A0A096NQY4_PAPAN Loading...

GS homeobox 1

AlphaFold DB (A0A2K6C122), UniProt , Accession A0A096NQY4, Species PAPAN (Papio anubis, Olive baboon), Gene GSX1, Length 264 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
1M40.1Very low50.4Low236 Ų236157.1 Ų157.1100%1.16384%0.836SS**  0111.10-74.6159155.800108.3
2P50.2Low50.1Low133 Ų133156.9 Ų156.986%0.86483%0.834SS**PPolyproline II helixtrans-74.6138.4-176.331.8-31.1000109.8S4P2-S4 PolarHBondContact O-N 3.19Å
3R57.8Low49.8Very low239 Ų239162.8 Ų162.890%0.90284%0.838SS**PPolyproline II helixtrans-81.4116.4176.4-60.8-171.677.995-0.3108.1
4S52.2Low49Very low109 Ų109164.7 Ų164.776%0.76284%0.841SS**PPolyproline II helixtrans-54.3136.9-179.236.20000112.7P2P2-S4 PolarHBondContact O-N 3.19Å
5F50.8Low48.7Very low199 Ų199160.4 Ų160.487%0.87384%0.84SS**PPolyproline II helixtrans-62.5120.7161.1-76-102.4000109
6L62.3Low48.3Very low168 Ų168155.1 Ų155.188%0.8884%0.837SS**  trans-120.9104.7155.6-113.7158.6000106.9D8L6-D8 PolarHBondContact O-N 2.67Å
7V46.9Very low48.2Very low114 Ų114156.7 Ų156.769%0.69184%0.837SS**  trans-62.7112166.3170.10000106.4S9V7-S9 PolarHBondContact O-N 2.9Å
8D50.5Low47.9Very low155 Ų155158.8 Ų158.883%0.82984%0.838SS**  trans-81107.9168-156.8-104.9000106.9L6L6-D8 PolarHBondContact O-N 2.67Å
9S49.8Very low47.3Very low97 Ų97161.3 Ų161.368%0.67884%0.841SS**  trans-59.1134.4179.7-66.60000110.9V7 V11V7-S9 PolarHBondContact O-N 2.9Å; S9-V11 PolarHBondContact O-N 3.38Å
10L47.5Very low47.1Very low155 Ų155157.7 Ų157.781%0.81284%0.835SS**  trans-48.4128.6173.7-80.288.9000112.3L12L10-L12 PolarHBondContact O-N 3.03Å
11V46.2Very low47.2Very low123 Ų123156 Ų15675%0.74583%0.833SS**  trans-54108.4151166.80000108.8S9 R13S9-V11 PolarHBondContact O-N 3.38Å; V11-R13 HydrophobicContact CG1-CG 4.08Å
12L46.5Very low47.3Very low155 Ų155153.7 Ų153.781%0.81282%0.82SS**  trans-94.9104.5152.8-116.985.2000107.4L10L10-L12 PolarHBondContact O-N 3.03Å
13R46Very low46.9Very low234 Ų234150 Ų15088%0.88381%0.806SS**  trans-96.3115.6151.8-73.9-179.792.3106-2.4105.7V11V11-R13 HydrophobicContact CG1-CG 4.08Å
14E39.4Very low46.3Very low189 Ų189144.1 Ų144.188%0.88380%0.801SS**  trans-139.8143.6152.8-153172.6118.300110.1
15A44.5Very low46.8Very low100 Ų100144.3 Ų144.383%0.82680%0.8SS**  trans-82.6150.4-16800000112.1
16G41.9Very low47.3Very low76 Ų76140 Ų14078%0.78479%0.792SS**  trans-160.3103.3167.700000110
17E46.2Very low46.9Very low182 Ų182136.8 Ų136.885%0.8578%0.781SS**  trans-57.4139.4171-73.9177.872.300111.7
18K43.3Very low47Very low195 Ų195139.2 Ų139.285%0.84879%0.79SS**  168.8127.7118.6-88.3156.7-171.7174.70112.9
19K36.6Very low47Very low206 Ų206140.5 Ų140.590%0.89679%0.788SS**  trans74108.9138.7-151.6168.2-175.7176.70119.1
20A42.5Very low47.3Very low88 Ų88141.3 Ų141.373%0.72779%0.791SS**  trans-66.4159.2162.600000111.6
21P50.2Low47.5Very low122 Ų122144.5 Ų144.579%0.79279%0.794SS**  -146.2151.78435.9-17.3000116.6
22E41.9Very low47.4Very low188 Ų188142.7 Ų142.788%0.87979%0.792SS**  trans58.9125.2138-134.6-92.711800121.6
23G41.4Very low47.9Very low56 Ų56140.2 Ų140.258%0.57778%0.783SS**  trans101.187.3150.600000118.3
24S45.8Very low48.4Very low115 Ų115134.2 Ų134.280%0.80477%0.774SS**  trans168.1148.3132.457.40000112.3
25P62.5Low49.4Very low113 Ų113129.4 Ų129.473%0.73476%0.76SS**PPolyproline II helixtrans-79.8161.2-165.833.3-34.8000113
26P61.3Low49.7Very low108 Ų108130.7 Ų130.770%0.70176%0.759SS**PPolyproline II helixtrans-68.9145.8-172.828.4-35.2000112.1L28P26-L28 PolarHBondContact O-N 3.15Å; P26-L28 VanDerWaalsContact O-N 3.17Å
27P53.8Low49.9Very low101 Ų101135 Ų13566%0.65676%0.758SS**PPolyproline II helixtrans-66.6117.7169.627.7-31.6000109.1F29P27-F29 HydrophobicContact CB-CE2 4.41Å; P27-F29 HydrophobicContact CG-CD2 4.45Å; P27-F29 HydrophobicContact CG-CE2 3.99Å; P27-F29 PolarHBondContact O-N 3.41Å
28L49.7Very low49.9Very low166 Ų166129.9 Ų129.987%0.86975%0.748SS**  trans-61.296.8166.1-65.5175.2000108.5P26 P30P26-L28 PolarHBondContact O-N 3.15Å; P26-L28 VanDerWaalsContact O-N 3.17Å; L28-P30 WeakPolarHBondContact O-CD 3.47Å
29F50.9Low49.9Very low181 Ų181128.8 Ų128.879%0.79475%0.75SS**  trans-74.7122.8162-78.2-80.6000108.1P27 Y31P27-F29 HydrophobicContact CB-CE2 4.41Å; P27-F29 HydrophobicContact CG-CD2 4.45Å; P27-F29 HydrophobicContact CG-CE2 3.99Å; P27-F29 PolarHBondContact O-N 3.41Å; F29-Y31 PolarHBondContact O-N 3.31Å; F29-Y31 VanDerWaalsContact O-N 3.14Å
30P54.6Low50.4Low114 Ų114127.6 Ų127.674%0.7475%0.748SS**  trans-68116.2173.226.7-30.2000108.3L28 A32L28-P30 WeakPolarHBondContact O-CD 3.47Å; P30-A32 PolarHBondContact O-N 3.39Å
31Y52Low50.7Low223 Ų223126.7 Ų126.788%0.87575%0.747SS**  trans-67.478.9166.4-148.2-95.4000108.1F29 V33F29-Y31 PolarHBondContact O-N 3.31Å; F29-Y31 VanDerWaalsContact O-N 3.14Å; Y31-V33 HydrophobicContact CD1-CG2 3.62Å; Y31-V33 HydrophobicContact CE1-CG2 3.56Å; Y31-V33 PolarHBondContact O-N 3.14Å
32A43.9Very low50.4Low84 Ų84129.2 Ų129.269%0.69475%0.752SS**  trans-88.692.2169.700000107.9P30 P34P30-A32 PolarHBondContact O-N 3.39Å; A32-P34 WeakPolarHBondContact O-CD 3.5Å
33V58.3Low50.7Low103 Ų103125.6 Ų125.662%0.62475%0.748SS**  trans-68.2115.31621730000107.1Y31Y31-V33 HydrophobicContact CD1-CG2 3.62Å; Y31-V33 HydrophobicContact CE1-CG2 3.56Å; Y31-V33 PolarHBondContact O-N 3.14Å
34P56.2Low51.1Low109 Ų109129 Ų12971%0.70876%0.76SS**  trans-72.3135.2165.927.5-29.5000109.3A32A32-P34 WeakPolarHBondContact O-CD 3.5Å
35P60.8Low51.5Low88 Ų88127.2 Ų127.257%0.57176%0.76SS**  trans-64.1150.7175.710.9-9.2000111.1H37P35-H37 PolarHBondContact O-N 3.42Å
36P49.6Very low51.2Low126 Ų126125.8 Ų125.882%0.81876%0.758SS**  trans-70.898.7168.530.4-30.3000107.7A38P36-A38 PolarHBondContact O-N 3.22Å
37H45.8Very low50.9Low166 Ų166122.8 Ų122.877%0.76974%0.738SS**  trans-64.2107.3162.2-79-83.3000107.9P35 L39P35-H37 PolarHBondContact O-N 3.42Å; H37-L39 PolarHBondContact O-N 3.45Å; H37-L39 VanDerWaalsContact O-N 3.1Å
38A47.2Very low51.1Low76 Ų76126.8 Ų126.863%0.62875%0.748SS**  trans-63.5103.7165.200000108.6P36 H40P36-A38 PolarHBondContact O-N 3.22Å; A38-H40 PolarHBondContact O-N 3.5Å; A38-H40 VanDerWaalsContact O-N 3.11Å
39L42.1Very low51.4Low172 Ų172121.4 Ų121.490%0.90173%0.727SS**  trans-80.277.2158.7-69-177.8000108.1H37H37-L39 PolarHBondContact O-N 3.45Å; H37-L39 VanDerWaalsContact O-N 3.1Å
40H48Very low51.6Low181 Ų181122.1 Ų122.184%0.83873%0.725SS**  trans-72.8125.7152.6-79.3-83.3000107.9A38A38-H40 PolarHBondContact O-N 3.5Å; A38-H40 VanDerWaalsContact O-N 3.11Å
41G49.1Very low51.6Low69 Ų69126.6 Ų126.671%0.71173%0.733SS**  trans133.143.9161.700000116.7
42L42.9Very low51.8Low174 Ų174119.6 Ų119.691%0.91172%0.721SS**  trans-122.7108.5150.9-71.9176000109.1
43S48.2Very low52.5Low112 Ų112119.4 Ų119.478%0.78373%0.727SS**  trans-47.8133.5172-176.90000111.4G45S43-G45 PolarHBondContact O-N 2.97Å
44P49.6Very low52.6Low128 Ų128121 Ų12183%0.83173%0.731SS**SBendtrans-76.4109.9175.630.2-29000108.7
45G55.8Low53Low77 Ų77124 Ų12479%0.79474%0.74SS**  trans154.18162.300000120.6S43S43-G45 PolarHBondContact O-N 2.97Å
46A54.7Low53.3Low84 Ų84121.8 Ų121.869%0.69473%0.727SS**  trans-112.294.6179.500000112.3H48A46-H48 PolarHBondContact O-N 3.33Å; A46-H48 PolarHBondContact O-ND1 3.21Å
47C56.5Low54Low44 Ų44122.5 Ų122.530%0.29773%0.728SS.*  trans-71.4116.8163.558.60000109.1A49 R50C47-A49 PolarHBondContact O-N 3.46Å; C47-R50 PolarHBondContact O-N 2.88Å
48H57.5Low55.1Low186 Ų186117.1 Ų117.186%0.86171%0.708SS**G310 helixtrans-62-12.8-176.6-70.976.1000113.7A46 R50A46-H48 PolarHBondContact O-N 3.33Å; A46-H48 PolarHBondContact O-ND1 3.21Å; H48-R50 VanDerWaalsContact C-N 3.26Å; H48-R50 PolarHBondContact O-N 3.31Å
49A54.7Low55.8Low52 Ų52118.5 Ų118.543%0.4371%0.711SS.*G310 helixtrans-72.5-11.617900000114.5C47 K51 C56C47-A49 PolarHBondContact O-N 3.46Å; A49-K51 VanDerWaalsContact C-N 3.31Å; A49-K51 PolarHBondContact O-N 3.35Å; A49-C56 HydrophobicContact CB-CB 4.01Å
50R55.1Low56.8Low197 Ų197116.9 Ų116.974%0.74370%0.703SS**G310 helixtrans-77.1-5.9-175.3-86.3-178.1146.3-137.3-6.2115.7C47 H48 A52C47-R50 PolarHBondContact O-N 2.88Å; H48-R50 VanDerWaalsContact C-N 3.26Å; H48-R50 PolarHBondContact O-N 3.31Å; R50-A52 VanDerWaalsContact C-N 3.28Å; R50-A52 PolarHBondContact O-N 3.08Å
51K54.6Low57.5Low208 Ų208109.7 Ų109.790%0.90467%0.672SS**G310 helixtrans-79.6-2.8-176.1-153.8169.6-179.9-177.20114.7A49A49-K51 VanDerWaalsContact C-N 3.31Å; A49-K51 PolarHBondContact O-N 3.35Å
52A57.2Low58Low76 Ų76111.4 Ų111.463%0.62867%0.669SS**G310 helixtrans-123.510.7-173.500000115.7R50 L54R50-A52 VanDerWaalsContact C-N 3.28Å; R50-A52 PolarHBondContact O-N 3.08Å; A52-L54 PolarHBondContact O-N 3.44Å; A52-L54 VanDerWaalsContact O-N 3.11Å
53G59.4Low58.6Low79 Ų79107.5 Ų107.581%0.81465%0.652SS**SBendtrans65.813.9176.800000115.5
54L60Low58.8Low138 Ų138105.9 Ų105.972%0.72365%0.646SS**  trans-101.9135.4176.4-70165.2000110.3A52 C56A52-L54 PolarHBondContact O-N 3.44Å; A52-L54 VanDerWaalsContact O-N 3.11Å; L54-C56 PolarHBondContact O-N 3.27Å; L54-C56 VanDerWaalsContact O-N 3.17Å
55L63.7Low59.1Low171 Ų171104.5 Ų104.590%0.89564%0.639SS**  trans-60.3114.5-176.8-59.8171.7000110.7V57L55-V57 PolarHBondContact O-N 3.49Å
56C68.3Low59Low42 Ų42108.8 Ų108.828%0.28464%0.639SS.*  trans-80.1114.8177.3-1770000110.3A49 L54 C58A49-C56 HydrophobicContact CB-CB 4.01Å; L54-C56 PolarHBondContact O-N 3.27Å; L54-C56 VanDerWaalsContact O-N 3.17Å; C56-C58 VanDerWaalsContact C-N 3.3Å; C56-C58 PolarHBondContact O-N 2.88Å
57V63.3Low58.7Low141 Ų141111.8 Ų111.886%0.85564%0.642SS**  trans-94.451.1179.4-161.50000110.7L55L55-V57 PolarHBondContact O-N 3.49Å
58C69.8Low58.2Low52 Ų52119 Ų11935%0.35167%0.671SS.*  trans-100.3137.7172.3-1720000109.2C56 L60 C61C56-C58 VanDerWaalsContact C-N 3.3Å; C56-C58 PolarHBondContact O-N 2.88Å; C58-L60 PolarHBondContact O-N 3.24Å; C58-C61 PolarHBondContact O-N 3.1Å
59P60.6Low57.7Low105 Ų105113.6 Ų113.668%0.68267%0.666SS**Hα-helixtrans-57.5-20.6-176.818.7-32.2000114.7
60L63.3Low57.8Low139 Ų139117.1 Ų117.173%0.72868%0.684SS**Hα-helixtrans-78.5-22.6176.2-66.6169.1000114C58 T63C58-L60 PolarHBondContact O-N 3.24Å; L60-T63 PolarHBondContact O-OG1 3.34Å
61C62.2Low57.6Low29 Ų29113.8 Ų113.820%0.19669%0.688CS.*Hα-helixtrans-91.1-30.4-177-54.10000112.3C58 T63 A64C58-C61 PolarHBondContact O-N 3.1Å; C61-T63 VanDerWaalsContact C-N 3.26Å; C61-T63 PolarHBondContact O-N 2.87Å; C61-A64 PolarHBondContact O-N 2.65Å
62V60.2Low57.2Low106 Ų106107.3 Ų107.364%0.64268%0.68SS**Hα-helixtrans-67.3-27.5178.2123.40000112.2
63T56.3Low57.3Low91 Ų91109.6 Ų109.656%0.55869%0.689SS**THydrogen-bonded Turntrans-83.6-20.9-178.551.60000113.7L60 C61L60-T63 PolarHBondContact O-OG1 3.34Å; C61-T63 VanDerWaalsContact C-N 3.26Å; C61-T63 PolarHBondContact O-N 2.87Å
64A53Low56.8Low79 Ų79111.8 Ų111.865%0.65369%0.688SS**G310 helixtrans-83.2-18.4-177.700000113.8C61 Q66C61-A64 PolarHBondContact O-N 2.65Å; A64-Q66 VanDerWaalsContact C-N 3.26Å; A64-Q66 PolarHBondContact O-N 2.76Å
65S54.9Low56Low98 Ų98110 Ų11069%0.68569%0.693SS**G310 helixtrans-80.71.7-180-70.30000114.7
66Q54.3Low55.3Low168 Ų168109.3 Ų109.379%0.78569%0.69SS**G310 helixtrans-106.88.3-172.7-73.5-83.375.500114.8A64A64-Q66 VanDerWaalsContact C-N 3.26Å; A64-Q66 PolarHBondContact O-N 2.76Å
67L48.7Very low54.3Low147 Ų147113 Ų11377%0.7771%0.713SS**SBendtrans-123.414.2-167.5-102.8169.7000118.6
68H45.6Very low53.5Low196 Ų196113.4 Ų113.491%0.90771%0.71SS**  trans-129105.3165.9-82.7166.9000111.5
69G47.1Very low52.5Low72 Ų72119.5 Ų119.574%0.74274%0.738SS**PPolyproline II helixtrans-86.2141.3159.500000110.2
70P55.6Low51.7Low126 Ų126124.5 Ų124.582%0.81875%0.749SS**PPolyproline II helixtrans-86.3151.5176.933.2-31.5000112
71P52.4Low50.5Low126 Ų126122 Ų12282%0.81875%0.749SS**PPolyproline II helixtrans-81159.9169.834.3-31000111.5
72G45.4Very low49.5Very low72 Ų72126.3 Ų126.374%0.74278%0.779SS**  trans-67.7-169.9-17100000118.3
73P59.5Low48.8Very low125 Ų125130.1 Ų130.181%0.81279%0.787SS**  trans-95.5168.1-137.238.6-37.2000115
74P49.6Very low48.6Very low125 Ų125130.9 Ų130.981%0.81279%0.794SS**  -146.5153.6109.135.2-18.2000116.8
75A42.7Very low48.5Very low99 Ų99133 Ų13382%0.81880%0.8SS**  trans59117.4151.100000121.1
76L47.6Very low47.9Very low157 Ų157138.7 Ų138.782%0.82281%0.813SS**  trans-68.2163.5165.5-59.6171.8000111.6
77P49.1Very low47.2Very low120 Ų120133.6 Ų133.678%0.77981%0.806SS**  -131.6156.49333-20.1000115.1
78L46.2Very low47.2Very low150 Ų150131.9 Ų131.979%0.78581%0.806SS**  trans-43.3131.7-177.4-80.873.6000115.8
79L48.5Very low46.9Very low180 Ų180130.7 Ų130.794%0.94280%0.801SS**  trans-136.9138.3130.4-71.697.7000110.3
80K43.2Very low46.7Very low210 Ų210136.4 Ų136.491%0.91380%0.802SS**  trans-93.1119.1-161.6178.6172178.3163.70110.6
81A38.3Very low45.9Very low87 Ų87136.6 Ų136.672%0.71980%0.804SS**  trans-145.5117159.100000109.8
82S42Very low45.3Very low118 Ų118139.4 Ų139.483%0.82581%0.806SS**  trans-83.2121.1-176.9176.20000110.1
83F45Very low45.2Very low187 Ų187140.4 Ų140.482%0.8281%0.808SS**  trans-109.8136.5161.3-72.6-81.4000108.8
84P52.8Low44.9Very low107 Ų107140.5 Ų140.570%0.69581%0.808SS**  trans-74.7152.5178.631-32.6000111.4
85P50.6Low44.8Very low123 Ų123143.1 Ų143.180%0.79981%0.814SS**  trans-78.3129-176.831.3-32.1000110.9G87P85-G87 PolarHBondContact O-N 2.98Å
86F41.8Very low44.6Very low217 Ų217141.6 Ų141.695%0.95281%0.809SS**  trans-73.494.1162.3-86.8-83.6000108.8
87G38.6Very low44.3Very low62 Ų62144.2 Ų144.264%0.63981%0.807SS**  trans-72.9130.9166.700000110.9P85 Q89P85-G87 PolarHBondContact O-N 2.98Å; G87-Q89 PolarHBondContact O-N 3.4Å
88S49Very low43.8Very low110 Ų110146.9 Ų146.977%0.76981%0.81SS**  trans-66117.3167.3-164.90000109.6
89Q39.6Very low43.7Very low172 Ų172146.7 Ų146.780%0.80480%0.804SS**  trans-141.9102.1169.7-71.6-79.127.600110.1G87G87-Q89 PolarHBondContact O-N 3.4Å
90Y43.1Very low43.1Very low191 Ų191143.9 Ų143.975%0.74980%0.8SS**  trans10.6136.2145.3-62.9-88000120.5
91C38.5Very low42.8Very low130 Ų130138.7 Ų138.788%0.87880%0.796SS**PPolyproline II helixtrans-61.1123.2173.1-22.50000111.5
92H40.3Very low42.7Very low186 Ų186141.2 Ų141.286%0.86180%0.802SS**PPolyproline II helixtrans-92.7121.9159.4-83.8-91.4000109.7
93A43.4Very low42.5Very low93 Ų93140.9 Ų140.977%0.76980%0.8SS**PPolyproline II helixtrans-83.8134.8161.300000108.9
94P52.5Low42.7Very low126 Ų126138.1 Ų138.182%0.81880%0.801SS**  trans-95.8104.7167.831.8-23.7000110
95L48.5Very low41.8Very low180 Ų180136.7 Ų136.794%0.94281%0.806SS**  trans-85.9122.7143.6-74.4175.6000106.8
96G37.4Very low41.3Very low68 Ų68137.8 Ų137.870%0.70181%0.81SS**  trans-174.459.1-17800000112Q98G96-Q98 PolarHBondContact O-N 3.41Å
97R41.1Very low41.1Very low211 Ų211130.8 Ų130.880%0.79679%0.792SS**  trans-70.2106.7165.1176.2170.1169.2-170.6-5.5107.5H99R97-H99 PolarHBondContact NE-NE2 2.91Å; R97-H99 VanDerWaalsContact NE-NE2 3.18Å
98Q40Very low40.8Very low176 Ų176137.1 Ų137.182%0.82281%0.805SS**  trans-116.6112.9164.5-69.3-7229.700108.4G96G96-Q98 PolarHBondContact O-N 3.41Å
99H42.7Very low40.2Very low146 Ų146137.3 Ų137.368%0.67681%0.806SS**  trans-73.5126.4165-75.9-142.1000107.2R97R97-H99 PolarHBondContact NE-NE2 2.91Å; R97-H99 VanDerWaalsContact NE-NE2 3.18Å
100S37.3Very low41.3Very low121 Ų121134.7 Ų134.785%0.84680%0.804SS**  trans-132.9118.5161.6-131.10000108.8
101A35.8Very low40.8Very low101 Ų101130 Ų13084%0.83581%0.805SS**  trans-71.4137.7-177.900000111
102V37Very low40.5Very low140 Ų140128.7 Ų128.785%0.84880%0.803SS**  trans-100.5124.5166.3160.10000108.4
103S37.2Very low40.2Very low111 Ų111124.6 Ų124.678%0.77680%0.801SS**  trans-109.8147.6153.5-68.60000108.3
104P50.5Low39.9Very low130 Ų130125 Ų12584%0.84481%0.805SS**  trans-93.9143.8-177.435.2-29.5000112.2
105G33.4Very low39.1Very low77 Ų77124 Ų12479%0.79481%0.807SS**  trans-150.6144.3175.500000111.3
106V38.7Very low38.5Very low146 Ų146119.9 Ų119.989%0.88580%0.799SS**  trans-97.4146.6-153.2163.20000114.5
107A37.5Very low38.5Very low70 Ų70121.4 Ų121.458%0.57981%0.805SS**  trans85.4143.9145.200000125.6
108H33.4Very low38.7Very low195 Ų195116.4 Ų116.490%0.90381%0.808SS**  trans98.9128.4150.9-58.4119.5000121
109S36.2Very low39Very low114 Ų114115.6 Ų115.680%0.79781%0.809SS**  trans-90.4-172.6-177.9-117.60000112.3
110P61.8Low39.2Very low117 Ų117119 Ų11976%0.7682%0.817SS**  cis-135.5-163.6-36.136.6-16.3000112.7
111A32.9Very low39.4Very low93 Ų93121.7 Ų121.777%0.76982%0.817SS**  trans109108.1159.100000115.6
112A33.2Very low40Very low102 Ų102123 Ų12384%0.84382%0.815SS**  99.1141.598.400000109.7
113A32.9Very low40.5Very low99 Ų99121.4 Ų121.482%0.81881%0.809SS**  cis-163.9148.7-5.500000104.9
114A37.5Very low41Very low103 Ų103126 Ų12685%0.85181%0.811SS**  trans-172.598.3141.400000108
115A36.5Very low41.4Very low103 Ų103125.6 Ų125.685%0.85181%0.809SS**  trans-63.1142.5162.400000110
116A35.5Very low42.6Very low94 Ų94129.7 Ų129.778%0.77781%0.811SS**  178.6118123.400000110.6
117A37.5Very low43.5Very low101 Ų101128.1 Ų128.184%0.83581%0.805SS**  trans37.9104.8138.900000119.2
118A44.2Very low44.4Very low105 Ų105129.7 Ų129.787%0.86880%0.803SS**  -149.2112.4129.600000109
119L46.6Very low45.6Very low160 Ų160126 Ų12684%0.83880%0.797SS**  trans-63.1146172.5-65161.2000110
120Y47.4Very low46.5Very low216 Ų216130.3 Ų130.385%0.84780%0.795SS**  trans41.496.2150.8-92-98.8000117.3
121Q41Very low45.9Very low179 Ų179132.7 Ų132.784%0.83680%0.796SS**  -164113.7122.1-110.7163.128.300112S123Q121-S123 PolarHBondContact O-N 3.42Å
122T48.3Very low46.7Very low129 Ų129137.3 Ų137.379%0.79180%0.799SS**  trans-43.999153.444.70000110.3
123S47.3Very low47.4Very low105 Ų105140.4 Ų140.473%0.73480%0.796SS**  trans-106110.1167.1500000108Q121Q121-S123 PolarHBondContact O-N 3.42Å
124Y49.4Very low47.9Very low207 Ų207141.3 Ų141.381%0.81280%0.795SS**  trans-54.5132169.2-65.3-92000108.9L126Y124-L126 PolarHBondContact O-N 2.93Å
125P58.6Low48.6Very low123 Ų123142.5 Ų142.580%0.79979%0.786SS**  trans-62.3109.4168.7-1426.5000107.9P127P125-P127 VanDerWaalsContact O-CD 3.31Å; P125-P127 WeakPolarHBondContact O-CD 3.23Å
126L57.9Low49.1Very low162 Ų162142.8 Ų142.885%0.84878%0.782SS**PPolyproline II helixtrans-67.3119.4171.4-149.783.8000107.1Y124 D128Y124-L126 PolarHBondContact O-N 2.93Å; L126-D128 PolarHBondContact O-N 3.48Å
127P58.6Low49.7Very low114 Ų114144.6 Ų144.674%0.7478%0.783SS**PPolyproline II helixtrans-66.8125.7178.7-17.531000110P125 P129P125-P127 VanDerWaalsContact O-CD 3.31Å; P125-P127 WeakPolarHBondContact O-CD 3.23Å; P127-P129 WeakPolarHBondContact O-CD 3.24Å
128D55Low50Low102 Ų102146.8 Ų146.855%0.54578%0.781SS.*PPolyproline II helixtrans-59.1120.7173.6-177.6-13.3000109.8L126 R130 Q131L126-D128 PolarHBondContact O-N 3.48Å; D128-R130 PolarHBondContact O-N 2.9Å; D128-R130 WeakPolarHBondContact OD1-CB 3.45Å; D128-R130 PolarHBondContact OD1-N 3.34Å; D128-Q131 PolarHBondContact O-N 3.13Å
129P58.7Low50.4Low119 Ų119146.7 Ų146.777%0.77377%0.774SS**THydrogen-bonded Turntrans-68.3-1.2-178.127.5-34.5000114.1P127P127-P129 WeakPolarHBondContact O-CD 3.24Å
130R55.9Low50.3Low204 Ų204144.5 Ų144.577%0.7777%0.772SS**THydrogen-bonded Turntrans-95.30.4179.7-61.6-170.271.7-131.61.9114.8D128 F132D128-R130 PolarHBondContact O-N 2.9Å; D128-R130 WeakPolarHBondContact OD1-CB 3.45Å; D128-R130 PolarHBondContact OD1-N 3.34Å; R130-F132 VanDerWaalsContact C-N 3.3Å; R130-F132 PolarHBondContact O-N 3.06Å
131Q48.9Very low50.3Low166 Ų166139.3 Ų139.378%0.77677%0.767SS**  trans-83.474.7178.4-140.7176.3-0.600110.9D128 H133D128-Q131 PolarHBondContact O-N 3.13Å; Q131-H133 PolarHBondContact O-N 3.2Å
132F49.8Very low50.9Low190 Ų190137.6 Ų137.683%0.83376%0.763SS**  trans-65.4101169.8-76.1-87.5000109.5R130 C134R130-F132 VanDerWaalsContact C-N 3.3Å; R130-F132 PolarHBondContact O-N 3.06Å; F132-C134 PolarHBondContact O-N 3.35Å; F132-C134 VanDerWaalsContact O-N 3.12Å
133H47.8Very low51Low167 Ų167140.4 Ų140.477%0.77377%0.767SS**  trans-54.9111.9166-13173.7000108.7Q131 I135Q131-H133 PolarHBondContact O-N 3.2Å; H133-I135 PolarHBondContact O-N 3.26Å
134C44.4Very low51.5Low119 Ų119143.4 Ų143.480%0.80478%0.775SS**  trans-7099.516348.20000106.7F132 S136F132-C134 PolarHBondContact O-N 3.35Å; F132-C134 VanDerWaalsContact O-N 3.12Å; C134-S136 VanDerWaalsContact C-N 3.31Å; C134-S136 PolarHBondContact O-N 2.97Å
135I50.2Low51.9Low128 Ų128139.5 Ų139.566%0.65678%0.775SS**  trans-69.496.2173.6-59174.8000106.8H133 V137H133-I135 PolarHBondContact O-N 3.26Å; I135-V137 HydrophobicContact CG2-CG1 4.48Å
136S48.4Very low51.5Low109 Ų109137.9 Ų137.976%0.76277%0.766SS**  trans-67.4124.1157-169.90000107.1C134 D138C134-S136 VanDerWaalsContact C-N 3.31Å; C134-S136 PolarHBondContact O-N 2.97Å; S136-D138 PolarHBondContact O-N 3.46Å
137V47.1Very low51.3Low131 Ų131136.8 Ų136.879%0.79477%0.772SS**  trans-82.591.1176.8-750000108.9I135I135-V137 HydrophobicContact CG2-CG1 4.48Å
138D44.2Very low51.5Low148 Ų148139.4 Ų139.479%0.79177%0.772SS**  trans-89.8138.2154.6167.8-121000108.8S136S136-D138 PolarHBondContact O-N 3.46Å
139S51.8Low52.4Low103 Ų103145.7 Ų145.772%0.7279%0.788SS**  trans-85.7111.2-173.7-65.80000109.3
140S45.7Very low53.5Low114 Ų114148.1 Ų148.180%0.79779%0.791SS**  trans175.8127.4143.7-81.60000113.4
141S46.3Very low54.9Low107 Ų107149.8 Ų149.875%0.74880%0.797SS**  trans65.1114.4149.5-146.60000121.3
142N54.6Low56.8Low143 Ų143146.9 Ų146.977%0.76579%0.791SS**  trans3398139.3-72.9-23.3000119.2
143Q50.1Low58.9Low187 Ų187142.3 Ų142.387%0.87479%0.788SS**  173.7138.9119.8-93171.777.200110.2
144L58.9Low61.3Low169 Ų169136.9 Ų136.989%0.88576%0.763SS**  trans-68.9143.6-168.3-47-153.1000110.7
145P57.8Low63.8Low125 Ų125134.8 Ų134.881%0.81275%0.746SS**  -156.2105.295.834.6-12.8000113.8
146S48.7Very low66.1Low89 Ų89132.9 Ų132.962%0.62274%0.744SS**  trans-164.3110.9154.4-161.90000108.5K148S146-K148 PolarHBondContact O-N 3.35Å
147S55.1Low68.5Low139 Ų139132.2 Ų132.297%0.97274%0.736SS**  trans-72.555.4169.8-162.90000110R149S147-R149 PolarHBondContact O-N 3.23Å
148K62.7Low70.9Confident169 Ų169127.4 Ų127.474%0.73571%0.705SS**  trans-84.7107.2171.4-133.6169.6-170.8167.90104.9S146 M150S146-K148 PolarHBondContact O-N 3.35Å; K148-M150 PolarHBondContact O-N 2.99Å
149R73.6Confident73.5Confident234 Ų234123.3 Ų123.388%0.88368%0.682SS**  trans-48.1110.4177.7-175.3-179.1-74.4153.7-2.3108.5S147 R151S147-R149 PolarHBondContact O-N 3.23Å; R149-R151 PolarHBondContact O-N 2.88Å
150M80.4Confident75.7Confident170 Ų170123.4 Ų123.484%0.83767%0.674SS**PPolyproline II helixtrans-57.7128-179.8-175.5148.35900108.4K148K148-M150 PolarHBondContact O-N 2.99Å
151R86.9Confident78.2Confident239 Ų239119.9 Ų119.990%0.90265%0.645SS**PPolyproline II helixtrans-76.8126.4177.4-67.7-174.7177.2-154.10.8107.8R149R149-R151 PolarHBondContact O-N 2.88Å
152T87.5Confident80.7Confident105 Ų105114.8 Ų114.864%0.64461%0.609SS**PPolyproline II helixtrans-85.3130.6168.447.60000109
153A94.4Very high82.8Confident94 Ų94112.3 Ų112.378%0.77759%0.593SS**PPolyproline II helixtrans-89.2146.3172.800000109.7
154F97.8Very high85.1Confident53 Ų53111.4 Ų111.423%0.23258%0.582CS.*PPolyproline II helixtrans-84.8148.7169.9-59.3-45.4000109.8Q158 L159 L186 Q190 W194F154-Q158 HydrophobicContact CB-CB 4.21Å; F154-L159 HydrophobicContact CB-CD2 3.98Å; F154-L159 HydrophobicContact CB-CG 4.15Å; F154-L159 HydrophobicContact CD2-CD2 4.17Å; F154-L186 HydrophobicContact CD1-CD1 4.09Å; F154-L186 HydrophobicContact CD1-CD2 3.74Å; F154-L186 HydrophobicContact CE1-CD1 4.02Å; F154-L186 HydrophobicContact CE1-CD2 3.68Å; F154-L186 HydrophobicContact CE1-CG 4.49Å; F154-Q190 HydrophobicContact CE1-CB 4.19Å; F154-Q190 HydrophobicContact CE1-CG 4.3Å; F154-Q190 HydrophobicContact CZ-CB 3.95Å; F154-Q190 HydrophobicContact CZ-CG 4.24Å; F154-W194 AromaticContact CD2-CD1 3.73Å; F154-W194 HydrophobicContact CE2-CB 4.3Å; F154-W194 AromaticContact CE2-CD1 3.64Å; F154-W194 HydrophobicContact CE2-CG 4.33Å
155T98.3Very high87Confident75 Ų75104.6 Ų104.646%0.4655%0.545SS..PPolyproline II helixtrans-70.1161.6175.571.90000110.7T157 Q158 L159T155-T157 VanDerWaalsContact C-N 3.33Å; T155-T157 PolarHBondContact O-N 3.05Å; T155-Q158 PolarHBondContact O-N 3.09Å; T155-Q158 VanDerWaalsContact OG1-CG 3.24Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.42Å; T155-Q158 PolarHBondContact OG1-N 2.91Å; T155-L159 WeakPolarHBondContact O-CG 3.14Å; T155-L159 PolarHBondContact O-N 3.04Å; T155-L159 VanDerWaalsContact O-N 3.1Å
156S97.8Very high88.9Confident88 Ų8899.1 Ų99.162%0.61551%0.509SS*.Hα-helixtrans-58.8-44.8177.4179.40000111.7Q158 L159 L160S156-Q158 VanDerWaalsContact C-N 3.35Å; S156-Q158 PolarHBondContact O-N 2.84Å; S156-L159 WeakPolarHBondContact O-CB 3.5Å; S156-L159 PolarHBondContact O-N 3.14Å; S156-L159 VanDerWaalsContact O-N 3.15Å; S156-L160 WeakPolarHBondContact O-CG 3.39Å; S156-L160 PolarHBondContact O-N 2.91Å
157T97.9Very high91.3Very high95 Ų9599.1 Ų99.158%0.58351%0.514SS*.Hα-helixtrans-59.2-43.1176.3-47.20000112.3T155 L159 L160 E161T155-T157 VanDerWaalsContact C-N 3.33Å; T155-T157 PolarHBondContact O-N 3.05Å; T157-L159 VanDerWaalsContact C-N 3.3Å; T157-L159 PolarHBondContact O-N 2.73Å; T157-L160 PolarHBondContact O-N 3.4Å; T157-E161 PolarHBondContact O-N 3.48Å; T157-E161 VanDerWaalsContact O-N 3.14Å
158Q98.4Very high93.3Very high30 Ų3097.3 Ų97.314%0.1450%0.502CS..Hα-helixtrans-60.5-40.8176.6-74.9172.4-23.500111.8F154 T155 S156 L162 L184F154-Q158 HydrophobicContact CB-CB 4.21Å; T155-Q158 PolarHBondContact O-N 3.09Å; T155-Q158 VanDerWaalsContact OG1-CG 3.24Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.42Å; T155-Q158 PolarHBondContact OG1-N 2.91Å; S156-Q158 VanDerWaalsContact C-N 3.35Å; S156-Q158 PolarHBondContact O-N 2.84Å; Q158-L162 WeakPolarHBondContact O-CB 3.45Å; Q158-L162 WeakPolarHBondContact O-CD1 3.35Å; Q158-L162 WeakPolarHBondContact O-CG 3.37Å; Q158-L162 PolarHBondContact O-N 3.38Å; Q158-L162 VanDerWaalsContact O-N 3.08Å; Q158-L184 HydrophobicContact CG-CB 4.36Å; Q158-L184 PolarHBondContact NE2-O 3.46Å
159L98.4Very high95Very high62 Ų6293.5 Ų93.533%0.32549%0.489SS..Hα-helixtrans-66.2-43.3178.4-66.2172.9000111.9F154 T155 S156 T157 E161 L162 E163F154-L159 HydrophobicContact CB-CD2 3.98Å; F154-L159 HydrophobicContact CB-CG 4.15Å; F154-L159 HydrophobicContact CD2-CD2 4.17Å; T155-L159 WeakPolarHBondContact O-CG 3.14Å; T155-L159 PolarHBondContact O-N 3.04Å; T155-L159 VanDerWaalsContact O-N 3.1Å; S156-L159 WeakPolarHBondContact O-CB 3.5Å; S156-L159 PolarHBondContact O-N 3.14Å; S156-L159 VanDerWaalsContact O-N 3.15Å; T157-L159 VanDerWaalsContact C-N 3.3Å; T157-L159 PolarHBondContact O-N 2.73Å; L159-E161 PolarHBondContact O-N 3.12Å; L159-L162 PolarHBondContact O-N 3.18Å; L159-E163 WeakPolarHBondContact O-CB 3.4Å; L159-E163 WeakPolarHBondContact O-CG 3.34Å; L159-E163 PolarHBondContact O-N 3.21Å
160L98.4Very high96.1Very high104 Ų10485.3 Ų85.355%0.54546%0.462SS..Hα-helixtrans-60.2-46.9179.2-71.4172.3000111.8S156 T157 E163 R164S156-L160 WeakPolarHBondContact O-CG 3.39Å; S156-L160 PolarHBondContact O-N 2.91Å; T157-L160 PolarHBondContact O-N 3.4Å; L160-E163 PolarHBondContact O-N 3.42Å; L160-R164 WeakPolarHBondContact O-CB 3.5Å; L160-R164 PolarHBondContact O-N 3.33Å
161E98.6Very high97Very high40 Ų4083.9 Ų83.919%0.18745%0.448CS..Hα-helixtrans-67.1-38.6178.2-67.8-59.5148.900112T157 L159 E163 R164 E165 Y183 L184T157-E161 PolarHBondContact O-N 3.48Å; T157-E161 VanDerWaalsContact O-N 3.14Å; L159-E161 PolarHBondContact O-N 3.12Å; E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 2.92Å; E161-R164 WeakPolarHBondContact O-CB 3.41Å; E161-R164 PolarHBondContact O-N 2.9Å; E161-R164 IonicContact OE2-NH1 3.6Å; E161-E165 WeakPolarHBondContact O-CG 3.42Å; E161-E165 PolarHBondContact O-N 2.89Å; E161-Y183 HydrophobicContact CG-CE1 4.06Å; E161-L184 HydrophobicContact CB-CD1 4.14Å; E161-L184 HydrophobicContact CB-CD2 3.65Å; E161-L184 HydrophobicContact CB-CG 4.49Å; E161-L184 HydrophobicContact CG-CD2 3.95Å
162L98.6Very high97.5Very high0 Ų073.9 Ų73.90%041%0.412CS..Hα-helixtrans-63.1-37.7173.8-72.2167.4000112.2Q158 L159 F166 I180 L184 L186 V191 W194 F195Q158-L162 WeakPolarHBondContact O-CB 3.45Å; Q158-L162 WeakPolarHBondContact O-CD1 3.35Å; Q158-L162 WeakPolarHBondContact O-CG 3.37Å; Q158-L162 PolarHBondContact O-N 3.38Å; Q158-L162 VanDerWaalsContact O-N 3.08Å; L159-L162 PolarHBondContact O-N 3.18Å; L162-F166 WeakPolarHBondContact O-CB 3.47Å; L162-F166 PolarHBondContact O-N 2.88Å; L162-I180 HydrophobicContact CD2-CG2 3.96Å; L162-L184 HydrophobicContact CD1-CD1 4.45Å; L162-L184 HydrophobicContact CD2-CD1 3.84Å; L162-L184 HydrophobicContact CG-CD1 3.69Å; L162-L186 HydrophobicContact CD1-CD1 4.24Å; L162-V191 HydrophobicContact CD2-CG1 4.18Å; L162-W194 VanDerWaalsContact C-CH2 3.49Å; L162-W194 HydrophobicContact CB-CD2 3.95Å; L162-W194 HydrophobicContact CB-CE3 3.87Å; L162-W194 HydrophobicContact CB-CH2 3.62Å; L162-W194 HydrophobicContact CB-CZ2 3.68Å; L162-W194 HydrophobicContact CB-CZ3 3.72Å; L162-W194 HydrophobicContact CD1-CB 4.5Å; L162-W194 HydrophobicContact CD1-CD2 3.84Å; L162-W194 HydrophobicContact CD1-CE3 4.43Å; L162-W194 HydrophobicContact CD1-CG 3.84Å; L162-W194 HydrophobicContact CD2-CD2 4.48Å; L162-W194 HydrophobicContact CD2-CE3 4.3Å; L162-W194 HydrophobicContact CG-CD2 4.31Å; L162-W194 HydrophobicContact CG-CE3 4.43Å; L162-W194 WeakPolarHBondContact O-CH2 3.49Å; L162-W194 WeakPolarHBondContact O-CZ3 3.42Å; L162-F195 HydrophobicContact CD2-CD2 4.5Å; L162-F195 HydrophobicContact CD2-CE2 3.93Å
163E98.5Very high98Very high92 Ų9272.2 Ų72.243%0.4341%0.405SS..Hα-helixtrans-69.2-41.3175.7-75.4-177.3174.800112.2L159 L160 E161 E165 F166 A167 W194L159-E163 WeakPolarHBondContact O-CB 3.4Å; L159-E163 WeakPolarHBondContact O-CG 3.34Å; L159-E163 PolarHBondContact O-N 3.21Å; L160-E163 PolarHBondContact O-N 3.42Å; E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 2.92Å; E163-E165 PolarHBondContact O-N 3.26Å; E163-F166 WeakPolarHBondContact O-CB 3.27Å; E163-F166 PolarHBondContact O-N 3.45Å; E163-A167 PolarHBondContact O-N 2.98Å; E163-W194 HydrophobicContact CG-CH2 3.84Å; E163-W194 HydrophobicContact CG-CZ2 3.9Å
164R98.4Very high98.2Very high167 Ų16774 Ų7463%0.6339%0.392SS*.Hα-helixtrans-57-49.3173.2-178.8-171.3-179.7-179.72111.3L160 E161 F166 A167 S168L160-R164 WeakPolarHBondContact O-CB 3.5Å; L160-R164 PolarHBondContact O-N 3.33Å; E161-R164 WeakPolarHBondContact O-CB 3.41Å; E161-R164 PolarHBondContact O-N 2.9Å; E161-R164 IonicContact OE2-NH1 3.6Å; R164-F166 VanDerWaalsContact C-N 3.33Å; R164-F166 PolarHBondContact O-N 3.07Å; R164-A167 PolarHBondContact O-N 2.9Å; R164-S168 PolarHBondContact O-N 3.45Å
165E98.4Very high98.2Very high26 Ų2677.3 Ų77.312%0.12141%0.411CS..Hα-helixtrans-63.4-39.1177.2-72.3-62.613500112.1E161 E163 A167 S168 N169 R176 I180 F195E161-E165 WeakPolarHBondContact O-CG 3.42Å; E161-E165 PolarHBondContact O-N 2.89Å; E163-E165 PolarHBondContact O-N 3.26Å; E165-A167 VanDerWaalsContact C-N 3.33Å; E165-A167 PolarHBondContact O-N 3.18Å; E165-S168 WeakPolarHBondContact O-CB 3.34Å; E165-S168 PolarHBondContact O-N 3.35Å; E165-N169 PolarHBondContact O-N 3.28Å; E165-R176 IonicContact OE1-CZ 2.9Å; E165-R176 IonicContact OE1-NH2 3.72Å; E165-R176 PolarHBondContact OE1-NH2 3.47Å; E165-R176 IonicContact OE2-CZ 3.78Å; E165-R176 VanDerWaalsContact OE2-CZ 3.27Å; E165-R176 IonicContact OE2-NE 3.29Å; E165-R176 PolarHBondContact OE2-NE 2.8Å; E165-R176 IonicContact OE2-NH2 3.03Å; E165-R176 PolarHBondContact OE2-NH2 3.27Å; E165-I180 HydrophobicContact CB-CD1 3.99Å; E165-I180 HydrophobicContact CG-CD1 3.68Å; E165-I180 HydrophobicContact CG-CG1 4.04Å; E165-F195 HydrophobicContact CB-CZ 3.98Å
166F98.6Very high98.2Very high11 Ų1178.1 Ų78.15%0.04841%0.406CS..Hα-helixtrans-64.2-37.2177.8-174.3-94.7000113.1L162 E163 R164 S168 N169 M170 W194 F195 R198 R199 H202L162-F166 WeakPolarHBondContact O-CB 3.47Å; L162-F166 PolarHBondContact O-N 2.88Å; E163-F166 WeakPolarHBondContact O-CB 3.27Å; E163-F166 PolarHBondContact O-N 3.45Å; R164-F166 VanDerWaalsContact C-N 3.33Å; R164-F166 PolarHBondContact O-N 3.07Å; F166-S168 VanDerWaalsContact C-N 3.34Å; F166-N169 CarbonylContact O-C 3.29Å; F166-N169 VanDerWaalsContact O-C 3.29Å; F166-M170 HydrophobicContact CD2-CB 4.45Å; F166-M170 HydrophobicContact CE1-CE 3.89Å; F166-M170 HydrophobicContact CE1-CG 4.02Å; F166-M170 HydrophobicContact CE2-CB 3.92Å; F166-M170 HydrophobicContact CE2-CE 4.35Å; F166-M170 HydrophobicContact CE2-CG 4.17Å; F166-M170 HydrophobicContact CZ-CB 4.04Å; F166-M170 HydrophobicContact CZ-CE 3.42Å; F166-M170 VanDerWaalsContact CZ-CE 3.42Å; F166-M170 HydrophobicContact CZ-CG 3.83Å; F166-M170 HydrophobicContact CZ-SD 4.47Å; F166-M170 PolarHBondContact O-N 2.76Å; F166-W194 HydrophobicContact CB-CH2 4.39Å; F166-W194 HydrophobicContact CB-CZ3 4.13Å; F166-W194 HydrophobicContact CD2-CZ3 4.46Å; F166-F195 HydrophobicContact CB-CE1 4.22Å; F166-F195 HydrophobicContact CB-CZ 4.35Å; F166-F195 AromaticContact CD2-CD1 3.91Å; F166-F195 HydrophobicContact CD2-CD1 3.91Å; F166-F195 AromaticContact CD2-CE1 3.91Å; F166-F195 HydrophobicContact CD2-CE1 3.91Å; F166-R198 HydrophobicContact CB-CG 4.5Å; F166-R198 HydrophobicContact CD1-CG 3.79Å; F166-R198 HydrophobicContact CD2-CB 4.09Å; F166-R198 HydrophobicContact CD2-CG 3.57Å; F166-R198 HydrophobicContact CE1-CG 3.79Å; F166-R198 HydrophobicContact CE2-CB 3.97Å; F166-R198 HydrophobicContact CE2-CG 3.57Å; F166-R198 HydrophobicContact CG-CG 3.67Å; F166-R198 HydrophobicContact CZ-CB 4.41Å; F166-R198 HydrophobicContact CZ-CG 3.67Å; F166-R199 HydrophobicContact CE2-CG 3.65Å; F166-R199 HydrophobicContact CZ-CG 4.07Å; F166-H202 HydrophobicContact CE1-CB 4.32Å; F166-H202 HydrophobicContact CZ-CB 4.16Å
167A97.9Very high98.3Very high89 Ų8976.4 Ų76.474%0.73639%0.386SS*.Hα-helixtrans-67.3-35.8176.100000112E163 R164 E165E163-A167 PolarHBondContact O-N 2.98Å; R164-A167 PolarHBondContact O-N 2.9Å; E165-A167 VanDerWaalsContact C-N 3.33Å; E165-A167 PolarHBondContact O-N 3.18Å
168S97.9Very high98.3Very high101 Ų10174.9 Ų74.971%0.70637%0.373SS*.Hα-helixtrans-68.2-49.2172.7170.70000111.8R164 E165 F166R164-S168 PolarHBondContact O-N 3.45Å; E165-S168 WeakPolarHBondContact O-CB 3.34Å; E165-S168 PolarHBondContact O-N 3.35Å; F166-S168 VanDerWaalsContact C-N 3.34Å
169N97.4Very high98.3Very high88 Ų8878.1 Ų78.147%0.47139%0.388SS..  trans-149.9119177.9-169.9-16.7000111.3E165 F166 Y171E165-N169 PolarHBondContact O-N 3.28Å; F166-N169 CarbonylContact O-C 3.29Å; F166-N169 VanDerWaalsContact O-C 3.29Å; N169-Y171 PolarHBondContact ND2-O 3.24Å; N169-Y171 VanDerWaalsContact ND2-O 3.15Å; N169-Y171 PolarHBondContact O-N 2.86Å; N169-Y171 VanDerWaalsContact O-N 3.08Å; N169-Y171 PolarHBondContact OD1-N 2.93Å; N169-Y171 PolarHBondContact OD1-O 2.91Å
170M97.5Very high98.3Very high62 Ų6275.5 Ų75.531%0.30538%0.375SS..SBendtrans-67.1-11.2179.7-60.1178.578.100113.7F166 R199 H202F166-M170 HydrophobicContact CD2-CB 4.45Å; F166-M170 HydrophobicContact CE1-CE 3.89Å; F166-M170 HydrophobicContact CE1-CG 4.02Å; F166-M170 HydrophobicContact CE2-CB 3.92Å; F166-M170 HydrophobicContact CE2-CE 4.35Å; F166-M170 HydrophobicContact CE2-CG 4.17Å; F166-M170 HydrophobicContact CZ-CB 4.04Å; F166-M170 HydrophobicContact CZ-CE 3.42Å; F166-M170 VanDerWaalsContact CZ-CE 3.42Å; F166-M170 HydrophobicContact CZ-CG 3.83Å; F166-M170 HydrophobicContact CZ-SD 4.47Å; F166-M170 PolarHBondContact O-N 2.76Å; M170-R199 WeakPolarHBondContact O-CD 3.48Å; M170-H202 HydrophobicContact CE-CB 4.15Å; M170-H202 VanDerWaalsContact CE-ND1 3.33Å; M170-H202 WeakPolarHBondContact CE-ND1 3.4Å
171Y98.3Very high98.3Very high140 Ų14070.8 Ų70.855%0.54935%0.351SS..SBendtrans-131.7129-177.8-65.1-97.8000111.4N169 R199N169-Y171 PolarHBondContact ND2-O 3.24Å; N169-Y171 VanDerWaalsContact ND2-O 3.15Å; N169-Y171 PolarHBondContact O-N 2.86Å; N169-Y171 VanDerWaalsContact O-N 3.08Å; N169-Y171 PolarHBondContact OD1-N 2.93Å; N169-Y171 PolarHBondContact OD1-O 2.91Å; Y171-R199 VanDerWaalsContact CZ-CD 3.49Å; Y171-R199 PolarHBondContact OH-NH1 3.15Å
172L98.3Very high98.3Very high29 Ų2973.7 Ų73.715%0.15237%0.371CS..  trans-94.3134.2179.7-61.4-179.8000112.6R176 R177 I180 V191 F195L172-R176 HydrophobicContact CD2-CG 3.9Å; L172-R177 HydrophobicContact CB-CB 4.37Å; L172-R177 HydrophobicContact CD1-CB 4.35Å; L172-R177 HydrophobicContact CD1-CG 4.46Å; L172-I180 HydrophobicContact CD1-CD1 3.88Å; L172-I180 HydrophobicContact CD2-CD1 3.62Å; L172-I180 HydrophobicContact CG-CD1 4.41Å; L172-V191 HydrophobicContact CD1-CG1 3.54Å; L172-F195 HydrophobicContact CD1-CD1 4.1Å; L172-F195 HydrophobicContact CD1-CD2 3.6Å; L172-F195 HydrophobicContact CD1-CE1 3.98Å; L172-F195 HydrophobicContact CD1-CE2 3.5Å; L172-F195 HydrophobicContact CD1-CG 3.92Å; L172-F195 HydrophobicContact CD1-CZ 3.7Å; L172-F195 HydrophobicContact CD2-CD1 4.36Å; L172-F195 HydrophobicContact CD2-CE1 3.66Å; L172-F195 HydrophobicContact CD2-CE2 4.34Å; L172-F195 HydrophobicContact CD2-CZ 3.66Å; L172-F195 HydrophobicContact CG-CD1 3.74Å; L172-F195 HydrophobicContact CG-CD2 4.19Å; L172-F195 HydrophobicContact CG-CE1 3.54Å; L172-F195 HydrophobicContact CG-CE2 4.04Å; L172-F195 HydrophobicContact CG-CG 4.06Å; L172-F195 HydrophobicContact CG-CZ 3.71Å
173S98.4Very high98.3Very high71 Ų7181 Ų8150%0.49740%0.4SS..  trans-68.2167.7162.6760000111.1R176 R177S173-R176 WeakPolarHBondContact OG-CB 3.49Å; S173-R176 PolarHBondContact OG-N 2.94Å; S173-R177 WeakPolarHBondContact O-CB 3.32Å; S173-R177 PolarHBondContact O-N 3.19Å; S173-R177 VanDerWaalsContact O-N 3.11Å
174R98.3Very high98.3Very high132 Ų13277.2 Ų77.250%0.49838%0.383SS..Hα-helixtrans-60.1-47.1178.3179.768.3-175.294.4-8.2111.5I178 E188R174-I178 VanDerWaalsContact NH1-CD1 3.27Å; R174-I178 WeakPolarHBondContact O-CG1 3.5Å; R174-I178 PolarHBondContact O-N 3.03Å; R174-E188 IonicContact CZ-OE1 3.27Å; R174-E188 VanDerWaalsContact CZ-OE1 3.29Å; R174-E188 IonicContact CZ-OE2 3.35Å; R174-E188 IonicContact NE-OE2 3.99Å; R174-E188 IonicContact NH1-OE1 3.8Å; R174-E188 PolarHBondContact NH1-OE1 3.08Å; R174-E188 IonicContact NH1-OE2 3.91Å; R174-E188 PolarHBondContact NH1-OE2 2.88Å; R174-E188 VanDerWaalsContact NH2-CD 3.3Å; R174-E188 IonicContact NH2-OE1 2.84Å; R174-E188 PolarHBondContact NH2-OE1 3.44Å; R174-E188 IonicContact NH2-OE2 2.91Å; R174-E188 PolarHBondContact NH2-OE2 3.39Å
175L98.4Very high98.3Very high121 Ų12176.3 Ų76.363%0.63439%0.39SS*.Hα-helixtrans-66.4-49-178.5-65.4178.4000111.1R177 I178 E179L175-R177 PolarHBondContact O-N 3.2Å; L175-I178 HydrophobicContact CD2-CD1 4.5Å; L175-I178 WeakPolarHBondContact O-CA 3.19Å; L175-I178 WeakPolarHBondContact O-CB 3.4Å; L175-I178 PolarHBondContact O-N 3.42Å; L175-E179 PolarHBondContact O-N 3.25Å; L175-E179 VanDerWaalsContact O-N 3.12Å
176R98.5Very high98.3Very high92 Ų9276.1 Ų76.135%0.34739%0.39SS..Hα-helixtrans-60-35.2-179.9-171.856176.2177-2.4112.5E165 L172 S173 I178 E179 I180E165-R176 IonicContact OE1-CZ 2.9Å; E165-R176 IonicContact OE1-NH2 3.72Å; E165-R176 PolarHBondContact OE1-NH2 3.47Å; E165-R176 IonicContact OE2-CZ 3.78Å; E165-R176 VanDerWaalsContact OE2-CZ 3.27Å; E165-R176 IonicContact OE2-NE 3.29Å; E165-R176 PolarHBondContact OE2-NE 2.8Å; E165-R176 IonicContact OE2-NH2 3.03Å; E165-R176 PolarHBondContact OE2-NH2 3.27Å; L172-R176 HydrophobicContact CD2-CG 3.9Å; S173-R176 WeakPolarHBondContact OG-CB 3.49Å; S173-R176 PolarHBondContact OG-N 2.94Å; R176-I178 VanDerWaalsContact C-N 3.34Å; R176-I178 PolarHBondContact O-N 2.93Å; R176-E179 WeakPolarHBondContact CD-OE2 3.15Å; R176-E179 IonicContact CZ-OE2 3.7Å; R176-E179 IonicContact NE-OE2 2.76Å; R176-E179 IonicContact NH1-OE2 2.65Å; R176-E179 PolarHBondContact NH1-OE2 3.11Å; R176-E179 PolarHBondContact O-N 3.48Å; R176-I180 HydrophobicContact CG-CD1 3.9Å; R176-I180 HydrophobicContact CG-CG1 4.49Å; R176-I180 WeakPolarHBondContact O-CG1 3.41Å; R176-I180 PolarHBondContact O-N 3.23Å; R176-I180 VanDerWaalsContact O-N 3.09Å
177R98.7Very high98.2Very high53 Ų5378.1 Ų78.120%0.241%0.406CS..Hα-helixtrans-62.7-38.6174-170.9-169.3-55.71687.5112.8L172 S173 L175 A181 E188 V191L172-R177 HydrophobicContact CB-CB 4.37Å; L172-R177 HydrophobicContact CD1-CB 4.35Å; L172-R177 HydrophobicContact CD1-CG 4.46Å; S173-R177 WeakPolarHBondContact O-CB 3.32Å; S173-R177 PolarHBondContact O-N 3.19Å; S173-R177 VanDerWaalsContact O-N 3.11Å; L175-R177 PolarHBondContact O-N 3.2Å; R177-A181 WeakPolarHBondContact O-CB 3.31Å; R177-A181 PolarHBondContact O-N 2.91Å; R177-E188 WeakPolarHBondContact CD-O 3.38Å; R177-E188 HydrophobicContact CG-CB 4.2Å; R177-V191 HydrophobicContact CG-CB 4.34Å; R177-V191 HydrophobicContact CG-CG1 4.23Å
178I98.6Very high98.3Very high62 Ų6276.8 Ų76.832%0.31838%0.384SS..Hα-helixtrans-64.4-48.9177.1-60.4168.6000109.2R174 L175 R176 I180 A181 T182R174-I178 VanDerWaalsContact NH1-CD1 3.27Å; R174-I178 WeakPolarHBondContact O-CG1 3.5Å; R174-I178 PolarHBondContact O-N 3.03Å; L175-I178 HydrophobicContact CD2-CD1 4.5Å; L175-I178 WeakPolarHBondContact O-CA 3.19Å; L175-I178 WeakPolarHBondContact O-CB 3.4Å; L175-I178 PolarHBondContact O-N 3.42Å; R176-I178 VanDerWaalsContact C-N 3.34Å; R176-I178 PolarHBondContact O-N 2.93Å; I178-I180 PolarHBondContact O-N 2.7Å; I178-A181 PolarHBondContact O-N 3.19Å; I178-T182 PolarHBondContact O-N 3.15Å; I178-T182 PolarHBondContact O-OG1 3.12Å; I178-T182 VanDerWaalsContact O-OG1 3.06Å
179E98.6Very high98.3Very high98 Ų9879.1 Ų79.146%0.45838%0.382SS..Hα-helixtrans-56.2-50.7-178.9-67167.8-173.100111.7L175 R176 A181 T182 Y183L175-E179 PolarHBondContact O-N 3.25Å; L175-E179 VanDerWaalsContact O-N 3.12Å; R176-E179 WeakPolarHBondContact CD-OE2 3.15Å; R176-E179 IonicContact CZ-OE2 3.7Å; R176-E179 IonicContact NE-OE2 2.76Å; R176-E179 IonicContact NH1-OE2 2.65Å; R176-E179 PolarHBondContact NH1-OE2 3.11Å; R176-E179 PolarHBondContact O-N 3.48Å; E179-A181 PolarHBondContact O-N 2.77Å; E179-T182 PolarHBondContact O-N 3.25Å; E179-Y183 VanDerWaalsContact O-CB 3.27Å; E179-Y183 WeakPolarHBondContact O-CB 3.41Å; E179-Y183 PolarHBondContact O-N 2.96Å
180I98.5Very high98.3Very high7 Ų777.7 Ų77.74%0.03637%0.372CS..Hα-helixtrans-64.2-42179.2-64.3166.7000111.1L162 E165 L172 R176 I178 Y183 L184 V191L162-I180 HydrophobicContact CD2-CG2 3.96Å; E165-I180 HydrophobicContact CB-CD1 3.99Å; E165-I180 HydrophobicContact CG-CD1 3.68Å; E165-I180 HydrophobicContact CG-CG1 4.04Å; L172-I180 HydrophobicContact CD1-CD1 3.88Å; L172-I180 HydrophobicContact CD2-CD1 3.62Å; L172-I180 HydrophobicContact CG-CD1 4.41Å; R176-I180 HydrophobicContact CG-CD1 3.9Å; R176-I180 HydrophobicContact CG-CG1 4.49Å; R176-I180 WeakPolarHBondContact O-CG1 3.41Å; R176-I180 PolarHBondContact O-N 3.23Å; R176-I180 VanDerWaalsContact O-N 3.09Å; I178-I180 PolarHBondContact O-N 2.7Å; I180-Y183 PolarHBondContact O-N 3.43Å; I180-L184 HydrophobicContact CG2-CD1 3.73Å; I180-L184 HydrophobicContact CG2-CG 4.3Å; I180-L184 WeakPolarHBondContact O-CB 3.39Å; I180-L184 WeakPolarHBondContact O-CG 3.32Å; I180-L184 PolarHBondContact O-N 3.48Å; I180-V191 HydrophobicContact CG2-CG1 4.03Å; I180-V191 HydrophobicContact CG2-CG2 4.29Å
181A98.6Very high98.4Very high5 Ų574.7 Ų74.74%0.04136%0.357CS..Hα-helixtrans-60.5-47.4179.400000111.3R177 I178 E179 N185 L186 E188 V191R177-A181 WeakPolarHBondContact O-CB 3.31Å; R177-A181 PolarHBondContact O-N 2.91Å; I178-A181 PolarHBondContact O-N 3.19Å; E179-A181 PolarHBondContact O-N 2.77Å; A181-N185 PolarHBondContact O-N 3.3Å; A181-N185 VanDerWaalsContact O-N 3.13Å; A181-L186 CarbonylContact C-O 3.42Å; A181-L186 WeakPolarHBondContact CA-O 2.99Å; A181-L186 VanDerWaalsContact CB-O 3.31Å; A181-L186 WeakPolarHBondContact CB-O 3.49Å; A181-L186 PolarHBondContact O-N 2.99Å; A181-E188 HydrophobicContact CB-CG 4.1Å; A181-V191 HydrophobicContact CB-CG2 4.06Å
182T98.5Very high98.4Very high101 Ų10173.4 Ų73.462%0.6236%0.355SS*.Hα-helixtrans-64.6-46.2177.2-56.30000111.4I178 E179 L184 N185I178-T182 PolarHBondContact O-N 3.15Å; I178-T182 PolarHBondContact O-OG1 3.12Å; I178-T182 VanDerWaalsContact O-OG1 3.06Å; E179-T182 PolarHBondContact O-N 3.25Å; T182-L184 VanDerWaalsContact C-N 3.34Å; T182-L184 PolarHBondContact O-N 3.28Å; T182-N185 PolarHBondContact O-N 2.93Å
183Y98.3Very high98.4Very high154 Ų15475.6 Ų75.660%0.60437%0.366SS*.Hα-helixtrans-61.9-38.4-178.6179.2-113.1000113.1E161 E179 I180E161-Y183 HydrophobicContact CG-CE1 4.06Å; E179-Y183 VanDerWaalsContact O-CB 3.27Å; E179-Y183 WeakPolarHBondContact O-CB 3.41Å; E179-Y183 PolarHBondContact O-N 2.96Å; I180-Y183 PolarHBondContact O-N 3.43Å
184L98.1Very high98.3Very high13 Ų1373.6 Ų73.67%0.06835%0.347CS..THydrogen-bonded Turntrans-95.33.1-177.4-60.2-177.4000114.1Q158 E161 L162 I180 T182 L186Q158-L184 HydrophobicContact CG-CB 4.36Å; Q158-L184 PolarHBondContact NE2-O 3.46Å; E161-L184 HydrophobicContact CB-CD1 4.14Å; E161-L184 HydrophobicContact CB-CD2 3.65Å; E161-L184 HydrophobicContact CB-CG 4.49Å; E161-L184 HydrophobicContact CG-CD2 3.95Å; L162-L184 HydrophobicContact CD1-CD1 4.45Å; L162-L184 HydrophobicContact CD2-CD1 3.84Å; L162-L184 HydrophobicContact CG-CD1 3.69Å; I180-L184 HydrophobicContact CG2-CD1 3.73Å; I180-L184 HydrophobicContact CG2-CG 4.3Å; I180-L184 WeakPolarHBondContact O-CB 3.39Å; I180-L184 WeakPolarHBondContact O-CG 3.32Å; I180-L184 PolarHBondContact O-N 3.48Å; T182-L184 VanDerWaalsContact C-N 3.34Å; T182-L184 PolarHBondContact O-N 3.28Å; L184-L186 VanDerWaalsContact C-N 3.26Å; L184-L186 HydrophobicContact CB-CD1 4.2Å; L184-L186 HydrophobicContact CB-CG 4.11Å; L184-L186 PolarHBondContact O-N 3.11Å
185N98.3Very high98.4Very high148 Ų14867.7 Ų67.779%0.79133%0.325SS*.THydrogen-bonded Turntrans51.843-172.1-5999.8000112.9A181 T182A181-N185 PolarHBondContact O-N 3.3Å; A181-N185 VanDerWaalsContact O-N 3.13Å; T182-N185 PolarHBondContact O-N 2.93Å
186L97.9Very high98.4Very high21 Ų2166.9 Ų66.911%0.1132%0.318CS..  trans-113.2156.3175.7-64.5-179000110.3F154 L162 A181 L184 Q190 V191F154-L186 HydrophobicContact CD1-CD1 4.09Å; F154-L186 HydrophobicContact CD1-CD2 3.74Å; F154-L186 HydrophobicContact CE1-CD1 4.02Å; F154-L186 HydrophobicContact CE1-CD2 3.68Å; F154-L186 HydrophobicContact CE1-CG 4.49Å; L162-L186 HydrophobicContact CD1-CD1 4.24Å; A181-L186 CarbonylContact C-O 3.42Å; A181-L186 WeakPolarHBondContact CA-O 2.99Å; A181-L186 VanDerWaalsContact CB-O 3.31Å; A181-L186 WeakPolarHBondContact CB-O 3.49Å; A181-L186 PolarHBondContact O-N 2.99Å; L184-L186 VanDerWaalsContact C-N 3.26Å; L184-L186 HydrophobicContact CB-CD1 4.2Å; L184-L186 HydrophobicContact CB-CG 4.11Å; L184-L186 PolarHBondContact O-N 3.11Å; L186-Q190 HydrophobicContact CB-CB 4.43Å; L186-V191 HydrophobicContact CB-CG2 4.08Å; L186-V191 HydrophobicContact CD1-CG2 4.43Å
187S98.4Very high98.3Very high54 Ų5467.4 Ų67.438%0.37833%0.328SS..  trans-72147.4167.266.10000110.6K189 Q190 V191S187-K189 PolarHBondContact O-N 3.36Å; S187-Q190 WeakPolarHBondContact O-CB 3.47Å; S187-Q190 PolarHBondContact O-N 3.38Å; S187-Q190 VanDerWaalsContact OG-CG 3.29Å; S187-Q190 WeakPolarHBondContact OG-CG 3.33Å; S187-Q190 PolarHBondContact OG-N 3.02Å; S187-Q190 PolarHBondContact OG-OE1 3.13Å; S187-V191 PolarHBondContact O-N 3.39Å; S187-V191 VanDerWaalsContact O-N 3.14Å
188E98.4Very high98.3Very high61 Ų6167.1 Ų67.129%0.28533%0.327SS..Hα-helixtrans-53.2-33173.3-62.2-176.5-160.500113R174 R177 A181 V191 K192R174-E188 IonicContact CZ-OE1 3.27Å; R174-E188 VanDerWaalsContact CZ-OE1 3.29Å; R174-E188 IonicContact CZ-OE2 3.35Å; R174-E188 IonicContact NE-OE2 3.99Å; R174-E188 IonicContact NH1-OE1 3.8Å; R174-E188 PolarHBondContact NH1-OE1 3.08Å; R174-E188 IonicContact NH1-OE2 3.91Å; R174-E188 PolarHBondContact NH1-OE2 2.88Å; R174-E188 VanDerWaalsContact NH2-CD 3.3Å; R174-E188 IonicContact NH2-OE1 2.84Å; R174-E188 PolarHBondContact NH2-OE1 3.44Å; R174-E188 IonicContact NH2-OE2 2.91Å; R174-E188 PolarHBondContact NH2-OE2 3.39Å; R177-E188 WeakPolarHBondContact CD-O 3.38Å; R177-E188 HydrophobicContact CG-CB 4.2Å; A181-E188 HydrophobicContact CB-CG 4.1Å; E188-V191 PolarHBondContact O-N 3.02Å; E188-K192 VanDerWaalsContact O-CB 3.3Å; E188-K192 WeakPolarHBondContact O-CB 3.4Å; E188-K192 PolarHBondContact O-N 3.24Å
189K98.1Very high98.3Very high150 Ų15068 Ų6865%0.65233%0.326SS*.Hα-helixtrans-63.9-43.3176.3-178.9180175.9-179.70111.2S187 K192 I193S187-K189 PolarHBondContact O-N 3.36Å; K189-K192 PolarHBondContact O-N 3.07Å; K189-I193 HydrophobicContact CG-CD1 3.88Å; K189-I193 WeakPolarHBondContact O-CB 3.39Å; K189-I193 VanDerWaalsContact O-CG1 3.25Å; K189-I193 WeakPolarHBondContact O-CG1 3.36Å; K189-I193 PolarHBondContact O-N 3.46Å
190Q98.1Very high98.2Very high57 Ų5767.7 Ų67.727%0.26633%0.33SS..Hα-helixtrans-63-46.3176.6-77.4163.2-60.100111F154 L186 S187 K192 I193 W194F154-Q190 HydrophobicContact CE1-CB 4.19Å; F154-Q190 HydrophobicContact CE1-CG 4.3Å; F154-Q190 HydrophobicContact CZ-CB 3.95Å; F154-Q190 HydrophobicContact CZ-CG 4.24Å; L186-Q190 HydrophobicContact CB-CB 4.43Å; S187-Q190 WeakPolarHBondContact O-CB 3.47Å; S187-Q190 PolarHBondContact O-N 3.38Å; S187-Q190 VanDerWaalsContact OG-CG 3.29Å; S187-Q190 WeakPolarHBondContact OG-CG 3.33Å; S187-Q190 PolarHBondContact OG-N 3.02Å; S187-Q190 PolarHBondContact OG-OE1 3.13Å; Q190-K192 VanDerWaalsContact C-N 3.34Å; Q190-K192 PolarHBondContact O-N 3.48Å; Q190-I193 PolarHBondContact O-N 3.06Å; Q190-W194 WeakPolarHBondContact O-CB 3.43Å; Q190-W194 PolarHBondContact O-N 3.38Å
191V98.4Very high98.1Very high0 Ų072.7 Ų72.70%035%0.352CS..Hα-helixtrans-59.4-46.1175.8-178.90000110.6L162 L172 R177 I180 A181 L186 S187 E188 I193 W194 F195L162-V191 HydrophobicContact CD2-CG1 4.18Å; L172-V191 HydrophobicContact CD1-CG1 3.54Å; R177-V191 HydrophobicContact CG-CB 4.34Å; R177-V191 HydrophobicContact CG-CG1 4.23Å; I180-V191 HydrophobicContact CG2-CG1 4.03Å; I180-V191 HydrophobicContact CG2-CG2 4.29Å; A181-V191 HydrophobicContact CB-CG2 4.06Å; L186-V191 HydrophobicContact CB-CG2 4.08Å; L186-V191 HydrophobicContact CD1-CG2 4.43Å; S187-V191 PolarHBondContact O-N 3.39Å; S187-V191 VanDerWaalsContact O-N 3.14Å; E188-V191 PolarHBondContact O-N 3.02Å; V191-I193 PolarHBondContact O-N 3.28Å; V191-W194 PolarHBondContact O-N 3.29Å; V191-F195 HydrophobicContact CG1-CD2 4Å; V191-F195 HydrophobicContact CG1-CE2 4.14Å; V191-F195 WeakPolarHBondContact O-CD2 3.41Å; V191-F195 PolarHBondContact O-N 3.42Å
192K98.2Very high98Very high113 Ų11376.5 Ų76.549%0.49137%0.369SS..Hα-helixtrans-57.8-46.9176.4-176.5-173.7178.9-178.50112.2E188 K189 Q190 Q196E188-K192 VanDerWaalsContact O-CB 3.3Å; E188-K192 WeakPolarHBondContact O-CB 3.4Å; E188-K192 PolarHBondContact O-N 3.24Å; K189-K192 PolarHBondContact O-N 3.07Å; Q190-K192 VanDerWaalsContact C-N 3.34Å; Q190-K192 PolarHBondContact O-N 3.48Å; K192-Q196 WeakPolarHBondContact O-CB 3.49Å; K192-Q196 PolarHBondContact O-N 2.98Å
193I98.2Very high97.8Very high75 Ų7579 Ų7939%0.38537%0.371SS..Hα-helixtrans-65.4-43.1179.7-70.3167.2000110.4K189 Q190 V191 Q196 N197K189-I193 HydrophobicContact CG-CD1 3.88Å; K189-I193 WeakPolarHBondContact O-CB 3.39Å; K189-I193 VanDerWaalsContact O-CG1 3.25Å; K189-I193 WeakPolarHBondContact O-CG1 3.36Å; K189-I193 PolarHBondContact O-N 3.46Å; Q190-I193 PolarHBondContact O-N 3.06Å; V191-I193 PolarHBondContact O-N 3.28Å; I193-Q196 PolarHBondContact O-N 3.37Å; I193-N197 PolarHBondContact O-N 3.36Å
194W98.3Very high97.6Very high29 Ų2979.8 Ų79.811%0.1138%0.378CS..Hα-helixtrans-60.5-47.9178.6-171.599.3000111.2F154 L162 E163 F166 Q190 V191 Q196 N197 R198F154-W194 AromaticContact CD2-CD1 3.73Å; F154-W194 HydrophobicContact CE2-CB 4.3Å; F154-W194 AromaticContact CE2-CD1 3.64Å; F154-W194 HydrophobicContact CE2-CG 4.33Å; L162-W194 VanDerWaalsContact C-CH2 3.49Å; L162-W194 HydrophobicContact CB-CD2 3.95Å; L162-W194 HydrophobicContact CB-CE3 3.87Å; L162-W194 HydrophobicContact CB-CH2 3.62Å; L162-W194 HydrophobicContact CB-CZ2 3.68Å; L162-W194 HydrophobicContact CB-CZ3 3.72Å; L162-W194 HydrophobicContact CD1-CB 4.5Å; L162-W194 HydrophobicContact CD1-CD2 3.84Å; L162-W194 HydrophobicContact CD1-CE3 4.43Å; L162-W194 HydrophobicContact CD1-CG 3.84Å; L162-W194 HydrophobicContact CD2-CD2 4.48Å; L162-W194 HydrophobicContact CD2-CE3 4.3Å; L162-W194 HydrophobicContact CG-CD2 4.31Å; L162-W194 HydrophobicContact CG-CE3 4.43Å; L162-W194 WeakPolarHBondContact O-CH2 3.49Å; L162-W194 WeakPolarHBondContact O-CZ3 3.42Å; E163-W194 HydrophobicContact CG-CH2 3.84Å; E163-W194 HydrophobicContact CG-CZ2 3.9Å; F166-W194 HydrophobicContact CB-CH2 4.39Å; F166-W194 HydrophobicContact CB-CZ3 4.13Å; F166-W194 HydrophobicContact CD2-CZ3 4.46Å; Q190-W194 WeakPolarHBondContact O-CB 3.43Å; Q190-W194 PolarHBondContact O-N 3.38Å; V191-W194 PolarHBondContact O-N 3.29Å; W194-Q196 VanDerWaalsContact C-N 3.3Å; W194-Q196 PolarHBondContact O-N 2.98Å; W194-N197 PolarHBondContact O-N 3.45Å; W194-R198 HydrophobicContact CE3-CB 4.02Å; W194-R198 HydrophobicContact CH2-CB 4.06Å; W194-R198 HydrophobicContact CH2-CG 3.8Å; W194-R198 HydrophobicContact CZ3-CB 3.75Å; W194-R198 HydrophobicContact CZ3-CG 3.84Å; W194-R198 WeakPolarHBondContact O-CB 3.43Å; W194-R198 PolarHBondContact O-N 3.03Å
195F98.7Very high97.2Very high8 Ų883 Ų834%0.03539%0.392CS..Hα-helixtrans-62.1-36.2176.6-91.9-104.2000112.6L162 E165 F166 L172 V191 R199L162-F195 HydrophobicContact CD2-CD2 4.5Å; L162-F195 HydrophobicContact CD2-CE2 3.93Å; E165-F195 HydrophobicContact CB-CZ 3.98Å; F166-F195 HydrophobicContact CB-CE1 4.22Å; F166-F195 HydrophobicContact CB-CZ 4.35Å; F166-F195 AromaticContact CD2-CD1 3.91Å; F166-F195 HydrophobicContact CD2-CD1 3.91Å; F166-F195 AromaticContact CD2-CE1 3.91Å; F166-F195 HydrophobicContact CD2-CE1 3.91Å; L172-F195 HydrophobicContact CD1-CD1 4.1Å; L172-F195 HydrophobicContact CD1-CD2 3.6Å; L172-F195 HydrophobicContact CD1-CE1 3.98Å; L172-F195 HydrophobicContact CD1-CE2 3.5Å; L172-F195 HydrophobicContact CD1-CG 3.92Å; L172-F195 HydrophobicContact CD1-CZ 3.7Å; L172-F195 HydrophobicContact CD2-CD1 4.36Å; L172-F195 HydrophobicContact CD2-CE1 3.66Å; L172-F195 HydrophobicContact CD2-CE2 4.34Å; L172-F195 HydrophobicContact CD2-CZ 3.66Å; L172-F195 HydrophobicContact CG-CD1 3.74Å; L172-F195 HydrophobicContact CG-CD2 4.19Å; L172-F195 HydrophobicContact CG-CE1 3.54Å; L172-F195 HydrophobicContact CG-CE2 4.04Å; L172-F195 HydrophobicContact CG-CG 4.06Å; L172-F195 HydrophobicContact CG-CZ 3.71Å; V191-F195 HydrophobicContact CG1-CD2 4Å; V191-F195 HydrophobicContact CG1-CE2 4.14Å; V191-F195 WeakPolarHBondContact O-CD2 3.41Å; V191-F195 PolarHBondContact O-N 3.42Å; F195-R199 WeakPolarHBondContact O-CG 3.29Å; F195-R199 PolarHBondContact O-N 3.4Å
196Q98.6Very high96.2Very high104 Ų10478.9 Ų78.949%0.48639%0.385SS..Hα-helixtrans-64.5-46.6174.8-171.1165.321.900111.5K192 I193 W194 V200K192-Q196 WeakPolarHBondContact O-CB 3.49Å; K192-Q196 PolarHBondContact O-N 2.98Å; I193-Q196 PolarHBondContact O-N 3.37Å; W194-Q196 VanDerWaalsContact C-N 3.3Å; W194-Q196 PolarHBondContact O-N 2.98Å; Q196-V200 WeakPolarHBondContact O-CG2 3.42Å; Q196-V200 PolarHBondContact O-N 3.44Å
197N97.9Very high94.6Very high103 Ų10387 Ų8755%0.55142%0.419SS*.Hα-helixtrans-63.8-42176.6-68.9-17.9000111.6I193 W194 R199 V200 K201I193-N197 PolarHBondContact O-N 3.36Å; W194-N197 PolarHBondContact O-N 3.45Å; N197-R199 PolarHBondContact O-N 3.39Å; N197-V200 PolarHBondContact O-N 2.97Å; N197-K201 PolarHBondContact O-N 3.17Å
198R98.1Very high92.7Very high47 Ų4786.6 Ų86.618%0.17742%0.424CS..Hα-helixtrans-63-42.5-179.6-174.763.8-170.7112.7-9.4112F166 W194 V200 K201 H202 E205F166-R198 HydrophobicContact CB-CG 4.5Å; F166-R198 HydrophobicContact CD1-CG 3.79Å; F166-R198 HydrophobicContact CD2-CB 4.09Å; F166-R198 HydrophobicContact CD2-CG 3.57Å; F166-R198 HydrophobicContact CE1-CG 3.79Å; F166-R198 HydrophobicContact CE2-CB 3.97Å; F166-R198 HydrophobicContact CE2-CG 3.57Å; F166-R198 HydrophobicContact CG-CG 3.67Å; F166-R198 HydrophobicContact CZ-CB 4.41Å; F166-R198 HydrophobicContact CZ-CG 3.67Å; W194-R198 HydrophobicContact CE3-CB 4.02Å; W194-R198 HydrophobicContact CH2-CB 4.06Å; W194-R198 HydrophobicContact CH2-CG 3.8Å; W194-R198 HydrophobicContact CZ3-CB 3.75Å; W194-R198 HydrophobicContact CZ3-CG 3.84Å; W194-R198 WeakPolarHBondContact O-CB 3.43Å; W194-R198 PolarHBondContact O-N 3.03Å; R198-V200 PolarHBondContact O-N 3.31Å; R198-K201 WeakPolarHBondContact O-CB 3.5Å; R198-K201 PolarHBondContact O-N 2.97Å; R198-H202 WeakPolarHBondContact O-CB 3.45Å; R198-H202 PolarHBondContact O-N 2.95Å; R198-E205 IonicContact CZ-OE2 3.03Å; R198-E205 IonicContact NH1-OE1 2.91Å; R198-E205 IonicContact NH1-OE2 2.77Å; R198-E205 PolarHBondContact NH1-OE2 3.48Å; R198-E205 IonicContact NH2-OE2 2.7Å
199R97.7Very high90.6Very high80 Ų8088 Ų8830%0.30244%0.44SS..Hα-helixtrans-61.6-39.9174.6-73.5-172.3-70.5137.4-3.4112.9F166 M170 Y171 F195 N197 H202 K203F166-R199 HydrophobicContact CE2-CG 3.65Å; F166-R199 HydrophobicContact CZ-CG 4.07Å; M170-R199 WeakPolarHBondContact O-CD 3.48Å; Y171-R199 VanDerWaalsContact CZ-CD 3.49Å; Y171-R199 PolarHBondContact OH-NH1 3.15Å; F195-R199 WeakPolarHBondContact O-CG 3.29Å; F195-R199 PolarHBondContact O-N 3.4Å; N197-R199 PolarHBondContact O-N 3.39Å; R199-H202 PolarHBondContact O-N 3.43Å; R199-K203 WeakPolarHBondContact O-CB 3.48Å; R199-K203 PolarHBondContact O-N 3.01Å
200V97.6Very high88.4Confident91 Ų9188.6 Ų88.655%0.55245%0.451SS*.Hα-helixtrans-63.2-44.9175.9174.20000110.7Q196 N197 R198 K203 K204Q196-V200 WeakPolarHBondContact O-CG2 3.42Å; Q196-V200 PolarHBondContact O-N 3.44Å; N197-V200 PolarHBondContact O-N 2.97Å; R198-V200 PolarHBondContact O-N 3.31Å; V200-K203 PolarHBondContact O-N 2.96Å; V200-K204 PolarHBondContact O-N 2.84Å; V200-K204 VanDerWaalsContact O-N 3.13Å
201K96Very high86.3Confident112 Ų11293.7 Ų93.749%0.48747%0.474SS..Hα-helixtrans-59.9-48.8176.1-166.4-168.1179.9-150.80111.3N197 R198 K203 K204 E205N197-K201 PolarHBondContact O-N 3.17Å; R198-K201 WeakPolarHBondContact O-CB 3.5Å; R198-K201 PolarHBondContact O-N 2.97Å; K201-K203 VanDerWaalsContact C-N 3.33Å; K201-K203 PolarHBondContact O-N 3.37Å; K201-K204 WeakPolarHBondContact O-CA 3.25Å; K201-K204 WeakPolarHBondContact O-CB 3.3Å; K201-K204 PolarHBondContact O-N 3.04Å; K201-E205 WeakPolarHBondContact CD-OE1 3.31Å; K201-E205 WeakPolarHBondContact CE-OE1 3.49Å; K201-E205 HydrophobicContact CG-CG 4.49Å; K201-E205 WeakPolarHBondContact CG-OE1 3.47Å; K201-E205 IonicContact NZ-OE1 3.72Å; K201-E205 PolarHBondContact NZ-OE1 3.14Å; K201-E205 WeakPolarHBondContact O-CG 3.46Å; K201-E205 PolarHBondContact O-N 3.21Å
202H95.5Very high83.8Confident85 Ų85104.6 Ų104.639%0.39452%0.516SS..Hα-helixtrans-58.2-42.6178-174.5-84.6000112.7F166 M170 R198 R199 K204 E205 G206F166-H202 HydrophobicContact CE1-CB 4.32Å; F166-H202 HydrophobicContact CZ-CB 4.16Å; M170-H202 HydrophobicContact CE-CB 4.15Å; M170-H202 VanDerWaalsContact CE-ND1 3.33Å; M170-H202 WeakPolarHBondContact CE-ND1 3.4Å; R198-H202 WeakPolarHBondContact O-CB 3.45Å; R198-H202 PolarHBondContact O-N 2.95Å; R199-H202 PolarHBondContact O-N 3.43Å; H202-K204 VanDerWaalsContact C-N 3.29Å; H202-K204 PolarHBondContact O-N 3.45Å; H202-E205 WeakPolarHBondContact CA-OE2 3.5Å; H202-E205 PolarHBondContact O-N 3.42Å; H202-G206 PolarHBondContact O-N 3.3Å; H202-G206 VanDerWaalsContact O-N 3.11Å
203K95.3Very high81.2Confident154 Ų154103.1 Ų103.167%0.6753%0.532SS*.Hα-helixtrans-62.9-35.3175.6-172.417769.2172.40112.5R199 V200 K201R199-K203 WeakPolarHBondContact O-CB 3.48Å; R199-K203 PolarHBondContact O-N 3.01Å; V200-K203 PolarHBondContact O-N 2.96Å; K201-K203 VanDerWaalsContact C-N 3.33Å; K201-K203 PolarHBondContact O-N 3.37Å
204K93.4Very high78.6Confident171 Ų171103.2 Ų103.274%0.74355%0.551SS**Hα-helixtrans-72.2-38.9177.2-172178.9177.4-177.20111.4V200 K201 H202 K207V200-K204 PolarHBondContact O-N 2.84Å; V200-K204 VanDerWaalsContact O-N 3.13Å; K201-K204 WeakPolarHBondContact O-CA 3.25Å; K201-K204 WeakPolarHBondContact O-CB 3.3Å; K201-K204 PolarHBondContact O-N 3.04Å; H202-K204 VanDerWaalsContact C-N 3.29Å; H202-K204 PolarHBondContact O-N 3.45Å; K204-K207 PolarHBondContact O-N 3.17Å
205E89.8Confident76Confident80 Ų80105.8 Ų105.837%0.37459%0.587SS.*Hα-helixtrans-61.7-45.2177.9-70.3163.8166.200111.2R198 K201 H202 K207 G208R198-E205 IonicContact CZ-OE2 3.03Å; R198-E205 IonicContact NH1-OE1 2.91Å; R198-E205 IonicContact NH1-OE2 2.77Å; R198-E205 PolarHBondContact NH1-OE2 3.48Å; R198-E205 IonicContact NH2-OE2 2.7Å; K201-E205 WeakPolarHBondContact CD-OE1 3.31Å; K201-E205 WeakPolarHBondContact CE-OE1 3.49Å; K201-E205 HydrophobicContact CG-CG 4.49Å; K201-E205 WeakPolarHBondContact CG-OE1 3.47Å; K201-E205 IonicContact NZ-OE1 3.72Å; K201-E205 PolarHBondContact NZ-OE1 3.14Å; K201-E205 WeakPolarHBondContact O-CG 3.46Å; K201-E205 PolarHBondContact O-N 3.21Å; H202-E205 WeakPolarHBondContact CA-OE2 3.5Å; H202-E205 PolarHBondContact O-N 3.42Å; E205-K207 VanDerWaalsContact C-N 3.32Å; E205-K207 PolarHBondContact O-N 3.11Å; E205-G208 PolarHBondContact O-N 3.34Å
206G78.2Confident73.3Confident62 Ų62109.3 Ų109.364%0.63963%0.626SS**Hα-helixtrans-70-17.2-178.800000116.3H202H202-G206 PolarHBondContact O-N 3.3Å; H202-G206 VanDerWaalsContact O-N 3.11Å
207K64Low70.5Confident190 Ų190108.3 Ų108.383%0.82664%0.643SS**Hα-helixtrans-92-14.7-178.3-135.692.2165.8178.90113.6K204 E205K204-K207 PolarHBondContact O-N 3.17Å; E205-K207 VanDerWaalsContact C-N 3.32Å; E205-K207 PolarHBondContact O-N 3.11Å
208G58Low67.6Low47 Ų47107 Ų10749%0.48566%0.655SS.*Hα-helixtrans-111.1-4.2-178.400000114.4E205 N210 H211E205-G208 PolarHBondContact O-N 3.34Å; G208-N210 VanDerWaalsContact C-N 3.27Å; G208-N210 PolarHBondContact O-N 3.28Å; G208-H211 PolarHBondContact O-N 2.99Å; G208-H211 VanDerWaalsContact O-N 3.15Å
209S53.9Low64.8Low89 Ų89109.8 Ų109.862%0.62269%0.688SS**G310 helixtrans-72.4-10.2-171.9-173.30000115.1H211S209-H211 PolarHBondContact O-N 3.34Å
210N53.1Low62Low164 Ų164109.9 Ų109.988%0.87771%0.713SS**G310 helixtrans-79.53.3170.6-149.343.2000112.9G208G208-N210 VanDerWaalsContact C-N 3.27Å; G208-N210 PolarHBondContact O-N 3.28Å
211H54Low59.1Low163 Ų163109.4 Ų109.476%0.75573%0.726SS**G310 helixtrans-149.550.7-179.3-115.5-47000113.2G208 S209G208-H211 PolarHBondContact O-N 2.99Å; G208-H211 VanDerWaalsContact O-N 3.15Å; S209-H211 PolarHBondContact O-N 3.34Å
212R46.4Very low56.4Low230 Ų230108.2 Ų108.287%0.86875%0.747SS**  trans163.5103.3148.9-88.3150.5-167.8-140.92.6111.2
213G43.4Very low53.6Low82 Ų82107.4 Ų107.485%0.84576%0.761SS**  trans-71.4144.8141.300000109
214G43.1Very low51Low76 Ų76106 Ų10678%0.78477%0.771SS**  trans120.5101.8166.500000115.2
215G43.3Very low48.7Very low83 Ų83102.4 Ų102.486%0.85677%0.773SS**  trans18.5132.3146.900000122
216G42.1Very low46.8Very low82 Ų82104.3 Ų104.385%0.84579%0.792SS**  trans86.6119.6130.900000118
217G39.6Very low45.4Very low83 Ų83110.7 Ų110.786%0.85681%0.805SS**  trans83.7115.7140.800000118.1
218G38.1Very low44.3Very low77 Ų77105.4 Ų105.479%0.79480%0.804SS**  trans93128.713500000118.3
219A38.4Very low43.3Very low105 Ų105109.2 Ų109.287%0.86882%0.822SS**  trans69.9109.9149.900000118.9
220G38.3Very low42.6Very low82 Ų82114.9 Ų114.985%0.84584%0.836SS**  80.3139106.800000118.3
221G37.8Very low41.6Very low80 Ų80112.8 Ų112.883%0.82583%0.832SS**  trans106.188.6158.300000114.2
222G38.4Very low41Very low88 Ų88108.9 Ų108.991%0.90783%0.829SS**  trans-67.9150.1154.100000110.2
223G38.1Very low41Very low67 Ų67103.1 Ų103.169%0.69182%0.823SS**  trans170.477.4176.400000112.8
224S39.3Very low40.9Very low126 Ų126107 Ų10788%0.88182%0.824SS**  44.597.9129.2-37.30000118.6
225A45.7Very low40.9Very low95 Ų95108.7 Ų108.779%0.78582%0.824SS**  trans-88.2147.7138.500000106.9
226P49.2Very low41Very low119 Ų119110.5 Ų110.577%0.77382%0.823SS**  cis-147.8130.849.436.1-15000115.2
227Q48.9Very low41.1Very low196 Ų196111 Ų11192%0.91682%0.819SS**  trans-136.7129.6153.4-69.9-168.638.100109.2C229Q227-C229 PolarHBondContact O-N 3.35Å
228G40.9Very low41.1Very low79 Ų79115.8 Ų115.881%0.81482%0.817SS**  trans-67.6123.9-166.700000113.2K230G228-K230 PolarHBondContact O-N 2.96Å
229C37.9Very low40.8Very low127 Ų127117.7 Ų117.786%0.85882%0.816SS**  trans-82.5101.9155.6-630000107.4Q227 C231Q227-C229 PolarHBondContact O-N 3.35Å; C229-C231 PolarHBondContact O-N 3.37Å
230K38Very low40.9Very low208 Ų208117.2 Ų117.290%0.90481%0.807SS**  trans-9085.7173.6-147.5164-176.3176.30107.1G228G228-K230 PolarHBondContact O-N 2.96Å
231C33.5Very low41.4Very low120 Ų120122.4 Ų122.481%0.81181%0.809SS**  trans-109.189.2159.753.40000107.7C229C229-C231 PolarHBondContact O-N 3.37Å
232A41.5Very low41.5Very low82 Ų82125.9 Ų125.968%0.67881%0.808SS**  trans-91.4123.1163.600000107.7
233S44.9Very low42.1Very low108 Ų108127.6 Ų127.676%0.75580%0.797SS**  trans68.4126156.9-47.40000114.6
234L42.8Very low42.6Very low164 Ų164132.4 Ų132.486%0.85981%0.807SS**  -149.8151.151.1-58.6154.2000105.5
235S41.1Very low42.8Very low112 Ų112134 Ų13478%0.78380%0.801SS**  cis-175.414448.511.60000108.8
236S45.4Very low43Very low120 Ų120137.3 Ų137.384%0.83980%0.804SS**  trans8.1117.3149.3-157.10000118.3
237A44.8Very low43.4Very low92 Ų92137.5 Ų137.576%0.7681%0.805SS**  trans-146.795.9138.900000108.1
238K39.4Very low43.2Very low185 Ų185136.7 Ų136.780%0.80480%0.804SS**  trans-63.9117.7156.5178.7178.8172.671.30106.7
239C33.2Very low43.9Very low116 Ų116138.6 Ų138.678%0.78481%0.805SS**  trans-121.787.6160.428.70000104.3
240S39.8Very low45Very low95 Ų95138.3 Ų138.366%0.66480%0.801SS**  59.290.395-63.80000110.1D242S240-D242 PolarHBondContact O-N 3.33Å
241E47.6Very low45.1Very low191 Ų191134 Ų13489%0.89380%0.797SS**  trans-49.1118.8139.6-68.9153.290.200107.1
242D40.8Very low45.8Very low153 Ų153134.3 Ų134.382%0.81880%0.8SS**  trans-155.8152.4147.7-131.5-72.5000110.1S240S240-D242 PolarHBondContact O-N 3.33Å
243D50.3Low46.6Very low125 Ų125135.7 Ų135.767%0.66881%0.805SS**  trans-61.4131.6-171.4-158.5-94.2000111.2
244D48.5Very low46.9Very low167 Ų167134.1 Ų134.189%0.89381%0.806SS**  trans-130.396.6160-97.3-63.2000108.7
245E43.8Very low47.4Very low161 Ų161135.7 Ų135.775%0.75281%0.806SS**  trans-27.4140.8160.9-78.5-164.581.400114.9P247E245-P247 VanDerWaalsContact O-CD 3.23Å; E245-P247 WeakPolarHBondContact O-CD 3.21Å
246L51.3Low48.2Very low163 Ų163135.4 Ų135.485%0.85380%0.795SS**  trans-48.4118.7160-61.9150.4000112.1M248L246-M248 PolarHBondContact O-N 3.27Å
247P56.9Low48.6Very low123 Ų123136 Ų13680%0.79979%0.789SS**  trans-89.7105.5157.330.4-22.8000109.8E245E245-P247 VanDerWaalsContact O-CD 3.23Å; E245-P247 WeakPolarHBondContact O-CD 3.21Å
248M45.2Very low49.5Very low180 Ų180140.3 Ų140.389%0.88779%0.786SS**  trans-4.9126.1153.2-63.9167.1174.200116.8L246L246-M248 PolarHBondContact O-N 3.27Å
249S56.1Low50.5Low119 Ų119137 Ų13783%0.83278%0.777SS**  trans-67.8136.9162.6-50.50000111
250P59Low51.9Low121 Ų121138.1 Ų138.179%0.78677%0.774SS**  trans-86.9127.1168.931.6-28.8000111.9
251S40.1Very low52.9Low117 Ų117140 Ų14082%0.81878%0.782SS**  trans39.4106.8140.4-66.50000119.6
252S50Low53.6Low126 Ų126136.8 Ų136.888%0.88178%0.775SS**  trans-90.9113143.4-1770000108.7
253S57.8Low54.1Low112 Ų112134.7 Ų134.778%0.78377%0.768SS**  trans-50.4140172.8-72.70000112.9
254G51.7Low55.2Low74 Ų74137.8 Ų137.876%0.76380%0.795SS**  trans-83.6166.4173.700000114.8
255K51.8Low55.5Low197 Ų197136.4 Ų136.486%0.85779%0.79SS**  trans156.6126.8148.1-126.2150.7165158.40102.2
256D58.1Low56.1Low106 Ų106135.1 Ų135.157%0.56779%0.792SS**  cis-170.714247.632.4-106.5000112.1R258D256-R258 VanDerWaalsContact CB-CZ 3.45Å; D256-R258 VanDerWaalsContact CG-CZ 3.43Å; D256-R258 IonicContact OD1-NH2 3.19Å; D256-R258 PolarHBondContact OD1-NH2 3.1Å; D256-R258 IonicContact OD2-CZ 3.09Å; D256-R258 IonicContact OD2-NE 2.9Å; D256-R258 PolarHBondContact OD2-NE 3.11Å; D256-R258 IonicContact OD2-NH2 2.67Å; D256-R258 PolarHBondContact OD2-NH2 3Å
257D54.4Low56.4Low132 Ų132133.5 Ų133.571%0.70679%0.789SS**  trans-76.4139167.3-165.6-70.1000110.1D259D257-D259 PolarHBondContact OD1-N 3.5Å
258R64.3Low56.4Low183 Ų183134.1 Ų134.169%0.69179%0.788SS**  trans-16373.5158.547.2-147.198.9-132.143.5109.6D256D256-R258 VanDerWaalsContact CB-CZ 3.45Å; D256-R258 VanDerWaalsContact CG-CZ 3.43Å; D256-R258 IonicContact OD1-NH2 3.19Å; D256-R258 PolarHBondContact OD1-NH2 3.1Å; D256-R258 IonicContact OD2-CZ 3.09Å; D256-R258 IonicContact OD2-NE 2.9Å; D256-R258 PolarHBondContact OD2-NE 3.11Å; D256-R258 IonicContact OD2-NH2 2.67Å; D256-R258 PolarHBondContact OD2-NH2 3Å
259D58.9Low57.1Low117 Ų117131.3 Ų131.363%0.62678%0.782SS**  trans15.5145.7130.3-136.2-15.7000121.6D257D257-D259 PolarHBondContact OD1-N 3.5Å
260L63.2Low57.1Low138 Ų138132.1 Ų132.172%0.72378%0.779SS**  trans61.1128.6159.4-45.5174.5000117.4
261T60.4Low57Low134 Ų134132.9 Ų132.982%0.82278%0.778SS**  -164.6138.258.3-34.70000110.8
262V63.5Low58.3Low124 Ų124134.1 Ų134.175%0.75278%0.775SS**  trans-55.2141165.4134.50000111.9
263T50.8Low59Low109 Ų109134.8 Ų134.867%0.66977%0.766SS**  trans3.6158.5144.1-2.60000119.7
264P72.9Confident59.1Low191 Ų191136.8 Ų136.8100%1.2477%0.765SS**  -125.1066.826.1-9.5000116.1

Retrieved 264 of 264 residues in 900.1 ms (Link to these results)