-28.5000107.9R29R29-P31 VanDerWaalsContact O-CD 3.28Å; R29-P31 WeakPolarHBondContact O-CD 3.41Å
32A37.2Very low34.8Very low87 Ų87150.4 Ų150.472%0.71981%0.808SS**PPolyproline II helixtrans-96.7123.216400000107.6
33D34.6Very low34.6Very low158 Ų158152.2 Ų152.285%0.84581%0.813SS**  trans-170.8154.6149.1-103.9-30.8000112.4
34S36.4Very low34.6Very low105 Ų105151.1 Ų151.173%0.73481%0.814SS**  trans53.381.516859.40000118
35A31.9Very low34.8Very low108 Ų108151.6 Ų151.689%0.89382%0.819SS**  trans-84.8112.8151.200000109.2
36Q33.1Very low34.9Very low172 Ų172152.4 Ų152.480%0.80482%0.819SS**  trans-112.2118.5171.9-82.1-177.4-28.100110.7L38Q36-L38 PolarHBondContact O-N 3.03Å
37L34.7Very low34.8Very low178 Ų178150.8 Ų150.893%0.93282%0.82SS**  trans-77.7104174.5-69.1171.2000109.8
38L31.4Very low34.8Very low148 Ų148144.9 Ų144.978%0.77581%0.81SS**  trans-95.292.9167.9-72.2175000110.1Q36 L40Q36-L38 PolarHBondContact O-N 3.03Å; L38-L40 PolarHBondContact O-N 2.95Å
39S31.3Very low34.7Very low104 Ų104144.1 Ų144.173%0.72781%0.81SS**  trans-70.6115.6164.4-174.20000109.1
40L32.4Very low34.7Very low149 Ų149138.7 Ų138.778%0.7880%0.802SS**  trans-10497175.3-67.5-178.2000110.1L38 S42L38-L40 PolarHBondContact O-N 2.95Å; L40-S42 PolarHBondContact O-N 3.41Å; L40-S42 VanDerWaalsContact O-N 3.16Å
41N31.5Very low34.7Very low150 Ų150132 Ų13280%0.80280%0.795SS**  trans-66.8105.8161.5-77.8-36000108.8L43N41-L43 PolarHBondContact O-N 2.99Å
42S33.1Very low34.8Very low120 Ų120133.1 Ų133.184%0.83980%0.795SS**  trans-69.5111.7172.8-69.10000110.3L40L40-S42 PolarHBondContact O-N 3.41Å; L40-S42 VanDerWaalsContact O-N 3.16Å
43L33.2Very low34.9Very low168 Ų168135.8 Ų135.888%0.8880%0.795SS**PPolyproline II helixtrans-64.6140.3175.8-71.8165.5000111.7N41N41-L43 PolarHBondContact O-N 2.99Å
44L37.9Very low35.1Very low154 Ų154137.6 Ų137.681%0.80680%0.798SS**PPolyproline II helixtrans-79.7143.3172.7-145.188.3000110.6
45P42.9Very low35.2Very low122 Ų122140.3 Ų140.379%0.79280%0.804SS**PPolyproline II helixtrans-91.3131.1146.932.7-27.1000109.6
46E37.9Very low35.6Very low173 Ų173143.2 Ų143.281%0.80880%0.799SS**PPolyproline II helixtrans-88.6149.9-175.3-164.1-169.9147.900112.7
47S34.2Very low36.3Very low118 Ų118143.1 Ų143.183%0.82580%0.804SS**  trans70.7134.5163.3-153.20000117.7
48G33.6Very low36.6Very low63 Ų63139.6 Ų139.665%0.64979%0.79SS**  cis168.3132.9-7.300000113.1
49I32.1Very low36.9Very low167 Ų167140.7 Ų140.786%0.85680%0.796SS**  trans-161.9123.8154.8-94.9145.8000104.8
50V35.5Very low37.1Very low119 Ų119141.9 Ų141.972%0.72179%0.794SS**  trans-84.2141.8172.2177.40000108.6D52V50-D52 WeakPolarHBondContact CG1-OD1 3.25Å
51A37.6Very low37.7Very low86 Ų86140.5 Ų140.571%0.71179%0.793SS**  trans-130.288.8172.500000108.7I53A51-I53 PolarHBondContact O-N 3.47Å
52D39.1Very low38.1Very low147 Ų147139.7 Ų139.779%0.78679%0.789SS**  trans-69.496179.2-58.2-51.1000110.4V50V50-D52 WeakPolarHBondContact CG1-OD1 3.25Å
53I37.7Very low38.2Very low143 Ų143139.1 Ų139.173%0.73379%0.785SS**  trans-137.186.5161.8-51.4-179.8000108.1A51 L55A51-I53 PolarHBondContact O-N 3.47Å; I53-L55 PolarHBondContact O-N 3.28Å
54E39.8Very low38.4Very low195 Ų195140.4 Ų140.491%0.91178%0.784SS**  trans-64.4124.6154.6-63.8-178.1134.700107.7
55L38.6Very low38.4Very low162 Ų162143.4 Ų143.485%0.84879%0.786SS**  trans-122.987.8169.7-161.873.1000108.6I53I53-L55 PolarHBondContact O-N 3.28Å
56E40.8Very low38.2Very low170 Ų170144.6 Ų144.679%0.79478%0.781SS**  trans-65.8156.4-179.2-165.6173-156.900112V58E56-V58 VanDerWaalsContact C-N 3.29Å; E56-V58 PolarHBondContact O-N 2.96Å
57N46.3Very low38Very low169 Ų169144 Ų14490%0.90478%0.783SS**  trans-74.573-177.7-76.1-49.8000112.6
58V41.8Very low38.1Very low104 Ų104146 Ų14663%0.6378%0.777SS**  trans-111.799.2169.9-174.70000110.2E56E56-V58 VanDerWaalsContact C-N 3.29Å; E56-V58 PolarHBondContact O-N 2.96Å
59L37.3Very low38.3Very low172 Ų172148.1 Ų148.190%0.90178%0.781SS**  trans-133.291.8167.3-79.8175.8000109.3
60D35.8Very low38.6Very low129 Ų129148.3 Ų148.369%0.6978%0.779SS**  trans-61.2133.4170.3-75.5-55.4000111D62D60-D62 VanDerWaalsContact C-N 3.26Å; D60-D62 PolarHBondContact O-N 3.31Å; D60-D62 VanDerWaalsContact O-N 3.13Å
61P44.4Very low38.8Very low119 Ų119148.4 Ų148.477%0.77378%0.781SS**THydrogen-bonded Turntrans-79.410.9-169.931.7-36.7000115.9
62D39.9Very low38.8Very low134 Ų134151.7 Ų151.772%0.71779%0.786SS**THydrogen-bonded Turntrans-124.42.8-167.3-100.2-44.7000117D60 F64D60-D62 VanDerWaalsContact C-N 3.26Å; D60-D62 PolarHBondContact O-N 3.31Å; D60-D62 VanDerWaalsContact O-N 3.13Å; D62-F64 PolarHBondContact O-N 3.26Å
63S35.8Very low38.7Very low107 Ų107150.7 Ų150.775%0.74879%0.788SS**  trans-80.779.8179.6-80.80000114.3
64F37.8Very low38.5Very low196 Ų196152 Ų15286%0.8680%0.795SS**  trans-79.3121.1168.9-82.4-95.5000112.7D62D62-F64 PolarHBondContact O-N 3.26Å
65Y38.1Very low38.2Very low217 Ų217154.5 Ų154.585%0.85180%0.796SS**  trans-92.8112.4164.4-88.5-83.6000111.3L67Y65-L67 PolarHBondContact O-N 3.49Å
66E37.7Very low37.9Very low147 Ų147152.5 Ų152.569%0.68780%0.796SS**  trans-75.3104.6179-170-164.9-151.500111.8K68E66-K68 PolarHBondContact O-N 3.24Å; E66-K68 IonicContact OE1-NZ 3.77Å; E66-K68 IonicContact OE2-NZ 3.59Å; E66-K68 PolarHBondContact OE2-NZ 3.05Å
67L34.9Very low37.6Very low160 Ų160150 Ų15084%0.83880%0.797SS**  trans-77.987.9172.4-124.580.9000111.1Y65 S69Y65-L67 PolarHBondContact O-N 3.49Å; L67-S69 VanDerWaalsContact C-N 3.34Å; L67-S69 PolarHBondContact O-N 2.92Å
68K36.2Very low37.1Very low161 Ų161150.2 Ų150.270%0.780%0.797SS**  trans-74.970.2-171.2-152.6-176.2-150.684.40114.5E66E66-K68 PolarHBondContact O-N 3.24Å; E66-K68 IonicContact OE1-NZ 3.77Å; E66-K68 IonicContact OE2-NZ 3.59Å; E66-K68 PolarHBondContact OE2-NZ 3.05Å
69S36.4Very low37.1Very low107 Ų107150.8 Ų150.875%0.74880%0.803SS**  trans-86.8108.7174.254.80000112.4L67L67-S69 VanDerWaalsContact C-N 3.34Å; L67-S69 PolarHBondContact O-N 2.92Å
70Q40.1Very low36.7Very low171 Ų171151 Ų15180%0.79980%0.804SS**PPolyproline II helixtrans-72.5130.1170.5-71.2-174.7-2.900111.1
71P39.5Very low36.5Very low120 Ų120149.8 Ų149.878%0.77981%0.805SS**PPolyproline II helixtrans-80.6121.9168.831.2-31.6000110.9
72L36.9Very low35.9Very low156 Ų156151 Ų15182%0.81780%0.804SS**PPolyproline II helixtrans-77126.4170.4-67.8173000110.4L74L72-L74 PolarHBondContact O-N 2.86Å
73P36.7Very low35.5Very low125 Ų125152.8 Ų152.881%0.81281%0.808SS**PPolyproline II helixtrans-78.6119.6175.430.6-32.7000111.2
74L34.3Very low35.2Very low170 Ų170151.2 Ų151.289%0.8980%0.802SS**PPolyproline II helixtrans-88.8117.2164.6-73.7174000110L72L72-L74 PolarHBondContact O-N 2.86Å
75R32.7Very low35.2Very low249 Ų249148.4 Ų148.494%0.9480%0.801SS**  trans-166.8142.4134.6-86.3-121.3170.2176.6-1.7111
76S31.5Very low35.8Very low120 Ų120144 Ų14484%0.83980%0.798SS**  trans-116.3126.5172.452.50000109.8
77S34.4Very low35.6Very low117 Ų117141.8 Ų141.882%0.81881%0.806SS**  trans-153.6138.5166.649.20000109
78L36.5Very low35.3Very low173 Ų173140.6 Ų140.691%0.90681%0.805SS**  trans-76.6159-173.1-73.6169.7000112.4
79P41.6Very low36.1Very low116 Ų116138.4 Ų138.475%0.75381%0.807SS**  trans-86.8151.5-164.634.2-36.4000114
80I29.8Very low35.8Very low178 Ų178137.4 Ų137.491%0.91381%0.805SS**  trans-144157157.2-107162000109.6
81S32Very low35.2Very low102 Ų102135 Ų13571%0.71380%0.803SS**  trans-71.3168.8-154.9-141.60000118.7
82L31.3Very low34.8Very low144 Ų144136.6 Ų136.675%0.75480%0.804SS**  trans85.7109.6151.7-66.3163000122.4
83Q30.5Very low34.3Very low173 Ų173134.3 Ų134.381%0.80880%0.801SS**  82.996.9114.2-156.8164.536.800122.2
84A31Very low34Very low74 Ų74132.6 Ų132.661%0.61280%0.798SS**  74.2106.6126.500000124.2
85T36.3Very low33.7Very low136 Ų136130 Ų13083%0.83479%0.793SS**  trans74.2176.6133.176.40000117.4
86P52.2Low33.6Very low124 Ų124123.3 Ų123.381%0.80579%0.785SS**  -135.4163.7-115.630.9-5.7000117.5
87A32.6Very low33.5Very low102 Ų102123 Ų12384%0.84378%0.783SS**  trans-162.5151.4157.200000114.2
88T28.8Very low33.5Very low135 Ų135122.5 Ų122.583%0.82879%0.786SS**  trans-126179.5165.845.60000107.9
89P52.2Low33.3Very low114 Ų114118.4 Ų118.474%0.7479%0.785SS**  cis-130.6-167-24.629.5-7.6000113.1
90A30.6Very low32.8Very low86 Ų86116.3 Ų116.371%0.71178%0.784SS**  trans75.2167.2155.500000117.4
91T28.4Very low32.9Very low121 Ų121113.9 Ų113.974%0.74278%0.783SS**  cis-153.6152.38.5-12.80000111.9
92L30Very low33.2Very low153 Ų153120.4 Ų120.480%0.80179%0.792SS**  trans60.2124.4145.9-69.7168.9000124
93S27.5Very low33.5Very low109 Ų109119.8 Ų119.876%0.76280%0.795SS**  91.8150.1123-69.70000124.6
94A29.3Very low34.1Very low89 Ų89117.7 Ų117.774%0.73680%0.796SS**  trans87.2100.215100000121.5
95S28.1Very low34.3Very low114 Ų114118.4 Ų118.480%0.79780%0.802SS**  57.1116.9121.8-51.10000121.6
96S30.5Very low34.9Very low110 Ų110120.9 Ų120.977%0.76981%0.806SS**  159153.495.454.90000115.2
97S29.7Very low34.6Very low114 Ų114119.3 Ų119.380%0.79780%0.798SS**  trans31.4116155.959.30000122
98A34.7Very low35.5Very low106 Ų106119 Ų11988%0.87679%0.79SS**  -163.8145.9117.300000110.9
99G32.7Very low36.6Very low86 Ų86116.7 Ų116.789%0.88778%0.779SS**  trans-88.4143.217200000112
100G31Very low36.3Very low72 Ų72115.4 Ų115.474%0.74277%0.773SS**  trans-165.29717700000111.8
101S31.6Very low37.6Very low127 Ų127114.4 Ų114.489%0.88876%0.76SS**  trans-69.9142-178.841.90000112.2
102R37.3Very low39.5Very low240 Ų240112.2 Ų112.291%0.90675%0.75SS**  trans-89.3127.3-171.5-60.8161.273.7-171.25.9111.2
103T38.6Very low41.4Very low131 Ų131114 Ų11480%0.80475%0.746SS**  trans-141.4127.3156.154.50000110
104P42.7Very low44Very low129 Ų129113.4 Ų113.484%0.83874%0.738SS**  trans-79.6131.7-178.831.4-33.5000112
105A36.2Very low46.7Very low88 Ų88114.1 Ų114.173%0.72773%0.729SS**  trans-88.5115.3174.600000111.4S107A105-S107 PolarHBondContact O-N 2.93Å
106M47.7Very low49.5Very low189 Ų189113.3 Ų113.393%0.93172%0.715SS**  trans-74.490.1172.9-66.6-174.576.100111.1
107S46.8Very low52.1Low90 Ų90116.9 Ų116.963%0.62971%0.712SS**  trans-137.536.9-175.2-66.70000114.3A105A105-S107 PolarHBondContact O-N 2.93Å
108S51.5Low54.9Low97 Ų97116 Ų11668%0.67870%0.695SS**  trans-89.5-34.1-175.352.80000115.3S112S108-S112 PolarHBondContact O-N 3.04Å
109S51Low57.6Low86 Ų86117 Ų11760%0.60168%0.682SS**Hα-helixtrans-70.8-40.2-166.1-167.90000114.6R113S109-R113 PolarHBondContact O-N 3.24Å
110S46.9Very low60.4Low87 Ų87118.3 Ų118.361%0.60867%0.667SS**Hα-helixtrans-69.3-43.6179.251.40000112.2R113 V114S110-R113 PolarHBondContact O-N 3.35Å; S110-V114 WeakPolarHBondContact O-CG2 3.49Å; S110-V114 PolarHBondContact O-N 2.88Å; S110-V114 VanDerWaalsContact O-N 3.11Å
111S57.5Low63.3Low64 Ų64120.3 Ų120.345%0.44866%0.659SS.*Hα-helixtrans-59.7-48.1177.8-172.30000111.5R113 V114 L115S111-R113 VanDerWaalsContact C-N 3.34Å; S111-R113 PolarHBondContact O-N 2.95Å; S111-V114 PolarHBondContact O-N 3.43Å; S111-V114 VanDerWaalsContact O-N 3.13Å; S111-L115 WeakPolarHBondContact O-CB 3.36Å; S111-L115 WeakPolarHBondContact O-CG 3.39Å; S111-L115 PolarHBondContact O-N 3.34Å
112S67.8Low66.2Low76 Ų76120.8 Ų120.853%0.53164%0.641SS.*Hα-helixtrans-54.4-46.5176.5176.90000112.6S108 V114 L115 L116S108-S112 PolarHBondContact O-N 3.04Å; S112-V114 PolarHBondContact O-N 3.4Å; S112-L115 PolarHBondContact O-N 3.01Å; S112-L116 WeakPolarHBondContact O-CB 3.28Å; S112-L116 PolarHBondContact O-N 3.38Å
113R70.4Confident68.8Low190 Ų190111.7 Ų111.772%0.71762%0.618SS**Hα-helixtrans-67.4-32.9179.3-162.6179.2-64.4-168.9-0.2113.2S109 S110 S111 R117S109-R113 PolarHBondContact O-N 3.24Å; S110-R113 PolarHBondContact O-N 3.35Å; S111-R113 VanDerWaalsContact C-N 3.34Å; S111-R113 PolarHBondContact O-N 2.95Å; R113-R117 WeakPolarHBondContact O-CB 3.36Å; R113-R117 PolarHBondContact O-N 3.04Å; R113-R117 VanDerWaalsContact O-N 3.17Å
114V82.1Confident71.2Confident96 Ų96112.4 Ų112.458%0.58261%0.612SS**Hα-helixtrans-72.4-42.7175.1171.90000111.3S110 S111 S112 R117 Q118S110-V114 WeakPolarHBondContact O-CG2 3.49Å; S110-V114 PolarHBondContact O-N 2.88Å; S110-V114 VanDerWaalsContact O-N 3.11Å; S111-V114 PolarHBondContact O-N 3.43Å; S111-V114 VanDerWaalsContact O-N 3.13Å; S112-V114 PolarHBondContact O-N 3.4Å; V114-R117 PolarHBondContact O-N 3.3Å; V114-Q118 PolarHBondContact O-N 2.86Å
115L85Confident73.5Confident105 Ų105109 Ų10955%0.5560%0.595SS.*Hα-helixtrans-61.9-47.4176-72.2167.7000111.4S111 S112 R117 Q118 Q119S111-L115 WeakPolarHBondContact O-CB 3.36Å; S111-L115 WeakPolarHBondContact O-CG 3.39Å; S111-L115 PolarHBondContact O-N 3.34Å; S112-L115 PolarHBondContact O-N 3.01Å; L115-R117 PolarHBondContact O-N 3.49Å; L115-Q118 PolarHBondContact O-N 3.15Å; L115-Q118 VanDerWaalsContact O-N 3.1Å; L115-Q119 PolarHBondContact O-N 3.15Å
116L87.5Confident76Confident96 Ų96110.8 Ų110.850%0.50359%0.588SS.*Hα-helixtrans-59.4-43.8176.3-179.461.6000111.9S112 Q118 Q119 L120S112-L116 WeakPolarHBondContact O-CB 3.28Å; S112-L116 PolarHBondContact O-N 3.38Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; L116-Q118 PolarHBondContact O-N 3.39Å; L116-Q119 PolarHBondContact O-N 3.29Å; L116-L120 PolarHBondContact O-N 2.82Å
117R86.2Confident78Confident186 Ų186106.3 Ų106.370%0.70257%0.565SS**Hα-helixtrans-60.6-40.2174.3-179.6176.3176.9-91.9-3.4112R113 V114 L115 M121R113-R117 WeakPolarHBondContact O-CB 3.36Å; R113-R117 PolarHBondContact O-N 3.04Å; R113-R117 VanDerWaalsContact O-N 3.17Å; V114-R117 PolarHBondContact O-N 3.3Å; L115-R117 PolarHBondContact O-N 3.49Å; R117-M121 WeakPolarHBondContact O-CB 3.47Å; R117-M121 PolarHBondContact O-N 3.3Å
118Q88.4Confident80Confident94 Ų94107.5 Ų107.544%0.43956%0.561SS.*Hα-helixtrans-70.9-34.3178.6-159.3-168.1103.700112.2V114 L115 L116 R122V114-Q118 PolarHBondContact O-N 2.86Å; L115-Q118 PolarHBondContact O-N 3.15Å; L115-Q118 VanDerWaalsContact O-N 3.1Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; L116-Q118 PolarHBondContact O-N 3.39Å; Q118-R122 WeakPolarHBondContact O-CB 3.47Å; Q118-R122 PolarHBondContact O-N 3.02Å
119Q91.8Very high81.8Confident129 Ų129107.4 Ų107.460%0.60355%0.549SS*.Hα-helixtrans-66.3-46.9173.6-172.4175.610.800111.5L115 L116 M121 R122 A123L115-Q119 PolarHBondContact O-N 3.15Å; L116-Q119 PolarHBondContact O-N 3.29Å; Q119-M121 PolarHBondContact O-N 2.8Å; Q119-R122 PolarHBondContact O-N 3.49Å; Q119-A123 PolarHBondContact O-N 2.85Å
120L91.5Very high83.5Confident112 Ų112108.8 Ų108.859%0.58654%0.541SS*.Hα-helixtrans-58.3-44.9174-101.7160000112.2L116 R122 A123 Q124L116-L120 PolarHBondContact O-N 2.82Å; L120-R122 VanDerWaalsContact C-N 3.31Å; L120-R122 PolarHBondContact O-N 3.1Å; L120-A123 PolarHBondContact O-N 3.05Å; L120-Q124 WeakPolarHBondContact O-CB 3.25Å; L120-Q124 PolarHBondContact O-N 2.67Å
121M91.5Very high85.4Confident115 Ų115112.2 Ų112.257%0.56754%0.541SS*.Hα-helixtrans-63.6-36.4177.8-160.4-177.594.100112.3R117 Q119 A125R117-M121 WeakPolarHBondContact O-CB 3.47Å; R117-M121 PolarHBondContact O-N 3.3Å; Q119-M121 PolarHBondContact O-N 2.8Å; M121-A125 PolarHBondContact O-N 3.43Å
122R92Very high86.7Confident136 Ų136113.3 Ų113.351%0.51354%0.539SS..Hα-helixtrans-68.7-42.3174.8-172.6178.1-67109.72.5111.9Q118 Q119 L120 A125 Q126Q118-R122 WeakPolarHBondContact O-CB 3.47Å; Q118-R122 PolarHBondContact O-N 3.02Å; Q119-R122 PolarHBondContact O-N 3.49Å; L120-R122 VanDerWaalsContact C-N 3.31Å; L120-R122 PolarHBondContact O-N 3.1Å; R122-A125 PolarHBondContact O-N 2.85Å; R122-Q126 WeakPolarHBondContact O-CG 3.49Å; R122-Q126 PolarHBondContact O-N 2.82Å; R122-Q126 VanDerWaalsContact O-N 3.08Å
123A91Very high87.3Confident50 Ų50117.4 Ų117.441%0.41354%0.543SS..Hα-helixtrans-64-43.2176.600000112Q119 L120 A125 Q126 E127Q119-A123 PolarHBondContact O-N 2.85Å; L120-A123 PolarHBondContact O-N 3.05Å; A123-A125 VanDerWaalsContact C-N 3.34Å; A123-A125 PolarHBondContact O-N 3.36Å; A123-Q126 PolarHBondContact O-N 3.36Å; A123-E127 PolarHBondContact O-N 3Å
124Q89.4Confident87.7Confident145 Ų145115.8 Ų115.868%0.67854%0.537SS*.Hα-helixtrans-62.1-39.8177.3-169.1173.725.500112.1L120 E127 Q128L120-Q124 WeakPolarHBondContact O-CB 3.25Å; L120-Q124 PolarHBondContact O-N 2.67Å; Q124-E127 PolarHBondContact O-N 2.84Å; Q124-Q128 PolarHBondContact O-N 2.88Å; Q124-Q128 VanDerWaalsContact O-N 3.1Å
125A90.8Very high87.3Confident59 Ų59116.2 Ų116.249%0.48853%0.532SS..Hα-helixtrans-65.6-40.3174.600000112.7M121 R122 A123 Q128 E129M121-A125 PolarHBondContact O-N 3.43Å; R122-A125 PolarHBondContact O-N 2.85Å; A123-A125 VanDerWaalsContact C-N 3.34Å; A123-A125 PolarHBondContact O-N 3.36Å; A125-Q128 PolarHBondContact O-N 3.39Å; A125-E129 PolarHBondContact O-N 3.49Å
126Q89.9Confident86.6Confident124 Ų124117.6 Ų117.658%0.57954%0.536SS*.Hα-helixtrans-66.7-38176.7-73.9178.2-41.100112.6R122 A123 Q128 E129 R130R122-Q126 WeakPolarHBondContact O-CG 3.49Å; R122-Q126 PolarHBondContact O-N 2.82Å; R122-Q126 VanDerWaalsContact O-N 3.08Å; A123-Q126 PolarHBondContact O-N 3.36Å; Q126-Q128 VanDerWaalsContact C-N 3.31Å; Q126-E129 PolarHBondContact O-N 3.42Å; Q126-R130 VanDerWaalsContact O-CB 3.3Å; Q126-R130 WeakPolarHBondContact O-CB 3.5Å; Q126-R130 PolarHBondContact O-N 2.93Å
127E89.2Confident85.7Confident96 Ų96116.5 Ų116.545%0.44954%0.541SS..Hα-helixtrans-65.3-36.2174.1-172.455.2-120.200111.4A123 Q124 R130 R131A123-E127 PolarHBondContact O-N 3Å; Q124-E127 PolarHBondContact O-N 2.84Å; E127-R130 PolarHBondContact O-N 2.97Å; E127-R130 IonicContact OE1-CZ 2.74Å; E127-R130 IonicContact OE1-NE 3.31Å; E127-R130 PolarHBondContact OE1-NE 2.91Å; E127-R130 IonicContact OE1-NH2 2.76Å; E127-R130 PolarHBondContact OE1-NH2 3.45Å; E127-R130 IonicContact OE2-CZ 3.15Å; E127-R130 IonicContact OE2-NE 2.83Å; E127-R130 PolarHBondContact OE2-NE 3.18Å; E127-R130 IonicContact OE2-NH2 2.66Å; E127-R131 WeakPolarHBondContact O-CB 3.41Å; E127-R131 PolarHBondContact O-N 3.31Å
128Q87.6Confident84.6Confident115 Ų115112 Ų11254%0.53754%0.543SS..Hα-helixtrans-68.7-45.5173.5-173.2172.2-25.600112.6Q124 A125 Q126 R130 R131 E132Q124-Q128 PolarHBondContact O-N 2.88Å; Q124-Q128 VanDerWaalsContact O-N 3.1Å; A125-Q128 PolarHBondContact O-N 3.39Å; Q126-Q128 VanDerWaalsContact C-N 3.31Å; Q128-R130 VanDerWaalsContact C-N 3.27Å; Q128-R130 PolarHBondContact O-N 2.92Å; Q128-R131 WeakPolarHBondContact O-CB 3.3Å; Q128-R131 PolarHBondContact O-N 3.11Å; Q128-R131 VanDerWaalsContact O-N 3.07Å; Q128-E132 WeakPolarHBondContact CG-OE1 3.25Å; Q128-E132 PolarHBondContact NE2-OE1 3.17Å; Q128-E132 PolarHBondContact O-N 3.45Å
129E90.2Very high83.2Confident94 Ų94111 Ų11144%0.43955%0.551SS.*Hα-helixtrans-59.1-40.7174.1-166.9-156.3144.600111A125 Q126 R131 E132 R133A125-E129 PolarHBondContact O-N 3.49Å; Q126-E129 PolarHBondContact O-N 3.42Å; E129-R131 VanDerWaalsContact C-N 3.28Å; E129-R131 PolarHBondContact O-N 2.94Å; E129-E132 PolarHBondContact O-N 2.96Å; E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 WeakPolarHBondContact O-CG 3.45Å; E129-R133 PolarHBondContact O-N 3.44Å; E129-R133 IonicContact OE1-CZ 3.6Å; E129-R133 VanDerWaalsContact OE1-CZ 3.24Å; E129-R133 IonicContact OE1-NE 2.83Å; E129-R133 PolarHBondContact OE1-NE 2.93Å; E129-R133 IonicContact OE1-NH2 2.72Å; E129-R133 PolarHBondContact OE1-NH2 3.07Å
130R87.6Confident81.3Confident116 Ų116108.1 Ų108.144%0.43855%0.549SS..Hα-helixtrans-62.5-35.2176.4-167.6-170.778.6116.9-2.3112.2Q126 E127 Q128 R134Q126-R130 VanDerWaalsContact O-CB 3.3Å; Q126-R130 WeakPolarHBondContact O-CB 3.5Å; Q126-R130 PolarHBondContact O-N 2.93Å; E127-R130 PolarHBondContact O-N 2.97Å; E127-R130 IonicContact OE1-CZ 2.74Å; E127-R130 IonicContact OE1-NE 3.31Å; E127-R130 PolarHBondContact OE1-NE 2.91Å; E127-R130 IonicContact OE1-NH2 2.76Å; E127-R130 PolarHBondContact OE1-NH2 3.45Å; E127-R130 IonicContact OE2-CZ 3.15Å; E127-R130 IonicContact OE2-NE 2.83Å; E127-R130 PolarHBondContact OE2-NE 3.18Å; E127-R130 IonicContact OE2-NH2 2.66Å; Q128-R130 VanDerWaalsContact C-N 3.27Å; Q128-R130 PolarHBondContact O-N 2.92Å; R130-R134 WeakPolarHBondContact O-CG 3.25Å; R130-R134 PolarHBondContact O-N 2.98Å
131R85.9Confident79.4Confident158 Ų158108.6 Ų108.660%0.59656%0.559SS**Hα-helixtrans-71.2-48.5174.6-177.3175.5-178.1153.74.1111.5E127 Q128 E129 R133 R134 E135E127-R131 WeakPolarHBondContact O-CB 3.41Å; E127-R131 PolarHBondContact O-N 3.31Å; Q128-R131 WeakPolarHBondContact O-CB 3.3Å; Q128-R131 PolarHBondContact O-N 3.11Å; Q128-R131 VanDerWaalsContact O-N 3.07Å; E129-R131 VanDerWaalsContact C-N 3.28Å; E129-R131 PolarHBondContact O-N 2.94Å; R131-R133 VanDerWaalsContact C-N 3.32Å; R131-R133 PolarHBondContact O-N 2.82Å; R131-R134 WeakPolarHBondContact O-CA 3.31Å; R131-R134 WeakPolarHBondContact O-CB 3.32Å; R131-R134 PolarHBondContact O-N 3.41Å; R131-E135 WeakPolarHBondContact CG-OE1 3.2Å; R131-E135 IonicContact CZ-OE1 2.85Å; R131-E135 IonicContact NE-OE1 2.73Å; R131-E135 PolarHBondContact NE-OE1 2.67Å; R131-E135 IonicContact NH2-OE1 3.27Å; R131-E135 PolarHBondContact NH2-OE1 2.69Å; R131-E135 PolarHBondContact O-N 2.9Å
132E84.2Confident77.2Confident88 Ų88112.9 Ų112.941%0.41158%0.575SS.*Hα-helixtrans-60.9-39.4177.1-71.5173.8-160.800111.4Q128 E129 R134 E135 Q136Q128-E132 WeakPolarHBondContact CG-OE1 3.25Å; Q128-E132 PolarHBondContact NE2-OE1 3.17Å; Q128-E132 PolarHBondContact O-N 3.45Å; E129-E132 PolarHBondContact O-N 2.96Å; E132-R134 VanDerWaalsContact C-N 3.34Å; E132-R134 PolarHBondContact O-N 3.42Å; E132-E135 PolarHBondContact O-N 3.21Å; E132-Q136 WeakPolarHBondContact O-CB 3.29Å; E132-Q136 VanDerWaalsContact O-CG 3.25Å; E132-Q136 WeakPolarHBondContact O-CG 3.44Å; E132-Q136 PolarHBondContact O-N 3.31Å
133R81.1Confident75Confident161 Ų161112.3 Ų112.361%0.60859%0.589SS**Hα-helixtrans-61.6-36.3170.6-78-173.8-174.1-129.35.4113.5E129 R131 A137E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 WeakPolarHBondContact O-CG 3.45Å; E129-R133 PolarHBondContact O-N 3.44Å; E129-R133 IonicContact OE1-CZ 3.6Å; E129-R133 VanDerWaalsContact OE1-CZ 3.24Å; E129-R133 IonicContact OE1-NE 2.83Å; E129-R133 PolarHBondContact OE1-NE 2.93Å; E129-R133 IonicContact OE1-NH2 2.72Å; E129-R133 PolarHBondContact OE1-NH2 3.07Å; R131-R133 VanDerWaalsContact C-N 3.32Å; R131-R133 PolarHBondContact O-N 2.82Å; R133-A137 WeakPolarHBondContact O-CB 3.32Å; R133-A137 PolarHBondContact O-N 3.1Å
134R78.3Confident72.6Confident157 Ų157115.3 Ų115.359%0.59261%0.607SS**Hα-helixtrans-71-40.3176.3-80.5173.5161.8-156.9-9.5111.6R130 R131 E132 A137 A138R130-R134 WeakPolarHBondContact O-CG 3.25Å; R130-R134 PolarHBondContact O-N 2.98Å; R131-R134 WeakPolarHBondContact O-CA 3.31Å; R131-R134 WeakPolarHBondContact O-CB 3.32Å; R131-R134 PolarHBondContact O-N 3.41Å; E132-R134 VanDerWaalsContact C-N 3.34Å; E132-R134 PolarHBondContact O-N 3.42Å; R134-A137 PolarHBondContact O-N 2.92Å; R134-A138 WeakPolarHBondContact O-CB 3.26Å; R134-A138 PolarHBondContact O-N 3.24Å
135E74.3Confident70.9Confident104 Ų104114.5 Ų114.549%0.48661%0.614SS.*Hα-helixtrans-70-37.5177.2-69.2170.8-171.700110.7R131 E132 A138 A139R131-E135 WeakPolarHBondContact CG-OE1 3.2Å; R131-E135 IonicContact CZ-OE1 2.85Å; R131-E135 IonicContact NE-OE1 2.73Å; R131-E135 PolarHBondContact NE-OE1 2.67Å; R131-E135 IonicContact NH2-OE1 3.27Å; R131-E135 PolarHBondContact NH2-OE1 2.69Å; R131-E135 PolarHBondContact O-N 2.9Å; E132-E135 PolarHBondContact O-N 3.21Å; E135-A138 PolarHBondContact O-N 3.05Å; E135-A139 VanDerWaalsContact O-CB 3.31Å; E135-A139 WeakPolarHBondContact O-CB 3.44Å; E135-A139 PolarHBondContact O-N 3.01Å
136Q71.3Confident68.2Low134 Ų134116.3 Ų116.363%0.62663%0.629SS**Hα-helixtrans-66.2-41.9169.8-73.1173.61600113.1E132 A138 A139 A140E132-Q136 WeakPolarHBondContact O-CB 3.29Å; E132-Q136 VanDerWaalsContact O-CG 3.25Å; E132-Q136 WeakPolarHBondContact O-CG 3.44Å; E132-Q136 PolarHBondContact O-N 3.31Å; Q136-A138 VanDerWaalsContact C-N 3.28Å; Q136-A138 PolarHBondContact O-N 3.06Å; Q136-A139 CarbonylContact O-C 3.56Å; Q136-A139 PolarHBondContact O-N 3.24Å; Q136-A140 PolarHBondContact O-N 3.15Å
137A66.9Low66.6Low74 Ų74116.3 Ų116.361%0.61264%0.64SS**Hα-helixtrans-65.5-31.8175.800000112.5R133 R134 A139R133-A137 WeakPolarHBondContact O-CB 3.32Å; R133-A137 PolarHBondContact O-N 3.1Å; R134-A137 PolarHBondContact O-N 2.92Å; A137-A139 VanDerWaalsContact C-N 3.32Å
138A64.1Low63.9Low91 Ų91116.1 Ų116.175%0.75266%0.655SS**Hα-helixtrans-76.2-17.7171.300000113.5R134 E135 Q136R134-A138 WeakPolarHBondContact O-CB 3.26Å; R134-A138 PolarHBondContact O-N 3.24Å; E135-A138 PolarHBondContact O-N 3.05Å; Q136-A138 VanDerWaalsContact C-N 3.28Å; Q136-A138 PolarHBondContact O-N 3.06Å
139A59.2Low61.3Low72 Ų72116 Ų11660%0.59567%0.666SS**THydrogen-bonded Turntrans-97.62.9179.200000114.1E135 Q136 A137 P141E135-A139 VanDerWaalsContact O-CB 3.31Å; E135-A139 WeakPolarHBondContact O-CB 3.44Å; E135-A139 PolarHBondContact O-N 3.01Å; Q136-A139 CarbonylContact O-C 3.56Å; Q136-A139 PolarHBondContact O-N 3.24Å; A137-A139 VanDerWaalsContact C-N 3.32Å; A139-P141 VanDerWaalsContact O-CD 3.28Å; A139-P141 WeakPolarHBondContact O-CD 3.48Å
140A52.4Low59.4Low69 Ų69117.3 Ų117.357%0.5768%0.683SS**PPolyproline II helixtrans-68118.5178.200000111.3Q136Q136-A140 PolarHBondContact O-N 3.15Å
141P51.7Low56.6Low122 Ų122116.6 Ų116.679%0.79270%0.702SS**PPolyproline II helixtrans-70.8143.4179.5-18.533000112.4A139A139-P141 VanDerWaalsContact O-CD 3.28Å; A139-P141 WeakPolarHBondContact O-CD 3.48Å
142F45.2Very low54.3Low206 Ų206117.1 Ų117.190%0.90472%0.715SS**PPolyproline II helixtrans-60.9131170.8-70.1-94.3000110.9
143P44.6Very low51.9Low124 Ų124118.3 Ų118.381%0.80573%0.733SS**PPolyproline II helixtrans-70.9138.3169.629.4-33.2000110.9
144S39.9Very low49.5Very low112 Ų112117.1 Ų117.178%0.78374%0.743SS**PPolyproline II helixtrans-79.8164.6177.7660000112.3
145P54.8Low47.3Very low129 Ų129115.3 Ų115.384%0.83875%0.749SS**PPolyproline II helixtrans-86.2160.8-157.933.9-36.9000115.7
146A34Very low45.3Very low96 Ų96114 Ų11479%0.79376%0.763SS**  trans-130.2158.716300000109.5
147P56.4Low43.5Very low124 Ų124113.9 Ų113.981%0.80577%0.772SS**  trans-109.9175.1-14640.5-36.8000116.9
148A32.5Very low41.9Very low93 Ų93115.7 Ų115.777%0.76978%0.78SS**  trans75.4142.7163.400000116.9
149S32.4Very low40.4Very low111 Ų111116.5 Ų116.578%0.77679%0.786SS**  cis-137.7-141.3-3.3-66.70000111.4
150P50.9Low39.1Very low123 Ų123116.8 Ų116.880%0.79980%0.796SS**  -125156.6-123.738-18.4000116.8
151A29Very low38.1Very low100 Ų100116 Ų11683%0.82680%0.796SS**  trans169.3130.7136.200000110.3
152I36.1Very low37.1Very low170 Ų170118.5 Ų118.587%0.87280%0.796SS**  trans-123.2125.4168.5-69.6178.6000110.2
153S34.4Very low36.6Very low113 Ų113114.6 Ų114.679%0.7979%0.79SS**  trans-159.7143153.7-76.20000105
154V31.7Very low36.5Very low135 Ų135117.4 Ų117.482%0.81880%0.797SS**  cis-132152.337.4172.70000112.9
155V31.9Very low36.1Very low119 Ų119115.4 Ų115.472%0.72179%0.794SS**  trans-22.8136.1164.21800000117.1V157V155-V157 HydrophobicContact CG1-CG2 3.65Å
156G31.5Very low35.3Very low76 Ų76119.7 Ų119.778%0.78479%0.793SS**  trans-129.2112.1151.900000110.4
157V33.1Very low35.8Very low133 Ų133120 Ų12081%0.80679%0.787SS**  trans-84.4144.5179.31730000110.6V155V155-V157 HydrophobicContact CG1-CG2 3.65Å
158S33.6Very low35.5Very low112 Ų112119.4 Ų119.478%0.78378%0.783SS**  trans-103.1161.6174.7-71.40000113.6
159A34Very low36.1Very low107 Ų107119.7 Ų119.788%0.88478%0.777SS**  trans93.2134.2159.100000118.9
160G30.1Very low36.4Very low78 Ų78118.8 Ų118.880%0.80478%0.776SS**  trans88117.1-178.600000113.2
161G31.3Very low35.9Very low54 Ų54122 Ų12256%0.55778%0.781SS**  cis175-173.8-5.500000111.8
162H32.5Very low36.7Very low173 Ų173123 Ų12380%0.80178%0.776SS**  trans60.9122158-5-83.7000120.7
163T34.8Very low37.3Very low125 Ų125119.7 Ų119.777%0.76777%0.766SS**  trans57.7121.3138.2570000122.6
164L40.8Very low38.4Very low182 Ų182126.3 Ų126.395%0.95377%0.774SS**  trans47.184.5135.5-77.8155.5000118.3
165G32.2Very low39.4Very low70 Ų70127.9 Ų127.972%0.72277%0.772SS**  trans-147.7101.5161.100000111.2P167G165-P167 WeakPolarHBondContact O-CD 3.28Å
166R38.4Very low40.5Very low220 Ų220128.5 Ų128.583%0.8378%0.776SS**PPolyproline II helixtrans-74.3118.6171.8168.1178.3174.8-175.60.5108.7
167P43.4Very low41.3Very low102 Ų102132.1 Ų132.166%0.66278%0.776SS**PPolyproline II helixtrans-63.7143.4166.7-16.831.6000109.6G165G165-P167 WeakPolarHBondContact O-CD 3.28Å
168P50.8Low42.4Very low111 Ų111134.8 Ų134.872%0.72178%0.777SS**PPolyproline II helixtrans-61.2146.4171.227.8-34.1000109.7A170P168-A170 PolarHBondContact O-N 2.95Å
169P44.8Very low42.9Very low99 Ų99134.9 Ų134.964%0.64377%0.773SS**PPolyproline II helixtrans-60.1129.5172.427.3-33.2000109Q171P169-Q171 PolarHBondContact O-N 3.17Å; P169-Q171 VanDerWaalsContact O-N 3.14Å
170A38.1Very low43.4Very low92 Ų92136.8 Ų136.876%0.7676%0.763SS**PPolyproline II helixtrans-55.9121.6-178.900000110.1P168 V172P168-A170 PolarHBondContact O-N 2.95Å; A170-V172 PolarHBondContact O-N 2.96Å
171Q41.9Very low44.4Very low190 Ų190137.1 Ų137.189%0.88875%0.75SS**  trans-77.687.9-170.5-169169.8500109.9P169 P173P169-Q171 PolarHBondContact O-N 3.17Å; P169-Q171 VanDerWaalsContact O-N 3.14Å; Q171-P173 WeakPolarHBondContact O-CD 3.32Å
172V45.7Very low45.5Very low121 Ų121142.8 Ų142.873%0.73376%0.762SS**  trans-57122.7179.4-174.80000109.5A170 R174A170-V172 PolarHBondContact O-N 2.96Å; V172-R174 PolarHBondContact O-N 2.87Å
173P48.3Very low46.5Very low102 Ų102139.7 Ų139.766%0.66275%0.75SS**  trans-56.8133.7176.6-26.335.5000111.3Q171 E175Q171-P173 WeakPolarHBondContact O-CD 3.32Å; P173-E175 PolarHBondContact O-N 3.16Å; P173-E175 VanDerWaalsContact O-N 3.15Å
174R56.7Low47.6Very low252 Ų252143 Ų14395%0.95176%0.757SS**SBendtrans-78.816.9175.1-82.9-171.4164.6-155.5-3.7113.6V172 V176V172-R174 PolarHBondContact O-N 2.87Å; R174-V176 PolarHBondContact O-N 2.95Å
175E54.4Low48Very low167 Ų167140 Ų14078%0.7874%0.742SS**  trans-8792.1173.5-64.9-171.7175.400109P173 L177P173-E175 PolarHBondContact O-N 3.16Å; P173-E175 VanDerWaalsContact O-N 3.15Å; E175-L177 PolarHBondContact O-N 3.14Å; E175-L177 VanDerWaalsContact O-N 3.13Å
176V55Low49.9Very low132 Ų132141 Ų14180%0.874%0.736SS**  trans-57.9116.9169.8179.90000107.7R174 K178R174-V176 PolarHBondContact O-N 2.95Å; V176-K178 PolarHBondContact O-N 3.47Å
177L47.8Very low51.8Low152 Ų152133.2 Ų133.280%0.79671%0.713SS**  trans-57109.5172.3-8187000108.4E175 V179E175-L177 PolarHBondContact O-N 3.14Å; E175-L177 VanDerWaalsContact O-N 3.13Å; L177-V179 PolarHBondContact O-N 3.31Å
178K56.2Low53Low190 Ų190139.1 Ų139.183%0.82672%0.722SS**  trans-67.886.1166.3-84.5-175173.3178.20108.1V176 Q180V176-K178 PolarHBondContact O-N 3.47Å; K178-Q180 VanDerWaalsContact C-N 3.3Å; K178-Q180 PolarHBondContact O-N 3.41Å
179V43.9Very low54.1Low114 Ų114141.4 Ų141.469%0.69172%0.717SS**  trans-65.196.2168.5-172.70000106.6L177 T181L177-V179 PolarHBondContact O-N 3.31Å; V179-T181 HydrophobicContact CB-CG2 4.47Å; V179-T181 HydrophobicContact CG1-CG2 3.75Å; V179-T181 PolarHBondContact O-N 2.86Å
180Q43.7Very low55.6Low146 Ų146141.5 Ų141.568%0.68271%0.709SS**  trans-72.272.7-177.3-167.272.321.200109.7K178 H182K178-Q180 VanDerWaalsContact C-N 3.3Å; K178-Q180 PolarHBondContact O-N 3.41Å; Q180-H182 PolarHBondContact O-CD2 3.31Å; Q180-H182 PolarHBondContact O-N 3.37Å; Q180-H182 VanDerWaalsContact O-N 3.08Å
181T52.5Low57.6Low86 Ų86141.5 Ų141.553%0.52870%0.696SS.*  trans-72.8102.8-179.960.60000109.6V179 L183V179-T181 HydrophobicContact CB-CG2 4.47Å; V179-T181 HydrophobicContact CG1-CG2 3.75Å; V179-T181 PolarHBondContact O-N 2.86Å; T181-L183 PolarHBondContact O-N 3.13Å
182H52.9Low59.4Low173 Ų173138 Ų13880%0.80168%0.68SS**  trans-70.370.1168.5-74.6-100.7000110.3Q180Q180-H182 PolarHBondContact O-CD2 3.31Å; Q180-H182 PolarHBondContact O-N 3.37Å; Q180-H182 VanDerWaalsContact O-N 3.08Å
183L53.5Low60.9Low107 Ų107135.8 Ų135.856%0.5666%0.661SS**  trans-84.7120.6166.9-9776.4000108.9T181 N185 T187T181-L183 PolarHBondContact O-N 3.13Å; L183-N185 PolarHBondContact O-N 2.85Å; L183-T187 HydrophobicContact CD2-CG2 3.65Å
184E59.2Low62.4Low195 Ų195133.2 Ų133.291%0.91165%0.648SS**SBendtrans-67-2.6177.8-153.7177.4123.700113.5
185N49.6Very low63.5Low119 Ų119127.2 Ų127.264%0.63663%0.626SS**SBendtrans-133.3132174.1-76.6-106.1000108.7L183 T187L183-N185 PolarHBondContact O-N 2.85Å; N185-T187 PolarHBondContact O-N 2.8Å
186P71.9Confident64.8Low91 Ų91123.1 Ų123.159%0.59160%0.603SS**  trans-62.5129.6179.725.9-33.7000110.4H190P186-H190 HydrophobicContact CB-CB 4.31Å
187T76.7Confident66.1Low57 Ų57122.1 Ų122.135%0.3559%0.59SS.*  trans-61.4151.4174.555.30000110.3L183 N185 Y189 H190 L191L183-T187 HydrophobicContact CD2-CG2 3.65Å; N185-T187 PolarHBondContact O-N 2.8Å; T187-Y189 PolarHBondContact O-N 3.01Å; T187-H190 PolarHBondContact O-N 3.44Å; T187-H190 PolarHBondContact OG1-ND1 2.89Å; T187-L191 PolarHBondContact O-N 2.95Å; T187-L191 VanDerWaalsContact O-N 3.08Å
188R69.8Low67.8Low225 Ų225121.6 Ų121.685%0.84958%0.583SS**Hα-helixtrans-50.6-36.8-176.2-75.8-166.3179.7-165.53.3113.3L191 Q192R188-L191 PolarHBondContact O-N 3.38Å; R188-Q192 WeakPolarHBondContact O-CB 3.47Å; R188-Q192 PolarHBondContact O-N 3.33Å
189Y73.3Confident69Low160 Ų160114.4 Ų114.463%0.62756%0.555SS**Hα-helixtrans-55.3-51.9173.2-179.7-94.7000112.4T187 L191 Q192 Q193T187-Y189 PolarHBondContact O-N 3.01Å; Y189-L191 PolarHBondContact O-N 2.99Å; Y189-Q192 PolarHBondContact O-N 3.16Å; Y189-Q193 VanDerWaalsContact O-CB 3.24Å; Y189-Q193 WeakPolarHBondContact O-CB 3.48Å; Y189-Q193 PolarHBondContact O-N 3.4Å
190H77.4Confident70.7Confident101 Ų101111.2 Ų111.247%0.46853%0.532SS..Hα-helixtrans-65.5-36177.2-68.898.5000112.7P186 T187 A194P186-H190 HydrophobicContact CB-CB 4.31Å; T187-H190 PolarHBondContact O-N 3.44Å; T187-H190 PolarHBondContact OG1-ND1 2.89Å; H190-A194 WeakPolarHBondContact O-CB 3.41Å; H190-A194 PolarHBondContact O-N 3.19Å
191L79.2Confident72.3Confident91 Ų91111.1 Ų111.148%0.47653%0.531SS..Hα-helixtrans-67.1-40.2176.8-176.561.9000111.9T187 R188 Y189 R195T187-L191 PolarHBondContact O-N 2.95Å; T187-L191 VanDerWaalsContact O-N 3.08Å; R188-L191 PolarHBondContact O-N 3.38Å; Y189-L191 PolarHBondContact O-N 2.99Å; L191-R195 WeakPolarHBondContact O-CG 3.46Å; L191-R195 PolarHBondContact O-N 2.97Å
192Q79Confident73.5Confident118 Ų118113.7 Ų113.755%0.55153%0.533SS*.Hα-helixtrans-73-37.9176.3-170.5164.9-3.700111.7R188 Y189 R195 R196R188-Q192 WeakPolarHBondContact O-CB 3.47Å; R188-Q192 PolarHBondContact O-N 3.33Å; Y189-Q192 PolarHBondContact O-N 3.16Å; Q192-R195 PolarHBondContact O-N 2.92Å; Q192-R196 PolarHBondContact O-N 3.33Å
193Q77.8Confident74.6Confident73 Ų73106.8 Ų106.834%0.34150%0.501SS..Hα-helixtrans-64.4-40172.8-170.9177.511.100111.7Y189 R196 Q197Y189-Q193 VanDerWaalsContact O-CB 3.24Å; Y189-Q193 WeakPolarHBondContact O-CB 3.48Å; Y189-Q193 PolarHBondContact O-N 3.4Å; Q193-R196 PolarHBondContact O-N 2.81Å; Q193-Q197 WeakPolarHBondContact O-CB 3.45Å; Q193-Q197 VanDerWaalsContact O-CG 3.29Å; Q193-Q197 WeakPolarHBondContact O-CG 3.39Å; Q193-Q197 PolarHBondContact O-N 3.32Å
194A79.7Confident75.4Confident48 Ų48104.7 Ų104.740%0.39750%0.496SS..Hα-helixtrans-65.1-41.2174.700000111.9H190 Q197 Q198H190-A194 WeakPolarHBondContact O-CB 3.41Å; H190-A194 PolarHBondContact O-N 3.19Å; A194-Q197 PolarHBondContact O-N 3.3Å; A194-Q198 WeakPolarHBondContact O-CB 3.49Å; A194-Q198 PolarHBondContact O-N 3.47Å
195R80.3Confident75.7Confident126 Ų126100 Ų10048%0.47548%0.48SS..Hα-helixtrans-59.9-49.6170.8-75.8178.8175.1-140.7-1111.8L191 Q192 Q197 Q198 V199 E272L191-R195 WeakPolarHBondContact O-CG 3.46Å; L191-R195 PolarHBondContact O-N 2.97Å; Q192-R195 PolarHBondContact O-N 2.92Å; R195-Q197 VanDerWaalsContact C-N 3.31Å; R195-Q197 PolarHBondContact O-N 2.89Å; R195-Q198 WeakPolarHBondContact O-CB 3.41Å; R195-Q198 PolarHBondContact O-N 3.07Å; R195-Q198 VanDerWaalsContact O-N 3.13Å; R195-V199 WeakPolarHBondContact O-CG2 3.37Å; R195-V199 PolarHBondContact O-N 3.49Å; R195-E272 IonicContact NH1-OE2 3.46Å; R195-E272 PolarHBondContact NH1-OE2 2.93Å
196R81.8Confident76.2Confident81 Ų8197.2 Ų97.231%0.30647%0.468SS..Hα-helixtrans-60.1-39.5176.5170.2152.7165.1-165.6-13111.9Q192 Q193 K200 D262 I265 D266 I269Q192-R196 PolarHBondContact O-N 3.33Å; Q193-R196 PolarHBondContact O-N 2.81Å; R196-K200 WeakPolarHBondContact O-CB 3.4Å; R196-K200 PolarHBondContact O-N 2.69Å; R196-D262 IonicContact CZ-OD1 3Å; R196-D262 VanDerWaalsContact CZ-OD1 3.26Å; R196-D262 IonicContact CZ-OD2 2.96Å; R196-D262 IonicContact NE-OD1 3.19Å; R196-D262 PolarHBondContact NE-OD1 3.01Å; R196-D262 IonicContact NH2-OD1 2.9Å; R196-D262 PolarHBondContact NH2-OD1 3.07Å; R196-D262 IonicContact NH2-OD2 2.92Å; R196-D262 PolarHBondContact NH2-OD2 3.27Å; R196-I265 HydrophobicContact CB-CG2 4.33Å; R196-I265 HydrophobicContact CG-CG2 3.93Å; R196-D266 IonicContact NH1-OD1 3.36Å; R196-D266 PolarHBondContact NH1-OD1 3.43Å; R196-D266 IonicContact NH1-OD2 3.26Å; R196-D266 PolarHBondContact NH1-OD2 3.34Å; R196-I269 HydrophobicContact CB-CD1 4.37Å
197Q83Confident75.6Confident112 Ų11297.9 Ų97.952%0.52347%0.466SS..Hα-helixtrans-64-41.7172.9-76.5172-9.200112.4Q193 A194 R195 K200 Q201Q193-Q197 WeakPolarHBondContact O-CB 3.45Å; Q193-Q197 VanDerWaalsContact O-CG 3.29Å; Q193-Q197 WeakPolarHBondContact O-CG 3.39Å; Q193-Q197 PolarHBondContact O-N 3.32Å; A194-Q197 PolarHBondContact O-N 3.3Å; R195-Q197 VanDerWaalsContact C-N 3.31Å; R195-Q197 PolarHBondContact O-N 2.89Å; Q197-K200 PolarHBondContact O-N 3.2Å; Q197-Q201 VanDerWaalsContact O-CB 3.31Å; Q197-Q201 WeakPolarHBondContact O-CB 3.4Å; Q197-Q201 PolarHBondContact O-N 2.89Å
198Q82.8Confident74.7Confident140 Ų14097.5 Ų97.565%0.65447%0.473SS*.Hα-helixtrans-63.7-44.2176.8-172.4178.215.200111.9A194 R195 Q201 Y202A194-Q198 WeakPolarHBondContact O-CB 3.49Å; A194-Q198 PolarHBondContact O-N 3.47Å; R195-Q198 WeakPolarHBondContact O-CB 3.41Å; R195-Q198 PolarHBondContact O-N 3.07Å; R195-Q198 VanDerWaalsContact O-N 3.13Å; Q198-Q201 PolarHBondContact O-N 3.46Å; Q198-Y202 WeakPolarHBondContact O-CB 3.28Å; Q198-Y202 PolarHBondContact O-N 3.2Å
199V81.3Confident73.7Confident39 Ų3992 Ų9224%0.23647%0.466CS..Hα-helixtrans-67.5-42.8175.5-178.40000110.8R195 Q201 Y202 L203 I265R195-V199 WeakPolarHBondContact O-CG2 3.37Å; R195-V199 PolarHBondContact O-N 3.49Å; V199-Q201 VanDerWaalsContact C-N 3.34Å; V199-Q201 PolarHBondContact O-N 3.05Å; V199-Y202 WeakPolarHBondContact O-CB 3.17Å; V199-Y202 PolarHBondContact O-N 2.66Å; V199-Y202 VanDerWaalsContact O-N 3.16Å; V199-L203 HydrophobicContact CG1-CD1 4.07Å; V199-L203 HydrophobicContact CG1-CG 4.35Å; V199-L203 WeakPolarHBondContact O-CG 3.41Å; V199-L203 PolarHBondContact O-N 2.69Å; V199-I265 HydrophobicContact CB-CG2 4.47Å; V199-I265 HydrophobicContact CG1-CG1 3.96Å; V199-I265 HydrophobicContact CG1-CG2 4.38Å
200K79.9Confident72.6Confident47 Ų4793.6 Ų93.620%0.20448%0.477CS..Hα-helixtrans-60.4-42.4175.8-164159.4-177.2169.50111.6R196 Q197 S204 E258 I261 D262 I265R196-K200 WeakPolarHBondContact O-CB 3.4Å; R196-K200 PolarHBondContact O-N 2.69Å; Q197-K200 PolarHBondContact O-N 3.2Å; K200-S204 VanDerWaalsContact O-CB 3.27Å; K200-S204 WeakPolarHBondContact O-CB 3.46Å; K200-S204 PolarHBondContact O-N 2.66Å; K200-S204 PolarHBondContact O-OG 2.77Å; K200-E258 WeakPolarHBondContact CE-OE1 3.44Å; K200-E258 IonicContact NZ-OE1 3.74Å; K200-E258 PolarHBondContact NZ-OE1 3.21Å; K200-I261 HydrophobicContact CG-CG2 4.47Å; K200-D262 IonicContact NZ-OD1 3.93Å; K200-D262 PolarHBondContact NZ-OD1 3.33Å; K200-D262 IonicContact NZ-OD2 2.71Å; K200-D262 PolarHBondContact NZ-OD2 2.69Å; K200-I265 HydrophobicContact CB-CD1 3.67Å; K200-I265 HydrophobicContact CD-CD1 4.2Å; K200-I265 HydrophobicContact CG-CD1 3.95Å
201Q77.3Confident71.3Confident144 Ų14496.9 Ų96.967%0.67350%0.497SS*.Hα-helixtrans-65.8-39.2174.3-172.3177.511.400112.3Q197 Q198 V199 T205Q197-Q201 VanDerWaalsContact O-CB 3.31Å; Q197-Q201 WeakPolarHBondContact O-CB 3.4Å; Q197-Q201 PolarHBondContact O-N 2.89Å; Q198-Q201 PolarHBondContact O-N 3.46Å; V199-Q201 VanDerWaalsContact C-N 3.34Å; V199-Q201 PolarHBondContact O-N 3.05Å; Q201-T205 WeakPolarHBondContact O-CB 3.42Å; Q201-T205 WeakPolarHBondContact O-CG2 3.44Å; Q201-T205 PolarHBondContact O-N 3.13Å
202Y76.3Confident69.5Low141 Ų14197.2 Ų97.255%0.55351%0.513SS*.Hα-helixtrans-62.1-51.8175.2-178.4-103.6000111.5Q198 V199 S204 T205 T206Q198-Y202 WeakPolarHBondContact O-CB 3.28Å; Q198-Y202 PolarHBondContact O-N 3.2Å; V199-Y202 WeakPolarHBondContact O-CB 3.17Å; V199-Y202 PolarHBondContact O-N 2.66Å; V199-Y202 VanDerWaalsContact O-N 3.16Å; Y202-S204 PolarHBondContact O-N 2.98Å; Y202-T205 WeakPolarHBondContact O-CG2 3.42Å; Y202-T205 PolarHBondContact O-N 3.27Å; Y202-T206 PolarHBondContact O-N 3.09Å; Y202-T206 PolarHBondContact O-OG1 3.43Å
203L76.3Confident67.7Low27 Ų2797.1 Ų97.114%0.14153%0.525CS..Hα-helixtrans-60.3-44.4176.9-64.9173.3000111.5V199 T206 L207 I265V199-L203 HydrophobicContact CG1-CD1 4.07Å; V199-L203 HydrophobicContact CG1-CG 4.35Å; V199-L203 WeakPolarHBondContact O-CG 3.41Å; V199-L203 PolarHBondContact O-N 2.69Å; L203-T206 PolarHBondContact O-N 3.05Å; L203-L207 WeakPolarHBondContact O-CB 3.31Å; L203-L207 VanDerWaalsContact O-CG 3.3Å; L203-L207 WeakPolarHBondContact O-CG 3.42Å; L203-L207 PolarHBondContact O-N 3.17Å; L203-L207 VanDerWaalsContact O-N 3.11Å; L203-I265 HydrophobicContact CD1-CD1 4.22Å; L203-I265 HydrophobicContact CD1-CG1 3.71Å
204S70.9Confident66Low64 Ų64103 Ų10345%0.44855%0.553SS.*Hα-helixtrans-65-36.6176.2-67.70000113.9K200 Y202 G208K200-S204 VanDerWaalsContact O-CB 3.27Å; K200-S204 WeakPolarHBondContact O-CB 3.46Å; K200-S204 PolarHBondContact O-N 2.66Å; K200-S204 PolarHBondContact O-OG 2.77Å; Y202-S204 PolarHBondContact O-N 2.98Å; S204-G208 WeakPolarHBondContact O-CA 3.37Å; S204-G208 PolarHBondContact O-N 3.1Å
205T65.8Low63.7Low95 Ų95105.5 Ų105.558%0.58357%0.573SS**Hα-helixtrans-77.2-29.8178.7-161.20000112.5Q201 Y202 G208 P209Q201-T205 WeakPolarHBondContact O-CB 3.42Å; Q201-T205 WeakPolarHBondContact O-CG2 3.44Å; Q201-T205 PolarHBondContact O-N 3.13Å; Y202-T205 WeakPolarHBondContact O-CG2 3.42Å; Y202-T205 PolarHBondContact O-N 3.27Å; T205-G208 PolarHBondContact O-N 2.93Å; T205-P209 WeakPolarHBondContact O-CD 3.42Å
206T59.9Low61.5Low61 Ų61107.5 Ų107.537%0.37459%0.592SS.*Hα-helixtrans-74.1-28.9174.9-61.20000111.8Y202 L203 M248Y202-T206 PolarHBondContact O-N 3.09Å; Y202-T206 PolarHBondContact O-OG1 3.43Å; L203-T206 PolarHBondContact O-N 3.05Å; T206-M248 HydrophobicContact CG2-CE 3.93Å; T206-M248 HydrophobicContact CG2-SD 4.39Å
207L58.7Low59.2Low105 Ų105110.1 Ų110.155%0.5562%0.617SS.*Hα-helixtrans-87.2-13172.6-64.8171.2000113.9L203L203-L207 WeakPolarHBondContact O-CB 3.31Å; L203-L207 VanDerWaalsContact O-CG 3.3Å; L203-L207 WeakPolarHBondContact O-CG 3.42Å; L203-L207 PolarHBondContact O-N 3.17Å; L203-L207 VanDerWaalsContact O-N 3.11Å
208G57.7Low57Low49 Ų49110.6 Ų110.651%0.50563%0.63SS.*  trans-76.1-29.6-168.200000120S204 T205 K210S204-G208 WeakPolarHBondContact O-CA 3.37Å; S204-G208 PolarHBondContact O-N 3.1Å; T205-G208 PolarHBondContact O-N 2.93Å; G208-K210 PolarHBondContact O-N 3.18Å
209P48.9Very low55.6Low109 Ų109109.7 Ų109.771%0.70864%0.636SS**THydrogen-bonded Turntrans-86.764.4-163.934.8-36.9000113.7T205T205-P209 WeakPolarHBondContact O-CD 3.42Å
210K51.1Low53.6Low194 Ų194113.8 Ų113.884%0.84366%0.664SS**THydrogen-bonded Turntrans-137.9-3.8175.2-97.4-110.6175.8174.50117.2G208G208-K210 PolarHBondContact O-N 3.18Å
211L49.6Very low51.1Low171 Ų171115.1 Ų115.190%0.89569%0.691SS**SBendtrans-125.4-0.1-175.5-66.6176.4000115.7
212A41.8Very low49.8Very low97 Ų97114.5 Ų114.580%0.80270%0.699SS**SBendtrans-104.224.4-171.400000114.9
213S40.8Very low47.5Very low117 Ų117115 Ų11582%0.81872%0.717SS**SBendtrans-147.244.5-173-52.90000114.8
214Q42.2Very low45.6Very low197 Ų197119.2 Ų119.292%0.92175%0.749SS**  trans-160.595.3161.2-116.5-165.3104.900111.3
215A30.4Very low43.8Very low99 Ų99120.8 Ų120.882%0.81877%0.766SS**  trans-174.381.1164.800000111.6
216L34.4Very low42.2Very low169 Ų169124.3 Ų124.389%0.88578%0.775SS**  trans-153.640.7169.7-126.5172.9000114.7
217T33.6Very low41.7Very low135 Ų135126.3 Ų126.383%0.82879%0.79SS**  trans-142.2138.5167.443.90000111
218P36.4Very low40.5Very low122 Ų122128.6 Ų128.679%0.79280%0.801SS**  trans-86.5164176.234.5-34.3000113.2
219P54.3Low39.4Very low121 Ų121131.9 Ų131.979%0.78681%0.814SS**  trans-95.2173.8-167.138.8-38.1000114.6
220P39.4Very low38.7Very low126 Ų126131.5 Ų131.582%0.81882%0.82SS**  -143.2154.612238.8-26.9000116.4
221G27.8Very low38.4Very low74 Ų74127.8 Ų127.876%0.76382%0.816SS**  trans78.9113.8132.300000120.4
222P48.9Very low37.4Very low131 Ų131129 Ų12985%0.85182%0.817SS**  trans-97.8146171.536.7-32000113.7
223T28.4Very low36.9Very low152 Ų152128.6 Ų128.693%0.93381%0.813SS**  trans-160.8160.7154.7-177.30000110.1
224S36.1Very low36.4Very low116 Ų116126.6 Ų126.681%0.81180%0.804SS**  trans-132.5126.7-166.4170.20000112.9
225A32.7Very low35.9Very low96 Ų96125.2 Ų125.279%0.79380%0.797SS**  trans-158.1146.9158.700000112.1
226Q33.7Very low36.2Very low169 Ų169126.3 Ų126.379%0.7979%0.794SS**  trans-119.6172.3165.6-85.8-79.9-4100106.7
227P48.3Very low36.1Very low104 Ų104125.3 Ų125.368%0.67580%0.795SS**  cis-141.5158.616.139.9-20.9000118.9
228L34.3Very low36.3Very low152 Ų152121.7 Ų121.780%0.79679%0.785SS**  trans59.6171.1155.8-90.181.4000118.6
229P35.2Very low36.7Very low118 Ų118122.5 Ų122.577%0.76679%0.79SS**  cis-111.5-179.4-10.740.8-29.5000113
230A33.4Very low36.3Very low102 Ų102123.7 Ų123.784%0.84380%0.795SS**  trans-147.8124.8178.100000114.6
231P45.1Very low36.4Very low116 Ų116121 Ų12175%0.75379%0.791SS**  trans-129.8141.5151.836.4-24000112.4
232E27.8Very low36.8Very low196 Ų196123.1 Ų123.192%0.91679%0.793SS**  trans175.4171.3132.2-99.6-15498.600114.5
233A31.5Very low36.3Very low88 Ų88120.1 Ų120.173%0.72778%0.78SS**  trans-76.9171.6172.300000112.2
234A30.1Very low37.2Very low75 Ų75118.5 Ų118.562%0.6277%0.772SS**  cis-169.6-168.6-23.100000108.6
235H31.6Very low37.8Very low169 Ų169120.4 Ų120.478%0.78277%0.773SS**  trans74.196.7164.2-60.3-73.5000119.9
236T38.1Very low38.2Very low121 Ų121118.5 Ų118.574%0.74275%0.754SS**  44.2113.8127.257.70000120.8
237T31.1Very low39Very low149 Ų149115.8 Ų115.891%0.91475%0.751SS**  -162.3132.2113.917.10000110.1
238G38.3Very low39.1Very low59 Ų59115.7 Ų115.761%0.60874%0.743SS**  trans-109.9140.6169.600000109.9T240G238-T240 PolarHBondContact O-N 2.87Å
239P44.8Very low40Very low138 Ų138111.5 Ų111.590%0.89673%0.73SS**  trans-75.991.7-177.930.3-34.4000111.6G241P239-G241 PolarHBondContact O-N 3.37Å
240T45.5Very low40.6Very low146 Ų146113.2 Ų113.290%0.89673%0.732SS**  trans-62.8115.5162.249.50000109.3G238G238-T240 PolarHBondContact O-N 2.87Å
241G41.3Very low41.6Very low71 Ų71113 Ų11373%0.73272%0.716SS**  trans-147-3.1-166.400000118.7P239P239-G241 PolarHBondContact O-N 3.37Å
242S37.7Very low41.9Very low117 Ų117113.7 Ų113.782%0.81872%0.718SS**SBendtrans-150.9142.8174.5-58.70000110.5
243A37.6Very low43.1Very low68 Ų68107.1 Ų107.156%0.56269%0.689SS**  trans-73.5137.6172.200000110.9N245 S246A243-N245 PolarHBondContact O-N 3.18Å; A243-N245 VanDerWaalsContact O-N 3.11Å; A243-S246 PolarHBondContact O-N 3.39Å
244P47.3Very low43.9Very low119 Ų119104.9 Ų104.977%0.77367%0.674SS**THydrogen-bonded Turntrans-68.4-11.9-175.728-35.9000114.2
245N48.3Very low45.1Very low156 Ų156107.8 Ų107.883%0.83469%0.69SS**THydrogen-bonded Turntrans-99.417.3-179-655.5000113.2A243A243-N245 PolarHBondContact O-N 3.18Å; A243-N245 VanDerWaalsContact O-N 3.11Å
246S41.2Very low46Very low56 Ų56103.1 Ų103.139%0.39268%0.676SS.*  trans-85.6127.3172.7-177.20000110.8A243 M248 A249A243-S246 PolarHBondContact O-N 3.39Å; S246-M248 PolarHBondContact O-N 2.98Å; S246-A249 WeakPolarHBondContact O-CB 3.26Å; S246-A249 PolarHBondContact O-N 2.82Å; S246-A249 VanDerWaalsContact O-N 3.09Å
247P51.7Low47Very low111 Ų111100.3 Ų100.372%0.72166%0.662SS**G310 helixtrans-63.9-16.1-177.726.5-35.1000113.6A249P247-A249 VanDerWaalsContact C-N 3.28Å; P247-A249 PolarHBondContact O-N 3.19Å
248M49.6Very low48.5Very low103 Ų10399.4 Ų99.451%0.50765%0.647SS.*G310 helixtrans-70.6-17.8175.1-72-139.168.500114.3T206 S246 L250T206-M248 HydrophobicContact CG2-CE 3.93Å; T206-M248 HydrophobicContact CG2-SD 4.39Å; S246-M248 PolarHBondContact O-N 2.98Å; M248-L250 PolarHBondContact O-N 2.89Å
249A53.7Low49.8Very low64 Ų64104.1 Ų104.153%0.52965%0.651SS.*G310 helixtrans-71.8-13.5-174.500000114.5S246 P247S246-A249 WeakPolarHBondContact O-CB 3.26Å; S246-A249 PolarHBondContact O-N 2.82Å; S246-A249 VanDerWaalsContact O-N 3.09Å; P247-A249 VanDerWaalsContact C-N 3.28Å; P247-A249 PolarHBondContact O-N 3.19Å
250L47.2Very low50.9Low153 Ų153101.7 Ų101.780%0.80163%0.628SS**G310 helixtrans-87.6-16.4-178.5-68.9172.9000113.8M248 T252M248-L250 PolarHBondContact O-N 2.89Å; L250-T252 PolarHBondContact O-N 2.94Å
251L53.5Low52.2Low99 Ų9996.6 Ų96.652%0.51859%0.594SS.*  trans-83.463.1-178.1-61.6-179.2000111.7I253L251-I253 PolarHBondContact O-N 3.41Å
252T51.4Low53.7Low129 Ų12994.3 Ų94.379%0.79157%0.565SS**  trans-74.268.3171-51.90000110L250 G254L250-T252 PolarHBondContact O-N 2.94Å; T252-G254 PolarHBondContact O-N 3.42Å; T252-G254 VanDerWaalsContact O-N 3.15Å
253I54.3Low55.5Low59 Ų5993.8 Ų93.830%0.30355%0.553SS.*  trans-72.3106.1173.9-58.9176.4000107.4L251L251-I253 PolarHBondContact O-N 3.41Å
254G48.6Very low57.5Low40 Ų4092.5 Ų92.541%0.41254%0.538SS..  trans-62.6157.217500000111.5T252 S256T252-G254 PolarHBondContact O-N 3.42Å; T252-G254 VanDerWaalsContact O-N 3.15Å; G254-S256 PolarHBondContact O-N 3.09Å
255S53.6Low59Low136 Ų13686.8 Ų86.895%0.95150%0.501SS*.SBendtrans-78.362.7-175.562.70000113.1
256S52.3Low60.4Low72 Ų7282.7 Ų82.750%0.50348%0.479SS..  trans-149.8128.5176.351.70000113.7G254 E260G254-S256 PolarHBondContact O-N 3.09Å; S256-E260 VanDerWaalsContact O-OE1 3.14Å
257S57.3Low62.3Low62 Ų6285.7 Ų85.743%0.43449%0.487SS..  trans74.9132.217097.30000118.4K259 E260S257-K259 PolarHBondContact O-N 2.92Å; S257-E260 WeakPolarHBondContact OG-CG 3.44Å; S257-E260 PolarHBondContact OG-N 3.06Å; S257-E260 VanDerWaalsContact OG-N 3.14Å; S257-E260 PolarHBondContact OG-OE1 3.49Å; S257-E260 VanDerWaalsContact OG-OE1 3.13Å
258E62.6Low63.6Low130 Ų13083.8 Ų83.861%0.60747%0.47SS*.Hα-helixtrans-69.7-18.7166.6-178.5174.7-165.300112K200 D262K200-E258 WeakPolarHBondContact CE-OE1 3.44Å; K200-E258 IonicContact NZ-OE1 3.74Å; K200-E258 PolarHBondContact NZ-OE1 3.21Å; E258-D262 PolarHBondContact O-N 2.67Å; E258-D262 VanDerWaalsContact O-N 3.13Å
259K66.6Low65Low157 Ų15780.1 Ų80.168%0.68345%0.453SS*.Hα-helixtrans-69.9-49.5-179.5-73.8-173.7173.7-175.40112S257 I261 D262 D263S257-K259 PolarHBondContact O-N 2.92Å; K259-I261 PolarHBondContact O-N 3.3Å; K259-I261 VanDerWaalsContact O-N 3.14Å; K259-D262 CarbonylContact O-C 3.53Å; K259-D262 WeakPolarHBondContact O-CA 3.4Å; K259-D262 PolarHBondContact O-N 2.87Å; K259-D263 WeakPolarHBondContact O-CB 3.26Å; K259-D263 VanDerWaalsContact O-CG 3.27Å; K259-D263 PolarHBondContact O-N 3Å
260E68.4Low66.1Low88 Ų8880.6 Ų80.641%0.41145%0.452SS..Hα-helixtrans-56-34.6177.1-74.7163.7-124.600111.8S256 S257 V264S256-E260 VanDerWaalsContact O-OE1 3.14Å; S257-E260 WeakPolarHBondContact OG-CG 3.44Å; S257-E260 PolarHBondContact OG-N 3.06Å; S257-E260 VanDerWaalsContact OG-N 3.14Å; S257-E260 PolarHBondContact OG-OE1 3.49Å; S257-E260 VanDerWaalsContact OG-OE1 3.13Å; E260-V264 WeakPolarHBondContact O-CB 3.46Å; E260-V264 VanDerWaalsContact O-CG2 3.25Å; E260-V264 WeakPolarHBondContact O-CG2 3.3Å; E260-V264 PolarHBondContact O-N 3.08Å
261I71.6Confident67.2Low39 Ų3978.2 Ų78.220%0.244%0.439CS..Hα-helixtrans-67.9-45174.1-58.3175.5000111.3K200 K259 I265K200-I261 HydrophobicContact CG-CG2 4.47Å; K259-I261 PolarHBondContact O-N 3.3Å; K259-I261 VanDerWaalsContact O-N 3.14Å; I261-I265 HydrophobicContact CG2-CD1 3.95Å; I261-I265 WeakPolarHBondContact O-CD1 3.25Å; I261-I265 WeakPolarHBondContact O-CG1 3.39Å; I261-I265 PolarHBondContact O-N 3.15Å
262D73.4Confident67.8Low23 Ų2378.3 Ų78.312%0.12344%0.437CS..Hα-helixtrans-70.6-34.2177.8-82.7-39.7000112.9R196 K200 E258 K259 I265 D266R196-D262 IonicContact CZ-OD1 3Å; R196-D262 VanDerWaalsContact CZ-OD1 3.26Å; R196-D262 IonicContact CZ-OD2 2.96Å; R196-D262 IonicContact NE-OD1 3.19Å; R196-D262 PolarHBondContact NE-OD1 3.01Å; R196-D262 IonicContact NH2-OD1 2.9Å; R196-D262 PolarHBondContact NH2-OD1 3.07Å; R196-D262 IonicContact NH2-OD2 2.92Å; R196-D262 PolarHBondContact NH2-OD2 3.27Å; K200-D262 IonicContact NZ-OD1 3.93Å; K200-D262 PolarHBondContact NZ-OD1 3.33Å; K200-D262 IonicContact NZ-OD2 2.71Å; K200-D262 PolarHBondContact NZ-OD2 2.69Å; E258-D262 PolarHBondContact O-N 2.67Å; E258-D262 VanDerWaalsContact O-N 3.13Å; K259-D262 CarbonylContact O-C 3.53Å; K259-D262 WeakPolarHBondContact O-CA 3.4Å; K259-D262 PolarHBondContact O-N 2.87Å; D262-I265 PolarHBondContact O-N 3.49Å; D262-D266 PolarHBondContact O-N 2.96Å
263D76.4Confident68.2Low105 Ų10575.6 Ų75.656%0.56142%0.423SS*.Hα-helixtrans-65.5-44.2174.5-66.2-39.1000110.6K259 I265 D266 E267K259-D263 WeakPolarHBondContact O-CB 3.26Å; K259-D263 VanDerWaalsContact O-CG 3.27Å; K259-D263 PolarHBondContact O-N 3Å; D263-I265 VanDerWaalsContact C-N 3.33Å; D263-I265 PolarHBondContact O-N 3.38Å; D263-D266 PolarHBondContact O-N 3.33Å; D263-E267 PolarHBondContact O-N 3.12Å
264V77.8Confident68.4Low41 Ų4175.6 Ų75.625%0.24843%0.429CS..Hα-helixtrans-64.9-34.6172.6167.30000111.9E260 E267 I268E260-V264 WeakPolarHBondContact O-CB 3.46Å; E260-V264 VanDerWaalsContact O-CG2 3.25Å; E260-V264 WeakPolarHBondContact O-CG2 3.3Å; E260-V264 PolarHBondContact O-N 3.08Å; V264-E267 PolarHBondContact O-N 3.38Å; V264-I268 HydrophobicContact CG1-CD1 3.78Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CB 3.22Å; V264-I268 WeakPolarHBondContact O-CD1 3.38Å; V264-I268 WeakPolarHBondContact O-CG1 3.43Å; V264-I268 PolarHBondContact O-N 2.72Å
265I78.7Confident68.8Low0 Ų081.3 Ų81.30%044%0.439CS..Hα-helixtrans-67.1-44174-70.3161.7000111R196 V199 K200 L203 I261 D262 D263 E267 I268 I269R196-I265 HydrophobicContact CB-CG2 4.33Å; R196-I265 HydrophobicContact CG-CG2 3.93Å; V199-I265 HydrophobicContact CB-CG2 4.47Å; V199-I265 HydrophobicContact CG1-CG1 3.96Å; V199-I265 HydrophobicContact CG1-CG2 4.38Å; K200-I265 HydrophobicContact CB-CD1 3.67Å; K200-I265 HydrophobicContact CD-CD1 4.2Å; K200-I265 HydrophobicContact CG-CD1 3.95Å; L203-I265 HydrophobicContact CD1-CD1 4.22Å; L203-I265 HydrophobicContact CD1-CG1 3.71Å; I261-I265 HydrophobicContact CG2-CD1 3.95Å; I261-I265 WeakPolarHBondContact O-CD1 3.25Å; I261-I265 WeakPolarHBondContact O-CG1 3.39Å; I261-I265 PolarHBondContact O-N 3.15Å; D262-I265 PolarHBondContact O-N 3.49Å; D263-I265 VanDerWaalsContact C-N 3.33Å; D263-I265 PolarHBondContact O-N 3.38Å; I265-E267 VanDerWaalsContact C-N 3.32Å; I265-I268 PolarHBondContact O-N 2.83Å; I265-I269 HydrophobicContact CG2-CD1 3.62Å; I265-I269 HydrophobicContact CG2-CG1 4.3Å; I265-I269 WeakPolarHBondContact O-CB 3.4Å; I265-I269 VanDerWaalsContact O-CG1 3.28Å; I265-I269 WeakPolarHBondContact O-CG1 3.41Å; I265-I269 PolarHBondContact O-N 3.46Å
266D78.4Confident68.9Low69 Ų6978.7 Ų78.737%0.36942%0.415SS..Hα-helixtrans-69.9-29.6178.6-74.4-11.1000111.1R196 D262 D263 S270R196-D266 IonicContact NH1-OD1 3.36Å; R196-D266 PolarHBondContact NH1-OD1 3.43Å; R196-D266 IonicContact NH1-OD2 3.26Å; R196-D266 PolarHBondContact NH1-OD2 3.34Å; D262-D266 PolarHBondContact O-N 2.96Å; D263-D266 PolarHBondContact O-N 3.33Å; D266-S270 VanDerWaalsContact O-CB 3.25Å; D266-S270 WeakPolarHBondContact O-CB 3.21Å; D266-S270 PolarHBondContact O-N 2.97Å; D266-S270 PolarHBondContact O-OG 3.06Å
267E80.8Confident68.8Low119 Ų11978.8 Ų78.856%0.55641%0.41SS*.Hα-helixtrans-64.4-50.5166.8-171.6-179.4-17700111.8D263 V264 I265 I269 S270 L271D263-E267 PolarHBondContact O-N 3.12Å; V264-E267 PolarHBondContact O-N 3.38Å; I265-E267 VanDerWaalsContact C-N 3.32Å; E267-I269 VanDerWaalsContact C-N 3.33Å; E267-I269 PolarHBondContact O-N 3.11Å; E267-S270 CarbonylContact O-C 3.58Å; E267-S270 WeakPolarHBondContact O-CB 3.35Å; E267-S270 PolarHBondContact O-N 3.02Å; E267-S270 VanDerWaalsContact O-N 3.11Å; E267-L271 HydrophobicContact CG-CD1 3.96Å; E267-L271 HydrophobicContact CG-CG 4.41Å; E267-L271 WeakPolarHBondContact O-CB 3.49Å; E267-L271 WeakPolarHBondContact O-CG 3.26Å; E267-L271 PolarHBondContact O-N 3.31Å
268I79.7Confident68.5Low72 Ų7280.2 Ų80.237%0.36941%0.409SS..Hα-helixtrans-58.9-42.7178.2-72.3165.2000111.5V264 I265 S270 L271 E272V264-I268 HydrophobicContact CG1-CD1 3.78Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CB 3.22Å; V264-I268 WeakPolarHBondContact O-CD1 3.38Å; V264-I268 WeakPolarHBondContact O-CG1 3.43Å; V264-I268 PolarHBondContact O-N 2.72Å; I265-I268 PolarHBondContact O-N 2.83Å; I268-S270 VanDerWaalsContact C-N 3.34Å; I268-L271 PolarHBondContact O-N 3.03Å; I268-E272 PolarHBondContact O-N 3.16Å
269I78.2Confident67.8Low26 Ų2679.2 Ų79.213%0.13341%0.406CS..Hα-helixtrans-69.2-33.7177.8-68.9171.5000111R196 I265 E267 S273R196-I269 HydrophobicContact CB-CD1 4.37Å; I265-I269 HydrophobicContact CG2-CD1 3.62Å; I265-I269 HydrophobicContact CG2-CG1 4.3Å; I265-I269 WeakPolarHBondContact O-CB 3.4Å; I265-I269 VanDerWaalsContact O-CG1 3.28Å; I265-I269 WeakPolarHBondContact O-CG1 3.41Å; I265-I269 PolarHBondContact O-N 3.46Å; E267-I269 VanDerWaalsContact C-N 3.33Å; E267-I269 PolarHBondContact O-N 3.11Å; I269-S273 WeakPolarHBondContact O-CB 3.27Å; I269-S273 PolarHBondContact O-N 3.46Å; I269-S273 PolarHBondContact O-OG 2.87Å
270S77.4Confident67.1Low74 Ų7475.1 Ų75.152%0.51739%0.391SS..Hα-helixtrans-69.8-38.8173.7-60.90000112.1D266 E267 I268 S273 S274D266-S270 VanDerWaalsContact O-CB 3.25Å; D266-S270 WeakPolarHBondContact O-CB 3.21Å; D266-S270 PolarHBondContact O-N 2.97Å; D266-S270 PolarHBondContact O-OG 3.06Å; E267-S270 CarbonylContact O-C 3.58Å; E267-S270 WeakPolarHBondContact O-CB 3.35Å; E267-S270 PolarHBondContact O-N 3.02Å; E267-S270 VanDerWaalsContact O-N 3.11Å; I268-S270 VanDerWaalsContact C-N 3.34Å; S270-S273 WeakPolarHBondContact O-CB 3.42Å; S270-S273 PolarHBondContact O-N 3.44Å; S270-S274 WeakPolarHBondContact O-CB 3.31Å; S270-S274 PolarHBondContact O-N 3.45Å
271L71.2Confident66.1Low102 Ų10274.5 Ų74.553%0.53440%0.396SS..Hα-helixtrans-67.7-42.6174.4-72.4168.6000112.1E267 I268 S273 S274 Y275E267-L271 HydrophobicContact CG-CD1 3.96Å; E267-L271 HydrophobicContact CG-CG 4.41Å; E267-L271 WeakPolarHBondContact O-CB 3.49Å; E267-L271 WeakPolarHBondContact O-CG 3.26Å; E267-L271 PolarHBondContact O-N 3.31Å; I268-L271 PolarHBondContact O-N 3.03Å; L271-S273 PolarHBondContact O-N 3.36Å; L271-S274 PolarHBondContact O-N 2.9Å; L271-Y275 WeakPolarHBondContact O-CB 3.49Å; L271-Y275 PolarHBondContact O-N 3.23Å
272E66.2Low65.1Low101 Ų10180.8 Ų80.847%0.47242%0.419SS..Hα-helixtrans-57.4-41.9170.8-174.5-174.7-137.400110.4R195 I268 N276R195-E272 IonicContact NH1-OE2 3.46Å; R195-E272 PolarHBondContact NH1-OE2 2.93Å; I268-E272 PolarHBondContact O-N 3.16Å; E272-N276 PolarHBondContact O-N 2.93Å; E272-N276 PolarHBondContact O-ND2 2.94Å
273S58.9Low63.8Low72 Ų7285.7 Ų85.750%0.50344%0.444SS..Hα-helixtrans-66.3-41.8178-58.90000112.5I269 S270 L271 N276I269-S273 WeakPolarHBondContact O-CB 3.27Å; I269-S273 PolarHBondContact O-N 3.46Å; I269-S273 PolarHBondContact O-OG 2.87Å; S270-S273 WeakPolarHBondContact O-CB 3.42Å; S270-S273 PolarHBondContact O-N 3.44Å; L271-S273 PolarHBondContact O-N 3.36Å; S273-N276 PolarHBondContact O-N 3.46Å
274S58.7Low62.2Low60 Ų6087.4 Ų87.442%0.4246%0.461SS..Hα-helixtrans-66.1-46.6177.8-166.20000112.1S270 L271 N276 D277 E278S270-S274 WeakPolarHBondContact O-CB 3.31Å; S270-S274 PolarHBondContact O-N 3.45Å; L271-S274 PolarHBondContact O-N 2.9Å; S274-N276 PolarHBondContact O-N 3.33Å; S274-N276 VanDerWaalsContact O-N 3.15Å; S274-D277 PolarHBondContact O-N 3.36Å; S274-E278 PolarHBondContact O-N 2.73Å
275Y57.1Low60.9Low159 Ų15988.7 Ų88.762%0.62448%0.483SS*.Hα-helixtrans-58.3-30.6178.4-170.1-98000112.6L271 M279L271-Y275 WeakPolarHBondContact O-CB 3.49Å; L271-Y275 PolarHBondContact O-N 3.23Å; Y275-M279 WeakPolarHBondContact O-CB 3.4Å; Y275-M279 PolarHBondContact O-N 3.27Å; Y275-M279 VanDerWaalsContact O-N 3.08Å
276N56.2Low58.9Low82 Ų8291.7 Ų91.744%0.43951%0.513SS..Hα-helixtrans-74.2-20.2175.4-87.3-89.5000114.8E272 S273 S274E272-N276 PolarHBondContact O-N 2.93Å; E272-N276 PolarHBondContact O-ND2 2.94Å; S273-N276 PolarHBondContact O-N 3.46Å; S274-N276 PolarHBondContact O-N 3.33Å; S274-N276 VanDerWaalsContact O-N 3.15Å
277D49.9Very low57.6Low74 Ų7494.8 Ų94.840%0.39654%0.535SS..Hα-helixtrans-95.2-34169.7-102.4-11.6000111.1S274 L280 K339S274-D277 PolarHBondContact O-N 3.36Å; D277-L280 WeakPolarHBondContact O-CB 3.34Å; D277-L280 PolarHBondContact O-N 3.02Å; D277-K339 IonicContact OD1-NZ 3.4Å; D277-K339 PolarHBondContact OD1-NZ 2.85Å; D277-K339 IonicContact OD2-NZ 2.74Å; D277-K339 PolarHBondContact OD2-NZ 3.42Å
278E49.5Very low55.9Low92 Ų9296 Ų9643%0.4355%0.551SS.*Hα-helixtrans-66.8-39.9176.7-92.4-159.5-127.800113.7S274 L280 S281 Y282S274-E278 PolarHBondContact O-N 2.73Å; E278-L280 PolarHBondContact O-N 2.74Å; E278-S281 WeakPolarHBondContact O-CA 3.45Å; E278-S281 WeakPolarHBondContact O-CB 3.45Å; E278-S281 PolarHBondContact O-N 3.07Å; E278-Y282 HydrophobicContact CB-CE2 4.15Å; E278-Y282 WeakPolarHBondContact O-CD2 3.43Å; E278-Y282 WeakPolarHBondContact OE2-CE2 3.47Å; E278-Y282 PolarHBondContact OE2-OH 3.24Å
279M48.7Very low54.3Low109 Ų10996.2 Ų96.254%0.53757%0.57SS.*THydrogen-bonded Turntrans-61.6-18.4175.6-172178.560.700112.8Y275Y275-M279 WeakPolarHBondContact O-CB 3.4Å; Y275-M279 PolarHBondContact O-N 3.27Å; Y275-M279 VanDerWaalsContact O-N 3.08Å
280L51.2Low52.3Low70 Ų70103.3 Ų103.337%0.36661%0.608SS.*THydrogen-bonded Turntrans-83-15.9172.4-94.6153.8000113.6D277 E278 L342D277-L280 WeakPolarHBondContact O-CB 3.34Å; D277-L280 PolarHBondContact O-N 3.02Å; E278-L280 PolarHBondContact O-N 2.74Å; L280-L342 HydrophobicContact CD2-CD2 3.79Å
281S48.5Very low50.7Low75 Ų75108.4 Ų108.452%0.52462%0.624SS.*THydrogen-bonded Turntrans-78.9-40.4175.9-169.30000112.5E278 L283E278-S281 WeakPolarHBondContact O-CA 3.45Å; E278-S281 WeakPolarHBondContact O-CB 3.45Å; E278-S281 PolarHBondContact O-N 3.07Å; S281-L283 VanDerWaalsContact C-N 3.29Å; S281-L283 PolarHBondContact O-N 2.88Å
282Y51Low49.2Very low172 Ų172111 Ų11168%0.67564%0.637SS**SBendtrans-80.710.9-169.5-61.3-71.1000116E278E278-Y282 HydrophobicContact CB-CE2 4.15Å; E278-Y282 WeakPolarHBondContact O-CD2 3.43Å; E278-Y282 WeakPolarHBondContact OE2-CE2 3.47Å; E278-Y282 PolarHBondContact OE2-OH 3.24Å
283L45.9Very low48.1Very low125 Ų125112.1 Ų112.165%0.65465%0.653SS**SBendtrans-97.6143.8169.1-91.475.3000111S281 G285S281-L283 VanDerWaalsContact C-N 3.29Å; S281-L283 PolarHBondContact O-N 2.88Å; L283-G285 PolarHBondContact O-N 3.22Å
284P42Very low46.8Very low142 Ų142113.9 Ų113.992%0.92267%0.665SS**THydrogen-bonded Turntrans-64106.4-169.1-22.734.5000113
285G51Low46.3Very low68 Ų68117.4 Ų117.470%0.70168%0.684SS**THydrogen-bonded Turntrans160.9-13.9-177.600000115.8L283 T287L283-G285 PolarHBondContact O-N 3.22Å; G285-T287 PolarHBondContact O-N 3.48Å
286G37.4Very low45.2Very low62 Ų62117.3 Ų117.364%0.63969%0.694SS**  trans-58.9131.3172.400000112.5T288G286-T288 PolarHBondContact O-N 3.16Å
287T51.1Low44.5Very low135 Ų135119 Ų11983%0.82871%0.71SS**  trans-94.291.5-165.552.90000114.3G285G285-T287 PolarHBondContact O-N 3.48Å
288T45Very low44Very low145 Ų145122 Ų12289%0.8973%0.73SS**  trans-165130.7144.716.40000111.7G286G286-T288 PolarHBondContact O-N 3.16Å
289G44.4Very low43.7Very low75 Ų75123.1 Ų123.177%0.77375%0.748SS**  trans77.383.715900000117.9
290L36.6Very low43Very low176 Ų176120.8 Ų120.892%0.92175%0.752SS**  -169.5143.1111.1-99175.5000110.7
291Q44.7Very low42.5Very low181 Ų181125.7 Ų125.785%0.84678%0.778SS**  trans-95.9118.4-178.1-179.4-177.737.900109.9
292L39.2Very low42.4Very low157 Ų157129.1 Ų129.182%0.82279%0.79SS**  trans-136.9127.5170.3-72176.7000110.6
293P43.5Very low42.3Very low124 Ų124129.3 Ų129.381%0.80580%0.802SS**  trans-79.3131.1172.132.1-31.8000110.1
294S31.1Very low42Very low108 Ų108129.9 Ų129.976%0.75581%0.805SS**  trans-129.1109.2172.9-170.70000110.4
295T47.6Very low42.3Very low134 Ų134128.6 Ų128.682%0.82280%0.795SS**  trans-90.2124.1175.150.90000109.9
296L35.1Very low41.8Very low158 Ų158135.7 Ų135.783%0.82780%0.802SS**  trans-129.6142.3168-73.2177.4000110.9
297P41.1Very low41.6Very low118 Ų118138 Ų13877%0.76681%0.809SS**  trans-89.6150.2-16834.6-36.1000114.6
298V40.3Very low40.9Very low136 Ų136136.5 Ų136.582%0.82480%0.803SS**  trans-10.8116.5153.9-174.20000116.2
299S43.2Very low40.4Very low116 Ų116138.4 Ų138.481%0.81180%0.802SS**  trans-86.5110.2153.457.60000109.4
300G33.8Very low40.1Very low59 Ų59138.4 Ų138.461%0.60880%0.802SS**  trans-85.9134.6-17400000114.3
301N39.7Very low40.3Very low173 Ų173136.7 Ų136.793%0.92580%0.799SS**  trans-85.5106.2160.9-75.87.2000108.3
302L47.8Very low39.9Very low148 Ų148132.4 Ų132.478%0.77579%0.794SS**  trans-124.469.5-177.1-139.1178.6000110.8V305L302-V305 HydrophobicContact CD2-CG2 3.97Å
303L48.1Very low40Very low176 Ų176131.3 Ų131.392%0.92179%0.794SS**  trans-150.652.2174.6-161.875.1000113
304D40.2Very low40Very low136 Ų136131.3 Ų131.373%0.72779%0.794SS**  trans-156.5100.1146.2-155.5-13.5000111
305V48.1Very low40.5Very low116 Ų116130.8 Ų130.870%0.70380%0.796SS**  trans-141.934.1178.3-160.80000110.3L302L302-V305 HydrophobicContact CD2-CG2 3.97Å
306Y40.3Very low40.2Very low217 Ų217132.2 Ų132.285%0.85180%0.797SS**  trans-149.960174.5-120.5-76.2000113.6
307S33.7Very low40.6Very low111 Ų111130.3 Ų130.378%0.77679%0.792SS**  trans-148.979.6165.9-83.70000111.9
308S35Very low40.7Very low103 Ų103131 Ų13172%0.7279%0.794SS**  trans-109.383.4-179.959.90000112.2
309Q35.3Very low40.4Very low184 Ų184129.3 Ų129.386%0.8679%0.788SS**  trans-159.372.2161.4-156.367.229.800115.3
310G38.3Very low41.1Very low75 Ų75131.3 Ų131.377%0.77379%0.79SS**  trans76.2-177.7148.100000120.8
311V39.5Very low41.7Very low141 Ų141133.4 Ų133.486%0.85580%0.795SS**  trans65.7108.2171-139.70000119.9
312A37.4Very low41.8Very low90 Ų90131 Ų13174%0.74479%0.791SS**  trans56.4131.414600000122.7
313T40.3Very low42Very low135 Ų135130.1 Ų130.183%0.82879%0.794SS**  trans-61.2153.3162.351.30000113.2
314P43.8Very low42.1Very low123 Ų123126.5 Ų126.580%0.79979%0.789SS**  -125.7162.8114.736.3-32.1000113.1
315A41.6Very low42.5Very low97 Ų97128.3 Ų128.380%0.80279%0.793SS**PPolyproline II helixtrans-77.7137.4-176.100000112.9
316I41.9Very low42.5Very low164 Ų164129.2 Ų129.284%0.84179%0.793SS**PPolyproline II helixtrans-89.1120.9165.2-61.7179.9000108.3V318I316-V318 PolarHBondContact O-N 3.17Å
317T42.5Very low43Very low118 Ų118124.5 Ų124.572%0.72479%0.79SS**PPolyproline II helixtrans-69.9125176.649.60000111.1S319T317-S319 PolarHBondContact O-N 2.99Å
318V43.5Very low43.6Very low132 Ų132126.8 Ų126.880%0.879%0.793SS**  trans-74.2112.7171-1790000109.2I316 N320I316-V318 PolarHBondContact O-N 3.17Å; V318-N320 PolarHBondContact O-N 3.45Å; V318-N320 VanDerWaalsContact O-N 3.07Å
319S35.4Very low44.3Very low102 Ų102127.5 Ų127.571%0.71379%0.787SS**  trans-74.195.1-179.1-63.50000112.4T317 S321T317-S319 PolarHBondContact O-N 2.99Å; S319-S321 PolarHBondContact O-N 3.4Å
320N57.6Low44.8Very low158 Ų158126.4 Ų126.485%0.84578%0.78SS**  trans-72.9101.3167.4-84.8-9.6000110.9V318V318-N320 PolarHBondContact O-N 3.45Å; V318-N320 VanDerWaalsContact O-N 3.07Å
321S45.9Very low45.4Very low102 Ų102133 Ų13371%0.71378%0.781SS**  trans-154.252.6171.566.60000115S319S319-S321 PolarHBondContact O-N 3.4Å
322C41.3Very low45.9Very low124 Ų124132.6 Ų132.684%0.83877%0.77SS**  trans-127.6100.9158.8-69.40000109.1A324C322-A324 PolarHBondContact O-N 3.44Å
323P51.2Low46.7Very low129 Ų129133 Ų13384%0.83876%0.759SS**  trans-73.2114.2179.928.9-32.7000110.3E325P323-E325 PolarHBondContact O-N 2.87Å
324A51.9Low48.1Very low100 Ų100129.3 Ų129.383%0.82674%0.738SS**  trans-91.474.2-177.500000112C322C322-A324 PolarHBondContact O-N 3.44Å
325E47.6Very low49.4Very low173 Ų173129.7 Ų129.781%0.80873%0.73SS**  trans-165.2110.8155.1-118172.6176.400113P323P323-E325 PolarHBondContact O-N 2.87Å
326L48.8Very low51Low135 Ų135130.2 Ų130.271%0.70772%0.723SS**  trans-142.586.7160.1-81.4-178.5000108.9N328 I329L326-N328 PolarHBondContact O-N 2.93Å; L326-I329 HydrophobicContact CB-CD1 4.11Å; L326-I329 HydrophobicContact CB-CG1 4.16Å; L326-I329 HydrophobicContact CD1-CD1 3.81Å
327P51.5Low52.9Low119 Ų119127.1 Ų127.177%0.77371%0.705SS**THydrogen-bonded Turntrans-76.753.7-175.633.5-37.1000112.4
328N46.1Very low54.9Low159 Ų159123.8 Ų123.885%0.8569%0.689SS**THydrogen-bonded Turntrans-158.79.4170.8-115.2-14.9000115.1L326 K330L326-N328 PolarHBondContact O-N 2.93Å; N328-K330 PolarHBondContact O-N 2.98Å; N328-K330 VanDerWaalsContact O-N 3.14Å
329I49Very low57Low117 Ų117120.8 Ų120.860%0.667%0.665SS**  trans-89.356.8173.8-41.4-176000111.1L326L326-I329 HydrophobicContact CB-CD1 4.11Å; L326-I329 HydrophobicContact CB-CG1 4.16Å; L326-I329 HydrophobicContact CD1-CD1 3.81Å
330K44.8Very low59.5Low161 Ų161118.5 Ų118.570%0.765%0.653SS**  trans-97.349.5149.4-141.4-153.2-167.6-160.80110.1N328 E332N328-K330 PolarHBondContact O-N 2.98Å; N328-K330 VanDerWaalsContact O-N 3.14Å; K330-E332 HydrophobicContact CD-CG 3.96Å; K330-E332 WeakPolarHBondContact CE-OE1 3.34Å; K330-E332 HydrophobicContact CG-CG 4Å; K330-E332 IonicContact NZ-OE1 3.23Å; K330-E332 PolarHBondContact NZ-OE1 3.3Å; K330-E332 PolarHBondContact O-N 3.35Å
331R52.8Low61Low214 Ų214115.1 Ų115.181%0.80863%0.634SS**  trans-66.881.8147.8-87.1-165.2-74.7157.8-5.4106.5I333R331-I333 PolarHBondContact O-N 2.98Å; R331-I333 VanDerWaalsContact O-N 3.09Å
332E49.5Very low63.1Low132 Ų132114.2 Ų114.262%0.61762%0.621SS**  trans-53115151.4-64.6-175.2145.500105.4K330 S334K330-E332 HydrophobicContact CD-CG 3.96Å; K330-E332 WeakPolarHBondContact CE-OE1 3.34Å; K330-E332 HydrophobicContact CG-CG 4Å; K330-E332 IonicContact NZ-OE1 3.23Å; K330-E332 PolarHBondContact NZ-OE1 3.3Å; K330-E332 PolarHBondContact O-N 3.35Å; E332-S334 VanDerWaalsContact C-N 3.34Å; E332-S334 PolarHBondContact O-N 3.36Å
333I53.8Low65.6Low100 Ų100113 Ų11351%0.51360%0.602SS.*  trans-53.9109.1164.7-61.8169.5000103.6R331 E335 E337 A338 L341R331-I333 PolarHBondContact O-N 2.98Å; R331-I333 VanDerWaalsContact O-N 3.09Å; I333-E335 PolarHBondContact O-N 3.38Å; I333-E337 HydrophobicContact CG2-CB 3.83Å; I333-E337 HydrophobicContact CG2-CG 3.76Å; I333-A338 HydrophobicContact CG2-CB 4.08Å; I333-L341 HydrophobicContact CG2-CD1 4.12Å
334S68.8Low67.6Low56 Ų56113.2 Ų113.239%0.39259%0.591SS.*  trans-53.7146.8-169.4177.20000108.6E332 T336 E337 A338E332-S334 VanDerWaalsContact C-N 3.34Å; E332-S334 PolarHBondContact O-N 3.36Å; S334-T336 WeakPolarHBondContact CB-OG1 3.06Å; S334-T336 CarbonylContact O-C 3.58Å; S334-T336 PolarHBondContact O-N 3.13Å; S334-T336 PolarHBondContact OG-OG1 3.11Å; S334-E337 PolarHBondContact N-OE2 2.87Å; S334-E337 CarbonylContact O-C 3.52Å; S334-E337 WeakPolarHBondContact O-CA 3.17Å; S334-E337 WeakPolarHBondContact O-CB 3.32Å; S334-E337 PolarHBondContact O-N 3.33Å; S334-A338 PolarHBondContact O-N 3.22Å
335E71.4Confident69.7Low132 Ų132116.1 Ų116.162%0.61758%0.581SS**Hα-helixtrans-52.3-32.5177.8-162.1-161.1136.200111.3I333 K339I333-E335 PolarHBondContact O-N 3.38Å; E335-K339 HydrophobicContact CG-CD 4.48Å; E335-K339 VanDerWaalsContact O-CB 3.26Å; E335-K339 WeakPolarHBondContact O-CB 2.92Å; E335-K339 WeakPolarHBondContact O-CG 3.46Å; E335-K339 PolarHBondContact O-N 2.84Å; E335-K339 WeakPolarHBondContact OE1-CE 3.4Å; E335-K339 IonicContact OE1-NZ 3.47Å; E335-K339 PolarHBondContact OE1-NZ 3.43Å
336T76.1Confident72Confident107 Ų107113.4 Ų113.466%0.65657%0.568SS**Hα-helixtrans-63.7-40.8171.664.40000114.2S334 A340S334-T336 WeakPolarHBondContact CB-OG1 3.06Å; S334-T336 CarbonylContact O-C 3.58Å; S334-T336 PolarHBondContact O-N 3.13Å; S334-T336 PolarHBondContact OG-OG1 3.11Å; T336-A340 VanDerWaalsContact O-CB 3.3Å; T336-A340 WeakPolarHBondContact O-CB 3.24Å; T336-A340 PolarHBondContact O-N 3.36Å
337E81.8Confident74.3Confident100 Ų100114.8 Ų114.847%0.46757%0.568SS.*Hα-helixtrans-74.7-38.7177-170.9-178.7-166.800111.2I333 S334 A340 L341I333-E337 HydrophobicContact CG2-CB 3.83Å; I333-E337 HydrophobicContact CG2-CG 3.76Å; S334-E337 PolarHBondContact N-OE2 2.87Å; S334-E337 CarbonylContact O-C 3.52Å; S334-E337 WeakPolarHBondContact O-CA 3.17Å; S334-E337 WeakPolarHBondContact O-CB 3.32Å; S334-E337 PolarHBondContact O-N 3.33Å; E337-A340 WeakPolarHBondContact O-CB 3.46Å; E337-A340 PolarHBondContact O-N 3.32Å; E337-L341 HydrophobicContact CG-CD1 4.47Å; E337-L341 WeakPolarHBondContact O-CG 3.4Å; E337-L341 PolarHBondContact O-N 2.92Å
338A83.1Confident76.5Confident47 Ų47115.7 Ų115.739%0.38856%0.56SS.*Hα-helixtrans-65.1-46.9173.900000111.4I333 S334 A340 L341 L342I333-A338 HydrophobicContact CG2-CB 4.08Å; S334-A338 PolarHBondContact O-N 3.22Å; A338-A340 PolarHBondContact O-N 3.13Å; A338-L341 PolarHBondContact O-N 3.45Å; A338-L342 WeakPolarHBondContact O-CB 3.26Å; A338-L342 PolarHBondContact O-N 3.25Å
339K88.2Confident78.9Confident69 Ų69111.5 Ų111.530%0.354%0.538SS..Hα-helixtrans-61.9-31.2171.4-75.9179.9170.8174.30111.8D277 E335 K343D277-K339 IonicContact OD1-NZ 3.4Å; D277-K339 PolarHBondContact OD1-NZ 2.85Å; D277-K339 IonicContact OD2-NZ 2.74Å; D277-K339 PolarHBondContact OD2-NZ 3.42Å; E335-K339 HydrophobicContact CG-CD 4.48Å; E335-K339 VanDerWaalsContact O-CB 3.26Å; E335-K339 WeakPolarHBondContact O-CB 2.92Å; E335-K339 WeakPolarHBondContact O-CG 3.46Å; E335-K339 PolarHBondContact O-N 2.84Å; E335-K339 WeakPolarHBondContact OE1-CE 3.4Å; E335-K339 IonicContact OE1-NZ 3.47Å; E335-K339 PolarHBondContact OE1-NZ 3.43Å; K339-K343 WeakPolarHBondContact O-CB 3.4Å; K339-K343 VanDerWaalsContact O-CG 3.3Å; K339-K343 WeakPolarHBondContact O-CG 3.36Å; K339-K343 PolarHBondContact O-N 2.9Å
340A87.6Confident81.2Confident55 Ų55110.2 Ų110.246%0.45553%0.532SS..Hα-helixtrans-71.1-48174.200000112.8T336 E337 A338 L342 K343 E344T336-A340 VanDerWaalsContact O-CB 3.3Å; T336-A340 WeakPolarHBondContact O-CB 3.24Å; T336-A340 PolarHBondContact O-N 3.36Å; E337-A340 WeakPolarHBondContact O-CB 3.46Å; E337-A340 PolarHBondContact O-N 3.32Å; A338-A340 PolarHBondContact O-N 3.13Å; A340-L342 VanDerWaalsContact C-N 3.3Å; A340-L342 PolarHBondContact O-N 2.95Å; A340-K343 CarbonylContact O-C 3.59Å; A340-K343 PolarHBondContact O-N 3.27Å; A340-K343 VanDerWaalsContact O-N 3.14Å; A340-E344 PolarHBondContact O-N 2.86Å
341L90.3Very high83.8Confident86 Ų86108.3 Ų108.345%0.4553%0.525SS..Hα-helixtrans-61.8-37.1176.8-71.9168.4000112I333 E337 A338 E344 R345I333-L341 HydrophobicContact CG2-CD1 4.12Å; E337-L341 HydrophobicContact CG-CD1 4.47Å; E337-L341 WeakPolarHBondContact O-CG 3.4Å; E337-L341 PolarHBondContact O-N 2.92Å; A338-L341 PolarHBondContact O-N 3.45Å; L341-E344 PolarHBondContact O-N 3.11Å; L341-R345 PolarHBondContact O-N 3.1Å
342L90Very high86Confident84 Ų84101.4 Ų101.444%0.4451%0.505SS..Hα-helixtrans-64.3-42.1173.6-174.959.5000111.8L280 A338 A340 R345 Q346L280-L342 HydrophobicContact CD2-CD2 3.79Å; A338-L342 WeakPolarHBondContact O-CB 3.26Å; A338-L342 PolarHBondContact O-N 3.25Å; A340-L342 VanDerWaalsContact C-N 3.3Å; A340-L342 PolarHBondContact O-N 2.95Å; L342-R345 PolarHBondContact O-N 3.33Å; L342-Q346 WeakPolarHBondContact O-CB 3.49Å; L342-Q346 PolarHBondContact O-N 2.87Å
343K93.6Very high88.3Confident99 Ų99100.1 Ų100.143%0.4350%0.501SS..Hα-helixtrans-69.7-33.2175.7-73175.1-178.1-1790112.3K339 A340 K347K339-K343 WeakPolarHBondContact O-CB 3.4Å; K339-K343 VanDerWaalsContact O-CG 3.3Å; K339-K343 WeakPolarHBondContact O-CG 3.36Å; K339-K343 PolarHBondContact O-N 2.9Å; A340-K343 CarbonylContact O-C 3.59Å; A340-K343 PolarHBondContact O-N 3.27Å; A340-K343 VanDerWaalsContact O-N 3.14Å; K343-K347 WeakPolarHBondContact O-CB 3.49Å; K343-K347 PolarHBondContact O-N 2.93Å
344E93.8Very high90.4Very high133 Ų133100.2 Ų100.262%0.62150%0.502SS*.Hα-helixtrans-63.9-47.2169.8-178175.3-150.800111.4A340 L341 Q346 K347 K348A340-E344 PolarHBondContact O-N 2.86Å; L341-E344 PolarHBondContact O-N 3.11Å; E344-Q346 PolarHBondContact O-N 3.43Å; E344-K347 WeakPolarHBondContact O-CB 3.31Å; E344-K347 PolarHBondContact O-N 3.28Å; E344-K348 WeakPolarHBondContact O-CB 3.44Å; E344-K348 PolarHBondContact O-N 2.86Å
345R96.2Very high91.8Very high161 Ų16199.5 Ų99.561%0.60849%0.493SS*.Hα-helixtrans-58.2-48.5174.5-179.3-174.9167.1-169.2-1.3111.2L341 L342 K347 K348 D349L341-R345 PolarHBondContact O-N 3.1Å; L342-R345 PolarHBondContact O-N 3.33Å; R345-K347 VanDerWaalsContact C-N 3.29Å; R345-K347 PolarHBondContact O-N 3.42Å; R345-K348 WeakPolarHBondContact O-CB 3.47Å; R345-K348 PolarHBondContact O-N 3.02Å; R345-K348 VanDerWaalsContact O-N 3.11Å; R345-D349 WeakPolarHBondContact CG-OD2 3.44Å; R345-D349 IonicContact NE-OD2 3.69Å; R345-D349 PolarHBondContact NE-OD2 3.17Å; R345-D349 IonicContact NH2-OD2 2.67Å; R345-D349 PolarHBondContact O-N 3.06Å
346Q95.8Very high93.1Very high115 Ų115101.3 Ų101.354%0.53749%0.494SS..Hα-helixtrans-59-41178.7-168.1-17529.900111.7L342 E344 D349 N350L342-Q346 WeakPolarHBondContact O-CB 3.49Å; L342-Q346 PolarHBondContact O-N 2.87Å; E344-Q346 PolarHBondContact O-N 3.43Å; Q346-D349 PolarHBondContact O-N 3.26Å; Q346-N350 VanDerWaalsContact O-CB 3.24Å; Q346-N350 WeakPolarHBondContact O-CB 3.47Å; Q346-N350 PolarHBondContact O-N 3.03Å
347K96.6Very high94.2Very high164 Ų164105.9 Ų105.971%0.71350%0.499SS*.Hα-helixtrans-63.7-41174.2-176.6-179.7179.1-177.80112.3K343 E344 R345 H351K343-K347 WeakPolarHBondContact O-CB 3.49Å; K343-K347 PolarHBondContact O-N 2.93Å; E344-K347 WeakPolarHBondContact O-CB 3.31Å; E344-K347 PolarHBondContact O-N 3.28Å; R345-K347 VanDerWaalsContact C-N 3.29Å; R345-K347 PolarHBondContact O-N 3.42Å; K347-H351 WeakPolarHBondContact O-CB 3.4Å; K347-H351 PolarHBondContact O-N 3Å
348K96.8Very high95Very high138 Ų138107.8 Ų107.860%0.650%0.502SS*.Hα-helixtrans-64.4-44.8174.9-178179.6178.9179.20111.6E344 R345 H351 N352E344-K348 WeakPolarHBondContact O-CB 3.44Å; E344-K348 PolarHBondContact O-N 2.86Å; R345-K348 WeakPolarHBondContact O-CB 3.47Å; R345-K348 PolarHBondContact O-N 3.02Å; R345-K348 VanDerWaalsContact O-N 3.11Å; K348-H351 PolarHBondContact O-N 2.88Å; K348-N352 WeakPolarHBondContact O-CB 3.49Å; K348-N352 PolarHBondContact O-N 2.73Å; K348-N352 PolarHBondContact O-ND2 2.89Å; K348-N352 VanDerWaalsContact O-ND2 3.16Å
349D97.2Very high95.7Very high71 Ų71112.7 Ų112.738%0.3851%0.51SS..Hα-helixtrans-71.3-34.2-179.6-71-25.1000112R345 Q346 N352 L353R345-D349 WeakPolarHBondContact CG-OD2 3.44Å; R345-D349 IonicContact NE-OD2 3.69Å; R345-D349 PolarHBondContact NE-OD2 3.17Å; R345-D349 IonicContact NH2-OD2 2.67Å; R345-D349 PolarHBondContact O-N 3.06Å; Q346-D349 PolarHBondContact O-N 3.26Å; D349-N352 PolarHBondContact O-N 2.96Å; D349-N352 PolarHBondContact OD1-ND2 3.26Å; D349-L353 PolarHBondContact O-N 2.96Å
350N98Very high96.2Very high91 Ų91115.3 Ų115.349%0.48752%0.522SS..Hα-helixtrans-63.8-46168.6-177.3-87.1000112.1Q346 N352 L353 I354Q346-N350 VanDerWaalsContact O-CB 3.24Å; Q346-N350 WeakPolarHBondContact O-CB 3.47Å; Q346-N350 PolarHBondContact O-N 3.03Å; N350-N352 VanDerWaalsContact C-N 3.35Å; N350-N352 PolarHBondContact O-N 3.37Å; N350-L353 WeakPolarHBondContact O-CB 3.43Å; N350-L353 PolarHBondContact O-N 3.48Å; N350-I354 WeakPolarHBondContact O-CG1 3.49Å; N350-I354 PolarHBondContact O-N 3.39Å; N350-I354 VanDerWaalsContact OD1-CD1 3.29Å; N350-I354 WeakPolarHBondContact OD1-CD1 3.43Å
351H98.1Very high96.7Very high120 Ų120117 Ų11756%0.55652%0.523SS*.Hα-helixtrans-59.6-43.9174.1176.774.2000112K347 K348 L353 I354 E355K347-H351 WeakPolarHBondContact O-CB 3.4Å; K347-H351 PolarHBondContact O-N 3Å; K348-H351 PolarHBondContact O-N 2.88Å; H351-L353 VanDerWaalsContact C-N 3.3Å; H351-L353 PolarHBondContact O-N 2.92Å; H351-I354 PolarHBondContact O-N 2.84Å; H351-E355 WeakPolarHBondContact O-CB 3.36Å; H351-E355 PolarHBondContact O-N 3.01Å
352N98.4Very high97.1Very high69 Ų69116.2 Ų116.237%0.36952%0.519SS..Hα-helixtrans-59-39.8174.8-72.1-30.8000112.1K348 D349 N350 R356K348-N352 WeakPolarHBondContact O-CB 3.49Å; K348-N352 PolarHBondContact O-N 2.73Å; K348-N352 PolarHBondContact O-ND2 2.89Å; K348-N352 VanDerWaalsContact O-ND2 3.16Å; D349-N352 PolarHBondContact O-N 2.96Å; D349-N352 PolarHBondContact OD1-ND2 3.26Å; N350-N352 VanDerWaalsContact C-N 3.35Å; N350-N352 PolarHBondContact O-N 3.37Å; N352-R356 VanDerWaalsContact O-CB 3.24Å; N352-R356 WeakPolarHBondContact O-CB 3.29Å; N352-R356 PolarHBondContact O-N 3.27Å
353L98.2Very high97.5Very high105 Ų105114.7 Ų114.755%0.5551%0.511SS..Hα-helixtrans-67.2-45.3176.818061.6000112D349 N350 H351 R356 R357D349-L353 PolarHBondContact O-N 2.96Å; N350-L353 WeakPolarHBondContact O-CB 3.43Å; N350-L353 PolarHBondContact O-N 3.48Å; H351-L353 VanDerWaalsContact C-N 3.3Å; H351-L353 PolarHBondContact O-N 2.92Å; L353-R356 PolarHBondContact O-N 3.44Å; L353-R357 PolarHBondContact O-N 3.42Å
354I98.3Very high97.7Very high102 Ų102112.3 Ų112.352%0.52350%0.503SS..Hα-helixtrans-61.8-48.4177.7-68.5169.5000110.6N350 H351 R356 R357 R358N350-I354 WeakPolarHBondContact O-CG1 3.49Å; N350-I354 PolarHBondContact O-N 3.39Å; N350-I354 VanDerWaalsContact OD1-CD1 3.29Å; N350-I354 WeakPolarHBondContact OD1-CD1 3.43Å; H351-I354 PolarHBondContact O-N 2.84Å; I354-R356 VanDerWaalsContact C-N 3.34Å; I354-R356 PolarHBondContact O-N 3.47Å; I354-R357 PolarHBondContact O-N 3.19Å; I354-R358 WeakPolarHBondContact O-CB 3.42Å; I354-R358 PolarHBondContact O-N 3.43Å
355E98.4Very high98Very high42 Ų42112.4 Ų112.420%0.19650%0.498CS..Hα-helixtrans-67.5-32.8178.2173.361.4175.800112H351 R358 R359H351-E355 WeakPolarHBondContact O-CB 3.36Å; H351-E355 PolarHBondContact O-N 3.01Å; E355-R358 PolarHBondContact O-N 2.92Å; E355-R358 IonicContact OE1-NH1 2.98Å; E355-R358 PolarHBondContact OE1-NH1 3.08Å; E355-R358 WeakPolarHBondContact OE2-CD 3.41Å; E355-R358 IonicContact OE2-CZ 3.58Å; E355-R358 IonicContact OE2-NE 2.79Å; E355-R358 IonicContact OE2-NH1 2.66Å; E355-R358 PolarHBondContact OE2-NH1 3.41Å; E355-R359 WeakPolarHBondContact O-CB 3.49Å; E355-R359 VanDerWaalsContact O-CG 3.26Å; E355-R359 WeakPolarHBondContact O-CG 3.48Å; E355-R359 PolarHBondContact O-N 3.22Å; E355-R359 IonicContact OE1-CZ 3.65Å; E355-R359 VanDerWaalsContact OE1-CZ 3.23Å; E355-R359 IonicContact OE1-NE 3.23Å; E355-R359 PolarHBondContact OE1-NE 3.39Å; E355-R359 IonicContact OE1-NH2 3.81Å; E355-R359 PolarHBondContact OE1-NH2 3.48Å
356R98.6Very high98.1Very high170 Ų170105.7 Ų105.764%0.64247%0.474SS*.Hα-helixtrans-63.4-45170.8-173.9-179.4-68.4133.1-2111.6N352 L353 I354 R359 F360N352-R356 VanDerWaalsContact O-CB 3.24Å; N352-R356 WeakPolarHBondContact O-CB 3.29Å; N352-R356 PolarHBondContact O-N 3.27Å; L353-R356 PolarHBondContact O-N 3.44Å; I354-R356 VanDerWaalsContact C-N 3.34Å; I354-R356 PolarHBondContact O-N 3.47Å; R356-R359 PolarHBondContact O-N 3.28Å; R356-F360 WeakPolarHBondContact O-CB 3.43Å; R356-F360 PolarHBondContact O-N 3.17Å
357R98.6Very high98.2Very high203 Ų203106.4 Ų106.477%0.76648%0.475SS*.Hα-helixtrans-62.2-41.9176.1-172.2177.8-178.2-178.50.8111.5L353 I354 F360 N361L353-R357 PolarHBondContact O-N 3.42Å; I354-R357 PolarHBondContact O-N 3.19Å; R357-F360 PolarHBondContact O-N 3.14Å; R357-N361 WeakPolarHBondContact O-CB 3.44Å; R357-N361 PolarHBondContact O-N 2.98Å
358R98.6Very high98.2Very high139 Ų139102.6 Ų102.653%0.52546%0.46SS..Hα-helixtrans-62-47.9174.3177.1175165.3-84.6-7.5112.1I354 E355 F360 N361 I362I354-R358 WeakPolarHBondContact O-CB 3.42Å; I354-R358 PolarHBondContact O-N 3.43Å; E355-R358 PolarHBondContact O-N 2.92Å; E355-R358 IonicContact OE1-NH1 2.98Å; E355-R358 PolarHBondContact OE1-NH1 3.08Å; E355-R358 WeakPolarHBondContact OE2-CD 3.41Å; E355-R358 IonicContact OE2-CZ 3.58Å; E355-R358 IonicContact OE2-NE 2.79Å; E355-R358 IonicContact OE2-NH1 2.66Å; E355-R358 PolarHBondContact OE2-NH1 3.41Å; R358-F360 VanDerWaalsContact C-N 3.34Å; R358-F360 PolarHBondContact O-N 3.19Å; R358-N361 PolarHBondContact O-N 3.38Å; R358-I362 HydrophobicContact CG-CD1 3.91Å; R358-I362 WeakPolarHBondContact O-CG1 3.24Å; R358-I362 PolarHBondContact O-N 2.81Å
359R98.6Very high98.3Very high150 Ų15098.8 Ų98.857%0.56645%0.446SS*.Hα-helixtrans-60.6-41.9176.2-74.8174.9-171-175.99.2112.3E355 R356 N363E355-R359 WeakPolarHBondContact O-CB 3.49Å; E355-R359 VanDerWaalsContact O-CG 3.26Å; E355-R359 WeakPolarHBondContact O-CG 3.48Å; E355-R359 PolarHBondContact O-N 3.22Å; E355-R359 IonicContact OE1-CZ 3.65Å; E355-R359 VanDerWaalsContact OE1-CZ 3.23Å; E355-R359 IonicContact OE1-NE 3.23Å; E355-R359 PolarHBondContact OE1-NE 3.39Å; E355-R359 IonicContact OE1-NH2 3.81Å; E355-R359 PolarHBondContact OE1-NH2 3.48Å; R356-R359 PolarHBondContact O-N 3.28Å; R359-N363 WeakPolarHBondContact O-CB 3.37Å; R359-N363 PolarHBondContact O-N 2.93Å; R359-N363 PolarHBondContact O-ND2 3.41Å; R359-N363 VanDerWaalsContact O-ND2 3.11Å; R359-N363 PolarHBondContact O-OD1 2.99Å
360F98.6Very high98.2Very high124 Ų12496.3 Ų96.354%0.54444%0.437SS..Hα-helixtrans-59.3-52.4175.6179.2-96.2000111.2R356 R357 R358 I362 N363 D364R356-F360 WeakPolarHBondContact O-CB 3.43Å; R356-F360 PolarHBondContact O-N 3.17Å; R357-F360 PolarHBondContact O-N 3.14Å; R358-F360 VanDerWaalsContact C-N 3.34Å; R358-F360 PolarHBondContact O-N 3.19Å; F360-I362 PolarHBondContact O-N 3.09Å; F360-N363 WeakPolarHBondContact O-CB 3.46Å; F360-N363 PolarHBondContact O-N 2.87Å; F360-N363 VanDerWaalsContact O-N 3.12Å; F360-D364 WeakPolarHBondContact CE1-OD2 3.49Å; F360-D364 WeakPolarHBondContact CZ-OD2 3.47Å; F360-D364 PolarHBondContact O-N 2.79Å
361N98.4Very high98.2Very high90 Ų9097.1 Ų97.148%0.48145%0.445SS..Hα-helixtrans-58.6-43.8178.9-177.9-104000113.1R357 R358 D364 R365R357-N361 WeakPolarHBondContact O-CB 3.44Å; R357-N361 PolarHBondContact O-N 2.98Å; R358-N361 PolarHBondContact O-N 3.38Å; N361-D364 PolarHBondContact O-N 2.85Å; N361-R365 WeakPolarHBondContact O-CG 3.36Å; N361-R365 PolarHBondContact O-N 3.37Å
362I98.5Very high98.1Very high70 Ų7096.9 Ų96.936%0.35945%0.447SS..Hα-helixtrans-62.7-43.1175.2-67.5166.6000111.3R358 F360 D364 I366R358-I362 HydrophobicContact CG-CD1 3.91Å; R358-I362 WeakPolarHBondContact O-CG1 3.24Å; R358-I362 PolarHBondContact O-N 2.81Å; F360-I362 PolarHBondContact O-N 3.09Å; I362-D364 VanDerWaalsContact C-N 3.31Å; I362-D364 PolarHBondContact O-N 3.29Å; I362-I366 HydrophobicContact CG2-CD1 4.06Å; I362-I366 WeakPolarHBondContact O-CG1 3.44Å; I362-I366 PolarHBondContact O-N 2.96Å; I362-I366 VanDerWaalsContact O-N 3.15Å
363N98.5Very high98Very high53 Ų5394.2 Ų94.228%0.28343%0.433SS..Hα-helixtrans-62.4-39.3178.3-68.1-25.5000111.8R359 F360 I366 K367 K385R359-N363 WeakPolarHBondContact O-CB 3.37Å; R359-N363 PolarHBondContact O-N 2.93Å; R359-N363 PolarHBondContact O-ND2 3.41Å; R359-N363 VanDerWaalsContact O-ND2 3.11Å; R359-N363 PolarHBondContact O-OD1 2.99Å; F360-N363 WeakPolarHBondContact O-CB 3.46Å; F360-N363 PolarHBondContact O-N 2.87Å; F360-N363 VanDerWaalsContact O-N 3.12Å; N363-I366 PolarHBondContact O-N 2.84Å; N363-K367 WeakPolarHBondContact O-CG 3.36Å; N363-K367 PolarHBondContact O-N 3.2Å; N363-K385 WeakPolarHBondContact OD1-CE 3.11Å; N363-K385 PolarHBondContact OD1-NZ 2.79Å
364D98.6Very high97.8Very high48 Ų4892.9 Ų92.926%0.25743%0.43SS..Hα-helixtrans-73.8-38.6-177.8-75.51.9000112.4F360 N361 I362 I366 K367 E368F360-D364 WeakPolarHBondContact CE1-OD2 3.49Å; F360-D364 WeakPolarHBondContact CZ-OD2 3.47Å; F360-D364 PolarHBondContact O-N 2.79Å; N361-D364 PolarHBondContact O-N 2.85Å; I362-D364 VanDerWaalsContact C-N 3.31Å; I362-D364 PolarHBondContact O-N 3.29Å; D364-I366 PolarHBondContact O-N 3.1Å; D364-K367 WeakPolarHBondContact O-CB 3.42Å; D364-K367 PolarHBondContact O-N 3.49Å; D364-K367 WeakPolarHBondContact OD1-CE 3.43Å; D364-K367 IonicContact OD1-NZ 2.66Å; D364-K367 PolarHBondContact OD1-NZ 3.34Å; D364-E368 WeakPolarHBondContact O-CB 3.3Å; D364-E368 PolarHBondContact O-N 2.95Å
365R98.6Very high97.2Very high135 Ų13595.9 Ų95.951%0.50944%0.44SS..Hα-helixtrans-61.9-31.4170-64.2-56.1-178.3-171.3-2.8112.4N361 E368 L369N361-R365 WeakPolarHBondContact O-CG 3.36Å; N361-R365 PolarHBondContact O-N 3.37Å; R365-E368 WeakPolarHBondContact CD-OE2 3.44Å; R365-E368 IonicContact CZ-OE2 2.8Å; R365-E368 IonicContact NE-OE2 2.69Å; R365-E368 IonicContact NH1-OE1 2.61Å; R365-E368 PolarHBondContact NH1-OE1 3.38Å; R365-E368 IonicContact NH1-OE2 3.39Å; R365-E368 PolarHBondContact NH1-OE2 2.84Å; R365-L369 WeakPolarHBondContact O-CG 3.32Å; R365-L369 PolarHBondContact O-N 2.93Å; R365-L369 VanDerWaalsContact O-N 3.08Å
366I98.4Very high96.1Very high21 Ų2196.2 Ų96.211%0.10845%0.446CS..Hα-helixtrans-70.5-39.8171.1-65166.5000111.3I362 N363 D364 G370 K385 I388 L389I362-I366 HydrophobicContact CG2-CD1 4.06Å; I362-I366 WeakPolarHBondContact O-CG1 3.44Å; I362-I366 PolarHBondContact O-N 2.96Å; I362-I366 VanDerWaalsContact O-N 3.15Å; N363-I366 PolarHBondContact O-N 2.84Å; D364-I366 PolarHBondContact O-N 3.1Å; I366-G370 PolarHBondContact O-N 3.45Å; I366-K385 HydrophobicContact CD1-CB 4.47Å; I366-K385 HydrophobicContact CD1-CD 4.26Å; I366-K385 HydrophobicContact CD1-CG 4.48Å; I366-K385 HydrophobicContact CG2-CB 4.22Å; I366-K385 HydrophobicContact CG2-CG 4.17Å; I366-I388 HydrophobicContact CG2-CB 4.25Å; I366-I388 HydrophobicContact CG2-CD1 4.06Å; I366-I388 HydrophobicContact CG2-CG2 3.99Å; I366-I388 WeakPolarHBondContact O-CG2 3.48Å; I366-L389 HydrophobicContact CD1-CD1 4.3Å; I366-L389 HydrophobicContact CG1-CD2 4.32Å
367K97.4Very high94.8Very high130 Ų13094.3 Ų94.357%0.56546%0.459SS*.Hα-helixtrans-62.2-43.9174.2-66170.1-168.21630111.9N363 D364 G370 T371N363-K367 WeakPolarHBondContact O-CG 3.36Å; N363-K367 PolarHBondContact O-N 3.2Å; D364-K367 WeakPolarHBondContact O-CB 3.42Å; D364-K367 PolarHBondContact O-N 3.49Å; D364-K367 WeakPolarHBondContact OD1-CE 3.43Å; D364-K367 IonicContact OD1-NZ 2.66Å; D364-K367 PolarHBondContact OD1-NZ 3.34Å; K367-G370 CarbonylContact O-C 3.46Å; K367-G370 VanDerWaalsContact O-CA 3.26Å; K367-G370 WeakPolarHBondContact O-CA 3.3Å; K367-G370 PolarHBondContact O-N 3.22Å; K367-T371 PolarHBondContact O-N 2.87Å
368E98.1Very high94Very high83 Ų8388.2 Ų88.239%0.38844%0.442SS..Hα-helixtrans-58.7-49.2177.7179.3-178.1-137.100111.4D364 R365 G370 T371 L372D364-E368 WeakPolarHBondContact O-CB 3.3Å; D364-E368 PolarHBondContact O-N 2.95Å; R365-E368 WeakPolarHBondContact CD-OE2 3.44Å; R365-E368 IonicContact CZ-OE2 2.8Å; R365-E368 IonicContact NE-OE2 2.69Å; R365-E368 IonicContact NH1-OE1 2.61Å; R365-E368 PolarHBondContact NH1-OE1 3.38Å; R365-E368 IonicContact NH1-OE2 3.39Å; R365-E368 PolarHBondContact NH1-OE2 2.84Å; E368-G370 PolarHBondContact O-N 3.35Å; E368-T371 PolarHBondContact O-N 3.07Å; E368-T371 PolarHBondContact O-OG1 2.8Å; E368-L372 PolarHBondContact O-N 2.89Å
369L98.3Very high92.9Very high59 Ų5987.8 Ų87.831%0.30946%0.457SS..Hα-helixtrans-54.2-41.3170-73.6171.3000111.6R365 T371 L372 I373 I388 L389R365-L369 WeakPolarHBondContact O-CG 3.32Å; R365-L369 PolarHBondContact O-N 2.93Å; R365-L369 VanDerWaalsContact O-N 3.08Å; L369-T371 PolarHBondContact O-N 2.79Å; L369-T371 VanDerWaalsContact O-N 3.13Å; L369-L372 PolarHBondContact O-N 2.85Å; L369-L372 VanDerWaalsContact O-N 3.09Å; L369-I373 VanDerWaalsContact O-CD1 3.26Å; L369-I373 WeakPolarHBondContact O-CD1 3.4Å; L369-I373 WeakPolarHBondContact O-CG1 3.21Å; L369-I373 PolarHBondContact O-N 3.08Å; L369-I388 HydrophobicContact CB-CG2 4.07Å; L369-L389 HydrophobicContact CD1-CD2 4.11Å
370G96.1Very high92Very high18 Ų1888.4 Ų88.419%0.18647%0.467CS..Hα-helixtrans-61.2-12.7173.400000115.9I366 K367 E368I366-G370 PolarHBondContact O-N 3.45Å; K367-G370 CarbonylContact O-C 3.46Å; K367-G370 VanDerWaalsContact O-CA 3.26Å; K367-G370 WeakPolarHBondContact O-CA 3.3Å; K367-G370 PolarHBondContact O-N 3.22Å; E368-G370 PolarHBondContact O-N 3.35Å
371T96.1Very high91.4Very high109 Ų10985.9 Ų85.967%0.66946%0.457SS*.Hα-helixtrans-98.2-23171.965.30000113.7K367 E368 L369K367-T371 PolarHBondContact O-N 2.87Å; E368-T371 PolarHBondContact O-N 3.07Å; E368-T371 PolarHBondContact O-OG1 2.8Å; L369-T371 PolarHBondContact O-N 2.79Å; L369-T371 VanDerWaalsContact O-N 3.13Å
372L97.1Very high90.9Very high115 Ų11591.7 Ų91.760%0.60247%0.472SS*.Hα-helixtrans-88.5-18.6-179.3-62.8174.1000113.6E368 L369 Y395E368-L372 PolarHBondContact O-N 2.89Å; L369-L372 PolarHBondContact O-N 2.85Å; L369-L372 VanDerWaalsContact O-N 3.09Å; L372-Y395 WeakPolarHBondContact O-CE1 3.49Å
373I95.8Very high90.6Very high13 Ų1393 Ų937%0.06747%0.473CS..SBendtrans-77.3133.1176.3-62.7154.4000109.7L369 K375 W383 I388 A391 S392L369-I373 VanDerWaalsContact O-CD1 3.26Å; L369-I373 WeakPolarHBondContact O-CD1 3.4Å; L369-I373 WeakPolarHBondContact O-CG1 3.21Å; L369-I373 PolarHBondContact O-N 3.08Å; I373-K375 PolarHBondContact O-N 3.06Å; I373-W383 HydrophobicContact CD1-CZ3 4.29Å; I373-W383 HydrophobicContact CG2-CH2 3.83Å; I373-W383 HydrophobicContact CG2-CZ3 4.15Å; I373-I388 HydrophobicContact CD1-CG2 3.83Å; I373-I388 VanDerWaalsContact CD1-O 3.3Å; I373-I388 WeakPolarHBondContact CD1-O 3.4Å; I373-A391 HydrophobicContact CD1-CB 4.16Å; I373-A391 HydrophobicContact CG2-CB 3.81Å; I373-S392 WeakPolarHBondContact CD1-OG 3.42Å
374P94Very high90.5Very high76 Ų7694.3 Ų94.349%0.49448%0.48SS..PPolyproline II helixtrans-57.5120.4169.5-23.733.7000110.6S376 Y395P374-S376 PolarHBondContact O-N 3.39Å; P374-Y395 HydrophobicContact CG-CD1 4.49Å; P374-Y395 HydrophobicContact CG-CD2 3.88Å; P374-Y395 HydrophobicContact CG-CE1 4.11Å; P374-Y395 HydrophobicContact CG-CE2 3.45Å; P374-Y395 VanDerWaalsContact CG-CE2 3.45Å; P374-Y395 HydrophobicContact CG-CG 4.39Å
375K85.7Confident90.4Very high166 Ų16697.5 Ų97.572%0.72249%0.491SS*.PPolyproline II helixtrans-65.7128.6178.5-66.2-179.8-1781760109.3I373I373-K375 PolarHBondContact O-N 3.06Å
376S76.1Confident90.3Very high48 Ų4893.2 Ų93.234%0.33649%0.49SS..PPolyproline II helixtrans-58.1141.1170.449.80000110.4P374 D378 M381P374-S376 PolarHBondContact O-N 3.39Å; S376-D378 PolarHBondContact O-N 3.22Å; S376-D378 VanDerWaalsContact O-N 3.1Å; S376-M381 VanDerWaalsContact OG-CB 3.25Å; S376-M381 WeakPolarHBondContact OG-CB 3.13Å; S376-M381 VanDerWaalsContact OG-CG 3.32Å; S376-M381 WeakPolarHBondContact OG-CG 3.2Å
377S71.7Confident90.2Very high130 Ų13094.2 Ų94.291%0.90950%0.497SS*.SBendtrans-70.20.6173.3-167.50000113.7P379S377-P379 WeakPolarHBondContact O-CD 3.41Å
378D80Confident90.1Very high75 Ų7588.9 Ų88.940%0.40147%0.474SS..  trans-80.8114.9174.417310.1000110.3S376 E380 M381S376-D378 PolarHBondContact O-N 3.22Å; S376-D378 VanDerWaalsContact O-N 3.1Å; D378-E380 VanDerWaalsContact C-N 3.28Å; D378-E380 PolarHBondContact O-N 2.95Å; D378-E380 PolarHBondContact OD1-N 2.8Å; D378-M381 HydrophobicContact CB-CB 4.5Å; D378-M381 WeakPolarHBondContact O-CB 3.3Å; D378-M381 PolarHBondContact O-N 2.88Å
379P75.4Confident90.1Very high130 Ų13088.6 Ų88.684%0.84448%0.475SS*.THydrogen-bonded Turntrans-73.2-15.2179.731.9-35.8000113.6S377 M381S377-P379 WeakPolarHBondContact O-CD 3.41Å; P379-M381 VanDerWaalsContact C-N 3.32Å
380E79.8Confident90.1Very high164 Ų16492.2 Ų92.277%0.76649%0.488SS*.THydrogen-bonded Turntrans-84.4-4.6176.3-60.6-162.9168.100112.9D378 R382D378-E380 VanDerWaalsContact C-N 3.28Å; D378-E380 PolarHBondContact O-N 2.95Å; D378-E380 PolarHBondContact OD1-N 2.8Å; E380-R382 WeakPolarHBondContact O-CG 3.49Å; E380-R382 PolarHBondContact O-N 2.88Å
381M86.7Confident90.1Very high70 Ų7092.5 Ų92.535%0.34549%0.489SS..  trans-6694.5-176.6-174.55759.500113S376 D378 P379 W383S376-M381 VanDerWaalsContact OG-CB 3.25Å; S376-M381 WeakPolarHBondContact OG-CB 3.13Å; S376-M381 VanDerWaalsContact OG-CG 3.32Å; S376-M381 WeakPolarHBondContact OG-CG 3.2Å; D378-M381 HydrophobicContact CB-CB 4.5Å; D378-M381 WeakPolarHBondContact O-CB 3.3Å; D378-M381 PolarHBondContact O-N 2.88Å; P379-M381 VanDerWaalsContact C-N 3.32Å; M381-W383 HydrophobicContact CG-CD2 4.42Å; M381-W383 HydrophobicContact CG-CZ2 3.95Å; M381-W383 PolarHBondContact O-N 2.61Å
382R89.1Confident90.1Very high213 Ų21387.7 Ų87.780%0.80446%0.46SS*.  trans-76.493.5179.1-62.9-175.571.6-165.73.3111.9E380 N384 T387E380-R382 WeakPolarHBondContact O-CG 3.49Å; E380-R382 PolarHBondContact O-N 2.88Å; R382-N384 PolarHBondContact O-N 3.48Å; R382-N384 VanDerWaalsContact O-N 3.1Å; R382-N384 PolarHBondContact O-ND2 2.92Å; R382-T387 PolarHBondContact O-OG1 3.43Å; R382-T387 VanDerWaalsContact O-OG1 3.07Å
383W91.6Very high90.2Very high96 Ų9685.6 Ų85.636%0.36445%0.451SS..  trans-59.8109.1173.8-63.997.6000112I373 M381 I388 A391I373-W383 HydrophobicContact CD1-CZ3 4.29Å; I373-W383 HydrophobicContact CG2-CH2 3.83Å; I373-W383 HydrophobicContact CG2-CZ3 4.15Å; M381-W383 HydrophobicContact CG-CD2 4.42Å; M381-W383 HydrophobicContact CG-CZ2 3.95Å; M381-W383 PolarHBondContact O-N 2.61Å; W383-I388 HydrophobicContact CB-CG1 4.38Å; W383-I388 HydrophobicContact CE3-CG1 3.75Å; W383-A391 HydrophobicContact CH2-CB 4.25Å; W383-A391 HydrophobicContact CZ3-CB 3.96Å
384N95.5Very high90.3Very high81 Ų8187.7 Ų87.743%0.43346%0.463SS..  trans-132.8170.4176.36874.1000108.6R382 G386 T387 I388R382-N384 PolarHBondContact O-N 3.48Å; R382-N384 VanDerWaalsContact O-N 3.1Å; R382-N384 PolarHBondContact O-ND2 2.92Å; N384-G386 PolarHBondContact O-N 3.02Å; N384-G386 VanDerWaalsContact O-N 3.1Å; N384-G386 WeakPolarHBondContact OD1-CA 3.39Å; N384-G386 PolarHBondContact OD1-N 2.96Å; N384-T387 PolarHBondContact N-OG1 2.75Å; N384-T387 WeakPolarHBondContact ND2-CG2 3.44Å; N384-T387 PolarHBondContact ND2-OG1 3.39Å; N384-T387 PolarHBondContact O-N 2.66Å; N384-T387 PolarHBondContact O-OG1 2.81Å; N384-T387 PolarHBondContact OD1-N 2.83Å; N384-T387 VanDerWaalsContact OD1-N 3.15Å; N384-I388 WeakPolarHBondContact O-CB 3.39Å; N384-I388 VanDerWaalsContact O-CG1 3.25Å; N384-I388 WeakPolarHBondContact O-CG1 3.33Å; N384-I388 PolarHBondContact O-N 2.91Å
385K96.6Very high90.5Very high115 Ų11587.4 Ų87.450%0.545%0.452SS..Hα-helixtrans-56.7-34.2-174.3-57.4-173.8-169178.30113.3N363 I366 L389N363-K385 WeakPolarHBondContact OD1-CE 3.11Å; N363-K385 PolarHBondContact OD1-NZ 2.79Å; I366-K385 HydrophobicContact CD1-CB 4.47Å; I366-K385 HydrophobicContact CD1-CD 4.26Å; I366-K385 HydrophobicContact CD1-CG 4.48Å; I366-K385 HydrophobicContact CG2-CB 4.22Å; I366-K385 HydrophobicContact CG2-CG 4.17Å; K385-L389 WeakPolarHBondContact O-CB 3.12Å; K385-L389 WeakPolarHBondContact O-CD1 3.26Å; K385-L389 WeakPolarHBondContact O-CG 3.33Å; K385-L389 PolarHBondContact O-N 3.14Å
386G97.1Very high91.1Very high46 Ų4683.6 Ų83.647%0.47444%0.439SS..Hα-helixtrans-72.8-47.9177.200000112.9N384 L389 K390N384-G386 PolarHBondContact O-N 3.02Å; N384-G386 VanDerWaalsContact O-N 3.1Å; N384-G386 WeakPolarHBondContact OD1-CA 3.39Å; N384-G386 PolarHBondContact OD1-N 2.96Å; G386-L389 PolarHBondContact O-N 3.5Å; G386-K390 WeakPolarHBondContact O-CB 3.36Å; G386-K390 PolarHBondContact O-N 3.4Å
387T95.7Very high92.1Very high41 Ų4187.9 Ų87.925%0.25245%0.448SS..Hα-helixtrans-68.8-37.4179.650.20000112.5R382 N384 A391R382-T387 PolarHBondContact O-OG1 3.43Å; R382-T387 VanDerWaalsContact O-OG1 3.07Å; N384-T387 PolarHBondContact N-OG1 2.75Å; N384-T387 WeakPolarHBondContact ND2-CG2 3.44Å; N384-T387 PolarHBondContact ND2-OG1 3.39Å; N384-T387 PolarHBondContact O-N 2.66Å; N384-T387 PolarHBondContact O-OG1 2.81Å; N384-T387 PolarHBondContact OD1-N 2.83Å; N384-T387 VanDerWaalsContact OD1-N 3.15Å; T387-A391 VanDerWaalsContact O-CB 3.28Å; T387-A391 WeakPolarHBondContact O-CB 3.34Å; T387-A391 PolarHBondContact O-N 3.42Å
388I96.6Very high93.4Very high18 Ų1887.1 Ų87.19%0.09243%0.428CS..Hα-helixtrans-57.7-57.1170.7-66.8166.3000110I366 L369 I373 W383 N384 K390 A391 S392I366-I388 HydrophobicContact CG2-CB 4.25Å; I366-I388 HydrophobicContact CG2-CD1 4.06Å; I366-I388 HydrophobicContact CG2-CG2 3.99Å; I366-I388 WeakPolarHBondContact O-CG2 3.48Å; L369-I388 HydrophobicContact CB-CG2 4.07Å; I373-I388 HydrophobicContact CD1-CG2 3.83Å; I373-I388 VanDerWaalsContact CD1-O 3.3Å; I373-I388 WeakPolarHBondContact CD1-O 3.4Å; W383-I388 HydrophobicContact CB-CG1 4.38Å; W383-I388 HydrophobicContact CE3-CG1 3.75Å; N384-I388 WeakPolarHBondContact O-CB 3.39Å; N384-I388 VanDerWaalsContact O-CG1 3.25Å; N384-I388 WeakPolarHBondContact O-CG1 3.33Å; N384-I388 PolarHBondContact O-N 2.91Å; I388-K390 VanDerWaalsContact C-N 3.34Å; I388-K390 PolarHBondContact O-N 2.89Å; I388-A391 PolarHBondContact O-N 3.33Å; I388-A391 VanDerWaalsContact O-N 3.16Å; I388-S392 PolarHBondContact O-N 3.33Å; I388-S392 PolarHBondContact O-OG 3.43Å
389L98.2Very high94.3Very high77 Ų7787 Ų8740%0.40343%0.427SS..Hα-helixtrans-62-39.7-176.8-73.7171.5000112.4I366 L369 K385 G386 S392 V393I366-L389 HydrophobicContact CD1-CD1 4.3Å; I366-L389 HydrophobicContact CG1-CD2 4.32Å; L369-L389 HydrophobicContact CD1-CD2 4.11Å; K385-L389 WeakPolarHBondContact O-CB 3.12Å; K385-L389 WeakPolarHBondContact O-CD1 3.26Å; K385-L389 WeakPolarHBondContact O-CG 3.33Å; K385-L389 PolarHBondContact O-N 3.14Å; G386-L389 PolarHBondContact O-N 3.5Å; L389-S392 WeakPolarHBondContact O-CB 3.4Å; L389-S392 PolarHBondContact O-N 3Å; L389-V393 WeakPolarHBondContact O-CG2 3.25Å; L389-V393 PolarHBondContact O-N 3.22Å
390K96.6Very high95.4Very high135 Ų13586.4 Ų86.459%0.58741%0.413SS*.Hα-helixtrans-58.3-51.9173.2-178.1-175.1178.9-64.10110.8G386 I388 S392 V393 D394G386-K390 WeakPolarHBondContact O-CB 3.36Å; G386-K390 PolarHBondContact O-N 3.4Å; I388-K390 VanDerWaalsContact C-N 3.34Å; I388-K390 PolarHBondContact O-N 2.89Å; K390-S392 VanDerWaalsContact C-N 3.31Å; K390-S392 PolarHBondContact O-N 2.85Å; K390-V393 PolarHBondContact O-N 3.38Å; K390-D394 IonicContact NZ-OD2 2.69Å; K390-D394 PolarHBondContact NZ-OD2 3.15Å; K390-D394 PolarHBondContact O-N 2.9Å
391A96Very high96.2Very high24 Ų2486.5 Ų86.520%0.19841%0.411CS..Hα-helixtrans-67.6-29.3-178.200000112.7I373 W383 T387 I388 Y395I373-A391 HydrophobicContact CD1-CB 4.16Å; I373-A391 HydrophobicContact CG2-CB 3.81Å; W383-A391 HydrophobicContact CH2-CB 4.25Å; W383-A391 HydrophobicContact CZ3-CB 3.96Å; T387-A391 VanDerWaalsContact O-CB 3.28Å; T387-A391 WeakPolarHBondContact O-CB 3.34Å; T387-A391 PolarHBondContact O-N 3.42Å; I388-A391 PolarHBondContact O-N 3.33Å; I388-A391 VanDerWaalsContact O-N 3.16Å; A391-Y395 WeakPolarHBondContact O-CB 3.4Å; A391-Y395 PolarHBondContact O-N 2.92Å
392S98Very high96.8Very high9 Ų987.6 Ų87.66%0.06342%0.415CS..Hα-helixtrans-58.6-50.8168.5-52.70000111.5I373 I388 L389 K390 Y395 I396I373-S392 WeakPolarHBondContact CD1-OG 3.42Å; I388-S392 PolarHBondContact O-N 3.33Å; I388-S392 PolarHBondContact O-OG 3.43Å; L389-S392 WeakPolarHBondContact O-CB 3.4Å; L389-S392 PolarHBondContact O-N 3Å; K390-S392 VanDerWaalsContact C-N 3.31Å; K390-S392 PolarHBondContact O-N 2.85Å; S392-Y395 PolarHBondContact O-N 3.29Å; S392-I396 VanDerWaalsContact O-CG1 3.26Å; S392-I396 WeakPolarHBondContact O-CG1 3.48Å; S392-I396 PolarHBondContact O-N 3.26Å
393V98.4Very high97.2Very high70 Ų7083.3 Ų83.342%0.42440%0.404SS..Hα-helixtrans-70.6-36.4-176.8-176.60000111.2L389 K390 R397L389-V393 WeakPolarHBondContact O-CG2 3.25Å; L389-V393 PolarHBondContact O-N 3.22Å; K390-V393 PolarHBondContact O-N 3.38Å; V393-R397 WeakPolarHBondContact O-CG 3.39Å; V393-R397 PolarHBondContact O-N 2.76Å; V393-R397 VanDerWaalsContact O-N 3.09Å; V393-R397 PolarHBondContact O-NE 3.31Å
394D97.5Very high97.6Very high58 Ų5883.3 Ų83.331%0.3141%0.408SS..Hα-helixtrans-64.3-40.7172.2-69.7-26.7000112.1K390 R397 K398K390-D394 IonicContact NZ-OD2 2.69Å; K390-D394 PolarHBondContact NZ-OD2 3.15Å; K390-D394 PolarHBondContact O-N 2.9Å; D394-R397 PolarHBondContact O-N 3.04Å; D394-R397 IonicContact OD1-CZ 3.25Å; D394-R397 IonicContact OD1-NE 2.73Å; D394-R397 IonicContact OD1-NH2 3.58Å; D394-R397 PolarHBondContact OD1-NH2 3.33Å; D394-K398 PolarHBondContact O-N 3.05Å
395Y97.8Very high97.7Very high69 Ų6987.6 Ų87.627%0.27142%0.419SS..Hα-helixtrans-70.6-40.2178.2-175.2-133.2000112.7L372 P374 A391 S392 R397 K398 L399L372-Y395 WeakPolarHBondContact O-CE1 3.49Å; P374-Y395 HydrophobicContact CG-CD1 4.49Å; P374-Y395 HydrophobicContact CG-CD2 3.88Å; P374-Y395 HydrophobicContact CG-CE1 4.11Å; P374-Y395 HydrophobicContact CG-CE2 3.45Å; P374-Y395 VanDerWaalsContact CG-CE2 3.45Å; P374-Y395 HydrophobicContact CG-CG 4.39Å; A391-Y395 WeakPolarHBondContact O-CB 3.4Å; A391-Y395 PolarHBondContact O-N 2.92Å; S392-Y395 PolarHBondContact O-N 3.29Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 2.74Å; Y395-K398 HydrophobicContact CD2-CD 4.4Å; Y395-K398 WeakPolarHBondContact O-CB 3.31Å; Y395-K398 PolarHBondContact O-N 3.47Å; Y395-K398 VanDerWaalsContact O-N 3.14Å; Y395-L399 HydrophobicContact CD1-CD1 4.04Å; Y395-L399 HydrophobicContact CD2-CD1 4.43Å; Y395-L399 HydrophobicContact CD2-CG 4.16Å; Y395-L399 HydrophobicContact CE1-CD1 3.67Å; Y395-L399 HydrophobicContact CE1-CG 4.34Å; Y395-L399 HydrophobicContact CE2-CD1 4.08Å; Y395-L399 HydrophobicContact CE2-CD2 3.94Å; Y395-L399 HydrophobicContact CE2-CG 3.82Å; Y395-L399 HydrophobicContact CG-CD1 4.41Å; Y395-L399 WeakPolarHBondContact O-CG 3.47Å; Y395-L399 PolarHBondContact O-N 3.22Å
396I98.5Very high97.8Very high86 Ų8685.6 Ų85.644%0.44142%0.419SS..Hα-helixtrans-58.6-44.5172.2-70.1163.1000110.4S392 K398 L399 Q400S392-I396 VanDerWaalsContact O-CG1 3.26Å; S392-I396 WeakPolarHBondContact O-CG1 3.48Å; S392-I396 PolarHBondContact O-N 3.26Å; I396-K398 PolarHBondContact O-N 2.81Å; I396-L399 PolarHBondContact O-N 3.05Å; I396-Q400 HydrophobicContact CG2-CG 4.46Å; I396-Q400 WeakPolarHBondContact O-CB 3.37Å; I396-Q400 VanDerWaalsContact O-CG 3.31Å; I396-Q400 WeakPolarHBondContact O-CG 3.22Å; I396-Q400 PolarHBondContact O-N 3.43Å
397R98.4Very high97.8Very high139 Ų13988.9 Ų88.953%0.52542%0.42SS..Hα-helixtrans-62.9-38.3174.6-75.7-173.8-73.9-125.63.8112.9V393 D394 Y395 K401V393-R397 WeakPolarHBondContact O-CG 3.39Å; V393-R397 PolarHBondContact O-N 2.76Å; V393-R397 VanDerWaalsContact O-N 3.09Å; V393-R397 PolarHBondContact O-NE 3.31Å; D394-R397 PolarHBondContact O-N 3.04Å; D394-R397 IonicContact OD1-CZ 3.25Å; D394-R397 IonicContact OD1-NE 2.73Å; D394-R397 IonicContact OD1-NH2 3.58Å; D394-R397 PolarHBondContact OD1-NH2 3.33Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 2.74Å; R397-K401 PolarHBondContact O-N 3.11Å
398K97.8Very high98Very high113 Ų11391 Ų9149%0.49143%0.43SS..Hα-helixtrans-60-54.2172.2-176.9-172.8-179.6-91.50110.3D394 Y395 I396 Q400 K401 E402D394-K398 PolarHBondContact O-N 3.05Å; Y395-K398 HydrophobicContact CD2-CD 4.4Å; Y395-K398 WeakPolarHBondContact O-CB 3.31Å; Y395-K398 PolarHBondContact O-N 3.47Å; Y395-K398 VanDerWaalsContact O-N 3.14Å; I396-K398 PolarHBondContact O-N 2.81Å; K398-Q400 VanDerWaalsContact C-N 3.33Å; K398-Q400 PolarHBondContact O-N 3.42Å; K398-K401 PolarHBondContact O-N 3.05Å; K398-K401 VanDerWaalsContact O-N 3.13Å; K398-E402 IonicContact NZ-OE1 3.99Å; K398-E402 PolarHBondContact NZ-OE1 3.37Å; K398-E402 IonicContact NZ-OE2 3Å; K398-E402 PolarHBondContact NZ-OE2 3.44Å; K398-E402 VanDerWaalsContact O-CB 3.31Å; K398-E402 WeakPolarHBondContact O-CB 3.4Å; K398-E402 PolarHBondContact O-N 2.97Å
399L98.4Very high98.1Very high73 Ų7394.7 Ų94.738%0.38245%0.449SS..Hα-helixtrans-60.2-39.4-177.4-71.8175.3000112.4Y395 I396 E402 Q403Y395-L399 HydrophobicContact CD1-CD1 4.04Å; Y395-L399 HydrophobicContact CD2-CD1 4.43Å; Y395-L399 HydrophobicContact CD2-CG 4.16Å; Y395-L399 HydrophobicContact CE1-CD1 3.67Å; Y395-L399 HydrophobicContact CE1-CG 4.34Å; Y395-L399 HydrophobicContact CE2-CD1 4.08Å; Y395-L399 HydrophobicContact CE2-CD2 3.94Å; Y395-L399 HydrophobicContact CE2-CG 3.82Å; Y395-L399 HydrophobicContact CG-CD1 4.41Å; Y395-L399 WeakPolarHBondContact O-CG 3.47Å; Y395-L399 PolarHBondContact O-N 3.22Å; I396-L399 PolarHBondContact O-N 3.05Å; L399-E402 PolarHBondContact O-N 3.06Å; L399-Q403 VanDerWaalsContact O-CB 3.27Å; L399-Q403 WeakPolarHBondContact O-CB 3.28Å; L399-Q403 PolarHBondContact O-N 2.81Å
400Q98.4Very high98.1Very high117 Ų11795 Ų9555%0.54745%0.449SS..Hα-helixtrans-62.1-44.2174.6-74.3171.1-2800112.1I396 K398 Q404I396-Q400 HydrophobicContact CG2-CG 4.46Å; I396-Q400 WeakPolarHBondContact O-CB 3.37Å; I396-Q400 VanDerWaalsContact O-CG 3.31Å; I396-Q400 WeakPolarHBondContact O-CG 3.22Å; I396-Q400 PolarHBondContact O-N 3.43Å; K398-Q400 VanDerWaalsContact C-N 3.33Å; K398-Q400 PolarHBondContact O-N 3.42Å; Q400-Q404 PolarHBondContact O-N 3.11Å
401K98.2Very high98.2Very high167 Ų16792.5 Ų92.573%0.72645%0.448SS*.Hα-helixtrans-67.2-36.4175.9-175.5174.7-179.6176.90112.3R397 K398 R405R397-K401 PolarHBondContact O-N 3.11Å; K398-K401 PolarHBondContact O-N 3.05Å; K398-K401 VanDerWaalsContact O-N 3.13Å; K401-R405 WeakPolarHBondContact O-CB 3.48Å; K401-R405 PolarHBondContact O-N 3.09Å
402E98.3Very high98.3Very high92 Ų9299.4 Ų99.443%0.4347%0.469SS..Hα-helixtrans-70.6-40.4178.6-164.5155.4-13800111.3K398 L399 R405 S406K398-E402 IonicContact NZ-OE1 3.99Å; K398-E402 PolarHBondContact NZ-OE1 3.37Å; K398-E402 IonicContact NZ-OE2 3Å; K398-E402 PolarHBondContact NZ-OE2 3.44Å; K398-E402 VanDerWaalsContact O-CB 3.31Å; K398-E402 WeakPolarHBondContact O-CB 3.4Å; K398-E402 PolarHBondContact O-N 2.97Å; L399-E402 PolarHBondContact O-N 3.06Å; E402-R405 PolarHBondContact O-N 3.32Å; E402-S406 WeakPolarHBondContact O-CB 3.44Å; E402-S406 PolarHBondContact O-N 2.89Å
403Q98.5Very high98.3Very high123 Ų123104.4 Ų104.458%0.57549%0.491SS*.Hα-helixtrans-63.6-42.7172.6-171.4-176.64100111.9L399 S406 K407L399-Q403 VanDerWaalsContact O-CB 3.27Å; L399-Q403 WeakPolarHBondContact O-CB 3.28Å; L399-Q403 PolarHBondContact O-N 2.81Å; Q403-S406 WeakPolarHBondContact O-CB 3.38Å; Q403-S406 PolarHBondContact O-N 3.37Å; Q403-K407 PolarHBondContact O-N 2.93Å; Q403-K407 VanDerWaalsContact O-N 3.16Å
404Q98.1Very high98.3Very high97 Ų97108.5 Ų108.545%0.45350%0.499SS..Hα-helixtrans-63.1-48.5174.5-175.457.241.600111Q400 S406 K407 D408Q400-Q404 PolarHBondContact O-N 3.11Å; Q404-S406 PolarHBondContact O-N 2.89Å; Q404-K407 WeakPolarHBondContact O-CB 3.37Å; Q404-K407 PolarHBondContact O-N 3.49Å; Q404-D408 PolarHBondContact NE2-OD1 3.13Å; Q404-D408 PolarHBondContact O-N 2.9Å
405R98.4Very high98.4Very high171 Ų171109.2 Ų109.265%0.64551%0.509SS*.Hα-helixtrans-56.2-35.5175.6-174.9-176.2179.9-161.8-0.3112.3K401 E402 D408 L409K401-R405 WeakPolarHBondContact O-CB 3.48Å; K401-R405 PolarHBondContact O-N 3.09Å; E402-R405 PolarHBondContact O-N 3.32Å; R405-D408 PolarHBondContact O-N 3.37Å; R405-L409 HydrophobicContact CG-CD1 4.15Å; R405-L409 WeakPolarHBondContact O-CB 3.49Å; R405-L409 VanDerWaalsContact O-CG 3.28Å; R405-L409 WeakPolarHBondContact O-CG 3.43Å; R405-L409 PolarHBondContact O-N 2.98Å
406S98.4Very high98.4Very high72 Ų72110.8 Ų110.850%0.50352%0.521SS..Hα-helixtrans-63.5-43.5175.2-162.20000111.9E402 Q403 Q404 L409 E410E402-S406 WeakPolarHBondContact O-CB 3.44Å; E402-S406 PolarHBondContact O-N 2.89Å; Q403-S406 WeakPolarHBondContact O-CB 3.38Å; Q403-S406 PolarHBondContact O-N 3.37Å; Q404-S406 PolarHBondContact O-N 2.89Å; S406-L409 PolarHBondContact O-N 2.74Å; S406-E410 WeakPolarHBondContact O-CB 3.28Å; S406-E410 PolarHBondContact O-N 2.91Å
407K98.5Very high98.4Very high115 Ų115110.3 Ų110.350%0.552%0.517SS..Hα-helixtrans-64.9-41.3174.9-65.5175.4179.4-178.70112.1Q403 Q404 L409 E410 S411Q403-K407 PolarHBondContact O-N 2.93Å; Q403-K407 VanDerWaalsContact O-N 3.16Å; Q404-K407 WeakPolarHBondContact O-CB 3.37Å; Q404-K407 PolarHBondContact O-N 3.49Å; K407-L409 VanDerWaalsContact C-N 3.31Å; K407-L409 PolarHBondContact O-N 2.87Å; K407-E410 PolarHBondContact O-N 3.37Å; K407-S411 WeakPolarHBondContact O-CB 3.43Å; K407-S411 PolarHBondContact O-N 3.29Å
408D98.3Very high98.4Very high86 Ų86110 Ų11046%0.4652%0.522SS..Hα-helixtrans-63-40.3177.7-53.8-30.1000111Q404 R405 R412Q404-D408 PolarHBondContact NE2-OD1 3.13Å; Q404-D408 PolarHBondContact O-N 2.9Å; R405-D408 PolarHBondContact O-N 3.37Å; D408-R412 WeakPolarHBondContact O-CB 3.44Å; D408-R412 PolarHBondContact O-N 3.36Å
409L98.6Very high98.4Very high96 Ų96106.7 Ų106.750%0.50352%0.516SS..Hα-helixtrans-68.1-42.6174.8-75.2169000112.4R405 S406 K407 R412 Q413R405-L409 HydrophobicContact CG-CD1 4.15Å; R405-L409 WeakPolarHBondContact O-CB 3.49Å; R405-L409 VanDerWaalsContact O-CG 3.28Å; R405-L409 WeakPolarHBondContact O-CG 3.43Å; R405-L409 PolarHBondContact O-N 2.98Å; S406-L409 PolarHBondContact O-N 2.74Å; K407-L409 VanDerWaalsContact C-N 3.31Å; K407-L409 PolarHBondContact O-N 2.87Å; L409-R412 PolarHBondContact O-N 3.39Å; L409-Q413 WeakPolarHBondContact O-CB 3.39Å; L409-Q413 PolarHBondContact O-N 3.07Å
410E98.4Very high98.4Very high84 Ų84107.5 Ų107.539%0.39352%0.52SS..Hα-helixtrans-63.9-43.2177.2-166.1-160.4145.700111.6S406 K407 R412 Q413 R414S406-E410 WeakPolarHBondContact O-CB 3.28Å; S406-E410 PolarHBondContact O-N 2.91Å; K407-E410 PolarHBondContact O-N 3.37Å; E410-R412 PolarHBondContact O-N 2.82Å; E410-Q413 WeakPolarHBondContact O-CB 3.44Å; E410-Q413 PolarHBondContact O-N 3.08Å; E410-R414 WeakPolarHBondContact O-CG 3.39Å; E410-R414 PolarHBondContact O-N 3.4Å; E410-R414 IonicContact OE1-CZ 3.52Å; E410-R414 VanDerWaalsContact OE1-CZ 3.23Å; E410-R414 IonicContact OE1-NE 2.79Å; E410-R414 PolarHBondContact OE1-NE 3.02Å; E410-R414 IonicContact OE1-NH2 3.24Å; E410-R414 PolarHBondContact OE1-NH2 2.89Å
411S98.5Very high98.4Very high82 Ų82108.1 Ų108.157%0.57352%0.517SS*.Hα-helixtrans-59.7-45.8173.7-1790000111.4K407 Q413 R414 S415K407-S411 WeakPolarHBondContact O-CB 3.43Å; K407-S411 PolarHBondContact O-N 3.29Å; S411-Q413 VanDerWaalsContact C-N 3.34Å; S411-Q413 PolarHBondContact O-N 2.89Å; S411-R414 PolarHBondContact O-N 3.3Å; S411-S415 PolarHBondContact O-N 2.83Å
412R98.4Very high98.4Very high169 Ų169103.8 Ų103.864%0.63851%0.508SS*.Hα-helixtrans-63-38.1174.5-174.3177.6179.2-172.6-1112.3D408 L409 E410 S415 L416D408-R412 WeakPolarHBondContact O-CB 3.44Å; D408-R412 PolarHBondContact O-N 3.36Å; L409-R412 PolarHBondContact O-N 3.39Å; E410-R412 PolarHBondContact O-N 2.82Å; R412-S415 PolarHBondContact O-N 3.36Å; R412-L416 HydrophobicContact CG-CD1 4.13Å; R412-L416 HydrophobicContact CG-CG 4.48Å; R412-L416 WeakPolarHBondContact O-CB 3.49Å; R412-L416 WeakPolarHBondContact O-CG 3.47Å; R412-L416 PolarHBondContact O-N 3.46Å
413Q98.4Very high98.4Very high113 Ų113104.6 Ų104.653%0.52852%0.515SS..Hα-helixtrans-62.6-52.4175.8-179.2-174.9-3200110.8L409 E410 S411 S415 L416 E417L409-Q413 WeakPolarHBondContact O-CB 3.39Å; L409-Q413 PolarHBondContact O-N 3.07Å; E410-Q413 WeakPolarHBondContact O-CB 3.44Å; E410-Q413 PolarHBondContact O-N 3.08Å; S411-Q413 VanDerWaalsContact C-N 3.34Å; S411-Q413 PolarHBondContact O-N 2.89Å; Q413-S415 PolarHBondContact O-N 2.86Å; Q413-L416 PolarHBondContact O-N 3.08Å; Q413-E417 HydrophobicContact CG-CG 4.41Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.25Å; Q413-E417 PolarHBondContact NE2-OE1 2.78Å; Q413-E417 WeakPolarHBondContact O-CG 3.46Å; Q413-E417 PolarHBondContact O-N 3.31Å
414R98.6Very high98.4Very high157 Ų157102.2 Ų102.259%0.59250%0.504SS*.Hα-helixtrans-55-40177.2-68.4170.4-179.4-124.87.9111.9E410 S411 Q418E410-R414 WeakPolarHBondContact O-CG 3.39Å; E410-R414 PolarHBondContact O-N 3.4Å; E410-R414 IonicContact OE1-CZ 3.52Å; E410-R414 VanDerWaalsContact OE1-CZ 3.23Å; E410-R414 IonicContact OE1-NE 2.79Å; E410-R414 PolarHBondContact OE1-NE 3.02Å; E410-R414 IonicContact OE1-NH2 3.24Å; E410-R414 PolarHBondContact OE1-NH2 2.89Å; S411-R414 PolarHBondContact O-N 3.3Å; R414-Q418 PolarHBondContact O-N 2.91Å
415S98.6Very high98.3Very high72 Ų72102.9 Ų102.950%0.50351%0.51SS..Hα-helixtrans-66-44.3175178.80000112.9S411 R412 Q413 Q418 A419S411-S415 PolarHBondContact O-N 2.83Å; R412-S415 PolarHBondContact O-N 3.36Å; Q413-S415 PolarHBondContact O-N 2.86Å; S415-Q418 PolarHBondContact O-N 2.88Å; S415-A419 WeakPolarHBondContact O-CB 3.2Å; S415-A419 PolarHBondContact O-N 3.27Å
416L98.6Very high98.3Very high103 Ų103100.3 Ų100.354%0.53950%0.5SS..Hα-helixtrans-65-38175.5-74169.9000112.2R412 Q413 A419 N420R412-L416 HydrophobicContact CG-CD1 4.13Å; R412-L416 HydrophobicContact CG-CG 4.48Å; R412-L416 WeakPolarHBondContact O-CB 3.49Å; R412-L416 WeakPolarHBondContact O-CG 3.47Å; R412-L416 PolarHBondContact O-N 3.46Å; Q413-L416 PolarHBondContact O-N 3.08Å; L416-A419 PolarHBondContact O-N 3.41Å; L416-N420 VanDerWaalsContact O-CB 3.26Å; L416-N420 WeakPolarHBondContact O-CB 3.24Å; L416-N420 PolarHBondContact O-N 2.67Å
417E98.4Very high98.1Very high76 Ų76100.7 Ų100.736%0.35550%0.496SS..Hα-helixtrans-64.9-41173.8-71174-163.100112.2Q413 N420 R421Q413-E417 HydrophobicContact CG-CG 4.41Å; Q413-E417 WeakPolarHBondContact CG-OE1 3.25Å; Q413-E417 PolarHBondContact NE2-OE1 2.78Å; Q413-E417 WeakPolarHBondContact O-CG 3.46Å; Q413-E417 PolarHBondContact O-N 3.31Å; E417-N420 PolarHBondContact O-N 3Å; E417-R421 WeakPolarHBondContact O-CG 3.21Å; E417-R421 PolarHBondContact O-N 3.19Å; E417-R421 IonicContact OE2-NH1 2.67Å
418Q98.4Very high98Very high132 Ų132100.4 Ų100.462%0.61750%0.496SS*.Hα-helixtrans-64.6-43.6174.6-175.2-178.95.500111.5R414 S415 N420 R421 S422R414-Q418 PolarHBondContact O-N 2.91Å; S415-Q418 PolarHBondContact O-N 2.88Å; Q418-N420 VanDerWaalsContact C-N 3.34Å; Q418-R421 PolarHBondContact O-N 3.43Å; Q418-S422 WeakPolarHBondContact O-CB 3.43Å; Q418-S422 PolarHBondContact O-N 2.89Å
419A98.4Very high97.8Very high44 Ų44100 Ų10036%0.36449%0.491SS..Hα-helixtrans-62.2-41.4174.700000111.7S415 L416 S422 L423S415-A419 WeakPolarHBondContact O-CB 3.2Å; S415-A419 PolarHBondContact O-N 3.27Å; L416-A419 PolarHBondContact O-N 3.41Å; A419-S422 PolarHBondContact O-N 3.11Å; A419-L423 VanDerWaalsContact O-CG 3.32Å; A419-L423 WeakPolarHBondContact O-CG 3.3Å; A419-L423 PolarHBondContact O-N 3.49Å
420N98.4Very high97.7Very high89 Ų8999.3 Ų99.348%0.47649%0.488SS..Hα-helixtrans-64.8-46.5177.3-162.6-24.9000111.3L416 E417 Q418 S422 L423 Q424L416-N420 VanDerWaalsContact O-CB 3.26Å; L416-N420 WeakPolarHBondContact O-CB 3.24Å; L416-N420 PolarHBondContact O-N 2.67Å; E417-N420 PolarHBondContact O-N 3Å; Q418-N420 VanDerWaalsContact C-N 3.34Å; N420-S422 VanDerWaalsContact C-N 3.32Å; N420-S422 PolarHBondContact O-N 3.48Å; N420-L423 PolarHBondContact O-N 3.29Å; N420-Q424 VanDerWaalsContact O-CG 3.29Å; N420-Q424 WeakPolarHBondContact O-CG 3.45Å; N420-Q424 PolarHBondContact O-N 3.48Å; N420-Q424 PolarHBondContact OD1-NE2 3.46Å
421R98.1Very high97.4Very high130 Ų13097.5 Ų97.549%0.49148%0.479SS..Hα-helixtrans-56.4-42.9172.3-74.4-177-70.5-98-0.8112.5E417 Q418 Q424 L425E417-R421 WeakPolarHBondContact O-CG 3.21Å; E417-R421 PolarHBondContact O-N 3.19Å; E417-R421 IonicContact OE2-NH1 2.67Å; Q418-R421 PolarHBondContact O-N 3.43Å; R421-Q424 PolarHBondContact O-N 2.98Å; R421-L425 WeakPolarHBondContact O-CG 3.46Å; R421-L425 PolarHBondContact O-N 2.9Å; R421-L425 VanDerWaalsContact O-N 3.11Å
422S98.3Very high97.2Very high76 Ų7698.2 Ų98.253%0.53148%0.476SS..Hα-helixtrans-63.6-43.1176.2-176.20000112.5Q418 A419 N420 L425 R426Q418-S422 WeakPolarHBondContact O-CB 3.43Å; Q418-S422 PolarHBondContact O-N 2.89Å; A419-S422 PolarHBondContact O-N 3.11Å; N420-S422 VanDerWaalsContact C-N 3.32Å; N420-S422 PolarHBondContact O-N 3.48Å; S422-L425 PolarHBondContact O-N 3.41Å; S422-R426 WeakPolarHBondContact O-CB 3.4Å; S422-R426 PolarHBondContact O-N 2.85Å
423L98.3Very high97Very high110 Ų11093.9 Ų93.958%0.57646%0.463SS*.Hα-helixtrans-66.2-38.7176.1-70.8170.7000112.4A419 N420 R426 I427A419-L423 VanDerWaalsContact O-CG 3.32Å; A419-L423 WeakPolarHBondContact O-CG 3.3Å; A419-L423 PolarHBondContact O-N 3.49Å; N420-L423 PolarHBondContact O-N 3.29Å; L423-R426 PolarHBondContact O-N 2.9Å; L423-I427 WeakPolarHBondContact O-CB 3.41Å; L423-I427 WeakPolarHBondContact O-CD1 3.27Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.31Å; L423-I427 PolarHBondContact O-N 3.26Å
424Q97.2Very high96.7Very high73 Ų7389.6 Ų89.634%0.34145%0.447SS..Hα-helixtrans-61.1-46.7175.2-71170.418.200111.6N420 R421 R426 I427 Q428 L447N420-Q424 VanDerWaalsContact O-CG 3.29Å; N420-Q424 WeakPolarHBondContact O-CG 3.45Å; N420-Q424 PolarHBondContact O-N 3.48Å; N420-Q424 PolarHBondContact OD1-NE2 3.46Å; R421-Q424 PolarHBondContact O-N 2.98Å; Q424-R426 PolarHBondContact O-N 3.46Å; Q424-I427 PolarHBondContact O-N 2.84Å; Q424-Q428 PolarHBondContact O-N 2.83Å; Q424-L447 HydrophobicContact CB-CD2 4.34Å; Q424-L447 HydrophobicContact CG-CD2 3.87Å
425L96.9Very high96.4Very high110 Ų11088.5 Ų88.558%0.57645%0.449SS*.Hα-helixtrans-62.9-40.6175.1-69171.6000111.9R421 S422 I427 Q428 E429R421-L425 WeakPolarHBondContact O-CG 3.46Å; R421-L425 PolarHBondContact O-N 2.9Å; R421-L425 VanDerWaalsContact O-N 3.11Å; S422-L425 PolarHBondContact O-N 3.41Å; L425-I427 VanDerWaalsContact C-N 3.35Å; L425-I427 PolarHBondContact O-N 2.83Å; L425-Q428 PolarHBondContact O-N 2.99Å; L425-E429 WeakPolarHBondContact O-CB 3.44Å; L425-E429 PolarHBondContact O-N 2.94Å
426R97.7Very high96.1Very high118 Ų11891 Ų9145%0.44546%0.455SS..Hα-helixtrans-68-32.3176.8-176.557.3-175.5-173.611.5113S422 L423 Q424 E429 L430S422-R426 WeakPolarHBondContact O-CB 3.4Å; S422-R426 PolarHBondContact O-N 2.85Å; L423-R426 PolarHBondContact O-N 2.9Å; Q424-R426 PolarHBondContact O-N 3.46Å; R426-E429 WeakPolarHBondContact CD-OE2 3.47Å; R426-E429 IonicContact CZ-OE1 3.52Å; R426-E429 IonicContact CZ-OE2 3.49Å; R426-E429 IonicContact NE-OE2 3.75Å; R426-E429 IonicContact NH1-OE1 2.67Å; R426-E429 PolarHBondContact NH1-OE1 3.43Å; R426-E429 IonicContact NH1-OE2 4Å; R426-E429 PolarHBondContact NH1-OE2 2.86Å; R426-E429 IonicContact NH2-OE1 3.99Å; R426-L430 HydrophobicContact CG-CD1 4.19Å; R426-L430 WeakPolarHBondContact O-CB 3.39Å; R426-L430 WeakPolarHBondContact O-CD1 3.19Å; R426-L430 VanDerWaalsContact O-CG 3.25Å; R426-L430 WeakPolarHBondContact O-CG 3.5Å; R426-L430 PolarHBondContact O-N 3.16Å; R426-L430 VanDerWaalsContact O-N 3.15Å
427I95.6Very high95.9Very high79 Ų7993.5 Ų93.541%0.40546%0.464SS..Hα-helixtrans-64.7-51.6171.5-72.2162000109.3L423 Q424 L425 E429 L430 E431L423-I427 WeakPolarHBondContact O-CB 3.41Å; L423-I427 WeakPolarHBondContact O-CD1 3.27Å; L423-I427 VanDerWaalsContact O-CG1 3.25Å; L423-I427 WeakPolarHBondContact O-CG1 3.31Å; L423-I427 PolarHBondContact O-N 3.26Å; Q424-I427 PolarHBondContact O-N 2.84Å; L425-I427 VanDerWaalsContact C-N 3.35Å; L425-I427 PolarHBondContact O-N 2.83Å; I427-E429 VanDerWaalsContact C-N 3.29Å; I427-E429 PolarHBondContact O-N 3.04Å; I427-L430 PolarHBondContact O-N 2.82Å; I427-E431 HydrophobicContact CG2-CG 4.08Å; I427-E431 WeakPolarHBondContact O-CG 3.25Å; I427-E431 PolarHBondContact O-N 2.89Å
428Q95.3Very high95.5Very high110 Ų11092.9 Ų92.951%0.51448%0.478SS..Hα-helixtrans-57.2-39.8178.1-179175.16800112.8Q424 L425 L432Q424-Q428 PolarHBondContact O-N 2.83Å; L425-Q428 PolarHBondContact O-N 2.99Å; Q428-L432 WeakPolarHBondContact O-CB 3.36Å; Q428-L432 PolarHBondContact O-N 3.01Å
429E95.6Very high95Very high77 Ų7791.8 Ų91.836%0.3648%0.475SS..Hα-helixtrans-61.3-43.9174.1-168-151.5139.300112.2L425 R426 I427 Q433L425-E429 WeakPolarHBondContact O-CB 3.44Å; L425-E429 PolarHBondContact O-N 2.94Å; R426-E429 WeakPolarHBondContact CD-OE2 3.47Å; R426-E429 IonicContact CZ-OE1 3.52Å; R426-E429 IonicContact CZ-OE2 3.49Å; R426-E429 IonicContact NE-OE2 3.75Å; R426-E429 IonicContact NH1-OE1 2.67Å; R426-E429 PolarHBondContact NH1-OE1 3.43Å; R426-E429 IonicContact NH1-OE2 4Å; R426-E429 PolarHBondContact NH1-OE2 2.86Å; R426-E429 IonicContact NH2-OE1 3.99Å; I427-E429 VanDerWaalsContact C-N 3.29Å; I427-E429 PolarHBondContact O-N 3.04Å; E429-Q433 VanDerWaalsContact O-CG 3.3Å; E429-Q433 WeakPolarHBondContact O-CG 3.29Å; E429-Q433 PolarHBondContact O-N 2.97Å; E429-Q433 PolarHBondContact OE1-NE2 2.76Å
430L95.4Very high94Very high81 Ų8195.7 Ų95.742%0.42450%0.497SS..Hα-helixtrans-72.9-36.7179.4-71.8168.9000112.5R426 I427 Q433 A434R426-L430 HydrophobicContact CG-CD1 4.19Å; R426-L430 WeakPolarHBondContact O-CB 3.39Å; R426-L430 WeakPolarHBondContact O-CD1 3.19Å; R426-L430 VanDerWaalsContact O-CG 3.25Å; R426-L430 WeakPolarHBondContact O-CG 3.5Å; R426-L430 PolarHBondContact O-N 3.16Å; R426-L430 VanDerWaalsContact O-N 3.15Å; I427-L430 PolarHBondContact O-N 2.82Å; L430-Q433 PolarHBondContact O-N 2.93Å; L430-A434 WeakPolarHBondContact O-CB 3.16Å; L430-A434 PolarHBondContact O-N 3Å
431E92.9Very high93Very high47 Ų4794.1 Ų94.122%0.2249%0.491CS..Hα-helixtrans-61.1-45.1172.9-71177.9150.900110.4I427 A434 Q435 V441 T444I427-E431 HydrophobicContact CG2-CG 4.08Å; I427-E431 WeakPolarHBondContact O-CG 3.25Å; I427-E431 PolarHBondContact O-N 2.89Å; E431-A434 PolarHBondContact O-N 3.31Å; E431-Q435 WeakPolarHBondContact O-CB 3.48Å; E431-Q435 PolarHBondContact O-N 3.19Å; E431-V441 HydrophobicContact CB-CG1 4.19Å; E431-V441 HydrophobicContact CG-CG1 3.94Å; E431-T444 WeakPolarHBondContact OE1-CG2 3.49Å; E431-T444 PolarHBondContact OE1-OG1 3.27Å
432L93Very high91.9Very high96 Ų9692.7 Ų92.750%0.50350%0.498SS..Hα-helixtrans-63.2-44175178.361.4000112.3Q428 A434 Q435 I436Q428-L432 WeakPolarHBondContact O-CB 3.36Å; Q428-L432 PolarHBondContact O-N 3.01Å; L432-A434 PolarHBondContact O-N 2.9Å; L432-Q435 PolarHBondContact O-N 2.94Å; L432-I436 HydrophobicContact CD1-CD1 4.1Å; L432-I436 HydrophobicContact CD1-CG1 4.36Å; L432-I436 HydrophobicContact CG-CD1 3.98Å; L432-I436 VanDerWaalsContact O-CG1 3.31Å; L432-I436 WeakPolarHBondContact O-CG1 3.35Å; L432-I436 PolarHBondContact O-N 2.71Å
433Q94.8Very high90.2Very high78 Ų7894.8 Ų94.836%0.36451%0.51SS..Hα-helixtrans-60.9-44.2175.8-75.4166.616.700111.6E429 L430 Q435 I436 H437E429-Q433 VanDerWaalsContact O-CG 3.3Å; E429-Q433 WeakPolarHBondContact O-CG 3.29Å; E429-Q433 PolarHBondContact O-N 2.97Å; E429-Q433 PolarHBondContact OE1-NE2 2.76Å; L430-Q433 PolarHBondContact O-N 2.93Å; Q433-Q435 VanDerWaalsContact C-N 3.35Å; Q433-Q435 PolarHBondContact O-N 3.13Å; Q433-I436 PolarHBondContact O-N 2.91Å; Q433-H437 PolarHBondContact O-CD2 3.36Å; Q433-H437 PolarHBondContact O-N 3.15Å
434A92.9Very high88.7Confident23 Ų2392.7 Ų92.719%0.1950%0.502CS..Hα-helixtrans-61.7-41.6175.900000112.1L430 E431 L432 H437 G438 L439 V441L430-A434 WeakPolarHBondContact O-CB 3.16Å; L430-A434 PolarHBondContact O-N 3Å; E431-A434 PolarHBondContact O-N 3.31Å; L432-A434 PolarHBondContact O-N 2.9Å; A434-H437 CarbonylContact O-C 3.47Å; A434-H437 PolarHBondContact O-N 2.83Å; A434-G438 PolarHBondContact O-N 3.14Å; A434-L439 HydrophobicContact CB-CB 4.27Å; A434-L439 HydrophobicContact CB-CD1 4.33Å; A434-L439 WeakPolarHBondContact O-CB 3.42Å; A434-L439 PolarHBondContact O-N 3.45Å; A434-V441 HydrophobicContact CB-CG2 3.75Å
435Q91.4Very high86.5Confident135 Ų13595.8 Ų95.863%0.63153%0.528SS*.Hα-helixtrans-64.1-42176.5-168.7179.222.700112.4E431 L432 Q433 H437 G438E431-Q435 WeakPolarHBondContact O-CB 3.48Å; E431-Q435 PolarHBondContact O-N 3.19Å; L432-Q435 PolarHBondContact O-N 2.94Å; Q433-Q435 VanDerWaalsContact C-N 3.35Å; Q433-Q435 PolarHBondContact O-N 3.13Å; Q435-H437 VanDerWaalsContact C-N 3.27Å; Q435-H437 PolarHBondContact O-N 2.96Å; Q435-G438 PolarHBondContact O-N 2.92Å
436I92.6Very high84.7Confident125 Ų12593.6 Ų93.664%0.64153%0.532SS*.Hα-helixtrans-62.2-36174.6-69.5164.8000111.2L432 Q433 G438L432-I436 HydrophobicContact CD1-CD1 4.1Å; L432-I436 HydrophobicContact CD1-CG1 4.36Å; L432-I436 HydrophobicContact CG-CD1 3.98Å; L432-I436 VanDerWaalsContact O-CG1 3.31Å; L432-I436 WeakPolarHBondContact O-CG1 3.35Å; L432-I436 PolarHBondContact O-N 2.71Å; Q433-I436 PolarHBondContact O-N 2.91Å; I436-G438 PolarHBondContact O-N 3.14Å
437H93.9Very high82.6Confident154 Ų15491.8 Ų91.871%0.71353%0.531SS*.THydrogen-bonded Turntrans-79.28.7173.2-71.8-59.9000114.4Q433 A434 Q435Q433-H437 PolarHBondContact O-CD2 3.36Å; Q433-H437 PolarHBondContact O-N 3.15Å; A434-H437 CarbonylContact O-C 3.47Å; A434-H437 PolarHBondContact O-N 2.83Å; Q435-H437 VanDerWaalsContact C-N 3.27Å; Q435-H437 PolarHBondContact O-N 2.96Å
438G89.5Confident80.5Confident63 Ų6394.6 Ų94.665%0.64955%0.546SS*.THydrogen-bonded Turntrans78.413.6173.900000115.1A434 Q435 I436A434-G438 PolarHBondContact O-N 3.14Å; Q435-G438 PolarHBondContact O-N 2.92Å; I436-G438 PolarHBondContact O-N 3.14Å
439L88.4Confident78.2Confident109 Ų10994 Ų9457%0.57155%0.554SS**  trans-84.6127.6175.2-59.4177.8000110.1A434 V441A434-L439 HydrophobicContact CB-CB 4.27Å; A434-L439 HydrophobicContact CB-CD1 4.33Å; A434-L439 WeakPolarHBondContact O-CB 3.42Å; A434-L439 PolarHBondContact O-N 3.45Å; L439-V441 PolarHBondContact O-N 3.13Å
440P78.3Confident76Confident126 Ų12698.2 Ų98.282%0.81858%0.579SS**  trans-75.197.3179.229.6-33.8000110.9
441V77.4Confident73.5Confident56 Ų5698.5 Ų98.534%0.33959%0.592SS.*PPolyproline II helixtrans-80.5122.6169.8-177.60000109E431 A434 L439E431-V441 HydrophobicContact CB-CG1 4.19Å; E431-V441 HydrophobicContact CG-CG1 3.94Å; A434-V441 HydrophobicContact CB-CG2 3.75Å; L439-V441 PolarHBondContact O-N 3.13Å
442P73.7Confident71.1Confident100 Ų100101.5 Ų101.565%0.64961%0.614SS**PPolyproline II helixtrans-71.1137.1172.329.8-33.1000109.9T444P442-T444 PolarHBondContact O-N 3.13Å
443P63.5Low68.7Low121 Ų121103.1 Ų103.179%0.78663%0.628SS**PPolyproline II helixtrans-63122.7-178.626-34.1000110.5P445P443-P445 VanDerWaalsContact O-CD 3.25Å; P443-P445 WeakPolarHBondContact O-CD 3.5Å
444T66.3Low66.3Low65 Ų65104.7 Ų104.740%0.39965%0.648SS.*  trans-71.5110.2-176.4330000111.1E431 P442 G446E431-T444 WeakPolarHBondContact OE1-CG2 3.49Å; E431-T444 PolarHBondContact OE1-OG1 3.27Å; P442-T444 PolarHBondContact O-N 3.13Å; T444-G446 PolarHBondContact O-N 3.15Å
445P51.8Low63.9Low138 Ų138107.9 Ų107.990%0.89667%0.674SS**THydrogen-bonded Turntrans-7793.2-171.831.1-33.9000111.1P443P443-P445 VanDerWaalsContact O-CD 3.25Å; P443-P445 WeakPolarHBondContact O-CD 3.5Å
446G58.1Low61.3Low64 Ų64107 Ų10766%0.6668%0.683SS**THydrogen-bonded Turntrans159.4-25.6171.500000115.6T444 L448T444-G446 PolarHBondContact O-N 3.15Å; G446-L448 PolarHBondContact O-N 3.39Å
447L54.8Low58.5Low80 Ų80107.9 Ų107.942%0.41969%0.689SS.*G310 helixtrans-78-20.4-169.6-78.1169.1000115.4Q424Q424-L447 HydrophobicContact CB-CD2 4.34Å; Q424-L447 HydrophobicContact CG-CD2 3.87Å
448L51.7Low55.7Low138 Ų138105 Ų10572%0.72369%0.686SS**G310 helixtrans-81.9-14.3-176-62178.9000114.5G446 L450 T452G446-L448 PolarHBondContact O-N 3.39Å; L448-L450 VanDerWaalsContact C-N 3.3Å; L448-L450 PolarHBondContact O-N 2.92Å; L448-T452 PolarHBondContact O-OG1 3.29Å
449S45.9Very low53.1Low98 Ų98110.1 Ų110.169%0.68570%0.698SS**G310 helixtrans-78.4-1.8-165.7-166.10000116
450L49.2Very low50.7Low166 Ų166114.3 Ų114.387%0.86971%0.711SS**G310 helixtrans-110.1-4.5-176.1-167.656000113.8L448L448-L450 VanDerWaalsContact C-N 3.3Å; L448-L450 PolarHBondContact O-N 2.92Å
451A44Very low48.7Very low86 Ų86114.1 Ų114.171%0.71171%0.71SS**SBendtrans-105-10.1-17800000114.3
452T43Very low46.6Very low110 Ų110120.4 Ų120.468%0.67574%0.736SS**  trans-134.764.9-167.942.60000113L448L448-T452 PolarHBondContact O-OG1 3.29Å
453T41.7Very low44.5Very low130 Ų130125 Ų12580%0.79875%0.748SS**  trans-119.945167.862.70000111.7
454S45.2Very low43Very low112 Ų112126.6 Ų126.678%0.78375%0.75SS**SBendtrans-157.338.5-177.965.90000114.9
455A41.6Very low41.2Very low90 Ų90130.7 Ų130.774%0.74477%0.769SS**SBendtrans-163142163.900000110.9
456S37.1Very low40.5Very low116 Ų116132.4 Ų132.481%0.81177%0.769SS**  trans57.3112.7170.4-48.30000115.7
457D33.3Very low39.4Very low144 Ų144138.2 Ų138.277%0.7778%0.779SS**  cis57.7129.545.5-161.617000115.1
458S34.8Very low38.4Very low93 Ų93144 Ų14465%0.6580%0.804SS**  trans35.6118164.3-66.10000119.9
459L34.9Very low37.4Very low171 Ų171146.7 Ų146.790%0.89581%0.813SS**  -168.1149.298.9-97.2168.5000111.7
460K38.7Very low36.7Very low196 Ų196145.9 Ų145.985%0.85282%0.82SS**PPolyproline II helixtrans-87.2142.6168.6-65.1176.4179.2176.60110
461P35.8Very low36.1Very low122 Ų122149.5 Ų149.579%0.79282%0.822SS**PPolyproline II helixtrans-92.2142.2147.629.2-19000110.6
462E32.6Very low36.3Very low189 Ų189151 Ų15188%0.88382%0.824SS**PPolyproline II helixtrans-70.6157.7164.7-69.5170.777.400110.7
463Q29.8Very low35.6Very low195 Ų195149.5 Ų149.591%0.91183%0.831SS**  trans-122.9122.5170.9-171.6169.7-12.400108.7
464L33.1Very low35.1Very low156 Ų156148 Ų14882%0.81783%0.832SS**  trans-79.8159.2-171.3-71.9165.4000113.3
465D28.6Very low34.4Very low151 Ų151147 Ų14781%0.80783%0.83SS**  trans-61141.5177.4-56.9-75.3000114
466I37.1Very low33.8Very low174 Ų174148.1 Ų148.189%0.89283%0.828SS**  trans-137133.3141.4-62.2-173.8000107.1
467E34.1Very low33.4Very low186 Ų186151.6 Ų151.687%0.86983%0.829SS**  trans-85.3148.9-177.5-58177.197.500113
468E33.7Very low33.4Very low201 Ų201152.7 Ų152.794%0.93983%0.829SS**  trans-143.9159.2141.1-143-168.5128.500110.5
469E30.6Very low33.3Very low195 Ų195155.2 Ų155.291%0.91184%0.84SS**  trans-103.8136-155.8-169.6-176.215800113.2
470G31.5Very low32.9Very low81 Ų81150.6 Ų150.684%0.83583%0.834SS**  trans-178.966.1-177.500000117.9
471R37.3Very low32.4Very low242 Ų242145.3 Ų145.391%0.91383%0.834SS**  trans-92.3171.4174.6-98.9-171.9163.5-173.7-2.2112.5
472P47.5Very low32Very low116 Ų116143 Ų14375%0.75383%0.833SS**  cis-142.1161.7-29.637.1-19.5000116.5
473G29.6Very low32.8Very low79 Ų79139.9 Ų139.981%0.81483%0.829SS**  trans82.6170.4145.500000119.1
474A30.5Very low33.1Very low99 Ų99135 Ų13582%0.81882%0.822SS**  cis-163.4160.3-13.500000112.4
475A29.3Very low33.3Very low91 Ų91136.2 Ų136.275%0.75282%0.824SS**  trans55.4106.315500000121.9
476T30.1Very low33.4Very low114 Ų114136.4 Ų136.470%0.69983%0.825SS**  4.4133.7120.7-26.70000118.6
477F28.8Very low33.3Very low188 Ų188132 Ų13283%0.82582%0.815SS**  -179.3169.8111.1-107.2-77.6000115.6
478H33.2Very low33.9Very low168 Ų168127.8 Ų127.878%0.77880%0.803SS**  trans-81.8162.1-174.7-70.8-114.3000115
479V31.4Very low33.9Very low146 Ų146125.8 Ų125.889%0.88579%0.794SS**  177.2146.6128.8145.10000108.1
480G28.4Very low34.1Very low74 Ų74124.8 Ų124.876%0.76379%0.789SS**  cis142.5122.2-5.100000112.3
481G28Very low34Very low84 Ų84129.7 Ų129.787%0.86679%0.79SS**  trans152.9120.9171.700000116.2
482G26.5Very low34.5Very low74 Ų74123.7 Ų123.776%0.76378%0.783SS**  trans-107.1-150.316400000110.9
483P48.8Very low34.3Very low124 Ų124124.3 Ų124.381%0.80579%0.787SS**  cis-138.9165.89.842.1-25.3000117.2
484A37.8Very low34.5Very low92 Ų92125.1 Ų125.176%0.7679%0.785SS**  trans38.8159.1142.300000122
485Q36.5Very low35.5Very low181 Ų181126.1 Ų126.185%0.84678%0.784SS**  cis-138.7166.916.9-58.5165.238.100107.6
486N30.6Very low36.1Very low156 Ų156127.9 Ų127.983%0.83479%0.787SS**  cis-165.3172.644.4-158.51.4000110.8
487A34.1Very low36.4Very low82 Ų82128.4 Ų128.468%0.67880%0.795SS**  trans-139.5-169.4-171.300000111.9
488P46.7Very low36.5Very low97 Ų97127.4 Ų127.463%0.6380%0.799SS**  cis-117.2-162-12.744.2-30.6000111.5
489H34.2Very low36.6Very low159 Ų159124 Ų12474%0.73680%0.799SS**  cis-133.3166.32.6-86.2-58.9000108.2
490Q34.5Very low36.7Very low173 Ų173125.2 Ų125.281%0.80880%0.8SS**  cis89.713030.5-77.5171.1-35.500117.4
491Q29.9Very low37.1Very low184 Ų184129.3 Ų129.386%0.8680%0.804SS**  trans-150.5144.7175.3173.1-176.4-21.500107.1
492P48.3Very low37.2Very low117 Ų117132.1 Ų132.176%0.7680%0.799SS**  trans-90.9160.6-168.134.6-36.3000116.1
493P42.9Very low37.5Very low129 Ų129136.7 Ų136.784%0.83881%0.805SS**  trans-100.5-176.1-178.241.2-37.1000114.7
494A34.9Very low36.7Very low95 Ų95137.4 Ų137.479%0.78580%0.797SS**  trans-97.3153.6-178.800000114.5
495P50.5Low36.4Very low121 Ų121141.4 Ų141.479%0.78680%0.798SS**  trans-95.8168.417838.3-35.6000114.5
496P42.1Very low36.5Very low128 Ų128138 Ų13883%0.83179%0.791SS**  trans-93.7178.5-175.438.7-37.3000115.1
497S36Very low36.6Very low124 Ų124136.1 Ų136.187%0.86779%0.79SS**  trans-68.2154.9-179.6-45.10000114.9
498D32Very low36.4Very low167 Ų167138.8 Ų138.889%0.89379%0.794SS**  trans-125.4161.4174.2-135.3-29.5000111.6
499A34.5Very low36.2Very low96 Ų96141.4 Ų141.479%0.79380%0.797SS**  trans-90.1159-170.700000114.3
500L34.7Very low36.1Very low173 Ų173142.6 Ų142.691%0.90681%0.808SS**  trans-123.8149.4168.8-162.7140.1000110.6
501L35.1Very low35.9Very low160 Ų160137.5 Ų137.584%0.83880%0.802SS**  trans-79.4146.6-157-67.4161.7000115.1
502D30.7Very low36.2Very low142 Ų142136 Ų13676%0.75980%0.8SS**  trans-81.3133.4166.2177.327.7000110.7
503L33.3Very low35.6Very low170 Ų170138.6 Ų138.689%0.8981%0.806SS**  trans-145.5122168.5-76.8-179.6000109.4
504H31.9Very low35Very low139 Ų139135.1 Ų135.164%0.64479%0.794SS**  trans-106.9-171.9-171.3-173.666.8000112.4
505F31Very low35.1Very low176 Ų176138.3 Ų138.377%0.77280%0.798SS**  trans85.7143.5172.3-50.3-73.5000116.9
506P39.1Very low34.6Very low109 Ų109136.7 Ų136.771%0.70879%0.788SS**  -131.8169-52.634.7-19.5000112.5
507S33.3Very low33.9Very low117 Ų117139.7 Ų139.782%0.81879%0.788SS**  trans-91.4134.5172.9-169.90000110.7
508D29.2Very low33.9Very low139 Ų139142.8 Ų142.874%0.74379%0.788SS**  trans-118.9163.1172.9-114.8-31.7000112.3
509H41.3Very low34Very low152 Ų152143 Ų14370%0.70479%0.788SS**  trans-143.897.7-147.654.5-72.3000114
510L32.5Very low33.7Very low183 Ų183141.3 Ų141.396%0.95878%0.781SS**  trans-165.6139.8167.8-136.966.7000108.8
511G30.7Very low33.6Very low67 Ų67141 Ų14169%0.69178%0.779SS**  cis-170157.9-600000111.1
512D35.9Very low33.4Very low153 Ų153141.8 Ų141.882%0.81878%0.778SS**  trans-48.1136.8169.6164.141.2000113.4
513L36.8Very low33.3Very low170 Ų170141.8 Ų141.889%0.8978%0.778SS**  trans-163.194.7152.9-116.7166.7000113.3
514G29.9Very low33.2Very low56 Ų56141.6 Ų141.658%0.57778%0.776SS**  trans42.1115.8138.200000121.2P516G514-P516 WeakPolarHBondContact O-CD 3.42Å
515D35.7Very low33.2Very low162 Ų162141.6 Ų141.687%0.86678%0.78SS**  trans-82.6128.915917615.4000111.2
516P41.7Very low33.2Very low88 Ų88140.5 Ų140.557%0.57178%0.779SS**  trans-135.9119.615835.7-18.7000113G514G514-P516 WeakPolarHBondContact O-CD 3.42Å
517F27.3Very low33Very low190 Ų190142 Ų14283%0.83378%0.777SS**  167.9108.6104.8-85.9-62000111.2
518H35.2Very low33.1Very low190 Ų190144.7 Ų144.788%0.8878%0.777SS**  trans-123.583.2172.3-169.250.5000111.4
519L34.3Very low33.6Very low171 Ų171146.4 Ų146.490%0.89578%0.78SS**  trans-151.4147.2166.5-64176.2000105.7
520G27.8Very low33.3Very low61 Ų61145.8 Ų145.863%0.62978%0.778SS**  cis164.51761.500000108.7
521L33.8Very low33.3Very low165 Ų165140.4 Ų140.486%0.86477%0.766SS**  trans71.1126.6-174-46.2170000112.6
522E30.3Very low33.6Very low178 Ų178142.3 Ų142.383%0.83276%0.764SS**  cis81.211439.6-62.1-159.6136.400115.6
523D28.6Very low33.6Very low142 Ų142141.4 Ų141.476%0.75976%0.764SS**  trans43.5101.8143.9-149.824.8000120.2
524I31.9Very low33.4Very low166 Ų166136.9 Ų136.985%0.85176%0.758SS**  trans-135112.6154.7-59.9-177.7000108.9
525L30Very low33.5Very low139 Ų139137.6 Ų137.673%0.72877%0.765SS**  trans-98.3-177.9161.8-77.2169000110
526M31.3Very low33.5Very low152 Ų152138.4 Ų138.475%0.74977%0.769SS**  trans80.8141.1176.8-52.4164.468.700114.6
527E34.8Very low33.3Very low141 Ų141139.7 Ų139.766%0.65978%0.78SS**  cis-161.8160.6-8.8-118.3155.6-161.200111.3
528E35.1Very low33.6Very low174 Ų174134.5 Ų134.581%0.81378%0.78SS**  trans30.6159146.2-64.8173.916700122.8
529E40.7Very low33.3Very low174 Ų174129.1 Ų129.181%0.81378%0.776SS**  cis-151.1172.59.2-141.3-162.2178.400107.6
530E36Very low33.3Very low140 Ų140125.5 Ų125.565%0.65477%0.771SS**  cis-138.7-107.8-4.4-171.2-123.2-140.700108.4V532E530-V532 VanDerWaalsContact CD-CG2 3.44Å; E530-V532 HydrophobicContact CG-CG2 4.13Å; E530-V532 VanDerWaalsContact OE1-CG2 3.31Å; E530-V532 WeakPolarHBondContact OE1-CG2 3.33Å; E530-V532 WeakPolarHBondContact OE2-CB 3.42Å; E530-V532 PolarHBondContact OE2-N 3.14Å
531G31.5Very low33.6Very low70 Ų70130.8 Ų130.872%0.72278%0.784SS**  trans115.317.5165.800000118.3
532V36.6Very low33.6Very low107 Ų107128.3 Ų128.365%0.64878%0.78SS**  trans-46.6133.4-173.2162.50000113.7E530E530-V532 VanDerWaalsContact CD-CG2 3.44Å; E530-V532 HydrophobicContact CG-CG2 4.13Å; E530-V532 VanDerWaalsContact OE1-CG2 3.31Å; E530-V532 WeakPolarHBondContact OE1-CG2 3.33Å; E530-V532 WeakPolarHBondContact OE2-CB 3.42Å; E530-V532 PolarHBondContact OE2-N 3.14Å
533V37.1Very low34.5Very low134 Ų134125.2 Ų125.281%0.81278%0.775SS**  cis-143158.845.5-172.10000108.8
534G32.6Very low34.7Very low74 Ų74125.9 Ų125.976%0.76378%0.778SS**  cis115145.814.300000111.5
535G30.6Very low34.6Very low71 Ų71129 Ų12973%0.73278%0.779SS**  cis-177.1-170.3-4.900000112.9
536L36.7Very low34.8Very low180 Ų180127 Ų12794%0.94278%0.782SS**  trans74.2141174.4-46.2-179.4000117.5
537S36.6Very low34.8Very low115 Ų115123.7 Ų123.780%0.80478%0.779SS**  cis-168.9138.9-19.9-174.40000112.2
538G33.3Very low34.8Very low81 Ų81122.8 Ų122.884%0.83579%0.788SS**  trans73.8158.516000000119.2
539G30.7Very low34.8Very low76 Ų76120.7 Ų120.778%0.78478%0.783SS**  cis169.279.6-6.200000117.4
540A33.8Very low35.2Very low96 Ų96118.1 Ų118.179%0.79378%0.781SS**  trans61.7154149.500000124.3
541L34.6Very low35.5Very low172 Ų172118.5 Ų118.590%0.90179%0.787SS**  trans82.8123.8159.4-50.3-173.3000121.8
542S32Very low35.7Very low113 Ų113123.2 Ų123.279%0.7980%0.795SS**  trans-85-178.6162.8-27.80000110.7
543P50Low35.3Very low112 Ų112122.9 Ų122.973%0.72780%0.797SS**  cis-157174.446.144.3-21.6000120.4
544L32.3Very low35.1Very low156 Ų156121.3 Ų121.382%0.81779%0.792SS**  trans40.9121.9143-67.8166.1000122.6
545R31.1Very low35Very low233 Ų233124.5 Ų124.588%0.87980%0.797SS**  -177.9145.1113.2-107.3-179.2-178.884.4-2.4115.1
546A33.6Very low35.2Very low96 Ų96126.2 Ų126.279%0.79380%0.797SS**  trans51.6161.914000000121.6
547A31.4Very low35.7Very low83 Ų83123.1 Ų123.169%0.68679%0.788SS**  cis-176.4169-31.400000108.1
548S34.5Very low35.5Very low121 Ų121122 Ų12285%0.84679%0.785SS**  trans58.7116.9162.851.50000119.9
549D35.8Very low35.4Very low130 Ų130124.2 Ų124.270%0.69578%0.783SS**  trans-86.4150.3159.9169.750.7000111.2
550P48.8Very low35.5Very low120 Ų120125.5 Ų125.578%0.77978%0.78SS**  trans-135.3122.2156.435.2-19.2000115
551L41.6Very low35.6Very low148 Ų148130.9 Ų130.978%0.77579%0.785SS**  trans-83.3126.3171.9-61.4172000113.4
552L36.2Very low35.4Very low169 Ų169126.8 Ų126.889%0.88578%0.776SS**  trans-156.5114.8146.9-75-171.6000107.6
553S28.6Very low35.6Very low100 Ų100127 Ų12770%0.69978%0.778SS**  82.4117.471.6-1670000115.6
554S32.4Very low34.8Very low101 Ų101126.2 Ų126.271%0.70678%0.775SS**  trans54.3109.7147.360.30000121.1
555V30.8Very low35.1Very low142 Ų142129.5 Ų129.586%0.86178%0.776SS**  -167.6147116.8134.60000113
556S35.3Very low35.5Very low106 Ų106128.5 Ų128.574%0.74177%0.772SS**  trans-136.2152.9159.9-79.30000105.4
557P47Very low35.6Very low115 Ų115127.7 Ų127.775%0.74776%0.761SS**  -158.5174.855.844-22.9000119.7
558A30.8Very low36.1Very low91 Ų91129 Ų12975%0.75277%0.765SS**  trans65.7163137.900000124.1
559V32.4Very low36.1Very low128 Ų128131.6 Ų131.678%0.77676%0.762SS**  trans95.2102.6175.8-176.40000113.9
560S31.6Very low36.2Very low104 Ų104129.8 Ų129.873%0.72776%0.759SS**  cis81105.439.7-51.70000115.9
561K36.1Very low36.4Very low209 Ų209130.5 Ų130.591%0.90975%0.754SS**  trans-172.5154.5153.5-102.1160.6-174.5174.20108.8
562A31.4Very low36.6Very low85 Ų85130.6 Ų130.670%0.70275%0.75SS**  cis-178.6139.9-43.500000109
563S35.5Very low37.1Very low119 Ų119130.9 Ų130.983%0.83275%0.747SS**  trans67.3161.3161.6-113.30000117.5
564S34.2Very low37.9Very low94 Ų94134.3 Ų134.366%0.65775%0.752SS**  cis-152.6177.8-2-142.40000114.6
565R38.8Very low38.6Very low226 Ų226138.9 Ų138.985%0.85378%0.784SS**  trans-46173174.7-49.7157169.8-161.2-7114.7
566R39.6Very low39Very low211 Ų211138.7 Ų138.780%0.79678%0.78SS**  cis-173.6170.125.5-158.6179.2174.7-92.98.3111.9
567S34.5Very low39.2Very low80 Ų80140.4 Ų140.456%0.55978%0.782SS**  trans69.4148.1159.8-100.90000117.7
568S42.7Very low38.8Very low111 Ų111141.8 Ų141.878%0.77678%0.784SS**  cis85.490.96.5-39.50000118.8
569F33.2Very low39.3Very low174 Ų174144.8 Ų144.876%0.76379%0.786SS**  trans-177.9145144.1-142.8-120.8000106.1M571F569-M571 HydrophobicContact CD1-CG 3.98Å; F569-M571 HydrophobicContact CE1-CG 3.68Å; F569-M571 HydrophobicContact CE1-SD 4.31Å
570S38.7Very low39.7Very low93 Ų93145.9 Ų145.965%0.6579%0.787SS**  cis83.1158.637.3-147.70000114.8
571M53.9Low40.2Very low134 Ų134148.7 Ų148.766%0.6679%0.791SS**  trans88.5131.3-161.8-54.1-16773.900113F569F569-M571 HydrophobicContact CD1-CG 3.98Å; F569-M571 HydrophobicContact CE1-CG 3.68Å; F569-M571 HydrophobicContact CE1-SD 4.31Å
572E44.2Very low40.5Very low150 Ų150144.4 Ų144.470%0.70178%0.782SS**  cis70.7143.328.9106.4-154.768.400112.7
573E48.2Very low41.2Very low176 Ų176148.9 Ų148.982%0.82279%0.788SS**  cis-157.8173.6-20.7-177.8160.490.600106.3
574E44.7Very low41.7Very low171 Ų171151.4 Ų151.480%0.79979%0.785SS**  trans59.1111.1161.1-160.5161.8121.800121.4
575S47.8Very low42.4Very low197 Ų197156.6 Ų156.6100%1.37880%0.796SS**  -163.40128.5-73.60000110.6

Retrieved 575 of 575 residues in 151.7 ms (Link to these results)