A0A096M8R4_POEFO Loading...

CREB regulated transcription coactivator 1

AlphaFold DB , UniProt , Accession A0A096M8R4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 452 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
1M43.8Very low40.9Very low254 Ų254141.5 Ų141.5100%1.25178%0.778SS**  0124.20-93.4164.9163.200107.5
2N37.4Very low40.2Very low125 Ų125136.5 Ų136.567%0.66878%0.784SS**  trans-128.8131.9-169.2178.824.1000105.3
3P50.3Low40Very low125 Ų125134.7 Ų134.781%0.81278%0.784SS**  trans-95.7117.4158.730.1-20.7000109.6
4K41.8Very low40.1Very low175 Ų175138.2 Ų138.276%0.76179%0.79SS**  trans-123.4173.4160.7-104-168.7179.5-178.10105.6
5P54Low39.7Very low103 Ų103140.7 Ų140.767%0.66979%0.792SS**  cis-125.2-179.3-47.329.5-7.8000108.4
6Q42.5Very low39.6Very low150 Ų150141.7 Ų141.770%0.70179%0.794SS**  163.1127.186.5-121.8178.3-58.700105.7
7E36Very low39.6Very low152 Ų152143.2 Ų143.271%0.7179%0.793SS**  78.6150.598.8-87.3-164.1153.300114.5
8V36.3Very low39.9Very low99 Ų99141.8 Ų141.860%0.679%0.791SS**  cis179.5140.3-16.8112.90000103.9
9F35.4Very low40.1Very low182 Ų182144.3 Ų144.380%0.79879%0.793SS**  trans60.7135.3152.2-76.9-110.9000123.1
10S40.5Very low40.4Very low114 Ų114149.1 Ų149.180%0.79780%0.799SS**  154.7125.3114-65.70000108
11G31.9Very low40.4Very low77 Ų77147.7 Ų147.779%0.79480%0.795SS**  97.9115.561.400000108
12G32.5Very low40.5Very low82 Ų82143.7 Ų143.785%0.84578%0.778SS**  trans-75.5173.7-170.900000115.9
13S37.6Very low40.8Very low113 Ų113144.9 Ų144.979%0.7978%0.783SS**  trans162.9125.3133.6-162.60000111.4
14Q41.3Very low40.2Very low184 Ų184146.7 Ų146.786%0.8679%0.786SS**  trans26.2115.3135.7-159.1-178.193.500119.5
15E34.7Very low40Very low176 Ų176144.2 Ų144.282%0.82279%0.785SS**  trans-167121.5141.2-147.2159.372.700115.9
16L38Very low39.5Very low156 Ų156144.8 Ų144.882%0.81779%0.786SS**  trans54.1133.6141.6-56.3170.1000124.6
17Q39.7Very low39.5Very low167 Ų167143.3 Ų143.378%0.7879%0.79SS**  trans-61167.4174.8-64.9-83-4300114.6
18P44.3Very low39.3Very low118 Ų118138.6 Ų138.677%0.76678%0.782SS**  -142.8117.197.133.2-15.6000115.6R20P18-R20 PolarHBondContact O-N 3.23Å
19K43.3Very low39.5Very low189 Ų189140.5 Ų140.582%0.82279%0.794SS**  17.696.4124.7-132.8149.2-179.9159.50116.2
20R47.6Very low39.4Very low240 Ų240140.3 Ų140.391%0.90680%0.796SS**  trans-98.5122.1158.4-75.7-153.9-69.4-124.60.8110.4P18P18-R20 PolarHBondContact O-N 3.23Å
21V39.4Very low39Very low120 Ų120142 Ų14273%0.72780%0.796SS**  trans-71.7117.9178.1177.30000108.8L23V21-L23 HydrophobicContact CG1-CD1 4.35Å
22L46.3Very low39.2Very low171 Ų171143.9 Ų143.990%0.89580%0.797SS**  trans-87.5115.3161.9-119.292.8000107.7L24L22-L24 PolarHBondContact O-N 3.28Å
23L42.8Very low39.3Very low149 Ų149149.3 Ų149.378%0.7880%0.8SS**  trans-69.4121.5175.8-136.473000108.8V21V21-L23 HydrophobicContact CG1-CD1 4.35Å
24L39.3Very low39.4Very low164 Ų164149.5 Ų149.586%0.85980%0.801SS**  trans-82113175.2-155.279.3000108.4L22L22-L24 PolarHBondContact O-N 3.28Å
25T36Very low38.9Very low123 Ų123148.5 Ų148.576%0.75580%0.802SS**  trans-100.6113.2170.2-61.80000108.9
26V43.9Very low38.9Very low114 Ų114144 Ų14469%0.69180%0.795SS**PPolyproline II helixtrans-90.3127.8169.1175.90000108.3
27P42Very low38.8Very low120 Ų120143.1 Ų143.178%0.77979%0.791SS**PPolyproline II helixtrans-81.1120.5161-10.327.9000110.1
28G32.5Very low38.8Very low53 Ų53143 Ų14355%0.54679%0.788SS.*PPolyproline II helixtrans-59.3147.4175.200000112.7
29T39.5Very low38.4Very low138 Ų138145 Ų14585%0.84779%0.792SS**  49.392.177.870.80000114.3
30E34.1Very low38.1Very low178 Ų178139.8 Ų139.883%0.83278%0.784SS**  trans-143.4128.8146.161.8-166.3104.200111.1
31N32.8Very low37.8Very low151 Ų151136.8 Ų136.881%0.80778%0.781SS**  trans-94.9136.9179.7-46.910.3000105.8
32S35.5Very low37.9Very low115 Ų115140.1 Ų140.180%0.80479%0.785SS**  trans-151.7110.8165.8-72.60000110.5
33E35.5Very low37.3Very low197 Ų197140 Ų14092%0.92178%0.78SS**  trans-60.2135.5158.4-84.9151.278.600110.5
34S38.2Very low36.8Very low116 Ų116140.1 Ų140.181%0.81178%0.781SS**  trans-162.1112.4144.657.10000111
35D32.5Very low36.5Very low164 Ų164141.9 Ų141.988%0.87778%0.776SS**  trans-53136.2159.8-170.3-83.8000111.7
36A34.5Very low36.6Very low82 Ų82142.4 Ų142.468%0.67877%0.774SS**  trans162.6105.3139.100000112.1
37D34.5Very low36.2Very low137 Ų137143.3 Ų143.373%0.73378%0.776SS**  73.6134.2120.8-1422000121.4
38K40.7Very low35.7Very low163 Ų163145.3 Ų145.371%0.70977%0.772SS**  trans87.993156-51.4-162.2-179.5176.30120.6
39D36Very low36Very low160 Ų160151.1 Ų151.186%0.85678%0.782SS**  59.2145.2106.3-94.5-51.3000121.3
40A36.8Very low35.9Very low80 Ų80152.1 Ų152.166%0.66178%0.782SS**  trans88.499.9156.800000116.3
41Q40.3Very low35.9Very low177 Ų177151.1 Ų151.183%0.82778%0.783SS**  94.395.881.7-167.6174.9-80.300109.1
42K41.3Very low36Very low190 Ų190148.3 Ų148.383%0.82678%0.781SS**  48.2129.9104.1-74.7-177.4178.3-75.70114
43Q34.5Very low36.1Very low168 Ų168148.1 Ų148.179%0.78578%0.779SS**  trans96.2117.1163.9-54.2-1582.200115.3
44L33.3Very low36.4Very low153 Ų153147.7 Ų147.780%0.80178%0.777SS**  -178.392.5111.3-157.358.5000107.8
45W31.7Very low36.7Very low201 Ų201147 Ų14776%0.76177%0.77SS**  56.1109112.7-75.289.5000115.3
46D39.1Very low37.1Very low133 Ų133147.4 Ų147.471%0.71177%0.772SS**  trans38.5118.8130.2-115.2-69000118.5
47D34.2Very low37.4Very low134 Ų134149.5 Ų149.572%0.71778%0.776SS**  -165.7119.1124.4-129.1-113.6000110.8
48K32.4Very low38.1Very low161 Ų161148.6 Ų148.670%0.778%0.78SS**  74.3117123.5-162.4168.9179.8178.50120.2
49K39.5Very low38.4Very low176 Ų176148.1 Ų148.177%0.76579%0.785SS**  trans33.5126139.3-65.1-172.2176.5-177.80117.2
50D35.8Very low39.1Very low158 Ų158145.2 Ų145.285%0.84577%0.773SS**  -162147.1112.5-89.3-38.1000112
51D34.5Very low39.3Very low158 Ų158147.3 Ų147.385%0.84578%0.78SS**  trans-16.5129.8160.8-99.3-96.9000117
52A35.4Very low39.9Very low92 Ų92142.7 Ų142.776%0.7678%0.78SS**  176.8118.4125.200000111.2
53S37.2Very low40.6Very low111 Ų111139.6 Ų139.678%0.77677%0.771SS**  trans-50.9125.8154.350.80000112.3
54Q41.9Very low41.5Very low187 Ų187139 Ų13987%0.87477%0.773SS**  trans-175.9155.8133.4-103-174.232.600111.8
55P44Very low42.7Very low101 Ų101138.4 Ų138.466%0.65677%0.769SS**  trans-81.1149.6-159.633.4-34.6000112.7T57P55-T57 PolarHBondContact O-N 3.29Å
56N41.8Very low43.4Very low174 Ų174137.1 Ų137.193%0.9377%0.769SS**  trans-48.6103.6171.6-58.8-72.1000111.2
57T40.6Very low43.9Very low125 Ų125136.5 Ų136.577%0.76777%0.773SS**  trans-112.8125.6160.6-59.60000106.6P55 D59P55-T57 PolarHBondContact O-N 3.29Å; T57-D59 PolarHBondContact O-N 2.94Å
58C49.9Very low44.1Very low118 Ų118135.3 Ų135.380%0.79778%0.775SS**  trans-51117.9-175.7-58.50000111.9V60C58-V60 PolarHBondContact O-N 3.37Å
59D46.5Very low44.9Very low153 Ų153132.6 Ų132.682%0.81877%0.774SS**  trans-71.6109.3169.3-167.79.5000108.5T57T57-D59 PolarHBondContact O-N 2.94Å
60V49.8Very low45.3Very low100 Ų100131.4 Ų131.461%0.60678%0.776SS**  trans-105.8113.3171.2179.50000106.8C58 G62C58-V60 PolarHBondContact O-N 3.37Å; V60-G62 PolarHBondContact O-N 3.33Å
61P41.5Very low45.4Very low124 Ų124132.9 Ų132.981%0.80578%0.777SS**THydrogen-bonded Turntrans-62120-177.1-21.731.7000111.3
62G52.8Low46Very low80 Ų80133.4 Ų133.483%0.82578%0.775SS**THydrogen-bonded Turntrans131.56165.700000118.3V60V60-G62 PolarHBondContact O-N 3.33Å
63I56.6Low46.3Very low125 Ų125136.3 Ų136.364%0.64178%0.776SS**  trans-115.1102.4175.550.6164.9000112.1I65I63-I65 HydrophobicContact CB-CG1 4.46Å; I63-I65 HydrophobicContact CD1-CD1 3.89Å; I63-I65 PolarHBondContact O-N 2.83Å
64N52.2Low46.3Very low156 Ų156136.7 Ų136.783%0.83478%0.779SS**  trans-78.997.6166.1-77.3-35.4000108.8
65I59.4Low46.2Very low139 Ų139133.4 Ų133.471%0.71377%0.774SS**  trans-96.6101.4171.6-60.2169.4000107.7I63I63-I65 HydrophobicContact CB-CG1 4.46Å; I63-I65 HydrophobicContact CD1-CD1 3.89Å; I63-I65 PolarHBondContact O-N 2.83Å
66F46.5Very low46Very low174 Ų174134.2 Ų134.276%0.76378%0.782SS**  trans-75.6127.9165.2-76.1-85.4000108.9S68F66-S68 PolarHBondContact O-N 3.06Å
67P50.4Low46Very low121 Ų121132.3 Ų132.379%0.78678%0.777SS**  trans-73.6114166.629.6-28.2000107.6
68S36.6Very low46.2Very low109 Ų109132 Ų13276%0.76277%0.774SS**  trans-74.2137.8165.6-68.70000108.8F66F66-S68 PolarHBondContact O-N 3.06Å
69P50.3Low45.6Very low104 Ų104132 Ų13268%0.67577%0.773SS**  trans-77.1145.4175.333.8-31.2000109.1
70D47Very low45.5Very low151 Ų151127.2 Ų127.281%0.80776%0.76SS**  trans72.394.4163.9-49.4-48.4000117.6
71Q39.4Very low45.4Very low189 Ų189126.7 Ų126.788%0.88378%0.775SS**  trans-154.7101.4142.3-157.382.178.700109.4
72E45.6Very low45.6Very low169 Ų169127.4 Ų127.479%0.7977%0.767SS**  trans-54163.8155.6-87.8-139.996.400111.6
73L42.7Very low45.4Very low152 Ų152131.6 Ų131.680%0.79677%0.77SS**  trans105.398.3169.3-52.5174.2000114.6
74S36Very low44.9Very low119 Ų119131.4 Ų131.483%0.83278%0.775SS**  trans-52.6142.2159.638.30000111.6
75P41.5Very low45.1Very low118 Ų118128.2 Ų128.277%0.76678%0.779SS**  -145.4139.2102.133.3-15.6000115
76S39.8Very low44.5Very low119 Ų119124.8 Ų124.883%0.83278%0.778SS**  trans20.9105.8147.9-162.90000119.3
77V40.9Very low45Very low134 Ų134122.2 Ų122.281%0.81278%0.782SS**  trans-145110.8144.6178.60000109
78V44.4Very low45.9Very low117 Ų117124.1 Ų124.171%0.70978%0.784SS**  trans32.5116149.1-169.70000118.4G80V78-G80 PolarHBondContact O-N 3.16Å
79P38.3Very low47.4Very low119 Ų119124 Ų12477%0.77378%0.781SS**  trans-75.4104.2155-13.329.9000109.9
80G43.3Very low48Very low53 Ų53124.9 Ų124.955%0.54678%0.78SS.*  trans-57.4139.2156.600000109.9V78 H82V78-G80 PolarHBondContact O-N 3.16Å; G80-H82 PolarHBondContact O-N 3.25Å; G80-H82 VanDerWaalsContact O-N 3.08Å; G80-H82 PolarHBondContact O-ND1 3.41Å
81G49.3Very low48.7Very low89 Ų89123.6 Ų123.692%0.91877%0.773SS**  trans-52.3111.8-173.600000112.8
82H44Very low49.7Very low139 Ų139120 Ų12064%0.64476%0.764SS**  trans-125.5119.7157.262.3-79.4000108.2G80 T84G80-H82 PolarHBondContact O-N 3.25Å; G80-H82 VanDerWaalsContact O-N 3.08Å; G80-H82 PolarHBondContact O-ND1 3.41Å; H82-T84 PolarHBondContact O-N 2.98Å; H82-T84 VanDerWaalsContact O-N 3.07Å
83N49.6Very low50.1Low167 Ų167119.1 Ų119.189%0.89376%0.764SS**  trans-18.399.9167.2-53.7-80.2000114.2
84T45Very low50.9Low122 Ų122116.5 Ų116.575%0.74875%0.75SS**  trans-135.9127.8154.7-570000106.4H82 G86H82-T84 PolarHBondContact O-N 2.98Å; H82-T84 VanDerWaalsContact O-N 3.07Å; T84-G86 PolarHBondContact O-N 3.32Å
85G57.1Low52.6Low88 Ų88118.8 Ų118.891%0.90775%0.747SS**  trans-57.690.6-173.100000113.7
86G46.9Very low53.7Low67 Ų67121 Ų12169%0.69175%0.745SS**  trans-95.6123.4163.800000108.9T84 L88T84-G86 PolarHBondContact O-N 3.32Å; G86-L88 PolarHBondContact O-N 3.35Å
87S57.3Low54.8Low121 Ų121120.2 Ų120.285%0.84674%0.738SS**  trans-46.5137.4168.9-55.70000110.3
88L69Low55.8Low161 Ų161119.1 Ų119.184%0.84373%0.733SS**  trans-45.4140.6173.4-73.9158.5000110.2G86 D90G86-L88 PolarHBondContact O-N 3.35Å; L88-D90 PolarHBondContact O-N 2.85Å; L88-D90 VanDerWaalsContact O-N 3.15Å
89P68.6Low56.6Low105 Ų105119.3 Ų119.368%0.68274%0.737SS**  trans-56.8124.9171.224.9-32.1000108.3L91P89-L91 PolarHBondContact O-N 3.28Å
90D62.1Low57.7Low124 Ų124121.6 Ų121.666%0.66374%0.742SS**  trans-62.9109.2-178.3-175.88.8000109.7L88 T92L88-D90 PolarHBondContact O-N 2.85Å; L88-D90 VanDerWaalsContact O-N 3.15Å; D90-T92 PolarHBondContact O-N 3.39Å; D90-T92 VanDerWaalsContact O-N 3.15Å; D90-T92 WeakPolarHBondContact OD1-CB 3.37Å; D90-T92 PolarHBondContact OD1-N 3.42Å; D90-T92 VanDerWaalsContact OD1-N 3.08Å; D90-T92 PolarHBondContact OD1-OG1 3.24Å; D90-T92 PolarHBondContact OD2-OG1 3.49Å
91L61.9Low58.4Low124 Ų124124.6 Ų124.665%0.64976%0.755SS**G310 helixtrans-731.9-180-60.6179.1000112.5P89 N93 I94P89-L91 PolarHBondContact O-N 3.28Å; L91-N93 PolarHBondContact O-N 3.02Å; L91-N93 VanDerWaalsContact O-N 3.11Å; L91-I94 HydrophobicContact CD2-CD1 3.86Å; L91-I94 PolarHBondContact O-N 2.94Å
92T59.4Low58.7Low114 Ų114126.2 Ų126.270%0.69975%0.747SS**G310 helixtrans-65.4-10.2176.2-47.90000112.8D90D90-T92 PolarHBondContact O-N 3.39Å; D90-T92 VanDerWaalsContact O-N 3.15Å; D90-T92 WeakPolarHBondContact OD1-CB 3.37Å; D90-T92 PolarHBondContact OD1-N 3.42Å; D90-T92 VanDerWaalsContact OD1-N 3.08Å; D90-T92 PolarHBondContact OD1-OG1 3.24Å; D90-T92 PolarHBondContact OD2-OG1 3.49Å
93N55.2Low58.8Low150 Ų150125.5 Ų125.580%0.80276%0.755SS**G310 helixtrans-94.28.5173-145.5-27.9000114.2L91 Q95L91-N93 PolarHBondContact O-N 3.02Å; L91-N93 VanDerWaalsContact O-N 3.11Å; N93-Q95 VanDerWaalsContact C-N 3.32Å; N93-Q95 PolarHBondContact O-N 3.26Å
94I59.6Low58.8Low97 Ų97125.6 Ų125.650%0.49775%0.754SS.*  trans-93.274.1168.4-47.6-176.4000108L91 F96L91-I94 HydrophobicContact CD2-CD1 3.86Å; L91-I94 PolarHBondContact O-N 2.94Å; I94-F96 VanDerWaalsContact C-N 3.35Å; I94-F96 HydrophobicContact CB-CE2 4.39Å; I94-F96 HydrophobicContact CG2-CD2 3.97Å; I94-F96 HydrophobicContact CG2-CE1 4.35Å; I94-F96 HydrophobicContact CG2-CE2 3.54Å; I94-F96 HydrophobicContact CG2-CZ 3.76Å; I94-F96 PolarHBondContact O-N 2.87Å
95Q71.8Confident59.4Low166 Ų166125.5 Ų125.578%0.77675%0.749SS**  trans-70.894.7168.9-173.869.952.800108N93 P97N93-Q95 VanDerWaalsContact C-N 3.32Å; N93-Q95 PolarHBondContact O-N 3.26Å; Q95-P97 WeakPolarHBondContact O-CD 3.13Å
96F64.4Low59.3Low164 Ų164126.4 Ų126.472%0.71974%0.739SS**PPolyproline II helixtrans-62.3121.5167.1-73.1-82.5000108.1I94I94-F96 VanDerWaalsContact C-N 3.35Å; I94-F96 HydrophobicContact CB-CE2 4.39Å; I94-F96 HydrophobicContact CG2-CD2 3.97Å; I94-F96 HydrophobicContact CG2-CE1 4.35Å; I94-F96 HydrophobicContact CG2-CE2 3.54Å; I94-F96 HydrophobicContact CG2-CZ 3.76Å; I94-F96 PolarHBondContact O-N 2.87Å
97P63.1Low59.5Low104 Ų104130.4 Ų130.468%0.67574%0.74SS**PPolyproline II helixtrans-60.4143.4169.325.3-31.2000108.2Q95Q95-P97 WeakPolarHBondContact O-CD 3.13Å
98P62.1Low59.1Low110 Ų110130.8 Ų130.871%0.71473%0.732SS**PPolyproline II helixtrans-54.2139.2175.622.5-31.6000109.3L100P98-L100 PolarHBondContact O-N 3.13Å
99P61.7Low58.3Low122 Ų122129.9 Ų129.979%0.79273%0.734SS**PPolyproline II helixtrans-57.1129.9-178.323.6-32.7000109.1S101P99-S101 PolarHBondContact O-N 2.87Å
100L60.4Low57.3Low166 Ų166129.2 Ų129.287%0.86973%0.727SS**PPolyproline II helixtrans-53.8130.9176.1-67.6168.3000108.5P98 T102P98-L100 PolarHBondContact O-N 3.13Å; L100-T102 PolarHBondContact O-N 3.26Å
101S58Low56.4Low117 Ų117129.5 Ų129.582%0.81874%0.739SS**  trans-58.2105.8167.9-54.50000107.1P99P99-S101 PolarHBondContact O-N 2.87Å
102T55.8Low55.4Low122 Ų122131.9 Ų131.975%0.74874%0.744SS**  trans-46.3127169.333.90000108.2L100 L104L100-T102 PolarHBondContact O-N 3.26Å; T102-L104 PolarHBondContact O-N 3.38Å; T102-L104 VanDerWaalsContact O-N 3.09Å
103P45.2Very low54.9Low125 Ų125131.8 Ų131.881%0.81275%0.745SS**  trans-58.9121.3175.723.5-30.8000107.7D105P103-D105 PolarHBondContact O-N 2.82Å; P103-D105 VanDerWaalsContact O-N 3.08Å
104L50.1Low54.2Low169 Ų169129.8 Ų129.889%0.88574%0.743SS**  trans-54.5113.3176.5-72.7156.9000108.6T102T102-L104 PolarHBondContact O-N 3.38Å; T102-L104 VanDerWaalsContact O-N 3.09Å
105D56.9Low53.4Low120 Ų120133.6 Ų133.664%0.64276%0.764SS**  trans-62128.3158.7-169.533.2000107.3P103 E107P103-D105 PolarHBondContact O-N 2.82Å; P103-D105 VanDerWaalsContact O-N 3.08Å; D105-E107 PolarHBondContact O-N 2.9Å
106P55.4Low51.7Low107 Ų107130.7 Ų130.770%0.69576%0.762SS**THydrogen-bonded Turntrans-66.87.8-173.422.1-32000116.1
107E51.5Low50.6Low151 Ų151128.5 Ų128.571%0.70677%0.767SS**THydrogen-bonded Turntrans-109.52.6-168.1-52.9-64.9116.800115.6D105D105-E107 PolarHBondContact O-N 2.9Å
108D49.8Very low49.7Very low129 Ų129128 Ų12869%0.6977%0.771SS**  trans-113.972.8-176.5-126.2-53.8000114V110D108-V110 PolarHBondContact O-N 3.34Å; D108-V110 VanDerWaalsContact O-N 3.1Å; D108-V110 WeakPolarHBondContact OD1-CG2 3.43Å
109T51.2Low48.6Very low142 Ų142130.5 Ų130.587%0.87178%0.779SS**  trans-79.666.5166.251.70000111.3
110V47.9Very low47.7Very low91 Ų91130 Ų13055%0.55278%0.778SS**  trans-135.9101.4168.9-148.40000110D108 F112D108-V110 PolarHBondContact O-N 3.34Å; D108-V110 VanDerWaalsContact O-N 3.1Å; D108-V110 WeakPolarHBondContact OD1-CG2 3.43Å; V110-F112 HydrophobicContact CB-CE2 4.29Å; V110-F112 WeakPolarHBondContact O-CD2 3.34Å; V110-F112 PolarHBondContact O-N 2.81Å
111S42.6Very low47.1Very low129 Ų129128.5 Ų128.590%0.90278%0.776SS**  trans-61.999.3179.4-59.40000111.9
112F42.5Very low46.9Very low175 Ų175126.6 Ų126.677%0.76878%0.775SS**  trans-91129.4161.7-69.4-80.6000109.7V110 S114V110-F112 HydrophobicContact CB-CE2 4.29Å; V110-F112 WeakPolarHBondContact O-CD2 3.34Å; V110-F112 PolarHBondContact O-N 2.81Å; F112-S114 PolarHBondContact O-N 2.91Å
113P48.1Very low46.8Very low111 Ų111125 Ų12572%0.72177%0.769SS**  trans-76.5123.5168.830.2-28.2000108.8L115P113-L115 PolarHBondContact O-N 3.17Å; P113-L115 VanDerWaalsContact O-N 3.1Å
114S40.8Very low47.1Very low108 Ų108126.7 Ų126.776%0.75577%0.77SS**  trans-56.7115.2167.8-72.10000109.7F112 S116F112-S114 PolarHBondContact O-N 2.91Å; S114-S116 PolarHBondContact O-N 3.39Å
115L42.8Very low47.2Very low178 Ų178124.5 Ų124.593%0.93276%0.764SS**  trans-68.380.8163.9-67.2170.7000108P113P113-L115 PolarHBondContact O-N 3.17Å; P113-L115 VanDerWaalsContact O-N 3.1Å
116S36.6Very low47Very low104 Ų104123.4 Ų123.473%0.72776%0.761SS**  trans-69.8131.7167.8-61.50000108.6S114S114-S116 PolarHBondContact O-N 3.39Å
117S39.7Very low46.6Very low119 Ų119124 Ų12483%0.83276%0.759SS**  trans-21.2128.5173.2-138.50000115.2N119S117-N119 PolarHBondContact O-N 2.65Å
118A45.5Very low46.8Very low93 Ų93122 Ų12277%0.76975%0.752SS**  trans-64.2121.3-178.400000113.1
119N39Very low47.2Very low163 Ų163121.2 Ų121.287%0.87275%0.753SS**  trans-132.4106.3148.5-92.885.6000109.1S117S117-N119 PolarHBondContact O-N 2.65Å
120S41.4Very low47.2Very low110 Ų110123.1 Ų123.177%0.76975%0.751SS**  trans-29.8143.6154-86.80000112.6
121T49.4Very low47.6Very low136 Ų136125.1 Ų125.183%0.83476%0.758SS**SBendcis-167.310915.720.40000103.4
122G53.7Low48.1Very low77 Ų77122 Ų12279%0.79475%0.746SS**  trans176.419.8-175.300000119.9
123S52.7Low48.3Very low88 Ų88119 Ų11962%0.61574%0.737SS**  trans-154.353.2178.4-100.40000115.2
124L51.4Low47.9Very low160 Ų160118.9 Ų118.984%0.83874%0.739SS**SBendtrans-93.2-12.2163.9-65.6177.7000113
125T53.1Low48Very low124 Ų124118.6 Ų118.676%0.76174%0.743SS**THydrogen-bonded Turntrans-80-32.8-179.5-48.20000112.7
126T51.9Low47.9Very low96 Ų96113.5 Ų113.559%0.58973%0.727SS**THydrogen-bonded Turntrans-82.4-21.7-174.6-28.40000113.4T129T126-T129 PolarHBondContact O-OG1 3.15Å
127N48Very low48.2Very low119 Ų119113.7 Ų113.764%0.63673%0.728SS**THydrogen-bonded Turntrans-77.9-28.9-179.9-166.4-96.4000112.4T129N127-T129 PolarHBondContact O-N 3.38Å
128L55.4Low48.1Very low109 Ų109117.1 Ų117.157%0.57173%0.731SS**G310 helixtrans-75-24-175.6-134.680.8000114.1
129T58.1Low47.4Very low114 Ų114115.8 Ų115.870%0.69973%0.726SS**G310 helixtrans-78.6-21.1178.535.90000113.3T126 N127T126-T129 PolarHBondContact O-OG1 3.15Å; N127-T129 PolarHBondContact O-N 3.38Å
130H49.8Very low47.2Very low182 Ų182115.7 Ų115.784%0.84372%0.724SS**G310 helixtrans-87.6-6179.6-140.9-80.4000113.7
131L56.6Low46.7Very low132 Ų132117.2 Ų117.269%0.69173%0.729SS**G310 helixtrans-105.55.5176.2-156.461.8000113.6I133L131-I133 VanDerWaalsContact C-N 3.28Å; L131-I133 HydrophobicContact CD2-CD1 4.44Å; L131-I133 PolarHBondContact O-N 3.29Å
132G52.9Low45.9Very low64 Ų64116.8 Ų116.866%0.6673%0.726SS**THydrogen-bonded Turntrans66.721171.800000115.6S134G132-S134 VanDerWaalsContact C-N 3.29Å; G132-S134 PolarHBondContact O-N 3.16Å; G132-S134 VanDerWaalsContact O-N 3.08Å
133I48.3Very low45.6Very low111 Ų111118.6 Ų118.657%0.56972%0.724SS**  trans-85.776.8173-47.7-177.8000108.5L131 A135L131-I133 VanDerWaalsContact C-N 3.28Å; L131-I133 HydrophobicContact CD2-CD1 4.44Å; L131-I133 PolarHBondContact O-N 3.29Å; I133-A135 PolarHBondContact O-N 3.43Å
134S38.5Very low44.5Very low109 Ų109120.3 Ų120.376%0.76274%0.736SS**  trans-60.9117.6163.3-62.70000108.3G132 A136G132-S134 VanDerWaalsContact C-N 3.29Å; G132-S134 PolarHBondContact O-N 3.16Å; G132-S134 VanDerWaalsContact O-N 3.08Å; S134-A136 VanDerWaalsContact C-N 3.3Å; S134-A136 PolarHBondContact O-N 3.37Å
135A42.5Very low43.7Very low102 Ų102121.5 Ų121.584%0.84374%0.737SS**  trans-61.994.7168.400000108.7I133 S137I133-A135 PolarHBondContact O-N 3.43Å; A135-S137 PolarHBondContact O-N 3.47Å
136A40.5Very low43.5Very low71 Ų71121 Ų12159%0.58774%0.736SS**  trans-64.7104.5171.700000109.1S134 H138S134-A136 VanDerWaalsContact C-N 3.3Å; S134-A136 PolarHBondContact O-N 3.37Å; A136-H138 PolarHBondContact O-N 3Å; A136-H138 PolarHBondContact O-ND1 3.41Å
137S43.7Very low42.3Very low108 Ų108122.1 Ų122.176%0.75575%0.748SS**  trans14.1101.1138.561.40000115.6A135A135-S137 PolarHBondContact O-N 3.47Å
138H37Very low41.6Very low191 Ų191124.1 Ų124.188%0.88476%0.756SS**  trans-127.395.2156.4-77.778.6000107.8A136A136-H138 PolarHBondContact O-N 3Å; A136-H138 PolarHBondContact O-ND1 3.41Å
139G31.7Very low40.5Very low66 Ų66125.1 Ų125.168%0.6877%0.766SS**SBendtrans-170.170.8-177.600000111.6
140I34.8Very low39.2Very low161 Ų161125.3 Ų125.383%0.82677%0.767SS**  trans54.399.6151-49.5169.7000116.3
141T30.9Very low38.4Very low141 Ų141123.1 Ų123.187%0.86577%0.767SS**  trans-129.8113.3154.149.10000110.2
142T33.4Very low37.3Very low127 Ų127120.7 Ų120.778%0.77977%0.773SS**  trans-75.7163165.744.10000111.1
143P46.8Very low36.1Very low116 Ų116126 Ų12675%0.75378%0.781SS**  trans-98.3162.1-132.137.7-36.3000113.7
144S28.5Very low35.2Very low124 Ų124130.3 Ų130.387%0.86779%0.79SS**  trans-178.7112.9132.2-73.70000111.2
145Q34.5Very low34.8Very low184 Ų184136.1 Ų136.186%0.8680%0.795SS**  trans-64.7-175.9164.2-95.1-169.7-42.600112.1
146P49.9Very low34.3Very low113 Ų113140 Ų14073%0.73480%0.796SS**  -131.3-178.2-69.935.8-15000110.1
147S26.8Very low35Very low121 Ų121141.5 Ų141.585%0.84680%0.8SS**  trans167.8143.2130.8-173.20000112.9
148M32.8Very low34.8Very low161 Ų161141.8 Ų141.879%0.79380%0.799SS**  trans-67.9171-169.5-68-83.2-17300117.2
149T33.5Very low34.6Very low130 Ų130139.3 Ų139.380%0.79880%0.797SS**  trans86.3140153.9730000115.6
150V30.2Very low35.1Very low117 Ų117142 Ų14271%0.70980%0.8SS**  cis-171.1156.414.91050000110.8
151T32.3Very low35.3Very low137 Ų137140 Ų14084%0.8480%0.797SS**  trans71.4134.8155.554.30000123.9
152G33Very low35.5Very low80 Ų80140.7 Ų140.783%0.82580%0.795SS**  trans165.185.8153.400000115.2
153Q29Very low35.6Very low175 Ų175140.6 Ų140.682%0.81879%0.794SS**  trans-76.5151.7-177.4-82-8920.600115.4
154R29.6Very low35.1Very low203 Ų203143.1 Ų143.177%0.76680%0.8SS**  trans63.4122.3138.6-87.3-100.5-179.3-156.12.8121.4
155R30.5Very low35.4Very low230 Ų230143.4 Ų143.487%0.86880%0.797SS**  149.1153.2106.6-105-170.9167-171.9-3.8114.5
156Q31.1Very low35.2Very low185 Ų185140.3 Ų140.386%0.86480%0.796SS**  trans-79.7177.2-170-88.8-142.211.400115.5
157P55.1Low34.2Very low102 Ų102141.7 Ų141.766%0.66280%0.797SS**  trans-89.9178.2-152.341.5-36000113.9
158P39.4Very low34.5Very low113 Ų113142.4 Ų142.473%0.73479%0.791SS**  -168.6173.899.844.4-22.1000119.7
159V33.6Very low34.4Very low139 Ų139142.2 Ų142.284%0.84279%0.788SS**  trans48147150.9-81.40000126.7
160V40.7Very low34.5Very low123 Ų123142 Ų14275%0.74578%0.781SS**  trans-57.4164.2-176.1-133.10000118.2
161P40.1Very low34.8Very low118 Ų118144.9 Ų144.977%0.76679%0.787SS**  -145.3159.3103.137.7-21.5000117.3
162L35.3Very low34.7Very low156 Ų156147.4 Ų147.482%0.81779%0.789SS**  trans-61.2138.5165.2-92.271.2000111.7
163T34.9Very low35Very low125 Ų125148.7 Ų148.777%0.76779%0.785SS**  trans-125.2117.1158.951.70000109.8
164L36.7Very low35.4Very low169 Ų169146 Ų14689%0.88578%0.783SS**  trans-80.7120166.4-70.9165.5000108.4
165T33.9Very low35.6Very low131 Ų131144.8 Ų144.880%0.80479%0.786SS**  trans-133123.2162.750.90000109.6
166S31.7Very low35.8Very low119 Ų119143.2 Ų143.283%0.83279%0.789SS**  trans-64147.9176.3-47.30000112.6
167D28.8Very low36Very low141 Ų141141.5 Ų141.575%0.75479%0.785SS**  trans104.2130136.8-136.2-0.6000120.2
168L32.9Very low35.1Very low137 Ų137142.4 Ų142.472%0.71779%0.793SS**  trans54.2106.4155.7-78.7150.2000120.8
169H31Very low35.1Very low157 Ų157142.9 Ų142.973%0.72780%0.796SS**  130120.1107.5-153.6-115.4000114.5
170L34Very low35.1Very low125 Ų125142.4 Ų142.465%0.65479%0.794SS**  trans76.8124.6150.1-100.6-94.7000120.5
171Q36.4Very low35.2Very low178 Ų178144.4 Ų144.483%0.83280%0.8SS**  trans92.374.6150.9-147.6152.487.600116.1
172Q32Very low34.8Very low190 Ų190144.7 Ų144.789%0.88880%0.804SS**  trans-105.9116.8158.6-76-168.1-27.800110.4
173S38Very low34.6Very low107 Ų107142.2 Ų142.275%0.74880%0.8SS**  trans-49.1149.2143.340.30000111.2
174P37.8Very low34.7Very low119 Ų119142 Ų14277%0.77380%0.8SS**  trans-113.3122151.425.9-11.4000110.3Q176P174-Q176 PolarHBondContact O-N 3.24Å
175Q34.7Very low34.6Very low177 Ų177139.7 Ų139.783%0.82779%0.793SS**  trans-47.5129.7153.8-70.7167.9-0.300108.9L177Q175-L177 PolarHBondContact O-N 3.33Å
176Q33.8Very low34.5Very low197 Ų197140.6 Ų140.692%0.92179%0.793SS**  trans-71.193.8171.3-73.3-134.6-38.600109.7P174P174-Q176 PolarHBondContact O-N 3.24Å
177L35.2Very low34.6Very low149 Ų149141.5 Ų141.578%0.7879%0.787SS**  trans-100.4137.4148.2-65.6176.1000107.2Q175Q175-L177 PolarHBondContact O-N 3.33Å
178S37Very low34.8Very low120 Ų120140.3 Ų140.384%0.83979%0.785SS**  trans-41.8143.1-174.2-390000114.7
179P38Very low34.9Very low123 Ų123142.6 Ų142.680%0.79979%0.792SS**  trans-111.1122.5154.732-19.6000110.7
180T34.8Very low35Very low130 Ų130138.7 Ų138.780%0.79879%0.787SS**  trans-55.1144.8161.653.70000111.3S182T180-S182 PolarHBondContact O-N 3.17Å
181L41.4Very low35.3Very low165 Ų165141.1 Ų141.186%0.86480%0.8SS**SBendtrans-21119.7160.3-59.3167.6000114.1
182S32.1Very low35.1Very low123 Ų123140.2 Ų140.286%0.8680%0.795SS**  trans176.3113.5145.2-76.50000110.8T180T180-S182 PolarHBondContact O-N 3.17Å
183S31.4Very low35.5Very low104 Ų104138.2 Ų138.273%0.72780%0.796SS**  trans-84.2135169174.70000110.2
184P37.1Very low35.5Very low120 Ų120140 Ų14078%0.77979%0.793SS**  trans-93.111215730.5-24.1000109.8N186P184-N186 PolarHBondContact O-N 3.31Å
185V34.3Very low35.8Very low122 Ų122140.6 Ų140.674%0.73979%0.794SS**  trans-68.3117.9165.6177.70000107.9I187V185-I187 HydrophobicContact CG1-CG1 3.97Å
186N31.2Very low36.6Very low149 Ų149137.7 Ų137.780%0.79778%0.784SS**  trans-102.6108.6169.8-142.8-22.3000108.3P184 T188P184-N186 PolarHBondContact O-N 3.31Å; N186-T188 PolarHBondContact O-N 3.39Å
187I34.4Very low38Very low139 Ų139132.4 Ų132.471%0.71377%0.765SS**  trans-84.9100.4175.5-60.8170.7000106.9V185V185-I187 HydrophobicContact CG1-CG1 3.97Å
188T33.6Very low39.4Very low115 Ų115128.7 Ų128.771%0.70675%0.746SS**  trans-123.9103.5160.9-47.70000108.3N186 A190N186-T188 PolarHBondContact O-N 3.39Å; T188-A190 PolarHBondContact O-N 3.33Å
189Q34.6Very low40.9Very low186 Ų186127.6 Ų127.687%0.86973%0.727SS**  trans-63.8110.9162.9-66.5170.8-12.100107.7
190A33Very low42.3Very low74 Ų74127.2 Ų127.261%0.61272%0.715SS**  trans-144.9108.316400000109.2T188 Q192T188-A190 PolarHBondContact O-N 3.33Å; A190-Q192 PolarHBondContact O-N 3.39Å
191L40Very low43.8Very low176 Ų176124.9 Ų124.992%0.92170%0.695SS**  trans-55.496.1163.9-175.775.3000108.8
192Q33.1Very low45Very low159 Ų159118.9 Ų118.974%0.74366%0.664SS**  trans-134.2112.9161.9-75.4-169.6-1.500108.2A190 E194A190-Q192 PolarHBondContact O-N 3.39Å; Q192-E194 PolarHBondContact O-N 3.04Å
193T40.1Very low46.7Very low148 Ų148115 Ų11591%0.90864%0.637SS**  trans-70.673165.650.20000108.2
194E38.3Very low48.4Very low146 Ų146117.7 Ų117.768%0.68264%0.638SS**  trans-99.4122.7162.8-148.6-166.6157.800106.9Q192 L196Q192-E194 PolarHBondContact O-N 3.04Å; E194-L196 VanDerWaalsContact C-N 3.26Å; E194-L196 PolarHBondContact O-N 3.26Å
195T42.8Very low49.9Very low130 Ų130116.9 Ų116.980%0.79862%0.62SS**  trans-63.591.9173.447.20000107.9T197T195-T197 PolarHBondContact O-N 3.46Å; T195-T197 VanDerWaalsContact O-N 3.14Å
196L53.3Low51.6Low116 Ų116116.3 Ų116.361%0.60762%0.619SS**  trans-49.9122.8172.9-66.9164.6000107.6E194E194-L196 VanDerWaalsContact C-N 3.26Å; E194-L196 PolarHBondContact O-N 3.26Å
197T63Low53.5Low86 Ų86115.5 Ų115.553%0.52861%0.614SS.*  trans-60.6141.9175.460.30000108T195 E199 Q200 Q201T195-T197 PolarHBondContact O-N 3.46Å; T195-T197 VanDerWaalsContact O-N 3.14Å; T197-E199 PolarHBondContact O-N 3.1Å; T197-Q200 WeakPolarHBondContact O-CB 3.37Å; T197-Q200 PolarHBondContact O-N 3.45Å; T197-Q201 PolarHBondContact O-N 3.37Å
198L64.9Low55.4Low71 Ų71109.5 Ų109.537%0.37258%0.582SS.*Hα-helixtrans-49.5-34.6-177.6178.473000112.6Q201 L202 L220 L223L198-Q201 PolarHBondContact O-N 3.38Å; L198-L202 HydrophobicContact CG-CD1 4.14Å; L198-L202 VanDerWaalsContact O-CG 3.32Å; L198-L202 WeakPolarHBondContact O-CG 3.43Å; L198-L202 PolarHBondContact O-N 3.15Å; L198-L220 HydrophobicContact CD2-CD1 3.87Å; L198-L220 HydrophobicContact CG-CD1 4.42Å; L198-L223 HydrophobicContact CD1-CD2 3.88Å; L198-L223 HydrophobicContact CD2-CB 4.22Å; L198-L223 HydrophobicContact CD2-CD2 3.43Å; L198-L223 VanDerWaalsContact CD2-CD2 3.43Å; L198-L223 HydrophobicContact CD2-CG 4.23Å; L198-L223 HydrophobicContact CG-CD2 4.15Å
199E67.9Low57.2Low97 Ų97109.6 Ų109.645%0.45358%0.578SS.*Hα-helixtrans-62.5-40.7176.4-168.1-134.4113.300113T197 Q201 L202 S203T197-E199 PolarHBondContact O-N 3.1Å; E199-Q201 VanDerWaalsContact C-N 3.32Å; E199-Q201 PolarHBondContact O-N 3.03Å; E199-L202 PolarHBondContact O-N 3.02Å; E199-S203 WeakPolarHBondContact O-CB 3.35Å; E199-S203 PolarHBondContact O-N 3.12Å; E199-S203 PolarHBondContact O-OG 2.99Å
200Q66.1Low59Low115 Ų115108.8 Ų108.854%0.53758%0.575SS.*Hα-helixtrans-68.1-34.5179.3-153.596.367.600111.5T197T197-Q200 WeakPolarHBondContact O-CB 3.37Å; T197-Q200 PolarHBondContact O-N 3.45Å
201Q66.7Low61.1Low81 Ų81108.7 Ų108.738%0.37956%0.564SS.*Hα-helixtrans-72.5-36.9176.4-166.6177.1-46.300111.7T197 L198 E199 Q204 Y205T197-Q201 PolarHBondContact O-N 3.37Å; L198-Q201 PolarHBondContact O-N 3.38Å; E199-Q201 VanDerWaalsContact C-N 3.32Å; E199-Q201 PolarHBondContact O-N 3.03Å; Q201-Q204 WeakPolarHBondContact O-CB 3.25Å; Q201-Q204 PolarHBondContact O-N 2.76Å; Q201-Y205 WeakPolarHBondContact O-CD2 3.48Å
202L68.1Low62.9Low40 Ų40104.7 Ų104.721%0.20955%0.547CS..Hα-helixtrans-71.8-32.7176.4-69.5173.7000112.3L198 E199 Q204 Y205 F208L198-L202 HydrophobicContact CG-CD1 4.14Å; L198-L202 VanDerWaalsContact O-CG 3.32Å; L198-L202 WeakPolarHBondContact O-CG 3.43Å; L198-L202 PolarHBondContact O-N 3.15Å; E199-L202 PolarHBondContact O-N 3.02Å; L202-Q204 PolarHBondContact O-N 3.14Å; L202-Y205 WeakPolarHBondContact O-CB 3.29Å; L202-Y205 PolarHBondContact O-N 3.32Å; L202-F208 HydrophobicContact CB-CD1 4.16Å; L202-F208 HydrophobicContact CB-CD2 4.08Å; L202-F208 HydrophobicContact CB-CE1 4.19Å; L202-F208 HydrophobicContact CB-CE2 4.12Å; L202-F208 HydrophobicContact CB-CG 4.1Å; L202-F208 HydrophobicContact CB-CZ 4.17Å; L202-F208 HydrophobicContact CD1-CE2 4.16Å; L202-F208 HydrophobicContact CD1-CZ 4.47Å; L202-F208 VanDerWaalsContact O-CB 3.28Å; L202-F208 WeakPolarHBondContact O-CB 3.47Å
203S66.6Low64.7Low42 Ų42102 Ų10229%0.29454%0.543SS..THydrogen-bonded Turntrans-65.3-15.7174.8-62.50000113.8E199 Y205E199-S203 WeakPolarHBondContact O-CB 3.35Å; E199-S203 PolarHBondContact O-N 3.12Å; E199-S203 PolarHBondContact O-OG 2.99Å; S203-Y205 PolarHBondContact O-N 3.2Å
204Q67.6Low66.2Low160 Ų160102.8 Ų102.875%0.74854%0.536SS*.THydrogen-bonded Turntrans-73.6-14.4172.8-130.8-172.4108.700112.6Q201 L202Q201-Q204 WeakPolarHBondContact O-CB 3.25Å; Q201-Q204 PolarHBondContact O-N 2.76Å; L202-Q204 PolarHBondContact O-N 3.14Å
205Y68.8Low67.9Low102 Ų10297.7 Ų97.740%0.452%0.519SS..SBendtrans-93.3118.8177.4-67.4-87.3000110.4Q201 L202 S203 L207 F208Q201-Y205 WeakPolarHBondContact O-CD2 3.48Å; L202-Y205 WeakPolarHBondContact O-CB 3.29Å; L202-Y205 PolarHBondContact O-N 3.32Å; S203-Y205 PolarHBondContact O-N 3.2Å; Y205-L207 PolarHBondContact O-N 3.39Å; Y205-L207 VanDerWaalsContact O-N 3.08Å; Y205-F208 WeakPolarHBondContact O-CB 3.44Å; Y205-F208 PolarHBondContact O-N 3.43Å
206P69.3Low69.6Low110 Ų11093.9 Ų93.971%0.71449%0.492SS*.THydrogen-bonded Turntrans-61.9-23.1-178.723.3-32.4000112.9
207L70.8Confident70.7Confident133 Ų13391 Ų9170%0.69649%0.485SS*.THydrogen-bonded Turntrans-66.9-34.6174.1-168.969.4000112.4Y205 Q210Y205-L207 PolarHBondContact O-N 3.39Å; Y205-L207 VanDerWaalsContact O-N 3.08Å; L207-Q210 PolarHBondContact O-N 3.38Å
208F74.6Confident71.2Confident12 Ų1293.2 Ų93.25%0.05349%0.49CS..G310 helixtrans-68.9-37.3179.6-173.7-102.7000111.4L202 Y205 Q210 L211 Q216L202-F208 HydrophobicContact CB-CD1 4.16Å; L202-F208 HydrophobicContact CB-CD2 4.08Å; L202-F208 HydrophobicContact CB-CE1 4.19Å; L202-F208 HydrophobicContact CB-CE2 4.12Å; L202-F208 HydrophobicContact CB-CG 4.1Å; L202-F208 HydrophobicContact CB-CZ 4.17Å; L202-F208 HydrophobicContact CD1-CE2 4.16Å; L202-F208 HydrophobicContact CD1-CZ 4.47Å; L202-F208 VanDerWaalsContact O-CB 3.28Å; L202-F208 WeakPolarHBondContact O-CB 3.47Å; Y205-F208 WeakPolarHBondContact O-CB 3.44Å; Y205-F208 PolarHBondContact O-N 3.43Å; F208-Q210 PolarHBondContact O-N 3.45Å; F208-L211 HydrophobicContact CD2-CD1 4.19Å; F208-L211 WeakPolarHBondContact O-CB 3.49Å; F208-L211 PolarHBondContact O-N 2.77Å; F208-Q216 HydrophobicContact CD1-CG 4.22Å; F208-Q216 VanDerWaalsContact CD1-NE2 3.28Å; F208-Q216 HydrophobicContact CD2-CG 4.26Å; F208-Q216 HydrophobicContact CE1-CB 4.4Å; F208-Q216 HydrophobicContact CE1-CG 3.71Å; F208-Q216 VanDerWaalsContact CE1-NE2 3.27Å; F208-Q216 HydrophobicContact CE2-CB 4.21Å; F208-Q216 HydrophobicContact CE2-CG 3.76Å; F208-Q216 HydrophobicContact CG-CG 4.48Å; F208-Q216 HydrophobicContact CZ-CB 3.8Å; F208-Q216 HydrophobicContact CZ-CG 3.45Å; F208-Q216 VanDerWaalsContact CZ-CG 3.45Å; F208-Q216 PolarHBondContact O-NE2 3.08Å
209N72.7Confident71.7Confident117 Ų11793.4 Ų93.463%0.62649%0.491SS*.G310 helixtrans-71.4-14.5176.1-101.519000114.4
210Q71.7Confident72Confident169 Ų16991.3 Ų91.379%0.7948%0.482SS*.G310 helixtrans-85.3-10.1173.8-83.2-120.5103.700113.3L207 F208L207-Q210 PolarHBondContact O-N 3.38Å; F208-Q210 PolarHBondContact O-N 3.45Å
211L76.1Confident72.2Confident72 Ų7288.8 Ų88.838%0.37748%0.477SS..SBendtrans-79.1144.4178.8-67.8164.3000110.7F208 A215 Q216F208-L211 HydrophobicContact CD2-CD1 4.19Å; F208-L211 WeakPolarHBondContact O-CB 3.49Å; F208-L211 PolarHBondContact O-N 2.77Å; L211-A215 HydrophobicContact CB-CB 4.29Å; L211-A215 HydrophobicContact CD2-CB 4.45Å; L211-Q216 HydrophobicContact CB-CG 4.2Å
212T77.5Confident72.2Confident92 Ų9290.4 Ų90.456%0.56449%0.488SS*.  trans-57.2143.6172.1-19.80000109.5Q214 A215 Q216T212-Q214 PolarHBondContact O-N 3.34Å; T212-A215 WeakPolarHBondContact O-CA 3.36Å; T212-A215 WeakPolarHBondContact O-CB 3.3Å; T212-A215 PolarHBondContact O-N 2.97Å; T212-Q216 PolarHBondContact O-N 3.47Å; T212-Q216 VanDerWaalsContact O-N 3.16Å
213P71.9Confident72.1Confident103 Ų10392.6 Ų92.667%0.66950%0.5SS*.Hα-helixtrans-54.3-31.2-178.8-2834.1000114.1A217P213-A217 PolarHBondContact O-N 3.02Å
214Q71.8Confident71.8Confident164 Ų16498.1 Ų98.177%0.76652%0.521SS*.Hα-helixtrans-66.7-36.7173.9-74.6167.4-30.600112.9T212 Q218T212-Q214 PolarHBondContact O-N 3.34Å; Q214-Q218 PolarHBondContact O-N 3.43Å; Q214-Q218 VanDerWaalsContact O-N 3.16Å
215A74.1Confident71.3Confident39 Ų3999.1 Ų99.132%0.32252%0.523SS..Hα-helixtrans-72.9-36.3177.900000111.8L211 T212 Q218 L219L211-A215 HydrophobicContact CB-CB 4.29Å; L211-A215 HydrophobicContact CD2-CB 4.45Å; T212-A215 WeakPolarHBondContact O-CA 3.36Å; T212-A215 WeakPolarHBondContact O-CB 3.3Å; T212-A215 PolarHBondContact O-N 2.97Å; A215-Q218 PolarHBondContact O-N 3.18Å; A215-L219 PolarHBondContact O-N 3.33Å; A215-L219 VanDerWaalsContact O-N 3.1Å
216Q77.6Confident70.2Confident51 Ų51100 Ų10024%0.23853%0.531CS..Hα-helixtrans-60.9-45.5172.1-76.9-170.5-4.800111.9F208 L211 T212 Q218 L219 L220F208-Q216 HydrophobicContact CD1-CG 4.22Å; F208-Q216 VanDerWaalsContact CD1-NE2 3.28Å; F208-Q216 HydrophobicContact CD2-CG 4.26Å; F208-Q216 HydrophobicContact CE1-CB 4.4Å; F208-Q216 HydrophobicContact CE1-CG 3.71Å; F208-Q216 VanDerWaalsContact CE1-NE2 3.27Å; F208-Q216 HydrophobicContact CE2-CB 4.21Å; F208-Q216 HydrophobicContact CE2-CG 3.76Å; F208-Q216 HydrophobicContact CG-CG 4.48Å; F208-Q216 HydrophobicContact CZ-CB 3.8Å; F208-Q216 HydrophobicContact CZ-CG 3.45Å; F208-Q216 VanDerWaalsContact CZ-CG 3.45Å; F208-Q216 PolarHBondContact O-NE2 3.08Å; L211-Q216 HydrophobicContact CB-CG 4.2Å; T212-Q216 PolarHBondContact O-N 3.47Å; T212-Q216 VanDerWaalsContact O-N 3.16Å; Q216-Q218 VanDerWaalsContact C-N 3.32Å; Q216-Q218 PolarHBondContact O-N 2.94Å; Q216-L219 PolarHBondContact O-N 3.32Å; Q216-L220 WeakPolarHBondContact O-CB 3.44Å; Q216-L220 PolarHBondContact O-N 3.5Å
217A76.4Confident68.9Low54 Ų54100.5 Ų100.545%0.44653%0.534SS..Hα-helixtrans-64.8-35.6-179.800000112.8P213 S221P213-A217 PolarHBondContact O-N 3.02Å; A217-S221 WeakPolarHBondContact O-CB 3.17Å; A217-S221 PolarHBondContact O-N 2.89Å; A217-S221 PolarHBondContact O-OG 3.26Å; A217-S221 VanDerWaalsContact O-OG 3.04Å
218Q74.9Confident67.9Low134 Ų13499 Ų9963%0.62654%0.54SS*.Hα-helixtrans-67.7-45.6176.5-165.775.1-13.200111.4Q214 A215 Q216 L220 S221 D222Q214-Q218 PolarHBondContact O-N 3.43Å; Q214-Q218 VanDerWaalsContact O-N 3.16Å; A215-Q218 PolarHBondContact O-N 3.18Å; Q216-Q218 VanDerWaalsContact C-N 3.32Å; Q216-Q218 PolarHBondContact O-N 2.94Å; Q218-L220 VanDerWaalsContact C-N 3.34Å; Q218-L220 PolarHBondContact O-N 3.14Å; Q218-S221 PolarHBondContact O-N 2.93Å; Q218-D222 WeakPolarHBondContact O-CB 3.46Å; Q218-D222 PolarHBondContact O-N 3.25Å
219L74.1Confident66.1Low75 Ų75103.7 Ų103.739%0.39357%0.565SS.*Hα-helixtrans-63.5-41.2179-148.7177.9000111.2A215 Q216 S221 D222 L223A215-L219 PolarHBondContact O-N 3.33Å; A215-L219 VanDerWaalsContact O-N 3.1Å; Q216-L219 PolarHBondContact O-N 3.32Å; L219-S221 VanDerWaalsContact C-N 3.35Å; L219-S221 PolarHBondContact O-N 3.06Å; L219-D222 PolarHBondContact O-N 2.87Å; L219-L223 PolarHBondContact O-N 2.87Å
220L75.5Confident64.3Low53 Ų53103.3 Ų103.328%0.27757%0.569SS.*Hα-helixtrans-66.3-37.8177-165.667.5000112L198 Q216 Q218 Q224L198-L220 HydrophobicContact CD2-CD1 3.87Å; L198-L220 HydrophobicContact CG-CD1 4.42Å; Q216-L220 WeakPolarHBondContact O-CB 3.44Å; Q216-L220 PolarHBondContact O-N 3.5Å; Q218-L220 VanDerWaalsContact C-N 3.34Å; Q218-L220 PolarHBondContact O-N 3.14Å; L220-Q224 PolarHBondContact O-N 3.36Å
221S69.1Low62.8Low61 Ų61105.2 Ų105.243%0.42758%0.578SS.*Hα-helixtrans-69-36175.5-70.50000112.9A217 Q218 L219 K225A217-S221 WeakPolarHBondContact O-CB 3.17Å; A217-S221 PolarHBondContact O-N 2.89Å; A217-S221 PolarHBondContact O-OG 3.26Å; A217-S221 VanDerWaalsContact O-OG 3.04Å; Q218-S221 PolarHBondContact O-N 2.93Å; L219-S221 VanDerWaalsContact C-N 3.35Å; L219-S221 PolarHBondContact O-N 3.06Å; S221-K225 PolarHBondContact O-N 3.05Å
222D67.8Low61.2Low116 Ų116104.9 Ų104.962%0.6259%0.593SS**Hα-helixtrans-66.5-45.4177.8-148.4-73.7000110.5Q218 L219 Q224 K225Q218-D222 WeakPolarHBondContact O-CB 3.46Å; Q218-D222 PolarHBondContact O-N 3.25Å; L219-D222 PolarHBondContact O-N 2.87Å; D222-Q224 VanDerWaalsContact C-N 3.26Å; D222-Q224 PolarHBondContact O-N 3.43Å; D222-K225 PolarHBondContact O-N 3.07Å; D222-K225 VanDerWaalsContact O-N 3.07Å
223L66Low59.7Low86 Ų86107 Ų10745%0.4560%0.599SS.*Hα-helixtrans-68.6-23.1-179.9-143.567.1000113.6L198 L219L198-L223 HydrophobicContact CD1-CD2 3.88Å; L198-L223 HydrophobicContact CD2-CB 4.22Å; L198-L223 HydrophobicContact CD2-CD2 3.43Å; L198-L223 VanDerWaalsContact CD2-CD2 3.43Å; L198-L223 HydrophobicContact CD2-CG 4.23Å; L198-L223 HydrophobicContact CG-CD2 4.15Å; L219-L223 PolarHBondContact O-N 2.87Å
224Q60.6Low58Low158 Ų158110.7 Ų110.774%0.73861%0.607SS**Hα-helixtrans-83.6-15.8173.2-76.5-160.7-31.400114.3L220 D222L220-Q224 PolarHBondContact O-N 3.36Å; D222-Q224 VanDerWaalsContact C-N 3.26Å; D222-Q224 PolarHBondContact O-N 3.43Å
225K55.1Low56.5Low180 Ų180107.4 Ų107.478%0.78360%0.595SS**SBendtrans-86.5-6.2-176.2-114.1155.8172.61740114.3S221 D222S221-K225 PolarHBondContact O-N 3.05Å; D222-K225 PolarHBondContact O-N 3.07Å; D222-K225 VanDerWaalsContact O-N 3.07Å
226Q46.3Very low54.6Low122 Ų122112.8 Ų112.857%0.5762%0.616SS**SBendtrans-82.7129.7176.7-127.5-178.2-16.100111.1A228Q226-A228 PolarHBondContact O-N 3.11Å
227P43.1Very low52.5Low120 Ų120114.6 Ų114.678%0.77964%0.64SS**  trans-69.5114.8173.8-0.214.6000109.2L229P227-L229 PolarHBondContact O-N 3.23Å
228A48.4Very low50.3Low101 Ų101119.2 Ų119.284%0.83566%0.656SS**  trans26.883.8163.800000116.7Q226Q226-A228 PolarHBondContact O-N 3.11Å
229L37Very low48.3Very low110 Ų110118.6 Ų118.658%0.57666%0.664SS**  trans-76.4143.1156.1-115.1110.2000109.5P227P227-L229 PolarHBondContact O-N 3.23Å
230P34.4Very low46.2Very low109 Ų109121.3 Ų121.371%0.70868%0.684SS**  trans-63.5142.7179.427.3-32.8000110.3G232P230-G232 PolarHBondContact O-N 3.18Å
231Q42.1Very low44Very low209 Ų209127.4 Ų127.498%0.97772%0.716SS**SBendtrans-57.195.4177.1-58.5-136-42.900110.4
232G41.4Very low42.2Very low66 Ų66128.7 Ų128.768%0.6873%0.73SS**  trans-166.910.4-17100000117.2P230 Q234P230-G232 PolarHBondContact O-N 3.18Å; G232-Q234 PolarHBondContact O-N 3.41Å
233I45.2Very low40.4Very low137 Ų137128.7 Ų128.770%0.70374%0.739SS**  trans-93.880.7167.2-51.1-174.8000107.9L235I233-L235 PolarHBondContact O-N 3.17Å
234Q38.2Very low38.6Very low179 Ų179130.5 Ų130.584%0.83676%0.759SS**  trans-71.6110.8152.2-71.3-142.89300106.4G232 I236G232-Q234 PolarHBondContact O-N 3.41Å; Q234-I236 PolarHBondContact O-N 3.08Å; Q234-I236 VanDerWaalsContact O-N 3.13Å
235L39.2Very low37.2Very low96 Ų96126.3 Ų126.350%0.50376%0.758SS.*  trans-53119.6163.8-85131.4000107.1I233 A237I233-L235 PolarHBondContact O-N 3.17Å; L235-A237 PolarHBondContact O-N 3.3Å
236I34.3Very low36Very low152 Ų152124.8 Ų124.878%0.77976%0.764SS**  trans-55.8105.2170.6-96.567.3000106.5Q234 L238Q234-I236 PolarHBondContact O-N 3.08Å; Q234-I236 VanDerWaalsContact O-N 3.13Å; I236-L238 PolarHBondContact O-N 3.34Å
237A33.6Very low35.2Very low89 Ų89123.7 Ų123.774%0.73678%0.776SS**PPolyproline II helixtrans-73.3117163.500000106.3L235L235-A237 PolarHBondContact O-N 3.3Å
238L30Very low34.6Very low151 Ų151124.7 Ų124.779%0.79178%0.78SS**PPolyproline II helixtrans-57.6127.6168.6-139.173.7000107.5I236 T240I236-L238 PolarHBondContact O-N 3.34Å; L238-T240 PolarHBondContact O-N 2.82Å
239P32.3Very low33.7Very low121 Ų121124.2 Ų124.279%0.78678%0.776SS**PPolyproline II helixtrans-65.6116.7-179.623.9-29.8000109.1
240T30.4Very low33.2Very low132 Ų132124.5 Ų124.581%0.8179%0.787SS**PPolyproline II helixtrans-62.4131.3160.127.70000108L238 A242L238-T240 PolarHBondContact O-N 2.82Å; T240-A242 PolarHBondContact O-N 3.25Å
241L30.3Very low32.9Very low181 Ų181124.6 Ų124.695%0.94879%0.79SS**  trans-57.198.9-179.8-161.672.1000109.4S243L241-S243 PolarHBondContact O-N 3.06Å
242A30.6Very low32.8Very low88 Ų88120 Ų12073%0.72778%0.779SS**  trans-71.1119.8176.100000108.6T240 S244T240-A242 PolarHBondContact O-N 3.25Å; A242-S244 PolarHBondContact O-N 3.34Å
243S30.9Very low32.2Very low116 Ų116122.3 Ų122.381%0.81178%0.784SS**  trans-53.5124.8167.358.30000109.6L241 G245L241-S243 PolarHBondContact O-N 3.06Å; S243-G245 PolarHBondContact O-N 3.48Å
244S27.9Very low32.1Very low124 Ų124120.8 Ų120.887%0.86778%0.783SS**  trans-52.8102.6-178.9-41.60000111.7A242A242-S244 PolarHBondContact O-N 3.34Å
245G29.8Very low31.6Very low70 Ų70119.2 Ų119.272%0.72278%0.781SS**  trans-75.3129.3163.200000109.5S243 A247S243-G245 PolarHBondContact O-N 3.48Å; G245-A247 PolarHBondContact O-N 3.12Å
246T31.1Very low31.1Very low147 Ų147119.9 Ų119.990%0.90279%0.793SS**  trans-60.8113175.944.90000111.2
247A28.6Very low30.8Very low100 Ų100121.2 Ų121.283%0.82680%0.797SS**  trans-96.8119.9169.200000110.7G245G245-A247 PolarHBondContact O-N 3.12Å
248T32.1Very low30.5Very low141 Ų141122.4 Ų122.487%0.86580%0.795SS**  trans-74123.3165.147.90000110.6
249A28.3Very low30.3Very low90 Ų90121.2 Ų121.274%0.74479%0.794SS**  trans-166.4114.7155.700000113.1
250S26.9Very low30.1Very low116 Ų116119.5 Ų119.581%0.81179%0.79SS**  trans44.7122.2137.251.70000122.6
251S28.9Very low29.9Very low111 Ų111118.3 Ų118.378%0.77679%0.787SS**  trans-55168.7164.464.80000115.8
252P39.8Very low29.9Very low114 Ų114118.6 Ų118.674%0.7479%0.786SS**  -146.7141.867.133.2-10.8000119
253S28Very low29.9Very low113 Ų113120.1 Ų120.179%0.7979%0.791SS**  trans65.3162.9139.5-50.20000122.6
254P43.1Very low29.8Very low105 Ų105121.4 Ų121.468%0.68279%0.788SS**  cis-133.5174.1-42.637.3-19.6000114.8
255D27.2Very low29.9Very low147 Ų147120.9 Ų120.979%0.78678%0.784SS**  trans84.4111.4152.6-63.2-34.3000123.9
256S29.9Very low29.8Very low109 Ų109122.6 Ų122.676%0.76278%0.784SS**  trans98.7100.3130.7-63.70000122.4
257Q27.3Very low29.7Very low181 Ų181125.9 Ų125.985%0.84678%0.782SS**  69.4113.3127.2-89.9-171.423.200123.7
258T26.8Very low29.7Very low113 Ų113132.8 Ų132.869%0.69379%0.787SS**  79.2110.6129.2-32.80000119.4
259T27.1Very low29.6Very low126 Ų126132.1 Ų132.177%0.77378%0.778SS**  150130.3108.7-50.50000113.1
260A27.5Very low29.8Very low85 Ų85135.4 Ų135.470%0.70278%0.778SS**  trans64.2105.1153.800000121.7
261S27Very low30.2Very low108 Ų108136.1 Ų136.176%0.75578%0.777SS**  trans-30140.313846.80000116.6
262M30Very low30.3Very low186 Ų186134.7 Ų134.792%0.91678%0.78SS**  -171.2116.1128.9-99.5172.4-152.600111.2
263S29.1Very low30Very low120 Ų120135.2 Ų135.284%0.83979%0.786SS**  trans-85.7128.2165.7-51.40000109.2
264I30Very low31.1Very low144 Ų144135.8 Ų135.874%0.73879%0.788SS**  trans-136.9104.2159.7-70.6-175.2000109.1
265S28.9Very low30.7Very low112 Ų112135 Ų13578%0.78379%0.79SS**  trans-78.7119.3154.3-47.90000107.4
266S28.6Very low31.1Very low106 Ų106134.7 Ų134.774%0.74179%0.793SS**  trans-120.893.417355.40000111
267Y29.6Very low31.6Very low217 Ų217139.1 Ų139.185%0.85180%0.802SS**  trans-52.8134.2156.2-86.7-102.3000110.5
268R27.6Very low32Very low245 Ų245135.4 Ų135.493%0.92580%0.796SS**  trans-129112.1151.5-177.6171.4-113.4-138.1-2.4107.7
269N30.4Very low32.9Very low126 Ų126136.1 Ų136.167%0.67480%0.803SS**  trans-120.3174.5168.8-131.8-39.1000107.9
270Q32.3Very low33.8Very low159 Ų159136.9 Ų136.974%0.74381%0.807SS**  trans94123.2174.8-47.3-5681.100114.1
271T34.3Very low34.4Very low132 Ų132137.7 Ų137.781%0.8181%0.808SS**  cis-171.5142.91531.80000110.5
272G31.1Very low35.4Very low80 Ų80138.2 Ų138.283%0.82581%0.808SS**  trans170.5107.1164.600000112.8
273S35Very low35.9Very low126 Ų126135.6 Ų135.688%0.88180%0.802SS**  trans-70.7172.2-162.9-76.40000118.2
274P49.6Very low36.4Very low125 Ų125135.1 Ų135.181%0.81280%0.799SS**  trans-106151.5-150.339.8-31.3000114.2
275A34.6Very low36.8Very low88 Ų88135.4 Ų135.473%0.72780%0.803SS**  trans-168.4144.6151.900000111
276T36.9Very low37.4Very low140 Ų140138.8 Ų138.886%0.85981%0.806SS**  trans71.787169.870.10000117.4
277Q39.2Very low37.7Very low203 Ų203137 Ų13795%0.94981%0.805SS**  trans-71.7129.6156.5-71173.9-28.300109.7
278S35.5Very low38.3Very low102 Ų102137 Ų13771%0.71381%0.809SS**  trans-124.4138.815442.80000107.4T280S278-T280 PolarHBondContact O-N 3.39Å
279P47.1Very low38.9Very low129 Ų129130.3 Ų130.384%0.83880%0.8SS**PPolyproline II helixtrans-75.4118.4-178.728.7-31000109.9S281P279-S281 PolarHBondContact O-N 2.82Å
280T45.8Very low39.8Very low142 Ų142131 Ų13187%0.87181%0.812SS**PPolyproline II helixtrans-71.1119.8165.2-25.30000108.2S278S278-T280 PolarHBondContact O-N 3.39Å
281S39.4Very low40.6Very low102 Ų102127 Ų12771%0.71381%0.814SS**PPolyproline II helixtrans-54.2152175-56.60000112.4P279P279-S281 PolarHBondContact O-N 2.82Å
282P47.8Very low40.6Very low118 Ų118124.5 Ų124.577%0.76681%0.814SS**PPolyproline II helixtrans-63.7140171.727.5-32.6000109.9S284P282-S284 PolarHBondContact O-N 3.02Å; P282-S284 VanDerWaalsContact O-N 3.11Å
283V41.4Very low40.7Very low131 Ų131125.9 Ų125.979%0.79481%0.81SS**  trans-52.9115.7166.5131.50000108.1N285V283-N285 PolarHBondContact O-N 3.38Å
284S38.5Very low41.1Very low111 Ų111126 Ų12678%0.77681%0.809SS**  trans-68.6108.3165.1-69.80000107.5P282 Q286P282-S284 PolarHBondContact O-N 3.02Å; P282-S284 VanDerWaalsContact O-N 3.11Å; S284-Q286 PolarHBondContact O-N 3.06Å
285N38.6Very low40.6Very low150 Ų150128.4 Ų128.480%0.80281%0.809SS**PPolyproline II helixtrans-58.6128.3157.5-92.31.7000107.4V283 G287V283-N285 PolarHBondContact O-N 3.38Å; N285-G287 PolarHBondContact O-N 3.35Å
286Q42.5Very low40.7Very low182 Ų182131.9 Ų131.985%0.8581%0.81SS**PPolyproline II helixtrans-52.9136.2-174-64.2-162.412.200111.5S284S284-Q286 PolarHBondContact O-N 3.06Å
287G35.4Very low40.7Very low70 Ų70132.6 Ų132.672%0.72281%0.807SS**PPolyproline II helixtrans-60.4137.617300000110.9N285 S289N285-G287 PolarHBondContact O-N 3.35Å; G287-S289 PolarHBondContact O-N 3.5Å
288F42.1Very low40.8Very low215 Ų215127.7 Ų127.794%0.94379%0.792SS**  trans-69103.6160.8-74.1-88.8000108.2
289S39Very low41.3Very low106 Ų106129 Ų12974%0.74180%0.796SS**  trans-73.6142.7154.7-69.40000109.1G287 G291G287-S289 PolarHBondContact O-N 3.5Å; S289-G291 PolarHBondContact O-N 3.1Å
290P48.9Very low41.3Very low140 Ų140129.8 Ų129.891%0.90980%0.798SS**SBendtrans-84.689.3177.933.9-28.9000108.8
291G49.8Very low41.5Very low76 Ų76126 Ų12678%0.78479%0.788SS**  trans-169.590.417800000110.7S289S289-G291 PolarHBondContact O-N 3.1Å
292G34.9Very low41.4Very low79 Ų79126.5 Ų126.581%0.81479%0.791SS**  trans174.6106.3176.800000111.7
293S33.4Very low41.6Very low108 Ų108128.2 Ų128.276%0.75579%0.792SS**  trans-58.2151.6170.7-53.80000111.9Q295S293-Q295 PolarHBondContact O-N 3.37Å
294P42.9Very low42.1Very low130 Ų130131.2 Ų131.284%0.84480%0.795SS**  trans-77.911317830.1-28.1000109.7
295Q38.5Very low42.8Very low174 Ų174129.2 Ų129.281%0.81379%0.791SS**  trans-112130.3166.7-75.4-802700109.8S293S293-Q295 PolarHBondContact O-N 3.37Å
296H37.4Very low43.2Very low161 Ų161127 Ų12775%0.74578%0.779SS**PPolyproline II helixtrans-65.9124.2-169.9174.7-99.4000113.2
297I37.3Very low43.7Very low156 Ų156123.3 Ų123.380%0.877%0.774SS**PPolyproline II helixtrans-91.6129.5164.5-64.2173000107.7
298P40.2Very low44.6Very low99 Ų99126.5 Ų126.564%0.64377%0.768SS**PPolyproline II helixtrans-75.7139.4-175.231.2-32.6000111.7V300P298-V300 PolarHBondContact O-N 3.03Å
299V46.3Very low45.3Very low129 Ų129122.7 Ų122.778%0.78275%0.748SS**  trans-44.9117.6172.6168.10000113
300V46.5Very low46.2Very low146 Ų146123.2 Ų123.289%0.88574%0.743SS**  trans-130.894139.1-74.80000109.4P298P298-V300 PolarHBondContact O-N 3.03Å
301G49.5Very low46.6Very low64 Ų64122.8 Ų122.866%0.6673%0.729SS**  trans65.492.915200000118.6
302S37.7Very low47.2Very low111 Ų111124.2 Ų124.278%0.77672%0.715SS**  trans-147.5112.4142.3-159.70000110F304S302-F304 PolarHBondContact O-N 3.46Å
303I53Low48.6Very low155 Ų155125 Ų12580%0.79570%0.7SS**  trans-87.422.1-169.8-38.398.2000111.8
304F51.2Low49.8Very low194 Ų194121.8 Ų121.885%0.85168%0.68SS**SBendtrans-145110.1177.4-78.7-83.8000112S302S302-F304 PolarHBondContact O-N 3.46Å
305G54.3Low50.5Low68 Ų68118.2 Ų118.270%0.70166%0.659SS**  trans90.8100.2149.300000116.5
306D46.1Very low51.5Low103 Ų103119.1 Ų119.155%0.55165%0.654SS**  trans-150.728.6154.3-105.8-20000113.9F308 Y309 D310D306-F308 PolarHBondContact O-N 2.87Å; D306-F308 VanDerWaalsContact O-N 3.16Å; D306-F308 WeakPolarHBondContact OD1-CE1 3.28Å; D306-Y309 PolarHBondContact O-N 3.43Å; D306-D310 PolarHBondContact O-N 3.25Å
307S52.1Low52.5Low106 Ų106118.6 Ų118.674%0.74165%0.652SS**Hα-helixtrans-62.9-18.2171-58.80000113.1Q311S307-Q311 WeakPolarHBondContact O-CB 3.41Å; S307-Q311 PolarHBondContact O-N 2.85Å
308F55.1Low53.4Low137 Ų137115.7 Ų115.760%0.60164%0.642SS**Hα-helixtrans-80-35177.598.6-88000112D306 Q312D306-F308 PolarHBondContact O-N 2.87Å; D306-F308 VanDerWaalsContact O-N 3.16Å; D306-F308 WeakPolarHBondContact OD1-CE1 3.28Å; F308-Q312 WeakPolarHBondContact O-CB 3.48Å; F308-Q312 PolarHBondContact O-N 3.34Å
309Y56.5Low54.4Low134 Ų134115.5 Ų115.553%0.52564%0.635SS.*Hα-helixtrans-74.6-42-176.3-156.6-94.1000111D306 Q312 L313D306-Y309 PolarHBondContact O-N 3.43Å; Y309-Q312 PolarHBondContact O-N 3.35Å; Y309-L313 HydrophobicContact CD1-CD1 3.83Å; Y309-L313 HydrophobicContact CE1-CD1 3.86Å; Y309-L313 PolarHBondContact O-N 2.91Å
310D57.5Low55Low118 Ų118112 Ų11263%0.63162%0.62SS**Hα-helixtrans-66.5-40.5173.9-161.974.9000111.7D306 Q312 L313 A314D306-D310 PolarHBondContact O-N 3.25Å; D310-Q312 VanDerWaalsContact C-N 3.29Å; D310-Q312 PolarHBondContact O-N 3.33Å; D310-L313 PolarHBondContact O-N 3.24Å; D310-A314 WeakPolarHBondContact O-CB 3.44Å; D310-A314 PolarHBondContact O-N 3.04Å
311Q58.3Low55.9Low131 Ų131110.8 Ų110.861%0.61261%0.608SS**Hα-helixtrans-63.9-33.8173.6-171.477.893.600112.1S307 S315S307-Q311 WeakPolarHBondContact O-CB 3.41Å; S307-Q311 PolarHBondContact O-N 2.85Å; Q311-S315 VanDerWaalsContact O-CB 3.25Å; Q311-S315 WeakPolarHBondContact O-CB 3.32Å; Q311-S315 PolarHBondContact O-N 3.04Å; Q311-S315 PolarHBondContact O-OG 3.19Å
312Q61.5Low56.5Low106 Ų106110.9 Ų110.950%0.49560%0.598SS.*Hα-helixtrans-71.3-38.3176.3-155.4-175.819.100111.6F308 Y309 D310 S315 R316F308-Q312 WeakPolarHBondContact O-CB 3.48Å; F308-Q312 PolarHBondContact O-N 3.34Å; Y309-Q312 PolarHBondContact O-N 3.35Å; D310-Q312 VanDerWaalsContact C-N 3.29Å; D310-Q312 PolarHBondContact O-N 3.33Å; Q312-S315 WeakPolarHBondContact CA-OG 3.24Å; Q312-S315 PolarHBondContact O-OG 3.03Å; Q312-R316 VanDerWaalsContact O-CG 3.29Å; Q312-R316 WeakPolarHBondContact O-CG 3.39Å; Q312-R316 PolarHBondContact O-N 2.82Å; Q312-R316 VanDerWaalsContact O-N 3.1Å
313L64.3Low57.4Low95 Ų95110.3 Ų110.350%0.49758%0.584SS.*Hα-helixtrans-65.9-46.6172.4-86.6150.6000111.8Y309 D310 S315 R316 Q317Y309-L313 HydrophobicContact CD1-CD1 3.83Å; Y309-L313 HydrophobicContact CE1-CD1 3.86Å; Y309-L313 PolarHBondContact O-N 2.91Å; D310-L313 PolarHBondContact O-N 3.24Å; L313-S315 PolarHBondContact O-N 3.12Å; L313-R316 PolarHBondContact O-N 2.84Å; L313-Q317 PolarHBondContact O-N 2.83Å
314A58.5Low57.7Low41 Ų41109 Ų10934%0.33957%0.574SS.*Hα-helixtrans-64.5-37.8178.300000112.8D310 T318D310-A314 WeakPolarHBondContact O-CB 3.44Å; D310-A314 PolarHBondContact O-N 3.04Å; A314-T318 WeakPolarHBondContact O-CB 3.29Å; A314-T318 WeakPolarHBondContact O-CG2 3.47Å; A314-T318 PolarHBondContact O-N 3.47Å; A314-T318 PolarHBondContact O-OG1 3.16Å
315S58.6Low58.1Low55 Ų55105.5 Ų105.539%0.38556%0.564SS.*Hα-helixtrans-69.6-34.8175.556.60000112.4Q311 Q312 L313 T318 N319Q311-S315 VanDerWaalsContact O-CB 3.25Å; Q311-S315 WeakPolarHBondContact O-CB 3.32Å; Q311-S315 PolarHBondContact O-N 3.04Å; Q311-S315 PolarHBondContact O-OG 3.19Å; Q312-S315 WeakPolarHBondContact CA-OG 3.24Å; Q312-S315 PolarHBondContact O-OG 3.03Å; L313-S315 PolarHBondContact O-N 3.12Å; S315-T318 WeakPolarHBondContact CA-OG1 3.49Å; S315-T318 PolarHBondContact O-OG1 3.2Å; S315-N319 VanDerWaalsContact O-CB 3.29Å; S315-N319 WeakPolarHBondContact O-CB 3.42Å; S315-N319 PolarHBondContact O-N 3.49Å
316R59.7Low58.5Low193 Ų193108.4 Ų108.473%0.72856%0.559SS**Hα-helixtrans-70.4-37.1175-70.6-168.293.7-122.8-1.8112.7Q312 L313 A320Q312-R316 VanDerWaalsContact O-CG 3.29Å; Q312-R316 WeakPolarHBondContact O-CG 3.39Å; Q312-R316 PolarHBondContact O-N 2.82Å; Q312-R316 VanDerWaalsContact O-N 3.1Å; L313-R316 PolarHBondContact O-N 2.84Å; R316-A320 PolarHBondContact O-N 3.43Å
317Q58.9Low58.9Low150 Ų150109.7 Ų109.770%0.70156%0.562SS**Hα-helixtrans-70.5-40.1175.7-70.2-155-23.600113L313 L321L313-Q317 PolarHBondContact O-N 2.83Å; Q317-L321 PolarHBondContact O-N 3.47Å; Q317-L321 VanDerWaalsContact O-N 3.14Å
318T55.8Low58.7Low95 Ų95110 Ų11058%0.58355%0.55SS*.Hα-helixtrans-69.4-32.6177.246.20000112.6A314 S315 L321 S322A314-T318 WeakPolarHBondContact O-CB 3.29Å; A314-T318 WeakPolarHBondContact O-CG2 3.47Å; A314-T318 PolarHBondContact O-N 3.47Å; A314-T318 PolarHBondContact O-OG1 3.16Å; S315-T318 WeakPolarHBondContact CA-OG1 3.49Å; S315-T318 PolarHBondContact O-OG1 3.2Å; T318-L321 PolarHBondContact O-N 3.06Å; T318-S322 VanDerWaalsContact O-CB 3.24Å; T318-S322 WeakPolarHBondContact O-CB 3.16Å; T318-S322 PolarHBondContact O-N 3.16Å
319N59.9Low58.4Low94 Ų94108.8 Ų108.850%0.50355%0.55SS..Hα-helixtrans-67.6-41.3176.5-162.4-85.7000112.3S315 S322 H323S315-N319 VanDerWaalsContact O-CB 3.29Å; S315-N319 WeakPolarHBondContact O-CB 3.42Å; S315-N319 PolarHBondContact O-N 3.49Å; N319-S322 PolarHBondContact O-N 2.96Å; N319-H323 PolarHBondContact O-N 2.99Å; N319-H323 PolarHBondContact O-ND1 2.82Å; N319-H323 PolarHBondContact OD1-CE1 2.85Å; N319-H323 PolarHBondContact OD1-ND1 3.3Å
320A60Low58Low56 Ų56110.4 Ų110.446%0.46356%0.564SS.*Hα-helixtrans-64.9-43.3174.900000112.2R316 S322 H323 Q324R316-A320 PolarHBondContact O-N 3.43Å; A320-S322 VanDerWaalsContact C-N 3.33Å; A320-S322 PolarHBondContact O-N 3.35Å; A320-H323 PolarHBondContact O-N 3.25Å; A320-Q324 PolarHBondContact O-N 2.81Å
321L66.3Low57.6Low120 Ų120111.9 Ų111.963%0.62857%0.57SS**Hα-helixtrans-66.1-36.3176.7-137.888000111.9Q317 T318 Q324 L325Q317-L321 PolarHBondContact O-N 3.47Å; Q317-L321 VanDerWaalsContact O-N 3.14Å; T318-L321 PolarHBondContact O-N 3.06Å; L321-Q324 PolarHBondContact O-N 3.02Å; L321-L325 WeakPolarHBondContact O-CB 3.24Å; L321-L325 PolarHBondContact O-N 2.94Å
322S60.2Low57Low66 Ų66110 Ų11046%0.46256%0.562SS.*Hα-helixtrans-64.9-41.2175.6-172.50000111.7T318 N319 A320 Q324 L325 E326T318-S322 VanDerWaalsContact O-CB 3.24Å; T318-S322 WeakPolarHBondContact O-CB 3.16Å; T318-S322 PolarHBondContact O-N 3.16Å; N319-S322 PolarHBondContact O-N 2.96Å; A320-S322 VanDerWaalsContact C-N 3.33Å; A320-S322 PolarHBondContact O-N 3.35Å; S322-Q324 VanDerWaalsContact C-N 3.34Å; S322-L325 PolarHBondContact O-N 3.13Å; S322-E326 VanDerWaalsContact O-CB 3.24Å; S322-E326 WeakPolarHBondContact O-CB 3.47Å; S322-E326 PolarHBondContact O-N 3.18Å
323H58Low56Low100 Ų100109.6 Ų109.646%0.46357%0.57SS.*Hα-helixtrans-66.8-37175.7-75.758.2000111.3N319 A320 Q327N319-H323 PolarHBondContact O-N 2.99Å; N319-H323 PolarHBondContact O-ND1 2.82Å; N319-H323 PolarHBondContact OD1-CE1 2.85Å; N319-H323 PolarHBondContact OD1-ND1 3.3Å; A320-H323 PolarHBondContact O-N 3.25Å; H323-Q327 WeakPolarHBondContact O-CB 3.19Å; H323-Q327 VanDerWaalsContact O-CG 3.23Å; H323-Q327 WeakPolarHBondContact O-CG 3.4Å; H323-Q327 PolarHBondContact O-N 3.25Å
324Q58.6Low54.8Low126 Ų126109.9 Ų109.959%0.58958%0.578SS**Hα-helixtrans-66.7-40.3173.2-72.3-169.2-57.500112.7A320 L321 S322 Q327 F328A320-Q324 PolarHBondContact O-N 2.81Å; L321-Q324 PolarHBondContact O-N 3.02Å; S322-Q324 VanDerWaalsContact C-N 3.34Å; Q324-Q327 PolarHBondContact O-N 3.33Å; Q324-F328 WeakPolarHBondContact O-CB 3.4Å; Q324-F328 PolarHBondContact O-N 2.86Å
325L60.8Low54Low122 Ų122115.5 Ų115.564%0.63960%0.6SS**Hα-helixtrans-71.8-35.1178.4-156.176000111.6L321 S322 F328 N329L321-L325 WeakPolarHBondContact O-CB 3.24Å; L321-L325 PolarHBondContact O-N 2.94Å; S322-L325 PolarHBondContact O-N 3.13Å; L325-F328 PolarHBondContact O-N 2.65Å; L325-N329 WeakPolarHBondContact O-CB 3.35Å; L325-N329 PolarHBondContact O-N 3.34Å
326E61Low52.9Low128 Ų128117.9 Ų117.960%0.59862%0.617SS**Hα-helixtrans-70.4-35.2175.2-161.3167.5-134.500111.8S322 N329 M330S322-E326 VanDerWaalsContact O-CB 3.24Å; S322-E326 WeakPolarHBondContact O-CB 3.47Å; S322-E326 PolarHBondContact O-N 3.18Å; E326-N329 PolarHBondContact O-N 3Å; E326-M330 PolarHBondContact O-N 3.45Å
327Q54.4Low51.8Low131 Ų131114.3 Ų114.361%0.61262%0.622SS**Hα-helixtrans-65.3-37.1169.1-77-179.2-48.300112.4H323 Q324 I331H323-Q327 WeakPolarHBondContact O-CB 3.19Å; H323-Q327 VanDerWaalsContact O-CG 3.23Å; H323-Q327 WeakPolarHBondContact O-CG 3.4Å; H323-Q327 PolarHBondContact O-N 3.25Å; Q324-Q327 PolarHBondContact O-N 3.33Å; Q327-I331 WeakPolarHBondContact O-CD1 2.91Å; Q327-I331 WeakPolarHBondContact O-CG1 3.46Å
328F48.8Very low50.8Low112 Ų112112.3 Ų112.349%0.49162%0.624SS.*Hα-helixtrans-74.3-36.1175.9-162.4-100.9000112.3Q324 L325 M330 I331 E332Q324-F328 WeakPolarHBondContact O-CB 3.4Å; Q324-F328 PolarHBondContact O-N 2.86Å; L325-F328 PolarHBondContact O-N 2.65Å; F328-M330 VanDerWaalsContact C-N 3.28Å; F328-M330 PolarHBondContact O-N 3.29Å; F328-I331 CarbonylContact O-C 3.6Å; F328-I331 PolarHBondContact O-N 3.3Å; F328-E332 HydrophobicContact CD1-CB 4.07Å; F328-E332 HydrophobicContact CE1-CB 3.8Å; F328-E332 HydrophobicContact CE1-CG 4.12Å; F328-E332 VanDerWaalsContact CE1-OE2 3.23Å; F328-E332 WeakPolarHBondContact CE1-OE2 3.46Å; F328-E332 HydrophobicContact CZ-CB 4.28Å; F328-E332 WeakPolarHBondContact CZ-OE2 3.23Å; F328-E332 PolarHBondContact O-N 3.2Å
329N49.2Very low49.5Very low112 Ų112112.7 Ų112.760%0.59963%0.631SS**Hα-helixtrans-75.2-15-177.8-153.827.3000113.3L325 E326 I331L325-N329 WeakPolarHBondContact O-CB 3.35Å; L325-N329 PolarHBondContact O-N 3.34Å; E326-N329 PolarHBondContact O-N 3Å; N329-I331 VanDerWaalsContact C-N 3.33Å
330M47Very low48.7Very low168 Ų168116 Ų11683%0.82865%0.648SS**THydrogen-bonded Turntrans-80.3-15168.8-151-163.6-5400112.8E326 F328E326-M330 PolarHBondContact O-N 3.45Å; F328-M330 VanDerWaalsContact C-N 3.28Å; F328-M330 PolarHBondContact O-N 3.29Å
331I50.4Low47.9Very low148 Ų148122.3 Ų122.376%0.75967%0.665SS**THydrogen-bonded Turntrans-116.2-20.7-174.8-41.8161.2000111.3Q327 F328 N329Q327-I331 WeakPolarHBondContact O-CD1 2.91Å; Q327-I331 WeakPolarHBondContact O-CG1 3.46Å; F328-I331 CarbonylContact O-C 3.6Å; F328-I331 PolarHBondContact O-N 3.3Å; N329-I331 VanDerWaalsContact C-N 3.33Å
332E45.8Very low46.2Very low93 Ų93122.2 Ų122.244%0.43568%0.675SS.*  trans-128.478.6179.3-163.6173.7128.700110.6F328F328-E332 HydrophobicContact CD1-CB 4.07Å; F328-E332 HydrophobicContact CE1-CB 3.8Å; F328-E332 HydrophobicContact CE1-CG 4.12Å; F328-E332 VanDerWaalsContact CE1-OE2 3.23Å; F328-E332 WeakPolarHBondContact CE1-OE2 3.46Å; F328-E332 HydrophobicContact CZ-CB 4.28Å; F328-E332 WeakPolarHBondContact CZ-OE2 3.23Å; F328-E332 PolarHBondContact O-N 3.2Å
333S39Very low45Very low96 Ų96128 Ų12867%0.67169%0.694SS**  trans-64.3129.7145.3-76.50000106.9I335S333-I335 PolarHBondContact O-N 3.11Å
334P39.9Very low43.9Very low101 Ų101128.7 Ų128.766%0.65671%0.709SS**  trans-61.4103.3-165.724.1-33.9000110S336P334-S336 PolarHBondContact O-N 3.08Å
335I42.8Very low43Very low159 Ų159128.6 Ų128.682%0.81572%0.723SS**  trans-72.874.3160.89.5173.4000106.5S333 S337S333-I335 PolarHBondContact O-N 3.11Å; I335-S337 VanDerWaalsContact C-N 3.34Å; I335-S337 PolarHBondContact O-N 3.4Å
336S33.8Very low42.4Very low105 Ų105129.1 Ų129.173%0.73473%0.731SS**  trans-59.8106.9155.2-68.90000106.3P334 S338P334-S336 PolarHBondContact O-N 3.08Å; S336-S338 PolarHBondContact O-N 3.15Å
337S37.4Very low42.1Very low118 Ų118128.6 Ų128.683%0.82573%0.732SS**SBendtrans-6092.6-177.550.80000111.7I335I335-S337 VanDerWaalsContact C-N 3.34Å; I335-S337 PolarHBondContact O-N 3.4Å
338S37.9Very low42Very low109 Ų109127.5 Ų127.576%0.76273%0.73SS**  trans-178.481.6150.3590000112.2S336S336-S338 PolarHBondContact O-N 3.15Å
339S29.2Very low42.1Very low103 Ų103130.8 Ų130.872%0.7274%0.74SS**  trans-166.6105148.2450000110.7F341S339-F341 PolarHBondContact O-N 3.15Å
340L42.7Very low42.4Very low163 Ų163130 Ų13085%0.85374%0.74SS**SBendtrans-55128.7156.3-72.5135.9000107.8
341F43.6Very low42.8Very low188 Ų188127.3 Ų127.383%0.82573%0.725SS**  trans72.6108.5178.3-58.2-89000116.6S339S339-F341 PolarHBondContact O-N 3.15Å
342S29.3Very low43.3Very low119 Ų119121.2 Ų121.283%0.83270%0.697SS**  trans-162143.6142.9-81.40000111.4
343Q36.2Very low43.8Very low186 Ų186119.4 Ų119.487%0.86970%0.698SS**  trans-75156.2-156.9-68.4153.5-3100114.6S345Q343-S345 PolarHBondContact O-N 3.18Å
344C34.3Very low44.7Very low116 Ų116122.1 Ų122.178%0.78470%0.702SS**  trans-11.1118.2159.4-49.60000115.2T346C344-T346 PolarHBondContact O-N 3.48Å
345S39Very low46Very low124 Ų124123.7 Ų123.787%0.86770%0.702SS**  trans-57.1112.2166.7-66.60000109.7Q343 L347Q343-S345 PolarHBondContact O-N 3.18Å; S345-L347 PolarHBondContact O-N 2.82Å
346T48.6Very low46.6Very low133 Ų133119.1 Ų119.182%0.81669%0.694SS**  trans-78.9101.2174.465.20000107.8C344 N348C344-T346 PolarHBondContact O-N 3.48Å; T346-N348 PolarHBondContact O-N 3.07Å
347L54.6Low47.9Very low117 Ų117120.1 Ų120.161%0.61369%0.69SS**  trans-59.5124.3163.4-76.8169.8000107.3S345 Y349S345-L347 PolarHBondContact O-N 2.82Å; L347-Y349 PolarHBondContact O-N 3.41Å
348N52.1Low48.8Very low107 Ų107118.7 Ų118.757%0.57268%0.676SS**  trans-52.7124178.6-171.9-72.8000109T346 T350 Q351 A352T346-N348 PolarHBondContact O-N 3.07Å; N348-T350 PolarHBondContact O-N 2.93Å; N348-T350 PolarHBondContact OD1-N 3.4Å; N348-T350 PolarHBondContact OD1-OG1 3.5Å; N348-Q351 WeakPolarHBondContact O-CB 3.23Å; N348-Q351 PolarHBondContact O-N 2.81Å; N348-A352 PolarHBondContact O-N 3.17Å
349Y51Low49.2Very low181 Ų181116.3 Ų116.371%0.7167%0.669SS**Hα-helixtrans-49.3-31.5-169.6-128.9-90.8000113.4L347 A353L347-Y349 PolarHBondContact O-N 3.41Å; Y349-A353 WeakPolarHBondContact O-CB 3.19Å; Y349-A353 PolarHBondContact O-N 3.23Å; Y349-A353 VanDerWaalsContact O-N 3.1Å
350T55.1Low49.8Very low96 Ų96117.1 Ų117.159%0.58968%0.675SS**Hα-helixtrans-70.7-32.9179.4-42.90000112.9N348 M354N348-T350 PolarHBondContact O-N 2.93Å; N348-T350 PolarHBondContact OD1-N 3.4Å; N348-T350 PolarHBondContact OD1-OG1 3.5Å; T350-M354 PolarHBondContact O-N 3.07Å
351Q55.8Low49.6Very low112 Ų112114.6 Ų114.652%0.52367%0.671SS.*Hα-helixtrans-78.5-35.6-179.7-145.6159.250.900111.2N348 M355N348-Q351 WeakPolarHBondContact O-CB 3.23Å; N348-Q351 PolarHBondContact O-N 2.81Å; Q351-M355 PolarHBondContact O-N 2.99Å
352A61.6Low49.8Very low19 Ų19113.4 Ų113.416%0.15767%0.672CS.*Hα-helixtrans-71-34.3173.700000113.2N348 M355 G356 L357 T358N348-A352 PolarHBondContact O-N 3.17Å; A352-M355 PolarHBondContact O-N 3.07Å; A352-G356 PolarHBondContact O-N 3.04Å; A352-L357 PolarHBondContact O-N 3.46Å; A352-T358 HydrophobicContact CB-CG2 4.46Å
353A55.3Low50.4Low55 Ų55116.4 Ų116.446%0.45567%0.673SS.*Hα-helixtrans-67.1-36.2176.700000112.8Y349 M355 G356 T358Y349-A353 WeakPolarHBondContact O-CB 3.19Å; Y349-A353 PolarHBondContact O-N 3.23Å; Y349-A353 VanDerWaalsContact O-N 3.1Å; A353-M355 VanDerWaalsContact C-N 3.32Å; A353-G356 PolarHBondContact O-N 2.54Å; A353-T358 HydrophobicContact CB-CG2 4.46Å
354M59.3Low50.2Low154 Ų154114.9 Ų114.976%0.75967%0.671SS**Hα-helixtrans-71.4-26175.2-76-170.2-6800113.3T350 G356T350-M354 PolarHBondContact O-N 3.07Å; M354-G356 VanDerWaalsContact C-N 3.32Å
355M65.3Low50.3Low134 Ų134114.9 Ų114.966%0.6667%0.672SS**THydrogen-bonded Turntrans-87.73.7178-72.1163.1160.900113.3Q351 A352 A353 L357Q351-M355 PolarHBondContact O-N 2.99Å; A352-M355 PolarHBondContact O-N 3.07Å; A353-M355 VanDerWaalsContact C-N 3.32Å; M355-L357 HydrophobicContact CB-CD1 4.22Å; M355-L357 HydrophobicContact CB-CG 4.12Å; M355-L357 PolarHBondContact O-N 3.31Å
356G57.4Low50.5Low62 Ų62116.4 Ų116.464%0.63967%0.666SS**THydrogen-bonded Turntrans67.813.3177.900000114.6A352 A353 M354 T358A352-G356 PolarHBondContact O-N 3.04Å; A353-G356 PolarHBondContact O-N 2.54Å; M354-G356 VanDerWaalsContact C-N 3.32Å; G356-T358 VanDerWaalsContact C-N 3.26Å; G356-T358 PolarHBondContact O-N 3.08Å
357L60.2Low50Low126 Ų126117.8 Ų117.866%0.6666%0.663SS**  trans-83.53-175.9-62.7178.1000113.5A352 M355 G359A352-L357 PolarHBondContact O-N 3.46Å; M355-L357 HydrophobicContact CB-CD1 4.22Å; M355-L357 HydrophobicContact CB-CG 4.12Å; M355-L357 PolarHBondContact O-N 3.31Å; L357-G359 VanDerWaalsContact C-N 3.34Å; L357-G359 PolarHBondContact O-N 3.2Å
358T56.8Low49.7Very low88 Ų88119.2 Ų119.254%0.5467%0.671SS.*  trans-92.566.6176.965.90000110.3A352 A353 G356A352-T358 HydrophobicContact CB-CG2 4.46Å; A353-T358 HydrophobicContact CB-CG2 4.46Å; G356-T358 VanDerWaalsContact C-N 3.26Å; G356-T358 PolarHBondContact O-N 3.08Å
359G45.8Very low48.6Very low59 Ų59121.9 Ų121.961%0.60869%0.685SS**  trans-109.8116.6173.600000110.8L357L357-G359 VanDerWaalsContact C-N 3.34Å; L357-G359 PolarHBondContact O-N 3.2Å
360S42.1Very low48Very low120 Ų120123.6 Ų123.684%0.83969%0.691SS**SBendtrans86.1117.6161.968.10000120.8
361S38.9Very low47.1Very low111 Ų111124 Ų12478%0.77670%0.698SS**  trans71.783.8150.573.60000121
362L47.9Very low46.3Very low163 Ų163124.3 Ų124.385%0.85371%0.713SS**  -92.495.8129-90.7168.7000107.1
363Q41.5Very low45.5Very low182 Ų182132.1 Ų132.185%0.8575%0.745SS**  trans-164.1134140.8-72.3-145.2-3.600108.8
364D31.2Very low45Very low153 Ų153132.1 Ų132.182%0.81875%0.751SS**  trans74.794.8162-115.7-7.4000119.7Q366D364-Q366 PolarHBondContact O-N 3.39Å
365S37.8Very low44.7Very low116 Ų116132.8 Ų132.881%0.81176%0.758SS**  trans-85.986.8155.6-84.50000109.5
366Q41.3Very low43.9Very low156 Ų156133.3 Ų133.373%0.72976%0.762SS**  trans-153.2113.4148.9-77.6-50.4-20.100110.7D364D364-Q366 PolarHBondContact O-N 3.39Å
367Q38.5Very low43.5Very low162 Ų162135.9 Ų135.976%0.75777%0.767SS**SBendtrans81.9123.3154.9-51.8-163.613.100120.1
368L49.3Very low42.8Very low148 Ų148136.6 Ų136.678%0.77577%0.771SS**  trans5296.5147.8-68162.9000117.3
369N29.6Very low42.7Very low162 Ų162139.4 Ų139.487%0.86678%0.781SS**  trans-162.7130.6137.2-127.139.7000111.8S371N369-S371 PolarHBondContact O-N 2.83Å
370Y37Very low43.3Very low217 Ų217142.5 Ų142.585%0.85178%0.783SS**  trans-60.5130.6172.1-72.2-92.5000109.7S372Y370-S372 PolarHBondContact O-N 3.41Å
371S36.3Very low43.6Very low105 Ų105144.3 Ų144.373%0.73478%0.782SS**  trans-67.3128.2-174-153.70000111.4N369 H373N369-S371 PolarHBondContact O-N 2.83Å; S371-H373 PolarHBondContact O-N 3.47Å
372S39.5Very low44Very low118 Ų118144 Ų14483%0.82578%0.776SS**  trans-56.1110167.2-57.40000111.3Y370Y370-S372 PolarHBondContact O-N 3.41Å
373H45.1Very low44.1Very low183 Ų183142.7 Ų142.785%0.84777%0.774SS**  trans-83.3116.7162.5-72.1-73.8000109.4S371S371-H373 PolarHBondContact O-N 3.47Å
374G43.7Very low44.3Very low55 Ų55139.1 Ų139.157%0.56777%0.765SS**  trans-66.6131.6168.100000111.9I376G374-I376 PolarHBondContact O-N 3.21Å
375N53.8Low45.4Very low169 Ų169136 Ų13690%0.90477%0.769SS**SBendtrans46.547.6141.1-57.5-25000119.6
376I47.8Very low46.2Very low145 Ų145138.3 Ų138.374%0.74477%0.767SS**  trans-120.1119.8158.4-56.2166.5000107.4G374 N378G374-I376 PolarHBondContact O-N 3.21Å; I376-N378 PolarHBondContact O-N 3.19Å; I376-N378 VanDerWaalsContact O-N 3.11Å
377P50.3Low46.3Very low115 Ų115135.9 Ų135.975%0.74777%0.767SS**  trans-72.2108.2169.529.4-28.9000107.9I379P377-I379 PolarHBondContact O-N 3.21Å
378N43.8Very low47.2Very low141 Ų141132.1 Ų132.175%0.75476%0.757SS**  trans-78.496.3173.2-144-7.6000107.2I376 I380I376-N378 PolarHBondContact O-N 3.19Å; I376-N378 VanDerWaalsContact O-N 3.11Å; N378-I380 VanDerWaalsContact C-N 3.31Å; N378-I380 PolarHBondContact O-N 2.93Å
379I55.6Low47.7Very low147 Ų147130.6 Ų130.675%0.75476%0.756SS**  trans-7491173.4-56.7173.3000107.1P377 L381P377-I379 PolarHBondContact O-N 3.21Å; I379-L381 PolarHBondContact O-N 3.05Å
380I59.1Low48.9Very low125 Ų125126.8 Ų126.864%0.64174%0.742SS**  trans-74112.5170.3-59.8175.3000107.3N378 T382N378-I380 VanDerWaalsContact C-N 3.31Å; N378-I380 PolarHBondContact O-N 2.93Å; I380-T382 HydrophobicContact CG2-CG2 4.16Å; I380-T382 PolarHBondContact O-N 3.25Å
381L46.8Very low49.9Very low158 Ų158121.1 Ų121.183%0.82773%0.725SS**  trans-67.697167.7-75.1162.6000109I379 V383I379-L381 PolarHBondContact O-N 3.05Å; L381-V383 PolarHBondContact O-N 2.88Å
382T47.6Very low51Low103 Ų103119.2 Ų119.263%0.63271%0.712SS**  trans-81.990.617246.60000110.1I380 T384I380-T382 HydrophobicContact CG2-CG2 4.16Å; I380-T382 PolarHBondContact O-N 3.25Å; T382-T384 PolarHBondContact O-N 3.03Å
383V50.5Low51.9Low136 Ų136121.6 Ų121.682%0.82471%0.708SS**  trans-73.5-5.4166.31650000112.2L381L381-V383 PolarHBondContact O-N 2.88Å
384T46Very low52.6Low107 Ų107119.3 Ų119.366%0.65670%0.697SS**SBendtrans-146.697177.945.10000112.2T382 E386T382-T384 PolarHBondContact O-N 3.03Å; T384-E386 PolarHBondContact O-N 3.31Å
385G53.5Low53.4Low87 Ų87122.5 Ų122.590%0.89770%0.701SS**SBend68.63.4118.800000122.8
386E54.9Low53.6Low166 Ų166119 Ų11978%0.77669%0.685SS**  trans-14398.8176.863.5-154.516600113.8T384T384-E386 PolarHBondContact O-N 3.31Å
387S44.4Very low54Low105 Ų105118.7 Ų118.773%0.73469%0.686SS**  trans-79.9145.8174.2-61.70000111.7
388P57.3Low54.2Low82 Ų82117.8 Ų117.853%0.53268%0.682SS.*  trans-66.614717525.6-32000112.1S390 L391P388-S390 PolarHBondContact O-N 3.2Å; P388-L391 HydrophobicContact CG-CD1 4.29Å; P388-L391 PolarHBondContact O-N 3.29Å
389P59.4Low54.8Low117 Ų117116.9 Ų116.976%0.7668%0.677SS**THydrogen-bonded Turntrans-69.2-1.4-164.126.4-35.7000116.4
390S55.2Low54.8Low81 Ų81113.9 Ų113.957%0.56667%0.673SS**THydrogen-bonded Turntrans-93.1-30.3-177.1-160.70000113.6P388P388-S390 PolarHBondContact O-N 3.2Å
391L57.6Low54.6Low98 Ų98111.2 Ų111.251%0.51368%0.677SS.*Hα-helixtrans-77.7-28.5-174.6-63.9176.3000112.7P388 K393 L395P388-L391 HydrophobicContact CG-CD1 4.29Å; P388-L391 PolarHBondContact O-N 3.29Å; L391-K393 PolarHBondContact O-N 3.41Å; L391-L395 VanDerWaalsContact O-CG 3.31Å; L391-L395 WeakPolarHBondContact O-CG 3.29Å; L391-L395 PolarHBondContact O-N 3.44Å; L391-L395 VanDerWaalsContact O-N 3.14Å
392S59.2Low54.9Low65 Ų65108.8 Ų108.846%0.45567%0.668SS.*Hα-helixtrans-68.1-32.8179.447.40000112.9T396S392-T396 WeakPolarHBondContact O-CB 3.2Å; S392-T396 PolarHBondContact O-N 3.12Å; S392-T396 VanDerWaalsContact O-N 3.14Å; S392-T396 PolarHBondContact O-OG1 3.08Å
393K58Low54.9Low168 Ų168106.9 Ų106.973%0.7367%0.669SS**Hα-helixtrans-73.9-37.8177.4-91.4178.8175.7176.40113.2L391 N397L391-K393 PolarHBondContact O-N 3.41Å; K393-N397 PolarHBondContact O-N 3.09Å
394E60.5Low54.9Low135 Ų135107.5 Ų107.563%0.63167%0.668SS**Hα-helixtrans-71.2-40.8176.7-84.6-1798600112.3T396 N397 S398E394-T396 PolarHBondContact O-N 3.43Å; E394-N397 PolarHBondContact O-N 3.34Å; E394-S398 WeakPolarHBondContact O-CB 3.34Å; E394-S398 PolarHBondContact O-N 3.37Å
395L59.6Low55.2Low123 Ų123108.2 Ų108.264%0.64467%0.672SS**Hα-helixtrans-66.1-37.9176.2-68.4172000112.4L391 N397 S398 L399L391-L395 VanDerWaalsContact O-CG 3.31Å; L391-L395 WeakPolarHBondContact O-CG 3.29Å; L391-L395 PolarHBondContact O-N 3.44Å; L391-L395 VanDerWaalsContact O-N 3.14Å; L395-N397 VanDerWaalsContact C-N 3.34Å; L395-N397 PolarHBondContact O-N 3.1Å; L395-S398 PolarHBondContact O-N 3.22Å; L395-L399 WeakPolarHBondContact O-CB 3.34Å; L395-L399 PolarHBondContact O-N 2.93Å
396T58.5Low54.9Low94 Ų94108.2 Ų108.258%0.57766%0.658SS**Hα-helixtrans-66.8-35.9178.1-550000111.8S392 E394 A400S392-T396 WeakPolarHBondContact O-CB 3.2Å; S392-T396 PolarHBondContact O-N 3.12Å; S392-T396 VanDerWaalsContact O-N 3.14Å; S392-T396 PolarHBondContact O-OG1 3.08Å; E394-T396 PolarHBondContact O-N 3.43Å; T396-A400 WeakPolarHBondContact O-CB 3.2Å; T396-A400 PolarHBondContact O-N 3.1Å; T396-A400 VanDerWaalsContact O-N 3.12Å
397N55.3Low54.6Low140 Ų140109.9 Ų109.975%0.74966%0.663SS**Hα-helixtrans-75-31.9175.8-110.120.9000113K393 E394 L395K393-N397 PolarHBondContact O-N 3.09Å; E394-N397 PolarHBondContact O-N 3.34Å; L395-N397 VanDerWaalsContact C-N 3.34Å; L395-N397 PolarHBondContact O-N 3.1Å
398S54.9Low54.5Low95 Ų95110.6 Ų110.666%0.66466%0.659SS**Hα-helixtrans-74-30.6176.2-153.50000112.1E394 L395E394-S398 WeakPolarHBondContact O-CB 3.34Å; E394-S398 PolarHBondContact O-N 3.37Å; L395-S398 PolarHBondContact O-N 3.22Å
399L56.9Low54.3Low123 Ų123111.4 Ų111.464%0.64467%0.673SS**Hα-helixtrans-81.9-25.7176.2-170.259.4000113.4L395 G401 V402L395-L399 WeakPolarHBondContact O-CB 3.34Å; L395-L399 PolarHBondContact O-N 2.93Å; L399-G401 PolarHBondContact O-N 3.18Å; L399-G401 VanDerWaalsContact O-N 3.07Å; L399-V402 PolarHBondContact O-N 2.83Å; L399-V402 VanDerWaalsContact O-N 3.13Å
400A55.6Low53.9Low83 Ų83112.6 Ų112.669%0.68667%0.673SS**THydrogen-bonded Turntrans-66.2-7.717900000114.8T396T396-A400 WeakPolarHBondContact O-CB 3.2Å; T396-A400 PolarHBondContact O-N 3.1Å; T396-A400 VanDerWaalsContact O-N 3.12Å
401G54.1Low53.7Low70 Ų70113.2 Ų113.272%0.72268%0.677SS**THydrogen-bonded Turntrans-97.3-7.1174.200000115.2L399L399-G401 PolarHBondContact O-N 3.18Å; L399-G401 VanDerWaalsContact O-N 3.07Å
402V53.3Low53.6Low106 Ų106117.3 Ų117.364%0.64269%0.694SS**SBendtrans-113.189.5179.3-154.20000107.1L399 D404L399-V402 PolarHBondContact O-N 2.83Å; L399-V402 VanDerWaalsContact O-N 3.13Å; V402-D404 PolarHBondContact O-N 3.42Å
403G47.7Very low53.1Low63 Ų63122.3 Ų122.365%0.64971%0.707SS**  trans-54.7131.3178.800000111.5V405G403-V405 PolarHBondContact O-N 3.19Å
404D52Low52.8Low150 Ų150119.6 Ų119.680%0.80271%0.707SS**  trans27.182.8140-16815.4000115.8V402 S406V402-D404 PolarHBondContact O-N 3.42Å; D404-S406 PolarHBondContact OD1-N 3.17Å
405V51.2Low52.6Low121 Ų121121.1 Ų121.173%0.73372%0.718SS**  trans-107.780.8153.3-172.30000106.4G403 F407G403-V405 PolarHBondContact O-N 3.19Å; V405-F407 PolarHBondContact O-N 3.17Å
406S46.4Very low52.6Low88 Ų88121.9 Ų121.962%0.61572%0.723SS**  trans-46.5117.9162176.90000109.4D404 D408D404-S406 PolarHBondContact OD1-N 3.17Å; S406-D408 PolarHBondContact O-N 3.08Å
407F49.1Very low52.8Low201 Ų201125.1 Ų125.188%0.88273%0.732SS**  trans-68.888.6166.3-75.9-89.3000107.8V405 A409V405-F407 PolarHBondContact O-N 3.17Å; F407-A409 PolarHBondContact O-N 2.99Å
408D42.5Very low52.8Low119 Ų119126.3 Ų126.364%0.63674%0.737SS**  trans-69111.2166-168.634.5000107.9S406 D410S406-D408 PolarHBondContact O-N 3.08Å; D408-D410 PolarHBondContact O-N 3.47Å
409A53.1Low52.9Low100 Ų100130.8 Ų130.883%0.82675%0.745SS**THydrogen-bonded Turntrans-75.829.4-174.200000113.3F407F407-A409 PolarHBondContact O-N 2.99Å
410D50.9Low53.2Low142 Ų142131.9 Ų131.976%0.75975%0.75SS**THydrogen-bonded Turntrans-130.311.3-176.2-102.8-12.7000114.3D408 Q412D408-D410 PolarHBondContact O-N 3.47Å; D410-Q412 VanDerWaalsContact C-N 3.3Å; D410-Q412 PolarHBondContact O-N 3.1Å
411S52Low53.6Low94 Ų94134.7 Ų134.766%0.65775%0.753SS**  trans-82.482164.848.50000110F413S411-F413 PolarHBondContact O-N 3.32Å
412Q54.5Low54.2Low184 Ų184136.6 Ų136.686%0.8675%0.753SS**  trans-45.7101.4162.3-179.7174.7-28.900109D410D410-Q412 VanDerWaalsContact C-N 3.3Å; D410-Q412 PolarHBondContact O-N 3.1Å
413F48.1Very low54.6Low169 Ų169139.3 Ų139.374%0.74176%0.763SS**  trans-51.4129166.9-88.7-93.7000107.6S411 L415S411-F413 PolarHBondContact O-N 3.32Å; F413-L415 VanDerWaalsContact C-N 3.28Å; F413-L415 PolarHBondContact O-N 2.98Å
414P52.6Low55.2Low112 Ų112142 Ų14273%0.72777%0.767SS**  trans-67.396.7167.1-520.4000106.5D416P414-D416 PolarHBondContact O-N 3.11Å
415L56.8Low55.6Low166 Ų166141.3 Ų141.387%0.86976%0.763SS**  trans-74.630.5165.5-75.8168.9000110.9F413 E417F413-L415 VanDerWaalsContact C-N 3.28Å; F413-L415 PolarHBondContact O-N 2.98Å; L415-E417 PolarHBondContact O-N 3.25Å
416D59.8Low56.1Low139 Ų139141.2 Ų141.274%0.74376%0.758SS**  trans-85.5110.4176.5-86.8-13.9000108P414P414-D416 PolarHBondContact O-N 3.11Å
417E61Low56.8Low163 Ų163139.7 Ų139.776%0.76276%0.756SS**  trans93.633146.3-55.7-175.5159.800120.5L415 K419L415-E417 PolarHBondContact O-N 3.25Å; E417-K419 PolarHBondContact O-N 3.49Å
418L56.3Low57.4Low165 Ų165134.7 Ų134.786%0.86474%0.738SS**  trans-86.568.8151.5-144.281000110.8I420L418-I420 HydrophobicContact CD2-CG1 4.44Å; L418-I420 PolarHBondContact O-N 3.45Å; L418-I420 VanDerWaalsContact O-N 3.08Å
419K56.7Low58.3Low188 Ų188134.9 Ų134.982%0.81774%0.735SS**  trans-69.796.6163-80.3173.7165.1171.40107.7E417 D421E417-K419 PolarHBondContact O-N 3.49Å; K419-D421 PolarHBondContact O-N 3.44Å
420I63.5Low58.6Low146 Ų146136 Ų13675%0.74972%0.724SS**  trans-69.8109.8169.1-45.7169.8000105.9L418L418-I420 HydrophobicContact CD2-CG1 4.44Å; L418-I420 PolarHBondContact O-N 3.45Å; L418-I420 VanDerWaalsContact O-N 3.08Å
421D64.3Low59.2Low143 Ų143135.7 Ų135.777%0.76572%0.722SS**  trans-60.3128171.7-111.3-10.3000108K419 L423K419-D421 PolarHBondContact O-N 3.44Å; D421-L423 PolarHBondContact O-N 3.39Å; D421-L423 VanDerWaalsContact O-N 3.12Å
422P65.7Low59.7Low109 Ų109137.9 Ų137.971%0.70873%0.726SS**  trans-61.2121.6175.924-30.4000108.3T424P422-T424 PolarHBondContact O-N 3.47Å
423L62Low60.3Low163 Ų163133.5 Ų133.585%0.85371%0.709SS**  trans-47.8115.7176.9-67.9166.3000109.1D421 L425D421-L423 PolarHBondContact O-N 3.39Å; D421-L423 VanDerWaalsContact O-N 3.12Å; L423-L425 PolarHBondContact O-N 3.18Å
424T60.7Low61.2Low120 Ų120131 Ų13174%0.73671%0.71SS**  trans-63.5124.9172.749.70000107.3P422 D426P422-T424 PolarHBondContact O-N 3.47Å; T424-D426 PolarHBondContact O-N 3.4Å
425L59.8Low61.5Low136 Ų136132.2 Ų132.271%0.71271%0.71SS**G310 helixtrans-6820.7177.1-62.1173.5000112.8L423 G427 L428L423-L425 PolarHBondContact O-N 3.18Å; L425-G427 PolarHBondContact O-N 3.22Å; L425-L428 HydrophobicContact CB-CD1 4.19Å; L425-L428 HydrophobicContact CD2-CD1 3.84Å; L425-L428 HydrophobicContact CG-CD1 4.44Å; L425-L428 PolarHBondContact O-N 3.07Å
426D62.7Low61.8Low119 Ų119128.1 Ų128.164%0.63669%0.687SS**G310 helixtrans-63.8-20-177.7-164.240.4000111.5T424 H429T424-D426 PolarHBondContact O-N 3.4Å; D426-H429 PolarHBondContact O-CE1 3.23Å; D426-H429 PolarHBondContact O-ND1 2.85Å
427G61.2Low62Low55 Ų55126.9 Ų126.957%0.56769%0.685SS**G310 helixtrans-79.1-10.2173.800000115.7L425L425-G427 PolarHBondContact O-N 3.22Å
428L61.7Low62Low96 Ų96126.4 Ų126.450%0.50369%0.687SS.*G310 helixtrans-84.4-7.9-177.4-65.3-177.6000113.6L425 M430 L431L425-L428 HydrophobicContact CB-CD1 4.19Å; L425-L428 HydrophobicContact CD2-CD1 3.84Å; L425-L428 HydrophobicContact CG-CD1 4.44Å; L425-L428 PolarHBondContact O-N 3.07Å; L428-M430 PolarHBondContact O-N 3.05Å; L428-L431 HydrophobicContact CD2-CD1 4.06Å; L428-L431 PolarHBondContact O-N 3.23Å
429H61.4Low62.3Low123 Ų123120.9 Ų120.957%0.56966%0.664SS**G310 helixtrans-66.3-26.7178.374.2-104.6000112.5D426 L431 N432D426-H429 PolarHBondContact O-CE1 3.23Å; D426-H429 PolarHBondContact O-ND1 2.85Å; H429-L431 PolarHBondContact O-N 3.01Å; H429-N432 PolarHBondContact O-N 2.86Å; H429-N432 VanDerWaalsContact O-N 3.13Å
430M58.8Low62.9Low123 Ų123116.7 Ų116.761%0.60665%0.651SS**G310 helixtrans-66-21.5176.1-74.4178.237.800113.4L428 N432 M436L428-M430 PolarHBondContact O-N 3.05Å; M430-N432 VanDerWaalsContact C-N 3.35Å; M430-M436 VanDerWaalsContact O-CE 3.29Å; M430-M436 WeakPolarHBondContact O-CE 3.47Å
431L62.8Low63.1Low136 Ų136114.3 Ų114.371%0.71265%0.645SS**G310 helixtrans-87.8-8.9176.9-62.2-180000112.9L428 H429L428-L431 HydrophobicContact CD2-CD1 4.06Å; L428-L431 PolarHBondContact O-N 3.23Å; H429-L431 PolarHBondContact O-N 3.01Å
432N62.3Low63.2Low140 Ų140110.3 Ų110.375%0.74963%0.632SS**SBendtrans-107.411.1-175.6-146.56.4000112.1H429 M430 P434H429-N432 PolarHBondContact O-N 2.86Å; H429-N432 VanDerWaalsContact O-N 3.13Å; M430-N432 VanDerWaalsContact C-N 3.35Å; N432-P434 WeakPolarHBondContact O-CD 3.36Å
433D68.3Low63.5Low92 Ų92108.2 Ų108.249%0.49262%0.617SS.*  trans-79.7106.5178.6-157.4-10.8000109.1D435 M436D433-D435 PolarHBondContact O-N 3.08Å; D433-M436 HydrophobicContact CB-CB 4.13Å; D433-M436 PolarHBondContact O-N 3.04Å; D433-M436 VanDerWaalsContact O-N 3.12Å
434P65.8Low64Low118 Ų118105.1 Ų105.177%0.76660%0.598SS**THydrogen-bonded Turntrans-68.8-14.2-17530.4-35.6000112.8N432N432-P434 WeakPolarHBondContact O-CD 3.36Å
435D59.7Low64.4Low136 Ų136104 Ų10473%0.72759%0.588SS**THydrogen-bonded Turntrans-1003.7177.7-70.1-24.3000112.5D433 V437D433-D435 PolarHBondContact O-N 3.08Å; D435-V437 PolarHBondContact O-N 2.84Å
436M63.7Low65Low81 Ų81101.9 Ų101.940%0.39958%0.581SS.*  trans-73.685.3169.3-169.5171.46000108.7M430 D433 L438M430-M436 VanDerWaalsContact O-CE 3.29Å; M430-M436 WeakPolarHBondContact O-CE 3.47Å; D433-M436 HydrophobicContact CB-CB 4.13Å; D433-M436 PolarHBondContact O-N 3.04Å; D433-M436 VanDerWaalsContact O-N 3.12Å; M436-L438 VanDerWaalsContact C-N 3.29Å; M436-L438 HydrophobicContact CE-CD2 3.76Å; M436-L438 HydrophobicContact CE-CG 4.28Å; M436-L438 HydrophobicContact CG-CD2 4.13Å; M436-L438 HydrophobicContact CG-CG 4.48Å; M436-L438 PolarHBondContact O-N 3.04Å; M436-L438 HydrophobicContact SD-CD2 4.2Å
437V63.6Low65.4Low113 Ų113103.1 Ų103.169%0.68558%0.581SS**  trans-63.190.3173.1179.10000108.2D435 A439D435-V437 PolarHBondContact O-N 2.84Å; V437-A439 WeakPolarHBondContact CG1-O 3.45Å; V437-A439 PolarHBondContact O-N 3.14Å
438L61.4Low66.1Low153 Ų153108 Ų10880%0.80158%0.582SS**  trans-69-9.6-179-74.7175.6000113.7M436M436-L438 VanDerWaalsContact C-N 3.29Å; M436-L438 HydrophobicContact CE-CD2 3.76Å; M436-L438 HydrophobicContact CE-CG 4.28Å; M436-L438 HydrophobicContact CG-CD2 4.13Å; M436-L438 HydrophobicContact CG-CG 4.48Å; M436-L438 PolarHBondContact O-N 3.04Å; M436-L438 HydrophobicContact SD-CD2 4.2Å
439A62.1Low66.4Low48 Ų48109.5 Ų109.540%0.39759%0.588SS.*SBendtrans-119.9116.1179.200000109.6V437V437-A439 WeakPolarHBondContact CG1-O 3.45Å; V437-A439 PolarHBondContact O-N 3.14Å
440D68.6Low66.7Low100 Ų100110.4 Ų110.454%0.53560%0.597SS.*  trans-50.5128.9168.8179.9-6.3000109A442 T443 E444D440-A442 PolarHBondContact O-N 3.5Å; D440-A442 PolarHBondContact OD1-N 3.39Å; D440-A442 VanDerWaalsContact OD1-N 3.12Å; D440-T443 WeakPolarHBondContact O-CA 3.38Å; D440-T443 VanDerWaalsContact O-CB 3.3Å; D440-T443 WeakPolarHBondContact O-CB 3.46Å; D440-T443 PolarHBondContact O-N 2.95Å; D440-E444 PolarHBondContact O-N 3.27Å
441P69.6Low67.3Low96 Ų96115.5 Ų115.562%0.62361%0.61SS**Hα-helixtrans-46.5-30.2175.3-30.935000114.5T443 E444 D445P441-T443 VanDerWaalsContact C-N 3.3Å; P441-T443 PolarHBondContact O-N 2.94Å; P441-E444 PolarHBondContact O-N 2.89Å; P441-D445 PolarHBondContact O-N 3.36Å; P441-D445 VanDerWaalsContact O-N 3.16Å
442A66.5Low67Low59 Ų59119 Ų11949%0.48863%0.628SS.*Hα-helixtrans-66.2-30.3175.200000113.6D440 T446D440-A442 PolarHBondContact O-N 3.5Å; D440-A442 PolarHBondContact OD1-N 3.39Å; D440-A442 VanDerWaalsContact OD1-N 3.12Å; A442-T446 PolarHBondContact O-N 3.48Å; A442-T446 PolarHBondContact O-OG1 3.48Å; A442-T446 VanDerWaalsContact O-OG1 3.08Å
443T71.4Confident67.2Low66 Ų66118 Ų11841%0.40562%0.622SS.*Hα-helixtrans-75.3-38.6176.5-54.90000110.8D440 P441 D445 T446 F447D440-T443 WeakPolarHBondContact O-CA 3.38Å; D440-T443 VanDerWaalsContact O-CB 3.3Å; D440-T443 WeakPolarHBondContact O-CB 3.46Å; D440-T443 PolarHBondContact O-N 2.95Å; P441-T443 VanDerWaalsContact C-N 3.3Å; P441-T443 PolarHBondContact O-N 2.94Å; T443-D445 VanDerWaalsContact C-N 3.33Å; T443-D445 PolarHBondContact O-N 3.37Å; T443-T446 WeakPolarHBondContact O-CB 3.31Å; T443-T446 PolarHBondContact O-N 3.13Å; T443-F447 HydrophobicContact CG2-CD2 4.23Å; T443-F447 HydrophobicContact CG2-CE2 3.74Å; T443-F447 WeakPolarHBondContact O-CD2 3.33Å; T443-F447 PolarHBondContact O-N 3.07Å
444E71.9Confident67.2Low98 Ų98119.4 Ų119.446%0.45863%0.629SS.*Hα-helixtrans-64.1-38.2175-172.8172.8159.400112D440 P441 T446 F447 R448D440-E444 PolarHBondContact O-N 3.27Å; P441-E444 PolarHBondContact O-N 2.89Å; E444-T446 VanDerWaalsContact C-N 3.3Å; E444-T446 PolarHBondContact O-N 3.19Å; E444-F447 PolarHBondContact O-N 3.24Å; E444-R448 WeakPolarHBondContact O-CG 3.36Å; E444-R448 PolarHBondContact O-N 3.05Å; E444-R448 VanDerWaalsContact O-N 3.15Å; E444-R448 IonicContact OE1-CZ 3.32Å; E444-R448 IonicContact OE1-NE 3.38Å; E444-R448 PolarHBondContact OE1-NE 3.34Å; E444-R448 IonicContact OE1-NH2 2.65Å; E444-R448 PolarHBondContact OE1-NH2 2.66Å
445D69.6Low67.2Low96 Ų96119.4 Ų119.451%0.51362%0.621SS.*Hα-helixtrans-66.7-33.3178.3-150.324000112.1P441 T443 R448 M449P441-D445 PolarHBondContact O-N 3.36Å; P441-D445 VanDerWaalsContact O-N 3.16Å; T443-D445 VanDerWaalsContact C-N 3.33Å; T443-D445 PolarHBondContact O-N 3.37Å; D445-R448 PolarHBondContact O-N 2.96Å; D445-M449 WeakPolarHBondContact O-CG 3.37Å; D445-M449 PolarHBondContact O-N 3.14Å
446T72.8Confident67.7Low92 Ų92118.5 Ų118.556%0.56462%0.615SS**Hα-helixtrans-61.6-45.3173.7-60.90000111.7A442 T443 E444 R448 M449 D450A442-T446 PolarHBondContact O-N 3.48Å; A442-T446 PolarHBondContact O-OG1 3.48Å; A442-T446 VanDerWaalsContact O-OG1 3.08Å; T443-T446 WeakPolarHBondContact O-CB 3.31Å; T443-T446 PolarHBondContact O-N 3.13Å; E444-T446 VanDerWaalsContact C-N 3.3Å; E444-T446 PolarHBondContact O-N 3.19Å; T446-R448 VanDerWaalsContact C-N 3.3Å; T446-R448 PolarHBondContact O-N 3.02Å; T446-M449 PolarHBondContact O-N 3.47Å; T446-D450 PolarHBondContact O-N 3.12Å; T446-D450 VanDerWaalsContact O-N 3.17Å
447F71.4Confident67.9Low145 Ų145120.8 Ų120.864%0.63663%0.628SS**Hα-helixtrans-68-27.7177.3-72.7-68.3000113.4T443 E444T443-F447 HydrophobicContact CG2-CD2 4.23Å; T443-F447 HydrophobicContact CG2-CE2 3.74Å; T443-F447 WeakPolarHBondContact O-CD2 3.33Å; T443-F447 PolarHBondContact O-N 3.07Å; E444-F447 PolarHBondContact O-N 3.24Å
448R75.1Confident68.2Low156 Ų156121.3 Ų121.359%0.58963%0.625SS**Hα-helixtrans-74.7-36.8175.7-71.7-179-177.5-171.52.4112.1E444 D445 T446E444-R448 WeakPolarHBondContact O-CG 3.36Å; E444-R448 PolarHBondContact O-N 3.05Å; E444-R448 VanDerWaalsContact O-N 3.15Å; E444-R448 IonicContact OE1-CZ 3.32Å; E444-R448 IonicContact OE1-NE 3.38Å; E444-R448 PolarHBondContact OE1-NE 3.34Å; E444-R448 IonicContact OE1-NH2 2.65Å; E444-R448 PolarHBondContact OE1-NH2 2.66Å; D445-R448 PolarHBondContact O-N 2.96Å; T446-R448 VanDerWaalsContact C-N 3.3Å; T446-R448 PolarHBondContact O-N 3.02Å
449M67.7Low68.7Low129 Ų129119.1 Ų119.164%0.63561%0.612SS**Hα-helixtrans-69.1-33175.7-72.8178.759.500112.9D445 T446 R451 L452D445-M449 WeakPolarHBondContact O-CG 3.37Å; D445-M449 PolarHBondContact O-N 3.14Å; T446-M449 PolarHBondContact O-N 3.47Å; M449-R451 PolarHBondContact O-N 3.27Å; M449-L452 PolarHBondContact O-N 3.32Å
450D67.3Low69.2Low141 Ų141124.5 Ų124.575%0.75463%0.629SS**THydrogen-bonded Turntrans-74.1-8.8-179.1-154.544000113.5T446T446-D450 PolarHBondContact O-N 3.12Å; T446-D450 VanDerWaalsContact O-N 3.17Å
451R70.9Confident69.3Low231 Ų231126.6 Ų126.687%0.87264%0.636SS**THydrogen-bonded Turntrans-103.40.2-179.1-134.3179.2-163.5-121.73.6114.2M449M449-R451 PolarHBondContact O-N 3.27Å
452L57.2Low69.2Low210 Ų210129.4 Ų129.4100%1.09964%0.638SS**  trans-102.80175.1-77.3160.3000109.4M449M449-L452 PolarHBondContact O-N 3.32Å

Retrieved 452 of 452 residues in 616.3 ms (Link to these results)