A0A096M4J6_POEFO Loading...

CXXC-type zinc finger protein 5

AlphaFold DB , UniProt , Accession A0A096M4J6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 278 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
1M44.1Very low39.9Very low238 Ų238137.5 Ų137.5100%1.17284%0.841SS**  0123.10-52170.879.800106.7
2S42.5Very low39.5Very low116 Ų116139.9 Ų139.981%0.81184%0.836SS**  cis-146.2146.4-32.1-76.30000104.2
3S38.1Very low39.2Very low124 Ų124141 Ų14187%0.86784%0.835SS**  trans-38.5152165.6-3.20000112.4
4G37.3Very low39.1Very low65 Ų65142.3 Ų142.367%0.6784%0.835SS**  cis126.3139.631.500000108.5
5L41.3Very low38.9Very low173 Ų173145.7 Ų145.791%0.90684%0.84SS**  trans69.7129.6151.1-60.9170.1000121.7
6S41.8Very low39.1Very low119 Ų119151.2 Ų151.283%0.83284%0.842SS**  135.6142.7112.6-840000117.4
7E37.8Very low38.9Very low196 Ų196149.2 Ų149.292%0.91684%0.841SS**  trans-88.5151.2-174.5-57173.193.400113.5
8G33.3Very low39Very low74 Ų74146.3 Ų146.376%0.76383%0.832SS**  trans75.1173.215100000119.4
9P48Very low38.7Very low131 Ų131144.6 Ų144.685%0.85183%0.829SS**  cis-138.2-170.4-15.239.8-20.1000114.8
10Q39.1Very low38.7Very low154 Ų154147.3 Ų147.372%0.7283%0.83SS**  trans-50.3160.2169.3-61168.93.600115.1
11T35.2Very low38.6Very low122 Ų122149.1 Ų149.175%0.74883%0.832SS**  167.8119.5116.941.30000110.9
12E35.7Very low38.2Very low167 Ų167144.9 Ų144.978%0.7881%0.814SS**  84.4135.483.1-42.6-134.4134.300114.2
13D34.9Very low38.3Very low154 Ų154143.9 Ų143.982%0.82481%0.807SS**  trans-60.3173.1-170.5-72.1-94.6000118.5
14L38.8Very low38.5Very low159 Ų159143.5 Ų143.583%0.83280%0.802SS**  trans99.6105.4161.1-88.681.9000116.1
15E35.3Very low38.9Very low193 Ų193146.6 Ų146.690%0.90281%0.808SS**  -169150.7100.5-98.3-145.7107.100113.2
16R41.9Very low39.2Very low234 Ų234145.9 Ų145.988%0.88380%0.803SS**  trans-81.9122-169.1178.3169.5-174.2-156.5-0.9110.3
17S36.5Very low39.6Very low117 Ų117146.2 Ų146.282%0.81879%0.792SS**  trans-136.5111.3156.8-169.10000111.2C19S17-C19 PolarHBondContact O-N 2.8Å
18S39.9Very low40.2Very low98 Ų98148.5 Ų148.569%0.68579%0.792SS**  trans-67.2115.1175.9159.30000110.4
19C33.7Very low41.1Very low113 Ų113153.6 Ų153.676%0.76479%0.788SS**  trans-142.7107.4152.9-83.80000108.6S17 Q21S17-C19 PolarHBondContact O-N 2.8Å; C19-Q21 PolarHBondContact O-N 3.19Å; C19-Q21 VanDerWaalsContact O-N 3.15Å
20K39.2Very low41.7Very low198 Ų198153.6 Ų153.686%0.86178%0.781SS**  trans-56.3114.4170.2-65.6-179.4171.7-173.70108.4
21Q36.1Very low42.7Very low186 Ų186158.3 Ų158.387%0.86979%0.792SS**  trans-92.899161.5-68.8-141.86.800107.9C19 S23C19-Q21 PolarHBondContact O-N 3.19Å; C19-Q21 VanDerWaalsContact O-N 3.15Å; Q21-S23 PolarHBondContact O-N 2.9Å
22D35.6Very low43.9Very low150 Ų150156.7 Ų156.780%0.80279%0.786SS**  trans-59.5121169.9-144.5-85.6000108.3
23S44.9Very low45Very low95 Ų95152 Ų15266%0.66478%0.782SS**  trans-64.8125.4174.5-75.90000109.3Q21 V25Q21-S23 PolarHBondContact O-N 2.9Å; S23-V25 PolarHBondContact O-N 3.13Å
24P42.1Very low45.9Very low116 Ų116151.4 Ų151.475%0.75378%0.777SS**  trans-70.7106.7170.727.2-30.2000108.4I26P24-I26 PolarHBondContact O-N 2.85Å
25V45.7Very low46.8Very low130 Ų130150.3 Ų150.379%0.78877%0.771SS**  trans-49.8111.8163.4172.90000107.4S23 E27S23-V25 PolarHBondContact O-N 3.13Å; V25-E27 PolarHBondContact O-N 3.45Å
26I47.2Very low47.7Very low157 Ų157146.5 Ų146.581%0.80577%0.766SS**  trans-69.488.5175.3-60.4170.9000107.1P24 R28P24-I26 PolarHBondContact O-N 2.85Å; I26-R28 PolarHBondContact O-N 3.32Å; I26-R28 VanDerWaalsContact O-N 3.12Å
27E49.9Very low48.5Very low127 Ų127143.3 Ų143.359%0.59376%0.76SS**  trans-67.6106.6173.1-167.3-177-166.700108.3V25 R29V25-E27 PolarHBondContact O-N 3.45Å; E27-R29 VanDerWaalsContact C-N 3.29Å; E27-R29 PolarHBondContact O-N 3.15Å; E27-R29 IonicContact OE2-CZ 3.62Å; E27-R29 IonicContact OE2-NH1 2.87Å; E27-R29 PolarHBondContact OE2-NH1 2.83Å; E27-R29 IonicContact OE2-NH2 3.74Å
28R51.3Low49.2Very low244 Ų244143 Ų14392%0.92176%0.756SS**  trans-63.886.9174.1-86.4-172.5155.1129.7-2.5110.2I26 N30I26-R28 PolarHBondContact O-N 3.32Å; I26-R28 VanDerWaalsContact O-N 3.12Å; R28-N30 PolarHBondContact O-N 3.11Å
29R53.3Low49.9Very low181 Ų181146 Ų14668%0.68376%0.763SS**  trans-66.5123.3168.9-84.3175.8169.868.23.4110.3E27E27-R29 VanDerWaalsContact C-N 3.29Å; E27-R29 PolarHBondContact O-N 3.15Å; E27-R29 IonicContact OE2-CZ 3.62Å; E27-R29 IonicContact OE2-NH1 2.87Å; E27-R29 PolarHBondContact OE2-NH1 2.83Å; E27-R29 IonicContact OE2-NH2 3.74Å
30N58.7Low50.9Low131 Ų131145 Ų14570%0.70176%0.758SS**  trans-68.9151.2164.9-164-56.3000109.4R28 S32 G33R28-N30 PolarHBondContact O-N 3.11Å; N30-S32 PolarHBondContact O-N 2.7Å; N30-G33 PolarHBondContact O-N 3.22Å
31R60.9Low51.8Low252 Ų252144.9 Ų144.995%0.95176%0.757SS**THydrogen-bonded Turntrans-67.216.1-165.4-143.1171.8-168.8-120.12.7115.5
32S60.9Low52.5Low89 Ų89141.1 Ų141.162%0.62275%0.752SS**THydrogen-bonded Turntrans-117.3-3.6-178.3-53.70000113.7N30 I34N30-S32 PolarHBondContact O-N 2.7Å; S32-I34 WeakPolarHBondContact O-CG1 3.32Å; S32-I34 PolarHBondContact O-N 3.18Å
33G57.8Low53.4Low67 Ų67140.5 Ų140.569%0.69175%0.748SS**  trans65.89.6171.200000116.3N30N30-G33 PolarHBondContact O-N 3.22Å
34I55.7Low53.8Low142 Ų142144.3 Ų144.373%0.72875%0.752SS**  trans-92123.8177.5-34.8-179.5000108.2S32 S36S32-I34 WeakPolarHBondContact O-CG1 3.32Å; S32-I34 PolarHBondContact O-N 3.18Å; I34-S36 PolarHBondContact O-N 3.17Å
35I57.4Low54.4Low136 Ų136146.9 Ų146.970%0.69776%0.76SS**  trans-57.1120.1172.4-58.5170.3000106.9E37I35-E37 HydrophobicContact CG2-CG 4.46Å; I35-E37 PolarHBondContact O-N 3.5Å
36S53.2Low54.5Low114 Ų114145.3 Ų145.380%0.79775%0.754SS**  trans-77.876.1170-54.50000107.6I34I34-S36 PolarHBondContact O-N 3.17Å
37E58.3Low54.9Low166 Ų166149 Ų14978%0.77676%0.758SS**  trans-62.5129.7163.9-106.4-175.613500107.6I35 L39I35-E37 HydrophobicContact CG2-CG 4.46Å; I35-E37 PolarHBondContact O-N 3.5Å; E37-L39 PolarHBondContact O-N 3.23Å; E37-L39 VanDerWaalsContact O-N 3.11Å
38P51.7Low55.2Low111 Ų111150 Ų15072%0.72177%0.773SS**  trans-61.8121.3172.525.4-30.5000107.2S40P38-S40 PolarHBondContact O-N 2.95Å
39L55.7Low54.7Low160 Ų160146 Ų14684%0.83877%0.769SS**  trans-55.281.8178.8-171.984000110.3E37 K41E37-L39 PolarHBondContact O-N 3.23Å; E37-L39 VanDerWaalsContact O-N 3.11Å; L39-K41 PolarHBondContact O-N 3.46Å; L39-K41 VanDerWaalsContact O-N 3.17Å
40S54.6Low54Low94 Ų94143 Ų14366%0.65778%0.776SS**  trans-8496.9177.265.60000108P38 S42P38-S40 PolarHBondContact O-N 2.95Å; S40-S42 VanDerWaalsContact C-N 3.28Å; S40-S42 PolarHBondContact O-N 3.07Å
41K57.2Low53.6Low194 Ų194145.6 Ų145.684%0.84378%0.784SS**SBendtrans52.825.1145.8-50.3177.6-174.7175.80118.3L39L39-K41 PolarHBondContact O-N 3.46Å; L39-K41 VanDerWaalsContact O-N 3.17Å
42S51Low52.4Low108 Ų108144.2 Ų144.276%0.75578%0.78SS**  trans-106.244.2176.6-157.70000113.3S40S40-S42 VanDerWaalsContact C-N 3.28Å; S40-S42 PolarHBondContact O-N 3.07Å
43L55Low51.4Low136 Ų136146.6 Ų146.671%0.71279%0.791SS**  trans-139.542170.4-83.5177.9000111.2
44K52Low50.5Low175 Ų175148.3 Ų148.376%0.76180%0.799SS**SBendtrans-128.9116.5164.1-68.2163.8-175-177.30104.1
45N55.6Low49.7Very low170 Ų170148.5 Ų148.591%0.90981%0.806SS**  trans102.157.5-177.1-45.8-11.5000114.6
46S48.5Very low48.7Very low97 Ų97147.4 Ų147.468%0.67881%0.811SS**  trans-127.399.6150.651.60000111.1
47R55.2Low47.9Very low236 Ų236148 Ų14889%0.89182%0.815SS**  trans71.591148.5-64.5-179.2174.2-167.7-3118.8L49R47-L49 PolarHBondContact O-N 3.23Å
48T55.2Low46.9Very low146 Ų146144.4 Ų144.490%0.89681%0.813SS**  trans-68.1100136.146.50000109.4
49L41.7Very low46.2Very low160 Ų160146 Ų14684%0.83882%0.822SS**  trans-157.890.3161.9-157.7119.7000111.4R47R47-L49 PolarHBondContact O-N 3.23Å
50S38.3Very low45.5Very low119 Ų119143.6 Ų143.683%0.83281%0.813SS**  trans-164.383.4143.2-158.30000108.6
51Q49.1Very low44.6Very low186 Ų186146.4 Ų146.487%0.86982%0.821SS**  trans-123.896.1159.6-75.1-174.18.400106.3
52Y37.5Very low43.4Very low222 Ų222140.6 Ų140.687%0.87182%0.816SS**  trans-143.4134.6153.6-96-80.5000108.1
53T38.8Very low42.5Very low139 Ų139144.1 Ų144.185%0.85382%0.82SS**  trans87.789.8174.571.70000117
54A38.9Very low41.6Very low103 Ų103142.2 Ų142.285%0.85182%0.815SS**  -162.8134.1113.500000110.3
55V39.4Very low40.7Very low146 Ų146140.4 Ų140.489%0.88581%0.813SS**  trans-64.3153.9-178.9-86.10000113.6
56S37Very low39.6Very low114 Ų114139.5 Ų139.580%0.79781%0.808SS**  trans-49.4146.1-178.3-43.60000116.3
57S36.2Very low38.8Very low126 Ų126140.3 Ų140.388%0.88181%0.814SS**  trans-155.2114.7137.8-68.70000109
58A37.3Very low37.8Very low90 Ų90134 Ų13474%0.74481%0.806SS**  trans-70.7147.7178.600000111.9
59T36Very low36.7Very low146 Ų146133.5 Ų133.590%0.89680%0.803SS**  trans-150.7138.4138.6-16.50000109.8
60T41Very low36.2Very low108 Ų108134.5 Ų134.566%0.66380%0.8SS**  trans-96.5172.7-160.850.20000112.3
61N35.3Very low35.8Very low154 Ų154132.8 Ų132.882%0.82479%0.788SS**  trans97103155-58.3-17.4000116.6
62G32.3Very low35.2Very low71 Ų71132.9 Ų132.973%0.73279%0.789SS**  trans-82.7168.1149.100000111.5
63H32.6Very low35.1Very low183 Ų183128.1 Ų128.185%0.84779%0.788SS**  trans-167.8160.3133.3-136.2-87.1000110.3
64T36.1Very low34.9Very low96 Ų96126.6 Ų126.659%0.58979%0.789SS**  trans-79.7179-166.347.30000116.6
65D33.7Very low34.5Very low136 Ų136131.1 Ų131.173%0.72779%0.79SS**  trans98.5105.7152-53.6-49.5000116.7
66N32.8Very low34.6Very low151 Ų151128.8 Ų128.881%0.80778%0.778SS**  78.1109.171.7-166.320.3000113.3
67S31.2Very low34.4Very low115 Ų115132.2 Ų132.280%0.80478%0.781SS**  trans-176.4149.9130.848.70000112.8
68S32.9Very low34.7Very low102 Ų102131.3 Ų131.371%0.71377%0.772SS**  trans-66.7157.9-169.349.10000118.2
69T32.4Very low35Very low137 Ų137132.8 Ų132.884%0.8477%0.774SS**  162.2147.5125.337.50000107.5
70K31.8Very low34.7Very low180 Ų180130.5 Ų130.578%0.78377%0.77SS**  cis-161.6134.3-14.7176.8170.2175.81790104.8
71S29.7Very low34.5Very low83 Ų83130 Ų13058%0.5878%0.777SS**  trans-22.3144.8164.750.70000119.1
72H36.9Very low34.8Very low189 Ų189128 Ų12888%0.87577%0.773SS**  -157.5135.2117.2-87.7-63.6000111.7
73S35.3Very low34.8Very low121 Ų121133.5 Ų133.585%0.84678%0.779SS**  trans-83.5148.9-176.5-640000114
74A33.1Very low35.2Very low108 Ų108129.5 Ų129.589%0.89378%0.777SS**  -177.6149128.200000111.6
75K32.5Very low35.2Very low197 Ų197131.5 Ų131.586%0.85779%0.79SS**  trans-130.2179.3-174.9-176.3167.6177.6175.40107.3
76P41.3Very low35.8Very low98 Ų98131.8 Ų131.864%0.63680%0.796SS**  -118.2166.2-59.136.7-22.1000113.6
77Q31.8Very low36.4Very low186 Ų186129.8 Ų129.887%0.86979%0.794SS**  158.6153.9128.3-97.8-171.6-77.300114.8
78P43.2Very low36.8Very low106 Ų106131.2 Ų131.269%0.68880%0.798SS**  trans-92.1-172.2179.442.8-35.5000111.1
79P43.3Very low37.5Very low122 Ų122134.4 Ų134.479%0.79281%0.806SS**  cis-139.2-169.11040.4-18.8000115.8
80A29.4Very low38.4Very low98 Ų98134.9 Ų134.981%0.8181%0.809SS**  trans116.8114.6153.300000117.5
81A37.7Very low39Very low96 Ų96131.4 Ų131.479%0.79381%0.814SS**  trans-63.4167.7155.900000110.1
82P41.3Very low39.7Very low114 Ų114132.2 Ų132.274%0.7483%0.825SS**  cis-136.9167.22338.3-19000114.9
83Q32Very low40Very low186 Ų186131.9 Ų131.987%0.86982%0.822SS**  174.4140.7126.2-93.1173.212.300111.8
84A41.6Very low40.7Very low98 Ų98133.5 Ų133.581%0.8182%0.82SS**  trans-71129.4-177.700000111.5
85T35.1Very low41.3Very low139 Ų139135.1 Ų135.185%0.85381%0.813SS**  trans-130.8121.1160.348.30000109.5S87T85-S87 PolarHBondContact O-N 2.83Å
86V46.9Very low42.1Very low142 Ų142135.2 Ų135.286%0.86181%0.809SS**  trans-71.7118.1175.61790000107.8
87S45.3Very low42.5Very low108 Ų108134.3 Ų134.376%0.75580%0.801SS**  trans173.7103.5150.7-81.90000110.2T85T85-S87 PolarHBondContact O-N 2.83Å
88T40.1Very low43.5Very low145 Ų145131 Ų13189%0.8979%0.789SS**  trans-177.476.415618.40000109.7
89L47.8Very low43.8Very low170 Ų170132.6 Ų132.689%0.8979%0.787SS**  trans-141.453.2170.5-85179.5000112.1
90T49.3Very low44.1Very low146 Ų146133.2 Ų133.290%0.89678%0.779SS**  trans-151.861.5167.154.20000112.2
91A45Very low45.2Very low108 Ų108132.1 Ų132.189%0.89376%0.763SS**SBendtrans-145.816.9169.700000114.3
92A44.3Very low45.8Very low99 Ų99132 Ų13282%0.81875%0.748SS**SBendtrans-126.49.3-178.800000114.1
93K44.2Very low46.3Very low183 Ų183133.7 Ų133.780%0.79675%0.746SS**SBendtrans-112.3-3.1-173.2-141.3172.9-175.6177.20115.1T97K93-T97 PolarHBondContact O-OG1 3.15Å
94L48.9Very low47.3Very low155 Ų155126.8 Ų126.881%0.81273%0.725SS**SBendtrans-99.2-18.5-179.2-67.5-179.8000114.2
95D45.8Very low47.9Very low141 Ų141128.1 Ų128.175%0.75471%0.714SS**Hα-helixtrans-74.7-37-178.5-163.5-107.5000112.6T97D95-T97 PolarHBondContact O-N 3.09Å
96R49.4Very low48.9Very low200 Ų200125.9 Ų125.976%0.75570%0.697SS**Hα-helixtrans-80.24.6-179-137.3-178.985.6-176.97.5115.3
97T51.1Low49.4Very low78 Ų78121.3 Ų121.348%0.47968%0.678SS.*Hα-helixtrans-105.6-23.6-179.4-36.80000111.1K93 D95 V101K93-T97 PolarHBondContact O-OG1 3.15Å; D95-T97 PolarHBondContact O-N 3.09Å; T97-V101 VanDerWaalsContact O-CG2 3.28Å; T97-V101 WeakPolarHBondContact O-CG2 3.45Å; T97-V101 PolarHBondContact O-N 3.12Å
98L52.2Low50.2Low117 Ų117122.6 Ų122.661%0.61368%0.676SS**Hα-helixtrans-79.9-43.5-178.1-165150.3000111.9Q100 V101 L102L98-Q100 PolarHBondContact O-N 3.42Å; L98-V101 PolarHBondContact O-N 3.04Å; L98-L102 PolarHBondContact O-N 2.77Å; L98-L102 VanDerWaalsContact O-N 3.1Å
99E48.9Very low51.2Low139 Ų139121.4 Ų121.465%0.6566%0.664SS**Hα-helixtrans-61-34172.1-75.8-81.5104.800112.2L102 E103E99-L102 PolarHBondContact O-N 3.21Å; E99-E103 PolarHBondContact O-N 3.1Å; E99-E103 VanDerWaalsContact O-N 3.16Å
100Q49.7Very low51.9Low135 Ų135119.6 Ų119.663%0.63165%0.651SS**Hα-helixtrans-79.6-21.9-178.1-151.8165.9-16.600112.8L98 G104L98-Q100 PolarHBondContact O-N 3.42Å; Q100-G104 PolarHBondContact O-N 3.43Å
101V52.9Low52.9Low76 Ų76120.4 Ų120.446%0.46164%0.642SS.*Hα-helixtrans-81.2-33170.8166.40000111.3T97 L98 G104 Q105T97-V101 VanDerWaalsContact O-CG2 3.28Å; T97-V101 WeakPolarHBondContact O-CG2 3.45Å; T97-V101 PolarHBondContact O-N 3.12Å; L98-V101 PolarHBondContact O-N 3.04Å; V101-G104 PolarHBondContact O-N 3.34Å; V101-Q105 WeakPolarHBondContact O-CG 3.49Å; V101-Q105 PolarHBondContact O-N 3.33Å
102L50.2Low53.9Low94 Ų94118.1 Ų118.149%0.49262%0.623SS.*Hα-helixtrans-70.8-41.8177.4-125.974.4000112.3L98 E99 G104 N106L98-L102 PolarHBondContact O-N 2.77Å; L98-L102 VanDerWaalsContact O-N 3.1Å; E99-L102 PolarHBondContact O-N 3.21Å; L102-G104 VanDerWaalsContact C-N 3.34Å; L102-N106 PolarHBondContact O-N 3.29Å; L102-N106 PolarHBondContact O-ND2 3.34Å; L102-N106 VanDerWaalsContact O-ND2 3.08Å
103E51.5Low55.2Low149 Ų149118.9 Ų118.970%0.69661%0.61SS**Hα-helixtrans-67.8-35173.7-162.770.5-140.600111.7E99 G107E99-E103 PolarHBondContact O-N 3.1Å; E99-E103 VanDerWaalsContact O-N 3.16Å; E103-G107 PolarHBondContact O-N 3.48Å
104G53.6Low56.3Low41 Ų41112.7 Ų112.742%0.42359%0.593SS.*Hα-helixtrans-69.4-32.9177.500000114.3Q100 V101 L102 L108Q100-G104 PolarHBondContact O-N 3.43Å; V101-G104 PolarHBondContact O-N 3.34Å; L102-G104 VanDerWaalsContact C-N 3.34Å; G104-L108 PolarHBondContact O-N 3.37Å
105Q53.6Low57.2Low125 Ų125107.6 Ų107.658%0.58457%0.573SS**Hα-helixtrans-73.5-37.7175.7-80.7-173.251.300112.5V101 L108 L109V101-Q105 WeakPolarHBondContact O-CG 3.49Å; V101-Q105 PolarHBondContact O-N 3.33Å; Q105-L108 PolarHBondContact O-N 3.49Å; Q105-L109 PolarHBondContact O-N 2.86Å
106N56.7Low58.2Low93 Ų93103.7 Ų103.750%0.49756%0.561SS.*Hα-helixtrans-66.4-39.3176.5-72.6-43.1000112L102 L108 L109 H110L102-N106 PolarHBondContact O-N 3.29Å; L102-N106 PolarHBondContact O-ND2 3.34Å; L102-N106 VanDerWaalsContact O-ND2 3.08Å; N106-L108 PolarHBondContact O-N 2.92Å; N106-L109 PolarHBondContact O-N 2.93Å; N106-H110 PolarHBondContact O-CD2 3.05Å; N106-H110 VanDerWaalsContact O-CD2 3.28Å; N106-H110 PolarHBondContact O-N 2.74Å; N106-H110 VanDerWaalsContact O-N 3.12Å
107G58.1Low59Low45 Ų4599.3 Ų99.346%0.46455%0.551SS.*Hα-helixtrans-65-37.5176.400000114E103 F111E103-G107 PolarHBondContact O-N 3.48Å; G107-F111 PolarHBondContact O-N 3.45Å; G107-F111 VanDerWaalsContact O-N 3.11Å
108L61.3Low59.8Low136 Ų136102.1 Ų102.171%0.71256%0.563SS**Hα-helixtrans-70.2-38.3179.5-136.395.2000112G104 Q105 N106 F111 A112G104-L108 PolarHBondContact O-N 3.37Å; Q105-L108 PolarHBondContact O-N 3.49Å; N106-L108 PolarHBondContact O-N 2.92Å; L108-F111 PolarHBondContact O-N 3.43Å; L108-A112 PolarHBondContact O-N 3.36Å
109L60Low60.4Low119 Ų119104.6 Ų104.662%0.62357%0.569SS**Hα-helixtrans-68.7-38.6178.6-141.8149.4000111Q105 N106 A112 Q113Q105-L109 PolarHBondContact O-N 2.86Å; N106-L109 PolarHBondContact O-N 2.93Å; L109-A112 PolarHBondContact O-N 3.21Å; L109-Q113 WeakPolarHBondContact O-CB 3.41Å; L109-Q113 PolarHBondContact O-N 3.26Å
110H63.7Low61Low133 Ų133106.4 Ų106.462%0.61657%0.569SS**Hα-helixtrans-62.9-39.1171.3-91.6-73.1000113.1N106 A114N106-H110 PolarHBondContact O-CD2 3.05Å; N106-H110 VanDerWaalsContact O-CD2 3.28Å; N106-H110 PolarHBondContact O-N 2.74Å; N106-H110 VanDerWaalsContact O-N 3.12Å; H110-A114 WeakPolarHBondContact O-CB 3.13Å; H110-A114 PolarHBondContact O-N 3.44Å
111F69.4Low61.4Low162 Ų162103.1 Ų103.171%0.71157%0.566SS**Hα-helixtrans-69.7-40.7177.5-162.1-90.6000111.9G107 L108 A114 A115G107-F111 PolarHBondContact O-N 3.45Å; G107-F111 VanDerWaalsContact O-N 3.11Å; L108-F111 PolarHBondContact O-N 3.43Å; F111-A114 PolarHBondContact O-N 2.71Å; F111-A115 WeakPolarHBondContact O-CB 3.24Å; F111-A115 PolarHBondContact O-N 2.9Å
112A66.8Low61.4Low61 Ų61102 Ų10250%0.50457%0.569SS.*Hα-helixtrans-63.2-41.5174.800000111.9L108 L109 A115 A116L108-A112 PolarHBondContact O-N 3.36Å; L109-A112 PolarHBondContact O-N 3.21Å; A112-A115 PolarHBondContact O-N 3.22Å; A112-A116 WeakPolarHBondContact O-CB 3.42Å; A112-A116 PolarHBondContact O-N 3.22Å
113Q71.1Confident61.5Low114 Ų114102.9 Ų102.953%0.53357%0.572SS.*Hα-helixtrans-65.1-40.9175.9-170.2175.7-1.500111.8L109 A116 L117L109-Q113 WeakPolarHBondContact O-CB 3.41Å; L109-Q113 PolarHBondContact O-N 3.26Å; Q113-A116 PolarHBondContact O-N 2.86Å; Q113-L117 WeakPolarHBondContact O-CG 3.45Å; Q113-L117 PolarHBondContact O-N 3.4Å; Q113-L117 VanDerWaalsContact O-N 3.16Å
114A66.9Low61.4Low54 Ų54103.5 Ų103.545%0.44658%0.575SS.*Hα-helixtrans-65.8-41.1175.200000112.4H110 F111 A116 L117 L118H110-A114 WeakPolarHBondContact O-CB 3.13Å; H110-A114 PolarHBondContact O-N 3.44Å; F111-A114 PolarHBondContact O-N 2.71Å; A114-A116 VanDerWaalsContact C-N 3.34Å; A114-A116 PolarHBondContact O-N 2.97Å; A114-L117 PolarHBondContact O-N 3.31Å; A114-L118 PolarHBondContact O-N 3.47Å
115A69.1Low61.2Low47 Ų47110 Ų11039%0.38859%0.594SS.*Hα-helixtrans-65.7-35.1176.800000112.5F111 A112 L118 K119F111-A115 WeakPolarHBondContact O-CB 3.24Å; F111-A115 PolarHBondContact O-N 2.9Å; A112-A115 PolarHBondContact O-N 3.22Å; A115-L118 PolarHBondContact O-N 2.85Å; A115-K119 PolarHBondContact O-N 3.47Å
116A65.3Low61Low60 Ų60111.8 Ų111.850%0.49660%0.604SS.*Hα-helixtrans-67.2-39.2174.800000112.4A112 Q113 A114 K119 R120A112-A116 WeakPolarHBondContact O-CB 3.42Å; A112-A116 PolarHBondContact O-N 3.22Å; Q113-A116 PolarHBondContact O-N 2.86Å; A114-A116 VanDerWaalsContact C-N 3.34Å; A114-A116 PolarHBondContact O-N 2.97Å; A116-K119 PolarHBondContact O-N 2.89Å; A116-R120 PolarHBondContact O-N 3.39Å; A116-R120 VanDerWaalsContact O-N 3.08Å
117L66.8Low60.6Low107 Ų107114.6 Ų114.656%0.5662%0.619SS**Hα-helixtrans-66.3-39.5173.7-69.4173000111.8Q113 A114 R120 A121Q113-L117 WeakPolarHBondContact O-CG 3.45Å; Q113-L117 PolarHBondContact O-N 3.4Å; Q113-L117 VanDerWaalsContact O-N 3.16Å; A114-L117 PolarHBondContact O-N 3.31Å; L117-R120 PolarHBondContact O-N 3.46Å; L117-A121 WeakPolarHBondContact O-CB 3.04Å; L117-A121 PolarHBondContact O-N 3.13Å
118L69.3Low60.1Low138 Ų138120.3 Ų120.372%0.72364%0.638SS**Hα-helixtrans-67.4-37.9176.6-138.777.9000112.3A114 A115 R120 A121 G122A114-L118 PolarHBondContact O-N 3.47Å; A115-L118 PolarHBondContact O-N 2.85Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-A121 PolarHBondContact O-N 2.92Å; L118-G122 PolarHBondContact O-N 3.5Å
119K64.7Low59.5Low169 Ų169119.6 Ų119.674%0.73564%0.641SS**Hα-helixtrans-65-35.7173.2-99.3-174.1176.5177.80112.7A115 A116 M123A115-K119 PolarHBondContact O-N 3.47Å; A116-K119 PolarHBondContact O-N 2.89Å; K119-M123 WeakPolarHBondContact O-CE 3.36Å
120R60Low58.6Low176 Ų176117.6 Ų117.666%0.66465%0.65SS**Hα-helixtrans-73.5-34.8175.4-167.6-179.2-74.9168.2-4.8112A116 L117 L118 M123A116-R120 PolarHBondContact O-N 3.39Å; A116-R120 VanDerWaalsContact O-N 3.08Å; L117-R120 PolarHBondContact O-N 3.46Å; L118-R120 VanDerWaalsContact C-N 3.34Å; R120-M123 WeakPolarHBondContact O-CG 3.31Å
121A57.9Low57.9Low67 Ų67115 Ų11555%0.55466%0.658SS**Hα-helixtrans-73.6-28.2174.800000113.1L117 L118 M123L117-A121 WeakPolarHBondContact O-CB 3.04Å; L117-A121 PolarHBondContact O-N 3.13Å; L118-A121 PolarHBondContact O-N 2.92Å; A121-M123 VanDerWaalsContact C-N 3.33Å; A121-M123 PolarHBondContact O-N 3.48Å
122G53.6Low56.8Low52 Ų52116 Ų11654%0.53667%0.667SS.*THydrogen-bonded Turntrans-77.7-9.5179.300000115.6L118L118-G122 PolarHBondContact O-N 3.5Å
123M51.9Low55.6Low112 Ų112116.9 Ų116.955%0.55268%0.683SS**THydrogen-bonded Turntrans-97.1-16.3177.157.6177.565.600113.8K119 R120 A121 H125K119-M123 WeakPolarHBondContact O-CE 3.36Å; R120-M123 WeakPolarHBondContact O-CG 3.31Å; A121-M123 VanDerWaalsContact C-N 3.33Å; A121-M123 PolarHBondContact O-N 3.48Å; M123-H125 VanDerWaalsContact C-N 3.3Å; M123-H125 PolarHBondContact O-N 3.03Å
124E49.2Very low54.4Low162 Ų162118.1 Ų118.176%0.75770%0.697SS**THydrogen-bonded Turntrans-85.5-0.8-178.8-63.2-76.3115.100113.1
125H50.4Low53.1Low177 Ų177118.8 Ų118.882%0.81971%0.71SS**THydrogen-bonded Turntrans-119.413.4-179.6-133-77.3000114.2M123M123-H125 VanDerWaalsContact C-N 3.3Å; M123-H125 PolarHBondContact O-N 3.03Å
126M49.6Very low52.1Low163 Ų163123.6 Ų123.680%0.80373%0.734SS**SBendtrans-122.230.8-179.2-82.3-78.6-83.600113
127L48.3Very low50.8Low152 Ų152124.1 Ų124.180%0.79675%0.746SS**  trans-125.2118.5163.5-92.399.3000110.7
128L46.2Very low49.6Very low166 Ų166123 Ų12387%0.86976%0.76SS**SBendtrans105143164.5-71.9166.3000118
129P49.3Very low48.1Very low121 Ų121120.2 Ų120.279%0.78677%0.765SS**  -126.3148.8-103.737.9-23.3000113.9
130G42.1Very low46.9Very low77 Ų77120.2 Ų120.279%0.79477%0.773SS**  trans168.487.7170.800000111.3
131G47.3Very low46.1Very low77 Ų77116.9 Ų116.979%0.79478%0.783SS**  trans-73.6139.8-16900000115.1
132M47.2Very low45Very low184 Ų184117.5 Ų117.591%0.90680%0.795SS**  trans-146.282.3149.4-48175.9-15400106.6V134M132-V134 PolarHBondContact O-N 3.19Å
133G40.9Very low44.2Very low80 Ų80121.5 Ų121.583%0.82582%0.815SS**  trans-71.7115173.600000109.5G135G133-G135 VanDerWaalsContact C-N 3.3Å; G133-G135 PolarHBondContact O-N 3.42Å
134V46.3Very low43.5Very low139 Ų139119.9 Ų119.984%0.84283%0.827SS**  trans-76.290.7166.2179.20000107.1M132 V136M132-V134 PolarHBondContact O-N 3.19Å; V134-V136 PolarHBondContact O-N 3.46Å
135G40.7Very low43Very low69 Ų69116.8 Ų116.871%0.71183%0.829SS**  trans-70.4115.6167.700000109.8G133 G137G133-G135 VanDerWaalsContact C-N 3.3Å; G133-G135 PolarHBondContact O-N 3.42Å; G135-G137 PolarHBondContact O-N 3.47Å; G135-G137 VanDerWaalsContact O-N 3.15Å
136V47.3Very low42.5Very low147 Ų147114.4 Ų114.489%0.89183%0.833SS**  trans-75.193.9161.7174.50000106.7V134V134-V136 PolarHBondContact O-N 3.46Å
137G37.1Very low42.1Very low72 Ų72114.2 Ų114.274%0.74284%0.835SS**  trans-113.8105.3171.600000109.4G135G135-G137 PolarHBondContact O-N 3.47Å; G135-G137 VanDerWaalsContact O-N 3.15Å
138G41.5Very low42.2Very low84 Ų84114.5 Ų114.587%0.86684%0.836SS**  trans-73.7141.5163.100000110.2
139G37.6Very low42Very low79 Ų79114.7 Ų114.781%0.81483%0.833SS**  trans-174.8102.6175.900000110.5
140D41.2Very low41.4Very low169 Ų169112.7 Ų112.790%0.90483%0.834SS**  trans-68.5159.8164.3-93.6-56.3000111.5
141A43Very low41Very low106 Ų106114.5 Ų114.588%0.87683%0.83SS**  trans98.1126.316300000118.5
142G34.9Very low40.7Very low79 Ų79115.8 Ų115.881%0.81483%0.827SS**  trans133.7103.7139.900000116.8
143S37.1Very low40.2Very low136 Ų136113 Ų11395%0.95182%0.82SS**  trans-43150.2168.1-58.40000116.6
144G35.5Very low40.1Very low78 Ų78115.2 Ų115.280%0.80482%0.817SS**  trans-178.4104160.600000112.1
145A38.8Very low40Very low98 Ų98116 Ų11681%0.8182%0.817SS**  trans-66.6151179.700000113.3
146S41.6Very low40Very low127 Ų127117.5 Ų117.589%0.88882%0.823SS**  -171.9129.4126.9-74.50000110.4
147D40Very low39.7Very low159 Ų159117.3 Ų117.385%0.8582%0.822SS**  trans-75.5168.7177.2-138.7-86.8000111.5
148L51.3Low39.6Very low157 Ų157117.6 Ų117.682%0.82282%0.824SS**  trans133.6124.6138.5-164.369.3000115.7
149E41.9Very low39.2Very low170 Ų170117.4 Ų117.479%0.79482%0.822SS**  trans-45.7162.7177-74.4-14990.600119.2
150G35.6Very low39.9Very low79 Ų79119.4 Ų119.481%0.81482%0.821SS**  trans-176.7104.8154.900000114
151T34.5Very low39.9Very low116 Ų116117.8 Ų117.871%0.71282%0.817SS**  trans-74.2142.5-178.4550000114.9
152S41.2Very low40Very low104 Ų104119.8 Ų119.873%0.72781%0.813SS**  trans25140143.467.90000124.2
153V36.7Very low39.8Very low125 Ų125125.2 Ų125.276%0.75881%0.814SS**  trans99137.8136.5162.30000120.6
154T38.5Very low40.6Very low126 Ų126124.9 Ų124.977%0.77381%0.809SS**  trans89.2109.3161.353.90000122.1
155D43.5Very low41.3Very low155 Ų155131.2 Ų131.283%0.82981%0.81SS**  29.6120.6125.6-147.2-90.4000120.4
156A41.6Very low41.4Very low102 Ų102129.5 Ų129.584%0.84380%0.802SS**  trans-152.9118.314800000110.8
157V41.3Very low41.5Very low143 Ų143130.5 Ų130.587%0.86780%0.802SS**  trans-70.8140172.865.80000112.2
158G34.8Very low41.7Very low77 Ų77126.2 Ų126.279%0.79480%0.796SS**  trans120.6114.6148.500000117.8
159G33.8Very low41.3Very low80 Ų80123.5 Ų123.583%0.82579%0.79SS**  trans130.2116.515200000116.3
160P50.7Low41.6Very low121 Ų121118.5 Ų118.579%0.78679%0.785SS**  trans-92140.2-167.836.1-31.3000112.5
161V42.8Very low42Very low136 Ų136120.7 Ų120.782%0.82477%0.772SS**  172.1141.8121.8-81.80000110.6
162D44Very low42.8Very low148 Ų148118.5 Ų118.579%0.79176%0.759SS**  trans70.857.8158.5-93.9-85.5000120.1
163F31.8Very low43.2Very low192 Ų192123.2 Ų123.284%0.84277%0.767SS**  trans-105.3131.1137.7-86.8-88.7000108.5Y165F163-Y165 PolarHBondContact O-N 3.39Å
164P52Low43.7Very low129 Ų129122.6 Ų122.684%0.83876%0.759SS**SBendtrans-77.548175.234.9-35.1000110.6
165Y51.6Low44.5Very low212 Ų212123.1 Ų123.183%0.83177%0.765SS**  trans-111.761.3162.3-154.3-99.4000107.4F163 V167F163-Y165 PolarHBondContact O-N 3.39Å; Y165-V167 PolarHBondContact O-N 3.25Å
166G39.8Very low45.3Very low62 Ų62117.8 Ų117.864%0.63975%0.747SS**  trans-72.3102.4170.100000109.3G168G166-G168 VanDerWaalsContact C-N 3.28Å; G166-G168 PolarHBondContact O-N 3.31Å
167V45.3Very low46.4Very low147 Ų147115.6 Ų115.689%0.89172%0.721SS**SBendtrans-39.398.9141.4169.70000107.5Y165Y165-V167 PolarHBondContact O-N 3.25Å
168G43.4Very low47.7Very low70 Ų70115.2 Ų115.272%0.72271%0.708SS**  trans161.85.1-173.200000119.5G166 G170G166-G168 VanDerWaalsContact C-N 3.28Å; G166-G168 PolarHBondContact O-N 3.31Å; G168-G170 PolarHBondContact O-N 2.71Å; G168-G170 VanDerWaalsContact O-N 3.13Å
169S42.4Very low49.7Very low100 Ų100114 Ų11470%0.69968%0.683SS**  trans-85.571.5154.3530000107.9F171S169-F171 PolarHBondContact O-N 3.33Å
170G47.8Very low51.1Low65 Ų65118 Ų11867%0.6768%0.682SS**  trans-55.595.5156.500000107G168 P172G168-G170 PolarHBondContact O-N 2.71Å; G168-G170 VanDerWaalsContact O-N 3.13Å; G170-P172 VanDerWaalsContact O-CD 3.32Å; G170-P172 WeakPolarHBondContact O-CD 3.36Å; G170-P172 VanDerWaalsContact O-N 3.17Å
171F45Very low52.2Low125 Ų125114.9 Ų114.955%0.54866%0.66SS.*  trans-59.3118.3154.9-80.5-87.4000104.3S169 F173 L177S169-F171 PolarHBondContact O-N 3.33Å; F171-F173 PolarHBondContact O-N 3.06Å; F171-L177 HydrophobicContact CD1-CD2 4.17Å
172P50.9Low53.2Low69 Ų69115.6 Ų115.645%0.44867%0.668SS.*  trans-59.1112.3176.224-29.8000105.2G170 N174 L177G170-P172 VanDerWaalsContact O-CD 3.32Å; G170-P172 WeakPolarHBondContact O-CD 3.36Å; G170-P172 VanDerWaalsContact O-N 3.17Å; P172-N174 PolarHBondContact O-N 3.06Å; P172-L177 HydrophobicContact CG-CD2 4.14Å
173F49.4Very low54.3Low204 Ų204112.8 Ų112.890%0.89567%0.665SS**  trans-66.757.5164.7-64.6-81.9000107.9F171 P175F171-F173 PolarHBondContact O-N 3.06Å; F173-P175 WeakPolarHBondContact O-CD 3.49Å
174N47.3Very low55.8Low111 Ų111105 Ų10559%0.59464%0.639SS**  trans-81.9117.9163.1-91.5-61000105.3P172 G176 L177P172-N174 PolarHBondContact O-N 3.06Å; N174-G176 VanDerWaalsContact C-N 3.33Å; N174-G176 PolarHBondContact O-N 3.18Å; N174-L177 PolarHBondContact O-N 3.44Å; N174-L177 VanDerWaalsContact O-N 3.09Å
175P55.1Low56.7Low137 Ų137102.8 Ų102.889%0.8962%0.623SS**THydrogen-bonded Turntrans-60100.2169.325.5-31.7000107.8F173F173-P175 WeakPolarHBondContact O-CD 3.49Å
176G59.7Low57.5Low44 Ų4497.1 Ų97.145%0.45460%0.603SS.*THydrogen-bonded Turntrans133.61.2-172.200000115.7N174 F178N174-G176 VanDerWaalsContact C-N 3.33Å; N174-G176 PolarHBondContact O-N 3.18Å; G176-F178 WeakPolarHBondContact O-CD2 3.43Å; G176-F178 WeakPolarHBondContact O-CE2 3.48Å; G176-F178 PolarHBondContact O-N 3.14Å
177L66.6Low59.2Low56 Ų5697.8 Ų97.829%0.29359%0.591SS.*PPolyproline II helixtrans-73.7118.5172.6-168.970.4000111F171 P172 N174 A188F171-L177 HydrophobicContact CD1-CD2 4.17Å; P172-L177 HydrophobicContact CG-CD2 4.14Å; N174-L177 PolarHBondContact O-N 3.44Å; N174-L177 VanDerWaalsContact O-N 3.09Å; L177-A188 PolarHBondContact O-N 3.11Å; L177-A188 VanDerWaalsContact O-N 3.1Å
178F67.7Low60Low134 Ų13492.4 Ų92.459%0.58856%0.563SS**EExtended strand (participates in β ladder)trans-100.9125.2175.7-67.2-82.9000110.5G176 V185 F186 L187G176-F178 WeakPolarHBondContact O-CD2 3.43Å; G176-F178 WeakPolarHBondContact O-CE2 3.48Å; G176-F178 PolarHBondContact O-N 3.14Å; F178-V185 HydrophobicContact CB-CG1 3.57Å; F178-V185 HydrophobicContact CD1-CG1 3.97Å; F178-V185 HydrophobicContact CG-CG1 4.11Å; F178-F186 CarbonylContact C-O 3.54Å; F178-F186 WeakPolarHBondContact CA-O 3.19Å; F178-L187 HydrophobicContact CD1-CD2 3.58Å; F178-L187 HydrophobicContact CD1-CG 3.96Å; F178-L187 HydrophobicContact CD2-CD2 4.39Å; F178-L187 HydrophobicContact CE1-CD1 4.43Å; F178-L187 HydrophobicContact CE1-CD2 3.27Å; F178-L187 HydrophobicContact CE1-CG 3.62Å; F178-L187 HydrophobicContact CE2-CD2 4.12Å; F178-L187 HydrophobicContact CG-CD2 4.14Å; F178-L187 HydrophobicContact CZ-CD2 3.57Å; F178-L187 HydrophobicContact CZ-CG 4.32Å
179I76Confident60.7Low53 Ų5395.5 Ų95.527%0.27256%0.563SS.*EExtended strand (participates in β ladder)trans-97.8119.6177.2-55.1178000108.5T181 V185 F186 A188 A191I179-T181 HydrophobicContact CG2-CG2 4.13Å; I179-V185 WeakPolarHBondContact O-CA 3.4Å; I179-F186 PolarHBondContact N-O 2.93Å; I179-F186 PolarHBondContact O-N 3.41Å; I179-A188 HydrophobicContact CD1-CB 4.02Å; I179-A188 HydrophobicContact CG1-CB 4.38Å; I179-A191 HydrophobicContact CD1-CB 4.06Å
180M64.3Low61.4Low162 Ų16293.5 Ų93.580%0.79855%0.549SS*.EExtended strand (participates in β ladder)trans-90.7106.2176.9-164.7157.277.600109.8V185M180-V185 HydrophobicContact CB-CG2 4.11Å; M180-V185 HydrophobicContact CG-CG2 3.7Å; M180-V185 HydrophobicContact SD-CG2 3.93Å
181T72.8Confident61.8Low56 Ų5691.8 Ų91.834%0.34453%0.528SS..EExtended strand (participates in β ladder)trans-103.3160.9172.364.60000109.7I179 A183 G184I179-T181 HydrophobicContact CG2-CG2 4.13Å; T181-A183 PolarHBondContact O-N 2.89Å; T181-G184 PolarHBondContact N-O 3.15Å; T181-G184 PolarHBondContact O-N 3.42Å; T181-G184 VanDerWaalsContact O-O 3.14Å; T181-G184 PolarHBondContact OG1-N 3.11Å; T181-G184 PolarHBondContact OG1-O 3.26Å
182P63.8Low62.3Low152 Ų15292.3 Ų92.399%0.98754%0.536SS*.THydrogen-bonded Turntrans-56.1-17.6173.3-25.734.8000114.2
183A66.8Low62.5Low88 Ų8896.8 Ų96.873%0.72755%0.551SS**THydrogen-bonded Turntrans-89.8-8.3175.500000114.1T181T181-A183 PolarHBondContact O-N 2.89Å
184G64.9Low62.6Low28 Ų2894.6 Ų94.629%0.28955%0.545SS..EExtended strand (participates in β ladder)trans137.3178.1-179.600000114.2T181 F186T181-G184 PolarHBondContact N-O 3.15Å; T181-G184 PolarHBondContact O-N 3.42Å; T181-G184 VanDerWaalsContact O-O 3.14Å; T181-G184 PolarHBondContact OG1-N 3.11Å; T181-G184 PolarHBondContact OG1-O 3.26Å; G184-F186 WeakPolarHBondContact O-CD2 3.35Å
185V70.7Confident63Low84 Ų8493 Ų9351%0.50955%0.547SS..EExtended strand (participates in β ladder)trans-95.5119.2178-1780000109.3F178 I179 M180F178-V185 HydrophobicContact CB-CG1 3.57Å; F178-V185 HydrophobicContact CD1-CG1 3.97Å; F178-V185 HydrophobicContact CG-CG1 4.11Å; I179-V185 WeakPolarHBondContact O-CA 3.4Å; M180-V185 HydrophobicContact CB-CG2 4.11Å; M180-V185 HydrophobicContact CG-CG2 3.7Å; M180-V185 HydrophobicContact SD-CG2 3.93Å
186F68.6Low62.7Low92 Ų9289.1 Ų89.140%0.40453%0.532SS..EExtended strand (participates in β ladder)trans-122146.4-178.7-64.1-88.2000111.2F178 I179 G184F178-F186 CarbonylContact C-O 3.54Å; F178-F186 WeakPolarHBondContact CA-O 3.19Å; I179-F186 PolarHBondContact N-O 2.93Å; I179-F186 PolarHBondContact O-N 3.41Å; G184-F186 WeakPolarHBondContact O-CD2 3.35Å
187L75.1Confident62.7Low76 Ų7694.9 Ų94.940%0.39855%0.552SS.*EExtended strand (participates in β ladder)trans-65.5139.2167-73.9169.7000109F178 D189 S190 A191F178-L187 HydrophobicContact CD1-CD2 3.58Å; F178-L187 HydrophobicContact CD1-CG 3.96Å; F178-L187 HydrophobicContact CD2-CD2 4.39Å; F178-L187 HydrophobicContact CE1-CD1 4.43Å; F178-L187 HydrophobicContact CE1-CD2 3.27Å; F178-L187 HydrophobicContact CE1-CG 3.62Å; F178-L187 HydrophobicContact CE2-CD2 4.12Å; F178-L187 HydrophobicContact CG-CD2 4.14Å; F178-L187 HydrophobicContact CZ-CD2 3.57Å; F178-L187 HydrophobicContact CZ-CG 4.32Å; L187-D189 PolarHBondContact O-N 3.45Å; L187-D189 VanDerWaalsContact O-N 3.07Å; L187-S190 PolarHBondContact O-N 3.48Å; L187-S190 PolarHBondContact O-OG 3.19Å; L187-A191 PolarHBondContact O-N 3.37Å
188A62.4Low61.3Low35 Ų3598.7 Ų98.729%0.28958%0.578SS.*Hα-helixtrans-53.7-32.5-175.100000113.8L177 I179 S190 A191 L192L177-A188 PolarHBondContact O-N 3.11Å; L177-A188 VanDerWaalsContact O-N 3.1Å; I179-A188 HydrophobicContact CD1-CB 4.02Å; I179-A188 HydrophobicContact CG1-CB 4.38Å; A188-S190 VanDerWaalsContact C-N 3.35Å; A188-S190 PolarHBondContact O-N 2.92Å; A188-A191 PolarHBondContact O-N 3.22Å; A188-L192 PolarHBondContact O-N 3.33Å
189D58.2Low60.3Low135 Ų135101.3 Ų101.372%0.72259%0.592SS**Hα-helixtrans-65.7-34.9177.8-166.942.5000112.9L187L187-D189 PolarHBondContact O-N 3.45Å; L187-D189 VanDerWaalsContact O-N 3.07Å
190S56.3Low58.5Low58 Ų58108.2 Ų108.241%0.40662%0.616SS.*Hα-helixtrans-79.2-24.6175.6-24.80000112.6L187 A188 M194L187-S190 PolarHBondContact O-N 3.48Å; L187-S190 PolarHBondContact O-OG 3.19Å; A188-S190 VanDerWaalsContact C-N 3.35Å; A188-S190 PolarHBondContact O-N 2.92Å; S190-M194 WeakPolarHBondContact O-CG 3.38Å
191A56Low57.7Low29 Ų29106.1 Ų106.124%0.2461%0.614CS.*Hα-helixtrans-75.8-36.5-179.100000111.9I179 L187 A188 H193 M194 A195I179-A191 HydrophobicContact CD1-CB 4.06Å; L187-A191 PolarHBondContact O-N 3.37Å; A188-A191 PolarHBondContact O-N 3.22Å; A191-H193 VanDerWaalsContact C-N 3.33Å; A191-H193 PolarHBondContact O-N 2.95Å; A191-M194 PolarHBondContact O-N 2.79Å; A191-M194 VanDerWaalsContact O-N 3.17Å; A191-A195 PolarHBondContact O-N 3.1Å
192L56Low56.6Low135 Ų135105 Ų10571%0.70761%0.61SS**Hα-helixtrans-66-37.7176.3-158.382.4000111.7A188 M194 A195 G196A188-L192 PolarHBondContact O-N 3.33Å; L192-M194 PolarHBondContact O-N 3.44Å; L192-A195 PolarHBondContact O-N 2.73Å; L192-A195 VanDerWaalsContact O-N 3.11Å; L192-G196 PolarHBondContact O-N 3.47Å; L192-G196 VanDerWaalsContact O-N 3.15Å
193H55.8Low55.8Low164 Ų164105.1 Ų105.176%0.75960%0.598SS**Hα-helixtrans-61-21.4174-109.593.4000113.9A191A191-H193 VanDerWaalsContact C-N 3.33Å; A191-H193 PolarHBondContact O-N 2.95Å
194M51.3Low55.1Low157 Ų157105 Ų10577%0.77359%0.592SS**Hα-helixtrans-95.2-19.9177.4-65.5-74.9-79.900112.6S190 A191 L192S190-M194 WeakPolarHBondContact O-CG 3.38Å; A191-M194 PolarHBondContact O-N 2.79Å; A191-M194 VanDerWaalsContact O-N 3.17Å; L192-M194 PolarHBondContact O-N 3.44Å
195A54.8Low54.6Low77 Ų77111 Ų11164%0.63661%0.613SS**Hα-helixtrans-97.7-19.6-174.800000114.1A191 L192 L197A191-A195 PolarHBondContact O-N 3.1Å; L192-A195 PolarHBondContact O-N 2.73Å; L192-A195 VanDerWaalsContact O-N 3.11Å; A195-L197 PolarHBondContact O-N 3.5Å
196G49.1Very low53.8Low57 Ų57113.2 Ų113.259%0.58862%0.62SS**SBendtrans-88.796.517600000112.6L192 T198L192-G196 PolarHBondContact O-N 3.47Å; L192-G196 VanDerWaalsContact O-N 3.15Å; G196-T198 PolarHBondContact O-N 3.41Å
197L59.1Low53Low165 Ų165111.1 Ų111.186%0.86462%0.62SS**  trans-60.2119176.9-56.1179.1000111.9A195A195-L197 PolarHBondContact O-N 3.5Å
198T37.2Very low52Low136 Ų136111.3 Ų111.383%0.83463%0.628SS**  trans-158.1118.2138.947.40000110.3G196G196-T198 PolarHBondContact O-N 3.41Å
199E47Very low51.6Low188 Ų188113 Ų11388%0.87964%0.642SS**  trans12.7107.4152.8-166.4146.1-172.400119.4
200Y38.7Very low51.5Low198 Ų198113.7 Ų113.778%0.77664%0.644SS**  trans-152.8124.1156.4-135.3-100.3000111.5A202Y200-A202 HydrophobicContact CD1-CB 3.6Å; Y200-A202 HydrophobicContact CE1-CB 4.04Å; Y200-A202 PolarHBondContact O-N 3.18Å; Y200-A202 VanDerWaalsContact O-N 3.12Å
201P46.2Very low51.5Low119 Ų119114.1 Ų114.177%0.77364%0.642SS**THydrogen-bonded Turntrans-77.511.8-178.230.3-32.5000114.5Q203P201-Q203 PolarHBondContact O-N 3.38Å
202A50.1Low51.5Low31 Ų31118.2 Ų118.226%0.25667%0.669SS.*THydrogen-bonded Turntrans-85.9-3.4-171.600000115.6Y200 S204 E205Y200-A202 HydrophobicContact CD1-CB 3.6Å; Y200-A202 HydrophobicContact CE1-CB 4.04Å; Y200-A202 PolarHBondContact O-N 3.18Å; Y200-A202 VanDerWaalsContact O-N 3.12Å; A202-S204 VanDerWaalsContact C-N 3.26Å; A202-S204 PolarHBondContact O-N 2.87Å; A202-E205 PolarHBondContact O-N 3.3Å
203Q47.3Very low51.6Low156 Ų156115 Ų11573%0.72967%0.668SS**Hα-helixtrans-68.4-25.4-176.9-145.8-16046.200113P201 A207P201-Q203 PolarHBondContact O-N 3.38Å; Q203-A207 VanDerWaalsContact O-CB 3.24Å; Q203-A207 WeakPolarHBondContact O-CB 3.18Å; Q203-A207 PolarHBondContact O-N 3.42Å
204S52.9Low52.1Low86 Ų86117 Ų11760%0.60168%0.675SS**Hα-helixtrans-71.9-33.2178.9176.20000113A202 S208A202-S204 VanDerWaalsContact C-N 3.26Å; A202-S204 PolarHBondContact O-N 2.87Å; S204-S208 WeakPolarHBondContact O-CB 3.39Å; S204-S208 PolarHBondContact O-N 3.47Å; S204-S208 PolarHBondContact O-OG 3.42Å
205E54.2Low53.5Low154 Ų154116.1 Ų116.172%0.7267%0.667SS**Hα-helixtrans-79.7-42.9-175-71.3-168.4120.400112A202 S208 A209A202-E205 PolarHBondContact O-N 3.3Å; E205-S208 WeakPolarHBondContact O-CB 3.3Å; E205-S208 PolarHBondContact O-N 2.95Å; E205-A209 PolarHBondContact O-N 2.99Å
206L53.4Low55Low129 Ų129121.5 Ų121.568%0.67568%0.676SS**Hα-helixtrans-69.5-39.5177.3-72.7163.7000112.2S208 A209L206-S208 PolarHBondContact O-N 2.92Å; L206-A209 PolarHBondContact O-N 3.08Å
207A51.6Low56.9Low48 Ų48124.5 Ų124.540%0.39767%0.669SS.*Hα-helixtrans-67.6-16.2174.300000113.5Q203Q203-A207 VanDerWaalsContact O-CB 3.24Å; Q203-A207 WeakPolarHBondContact O-CB 3.18Å; Q203-A207 PolarHBondContact O-N 3.42Å
208S54Low58.4Low80 Ų80125.3 Ų125.356%0.55967%0.666SS**Hα-helixtrans-87.5-26.3175.5-65.60000112.9S204 E205 L206S204-S208 WeakPolarHBondContact O-CB 3.39Å; S204-S208 PolarHBondContact O-N 3.47Å; S204-S208 PolarHBondContact O-OG 3.42Å; E205-S208 WeakPolarHBondContact O-CB 3.3Å; E205-S208 PolarHBondContact O-N 2.95Å; L206-S208 PolarHBondContact O-N 2.92Å
209A54.1Low61.1Low71 Ų71127.8 Ų127.859%0.58766%0.66SS**Hα-helixtrans-72.8-33.4178.700000113.2E205 L206E205-A209 PolarHBondContact O-N 2.99Å; L206-A209 PolarHBondContact O-N 3.08Å
210I55.9Low63.4Low150 Ų150120.6 Ų120.677%0.76963%0.63SS**SBendtrans-87.9-3.1179.355.5175.3000114.6
211N55.9Low66.1Low66 Ų66112.7 Ų112.735%0.35361%0.609SS.*  trans-109.942.2177.7-152.8-38.2000112.8G213 K215N211-G213 VanDerWaalsContact C-N 3.26Å; N211-G213 PolarHBondContact O-N 3.11Å; N211-K215 HydrophobicContact CB-CB 4.16Å; N211-K215 HydrophobicContact CB-CD 4.32Å; N211-K215 WeakPolarHBondContact ND2-CB 3.26Å; N211-K215 WeakPolarHBondContact ND2-CD 3.29Å; N211-K215 WeakPolarHBondContact OD1-CB 3.33Å; N211-K215 PolarHBondContact OD1-N 3.46Å
212S56.8Low68.5Low115 Ų115113.8 Ų113.880%0.80461%0.605SS**THydrogen-bonded Turntrans-74.8-5-169.149.80000115.1
213G57.8Low70.7Confident68 Ų68112.9 Ų112.970%0.70160%0.597SS**THydrogen-bonded Turntrans-109.2-36.8-175.600000116.8N211N211-G213 VanDerWaalsContact C-N 3.26Å; N211-G213 PolarHBondContact O-N 3.11Å
214K67.5Low73.1Confident206 Ų206108.2 Ų108.290%0.89658%0.58SS**THydrogen-bonded Turntrans-140.7-10.3-158.1-68.1170.5-174.6172.50115.9
215K80.8Confident75.2Confident138 Ų138104.6 Ų104.660%0.655%0.554SS**  trans-85.9127.5178.8-175.9165177.2176.70112.3N211 R217N211-K215 HydrophobicContact CB-CB 4.16Å; N211-K215 HydrophobicContact CB-CD 4.32Å; N211-K215 WeakPolarHBondContact ND2-CB 3.26Å; N211-K215 WeakPolarHBondContact ND2-CD 3.29Å; N211-K215 WeakPolarHBondContact OD1-CB 3.33Å; N211-K215 PolarHBondContact OD1-N 3.46Å; K215-R217 PolarHBondContact O-N 3.41Å; K215-R217 VanDerWaalsContact O-N 3.15Å
216K85Confident77.2Confident190 Ų19098.2 Ų98.283%0.82653%0.527SS*.  trans-60.8114.1174.4-175.8175.2-177.8174.80110.1
217R89.3Confident79.3Confident120 Ų12099.1 Ų99.145%0.45352%0.521SS..PPolyproline II helixtrans-55.2140.2173-72178.5-80.8138.6-4.4111.2K215 L256 K258K215-R217 PolarHBondContact O-N 3.41Å; K215-R217 VanDerWaalsContact O-N 3.15Å; R217-L256 HydrophobicContact CB-CD2 3.38Å; R217-K258 PolarHBondContact NH1-O 3.24Å
218K91Very high81.4Confident182 Ų182102.2 Ų102.279%0.79152%0.523SS*.PPolyproline II helixtrans-80.4162.7176.4-63.4-68.3-177.3170.60110.5
219R94.4Very high83.4Confident188 Ų188108.2 Ų108.271%0.70953%0.533SS*.PPolyproline II helixtrans-88.7148.3175.758.2176.4178.2-104.1-3.5109.2G221 C253 L256R219-G221 VanDerWaalsContact C-N 3.33Å; R219-G221 PolarHBondContact O-N 3.46Å; R219-C253 HydrophobicContact CB-CB 4.25Å; R219-L256 HydrophobicContact CB-CD1 4.27Å
220C94.9Very high85.4Confident38 Ų38111.6 Ų111.626%0.25754%0.54SS..  trans-72.1-24.2-179.872.90000114.4M222 C223 C253 E255C220-M222 PolarHBondContact O-N 3.05Å; C220-C223 PolarHBondContact SG-N 3.23Å; C220-C223 VanDerWaalsContact SG-N 3.44Å; C220-C223 PolarHBondContact SG-SG 2.83Å; C220-C253 PolarHBondContact N-SG 3.2Å; C220-E255 HydrophobicContact CB-CG 4.4Å; C220-E255 WeakPolarHBondContact CB-OE1 3.29Å; C220-E255 VanDerWaalsContact CB-OE2 3.31Å; C220-E255 WeakPolarHBondContact CB-OE2 3.46Å
221G95.3Very high87.3Confident32 Ų32106.5 Ų106.533%0.3351%0.514SS..SBendtrans79.6-25.6179.900000114.7R219R219-G221 VanDerWaalsContact C-N 3.33Å; R219-G221 PolarHBondContact O-N 3.46Å
222M96.4Very high89.3Confident142 Ų142105.1 Ų105.170%0.751%0.509SS*.  trans-100.4-16.7-171.4-59.8-56.4-80.100115.1C220 R227C220-M222 PolarHBondContact O-N 3.05Å; M222-R227 PolarHBondContact O-NH1 3.47Å
223C96.6Very high91.1Very high12 Ų12107 Ų1078%0.08151%0.505CS..SBendtrans-72.9154.5177.865.90000112C220 P225 C226 R227 E254C220-C223 PolarHBondContact SG-N 3.23Å; C220-C223 VanDerWaalsContact SG-N 3.44Å; C220-C223 PolarHBondContact SG-SG 2.83Å; C223-P225 VanDerWaalsContact C-CD 3.43Å; C223-P225 VanDerWaalsContact C-N 3.32Å; C223-P225 HydrophobicContact CB-CG 4.34Å; C223-P225 VanDerWaalsContact SG-CG 3.55Å; C223-C226 WeakPolarHBondContact O-CA 3.41Å; C223-C226 WeakPolarHBondContact O-CB 3.42Å; C223-C226 PolarHBondContact O-N 3Å; C223-C226 PolarHBondContact SG-SG 3.18Å; C223-R227 PolarHBondContact O-N 3.16Å; C223-R227 VanDerWaalsContact O-N 3.13Å; C223-E254 HydrophobicContact CB-CB 4.38Å; C223-E254 HydrophobicContact CB-CG 4.33Å
224P96.6Very high93Very high58 Ų58112.5 Ų112.538%0.37751%0.513SS..Hα-helixtrans-47.1-43.5177.1-25.332.5000115.1C226 R227P224-C226 VanDerWaalsContact C-N 3.35Å; P224-C226 PolarHBondContact O-N 3.4Å; P224-R227 PolarHBondContact O-N 3.33Å
225P97.4Very high94.5Very high9 Ų9103.3 Ų103.36%0.05847%0.474CS..Hα-helixtrans-69-28.6176.323.7-30.2000113.8C223 F250 R251 K252 E254C223-P225 VanDerWaalsContact C-CD 3.43Å; C223-P225 VanDerWaalsContact C-N 3.32Å; C223-P225 HydrophobicContact CB-CG 4.34Å; C223-P225 VanDerWaalsContact SG-CG 3.55Å; P225-F250 WeakPolarHBondContact CA-O 3.38Å; P225-F250 WeakPolarHBondContact CB-O 3.49Å; P225-R251 WeakPolarHBondContact O-CA 3.15Å; P225-K252 WeakPolarHBondContact CB-O 3.02Å; P225-K252 VanDerWaalsContact CG-O 3.26Å; P225-K252 WeakPolarHBondContact CG-O 3.46Å; P225-E254 VanDerWaalsContact CD-OE1 3.3Å; P225-E254 WeakPolarHBondContact CD-OE1 3.28Å; P225-E254 HydrophobicContact CG-CG 3.94Å
226C97.3Very high95.2Very high21 Ų21100.7 Ų100.714%0.14247%0.474CS..Hα-helixtrans-72.6-33.8176.2-79.90000113.4C223 P224 R228 C253C223-C226 WeakPolarHBondContact O-CA 3.41Å; C223-C226 WeakPolarHBondContact O-CB 3.42Å; C223-C226 PolarHBondContact O-N 3Å; C223-C226 PolarHBondContact SG-SG 3.18Å; P224-C226 VanDerWaalsContact C-N 3.35Å; P224-C226 PolarHBondContact O-N 3.4Å; C226-R228 PolarHBondContact O-N 2.89Å; C226-C253 VanDerWaalsContact SG-CB 3.58Å
227R96.8Very high95.8Very high147 Ų14793.1 Ų93.156%0.55544%0.444SS*.Hα-helixtrans-70.6-20.2177.9-67.8-171.5-73.2-119.6-2.3113.2M222 C223 P224 R229M222-R227 PolarHBondContact O-NH1 3.47Å; C223-R227 PolarHBondContact O-N 3.16Å; C223-R227 VanDerWaalsContact O-N 3.13Å; P224-R227 PolarHBondContact O-N 3.33Å; R227-R229 PolarHBondContact O-N 3.42Å
228R96.4Very high96.1Very high113 Ų11387.8 Ų87.843%0.42643%0.425SS..  trans-69.1118.8176.7-69.1-177.5-175104.56.5111.8C226 F250 R251C226-R228 PolarHBondContact O-N 2.89Å; R228-F250 WeakPolarHBondContact CD-O 3.45Å; R228-F250 PolarHBondContact NH1-O 2.95Å; R228-R251 HydrophobicContact CB-CG 4.08Å; R228-R251 PolarHBondContact O-NE 3.45Å; R228-R251 PolarHBondContact O-NH2 3.24Å; R228-R251 VanDerWaalsContact O-NH2 3.14Å
229R95.6Very high96.4Very high207 Ų20789.5 Ų89.578%0.78143%0.427SS*.  trans-85-39.8175.8-59.1-61.6179.6171.4-1.1112.3R227 R251R227-R229 PolarHBondContact O-N 3.42Å; R229-R251 VanDerWaalsContact O-CZ 3.22Å; R229-R251 PolarHBondContact O-NH1 3.43Å; R229-R251 PolarHBondContact O-NH2 3.1Å
230I96Very high96.5Very high142 Ų14285 Ų8573%0.72842%0.417SS*.SBendtrans-87.5152.7-179.763.4171.7000112.3R251I230-R251 VanDerWaalsContact O-CD 3.29Å; I230-R251 WeakPolarHBondContact O-CD 3.45Å
231N96.1Very high96.5Very high43 Ų4388.2 Ų88.223%0.2342%0.424CS..  trans-88.7149.7175.3-62.1-69.9000110.2E233 R241 R251N231-E233 PolarHBondContact O-N 2.99Å; N231-R241 PolarHBondContact ND2-NH1 3.35Å; N231-R241 VanDerWaalsContact ND2-NH1 3.1Å; N231-R241 PolarHBondContact OD1-NH1 3.31Å; N231-R241 PolarHBondContact OD1-NH2 3.11Å; N231-R251 VanDerWaalsContact OD1-CD 3.29Å; N231-R251 WeakPolarHBondContact OD1-CD 3.47Å; N231-R251 PolarHBondContact OD1-NH1 3.28Å
232C96.4Very high96.5Very high37 Ų3796.7 Ų96.725%0.2545%0.451CS..  trans-74.7-13.7-178.778.50000114.4Q234 C235 C238 C248 F250C232-Q234 WeakPolarHBondContact O-CG 3.37Å; C232-Q234 PolarHBondContact O-N 2.96Å; C232-C235 PolarHBondContact SG-N 3.15Å; C232-C235 VanDerWaalsContact SG-N 3.41Å; C232-C235 VanDerWaalsContact SG-SG 3.63Å; C232-C238 VanDerWaalsContact SG-SG 3.66Å; C232-C248 PolarHBondContact SG-SG 3.36Å; C232-F250 HydrophobicContact CB-CD2 3.58Å; C232-F250 HydrophobicContact CB-CE2 4.13Å; C232-F250 HydrophobicContact CB-CG 4.39Å; C232-F250 WeakPolarHBondContact SG-CD2 3.27Å
233E96.3Very high96.4Very high153 Ų15395.8 Ų95.872%0.71545%0.454SS*.SBendtrans58.3-17.5-176.9-64.2178-175.800117.8N231 C238N231-E233 PolarHBondContact O-N 2.99Å; E233-C238 VanDerWaalsContact C-CB 3.49Å; E233-C238 PolarHBondContact N-SG 3.12Å; E233-C238 WeakPolarHBondContact O-CB 3.43Å
234Q97.6Very high96.3Very high184 Ų18496.6 Ų96.686%0.8646%0.464SS*.SBendtrans-97-18.1-173.5-61.7170.43000114.6C232C232-Q234 WeakPolarHBondContact O-CG 3.37Å; C232-Q234 PolarHBondContact O-N 2.96Å
235C97.6Very high96.1Very high13 Ų13102.8 Ų102.89%0.08849%0.488CS..SBendtrans-77.9159.5-178.976.70000112C232 S237 C238 R239 K249 F250C232-C235 PolarHBondContact SG-N 3.15Å; C232-C235 VanDerWaalsContact SG-N 3.41Å; C232-C235 VanDerWaalsContact SG-SG 3.63Å; C235-S237 VanDerWaalsContact C-N 3.32Å; C235-S237 PolarHBondContact O-N 3.49Å; C235-C238 CarbonylContact O-C 3.58Å; C235-C238 WeakPolarHBondContact O-CA 3.14Å; C235-C238 VanDerWaalsContact O-CB 3.28Å; C235-C238 WeakPolarHBondContact O-CB 3.28Å; C235-C238 PolarHBondContact O-N 3.14Å; C235-C238 PolarHBondContact SG-N 3.24Å; C235-C238 PolarHBondContact SG-SG 3.38Å; C235-R239 PolarHBondContact O-N 2.97Å; C235-K249 HydrophobicContact CB-CB 3.93Å; C235-K249 PolarHBondContact SG-N 2.89Å; C235-K249 VanDerWaalsContact SG-N 3.42Å; C235-F250 HydrophobicContact CB-CD2 4.49Å; C235-F250 HydrophobicContact CB-CE2 4.23Å
236S96.2Very high96Very high84 Ų84108.4 Ų108.459%0.58751%0.513SS*.Hα-helixtrans-52.6-45178.756.70000113.4C238 R239 N240S236-C238 PolarHBondContact O-N 2.78Å; S236-R239 PolarHBondContact O-N 3.15Å; S236-R239 VanDerWaalsContact O-N 3.14Å; S236-N240 PolarHBondContact O-N 3.22Å; S236-N240 PolarHBondContact O-OD1 3.5Å
237S97Very high95.9Very high30 Ų30111.2 Ų111.221%0.2153%0.526CS..Hα-helixtrans-62.3-27.9175.5-46.80000113.4C235C235-S237 VanDerWaalsContact C-N 3.32Å; C235-S237 PolarHBondContact O-N 3.49Å
238C97.4Very high95.9Very high8 Ų8104.2 Ų104.25%0.05450%0.5CS..Hα-helixtrans-77.7-42.6173.5-73.60000111.6C232 E233 C235 S236 N240 R241 C248C232-C238 VanDerWaalsContact SG-SG 3.66Å; E233-C238 VanDerWaalsContact C-CB 3.49Å; E233-C238 PolarHBondContact N-SG 3.12Å; E233-C238 WeakPolarHBondContact O-CB 3.43Å; C235-C238 CarbonylContact O-C 3.58Å; C235-C238 WeakPolarHBondContact O-CA 3.14Å; C235-C238 VanDerWaalsContact O-CB 3.28Å; C235-C238 WeakPolarHBondContact O-CB 3.28Å; C235-C238 PolarHBondContact O-N 3.14Å; C235-C238 PolarHBondContact SG-N 3.24Å; C235-C238 PolarHBondContact SG-SG 3.38Å; S236-C238 PolarHBondContact O-N 2.78Å; C238-N240 VanDerWaalsContact C-N 3.27Å; C238-N240 PolarHBondContact O-N 3.49Å; C238-R241 WeakPolarHBondContact O-CB 3.35Å; C238-R241 VanDerWaalsContact O-CD 3.27Å; C238-R241 WeakPolarHBondContact O-CD 3.38Å; C238-R241 WeakPolarHBondContact O-CG 3.49Å; C238-R241 PolarHBondContact O-N 3.12Å; C238-R241 PolarHBondContact SG-NH2 3.28Å; C238-C248 PolarHBondContact SG-SG 3.16Å
239R97.1Very high95.9Very high219 Ų219106 Ų10683%0.82651%0.511SS*.Hα-helixtrans-62.4-35.4179.4-168.2175179.9171.4-0.3112C235 S236C235-R239 PolarHBondContact O-N 2.97Å; S236-R239 PolarHBondContact O-N 3.15Å; S236-R239 VanDerWaalsContact O-N 3.14Å
240N96.7Very high96Very high94 Ų94101.4 Ų101.450%0.50350%0.497SS..THydrogen-bonded Turntrans-100.128178.2-61.393.7000113.3S236 C238 K242 T243 G244S236-N240 PolarHBondContact O-N 3.22Å; S236-N240 PolarHBondContact O-OD1 3.5Å; C238-N240 VanDerWaalsContact C-N 3.27Å; C238-N240 PolarHBondContact O-N 3.49Å; N240-K242 PolarHBondContact O-N 3.48Å; N240-K242 VanDerWaalsContact O-N 3.15Å; N240-T243 PolarHBondContact O-N 3.43Å; N240-T243 VanDerWaalsContact O-N 3.12Å; N240-G244 PolarHBondContact O-N 3.33Å
241R94.2Very high96Very high105 Ų10597.6 Ų97.640%0.39647%0.473SS..THydrogen-bonded Turntrans-52.9-35.7-177-92.8167.2-171.8-75.9-27.3115.3N231 C238 T243N231-R241 PolarHBondContact ND2-NH1 3.35Å; N231-R241 VanDerWaalsContact ND2-NH1 3.1Å; N231-R241 PolarHBondContact OD1-NH1 3.31Å; N231-R241 PolarHBondContact OD1-NH2 3.11Å; C238-R241 WeakPolarHBondContact O-CB 3.35Å; C238-R241 VanDerWaalsContact O-CD 3.27Å; C238-R241 WeakPolarHBondContact O-CD 3.38Å; C238-R241 WeakPolarHBondContact O-CG 3.49Å; C238-R241 PolarHBondContact O-N 3.12Å; C238-R241 PolarHBondContact SG-NH2 3.28Å; R241-T243 VanDerWaalsContact C-N 3.31Å; R241-T243 PolarHBondContact O-N 3.21Å
242K94.1Very high96Very high209 Ų20999.6 Ų99.691%0.90948%0.48SS*.THydrogen-bonded Turntrans-68.8-31.4-177.3-168.4174.8-179.3-177.60112.5N240N240-K242 PolarHBondContact O-N 3.48Å; N240-K242 VanDerWaalsContact O-N 3.15Å
243T95.5Very high96.1Very high123 Ų12398 Ų9876%0.75547%0.469SS*.THydrogen-bonded Turntrans-109.8-26.5-174.1-46.20000112.3N240 R241N240-T243 PolarHBondContact O-N 3.43Å; N240-T243 VanDerWaalsContact O-N 3.12Å; R241-T243 VanDerWaalsContact C-N 3.31Å; R241-T243 PolarHBondContact O-N 3.21Å
244G93.6Very high96Very high29 Ų2995.5 Ų95.530%0.29946%0.457SS..  trans-97.2122.2-17600000112.8N240 Q246N240-G244 PolarHBondContact O-N 3.33Å; G244-Q246 PolarHBondContact O-N 3.35Å
245H94Very high95.7Very high189 Ų18992 Ų9288%0.87544%0.44SS*.  trans-78.825.6171.6-62.2153.7000113.9
246Q95.1Very high95.4Very high126 Ų12693.4 Ų93.459%0.58945%0.447SS*.  trans-96.3134.4-177.3-62.8-66.976.400110.6G244G244-Q246 PolarHBondContact O-N 3.35Å
247I94.5Very high95Very high81 Ų8197.6 Ų97.642%0.41546%0.455SS..  trans-64.6148.9170.5-170166.6000110.4K249 R251 K252I247-K249 PolarHBondContact O-N 3.02Å; I247-R251 HydrophobicContact CD1-CB 4.03Å; I247-R251 WeakPolarHBondContact CD1-O 3.37Å; I247-R251 HydrophobicContact CG1-CB 3.98Å; I247-K252 HydrophobicContact CG2-CB 4.04Å; I247-K252 HydrophobicContact CG2-CD 3.39Å; I247-K252 HydrophobicContact CG2-CG 4.32Å
248C97.4Very high94.5Very high0 Ų0103.4 Ų103.40%048%0.476CS..  trans-45.8135.7172.3175.50000111.2C232 C238 F250 R251 K252C232-C248 PolarHBondContact SG-SG 3.36Å; C238-C248 PolarHBondContact SG-SG 3.16Å; C248-F250 PolarHBondContact O-N 3.08Å; C248-R251 HydrophobicContact CB-CB 4.06Å; C248-R251 HydrophobicContact CB-CG 3.94Å; C248-R251 CarbonylContact O-C 3.54Å; C248-R251 WeakPolarHBondContact O-CA 3.4Å; C248-R251 PolarHBondContact O-N 3.05Å; C248-K252 PolarHBondContact O-N 3.46Å; C248-K252 VanDerWaalsContact O-N 3.11Å
249K96.3Very high93.3Very high151 Ų151112.1 Ų112.166%0.65751%0.513SS*.G310 helixtrans-53.9-39.5-178.7-170.6177-179.9-176.80112.2C235 I247 R251C235-K249 HydrophobicContact CB-CB 3.93Å; C235-K249 PolarHBondContact SG-N 2.89Å; C235-K249 VanDerWaalsContact SG-N 3.42Å; I247-K249 PolarHBondContact O-N 3.02Å; K249-R251 VanDerWaalsContact C-N 3.29Å; K249-R251 PolarHBondContact O-N 2.78Å
250F96.9Very high92Very high110 Ų110106.1 Ų106.148%0.48250%0.502SS..G310 helixtrans-82.5-1179.5-60.3-81.9000114.6P225 R228 C232 C235 C248P225-F250 WeakPolarHBondContact CA-O 3.38Å; P225-F250 WeakPolarHBondContact CB-O 3.49Å; R228-F250 WeakPolarHBondContact CD-O 3.45Å; R228-F250 PolarHBondContact NH1-O 2.95Å; C232-F250 HydrophobicContact CB-CD2 3.58Å; C232-F250 HydrophobicContact CB-CE2 4.13Å; C232-F250 HydrophobicContact CB-CG 4.39Å; C232-F250 WeakPolarHBondContact SG-CD2 3.27Å; C235-F250 HydrophobicContact CB-CD2 4.49Å; C235-F250 HydrophobicContact CB-CE2 4.23Å; C248-F250 PolarHBondContact O-N 3.08Å
251R97.1Very high90Very high62 Ų62106.9 Ų106.923%0.23452%0.515CS..G310 helixtrans-115.6-0.1175.4-58.8-178.872.8-163.90.8113.2P225 R228 R229 I230 N231 I247 C248 K249 C253P225-R251 WeakPolarHBondContact O-CA 3.15Å; R228-R251 HydrophobicContact CB-CG 4.08Å; R228-R251 PolarHBondContact O-NE 3.45Å; R228-R251 PolarHBondContact O-NH2 3.24Å; R228-R251 VanDerWaalsContact O-NH2 3.14Å; R229-R251 VanDerWaalsContact O-CZ 3.22Å; R229-R251 PolarHBondContact O-NH1 3.43Å; R229-R251 PolarHBondContact O-NH2 3.1Å; I230-R251 VanDerWaalsContact O-CD 3.29Å; I230-R251 WeakPolarHBondContact O-CD 3.45Å; N231-R251 VanDerWaalsContact OD1-CD 3.29Å; N231-R251 WeakPolarHBondContact OD1-CD 3.47Å; N231-R251 PolarHBondContact OD1-NH1 3.28Å; I247-R251 HydrophobicContact CD1-CB 4.03Å; I247-R251 WeakPolarHBondContact CD1-O 3.37Å; I247-R251 HydrophobicContact CG1-CB 3.98Å; C248-R251 HydrophobicContact CB-CB 4.06Å; C248-R251 HydrophobicContact CB-CG 3.94Å; C248-R251 CarbonylContact O-C 3.54Å; C248-R251 WeakPolarHBondContact O-CA 3.4Å; C248-R251 PolarHBondContact O-N 3.05Å; K249-R251 VanDerWaalsContact C-N 3.29Å; K249-R251 PolarHBondContact O-N 2.78Å; R251-C253 PolarHBondContact O-N 3.32Å
252K96.1Very high88.1Confident85 Ų85105.7 Ų105.737%0.3753%0.528SS..SBendtrans-68119.3175.8-173.576.2176.5-151.10108.7P225 I247 C248 E254P225-K252 WeakPolarHBondContact CB-O 3.02Å; P225-K252 VanDerWaalsContact CG-O 3.26Å; P225-K252 WeakPolarHBondContact CG-O 3.46Å; I247-K252 HydrophobicContact CG2-CB 4.04Å; I247-K252 HydrophobicContact CG2-CD 3.39Å; I247-K252 HydrophobicContact CG2-CG 4.32Å; C248-K252 PolarHBondContact O-N 3.46Å; C248-K252 VanDerWaalsContact O-N 3.11Å; K252-E254 PolarHBondContact O-N 3.17Å
253C96.8Very high86Confident3 Ų3100.4 Ų100.42%0.0252%0.523CS..  trans-55.4137177-174.50000110.8R219 C220 C226 R251 E255 L256 K257R219-C253 HydrophobicContact CB-CB 4.25Å; C220-C253 PolarHBondContact N-SG 3.2Å; C226-C253 VanDerWaalsContact SG-CB 3.58Å; R251-C253 PolarHBondContact O-N 3.32Å; C253-E255 PolarHBondContact O-N 3.12Å; C253-L256 HydrophobicContact CB-CB 3.92Å; C253-L256 HydrophobicContact CB-CD1 3.69Å; C253-L256 HydrophobicContact CB-CG 3.88Å; C253-L256 PolarHBondContact O-N 3.26Å; C253-K257 PolarHBondContact O-N 3.33Å
254E95.3Very high83.9Confident100 Ų100101.3 Ų101.347%0.46752%0.523SS..Hα-helixtrans-63.9-41.9-179.4-72.5166.1-165.700111.6C223 P225 K252 L256 K257 K258C223-E254 HydrophobicContact CB-CB 4.38Å; C223-E254 HydrophobicContact CB-CG 4.33Å; P225-E254 VanDerWaalsContact CD-OE1 3.3Å; P225-E254 WeakPolarHBondContact CD-OE1 3.28Å; P225-E254 HydrophobicContact CG-CG 3.94Å; K252-E254 PolarHBondContact O-N 3.17Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.02Å; E254-K257 WeakPolarHBondContact O-CB 3.35Å; E254-K257 PolarHBondContact O-N 2.96Å; E254-K257 VanDerWaalsContact O-N 3.11Å; E254-K258 PolarHBondContact O-N 2.81Å
255E92Very high81.6Confident110 Ų110109.2 Ų109.251%0.51455%0.552SS.*Hα-helixtrans-63.9-34.6173.7-69.2171.6-149.200113.6C220 C253 K257 K258C220-E255 HydrophobicContact CB-CG 4.4Å; C220-E255 WeakPolarHBondContact CB-OE1 3.29Å; C220-E255 VanDerWaalsContact CB-OE2 3.31Å; C220-E255 WeakPolarHBondContact CB-OE2 3.46Å; C253-E255 PolarHBondContact O-N 3.12Å; E255-K257 VanDerWaalsContact C-N 3.28Å; E255-K257 PolarHBondContact O-N 2.87Å; E255-K258 PolarHBondContact O-N 2.81Å
256L90.4Very high79.5Confident44 Ų44105.8 Ų105.823%0.2354%0.544CS..Hα-helixtrans-74.1-21175.1-71.2170.9000112.7R217 R219 C253 E254R217-L256 HydrophobicContact CB-CD2 3.38Å; R219-L256 HydrophobicContact CB-CD1 4.27Å; C253-L256 HydrophobicContact CB-CB 3.92Å; C253-L256 HydrophobicContact CB-CD1 3.69Å; C253-L256 HydrophobicContact CB-CG 3.88Å; C253-L256 PolarHBondContact O-N 3.26Å; E254-L256 VanDerWaalsContact C-N 3.33Å; E254-L256 PolarHBondContact O-N 3.02Å
257K87.6Confident77.3Confident172 Ų172108.2 Ų108.275%0.74856%0.557SS**Hα-helixtrans-75.5-31.3176.7-172.9-176.2175.2-169.90111.1C253 E254 E255 K259C253-K257 PolarHBondContact O-N 3.33Å; E254-K257 WeakPolarHBondContact O-CB 3.35Å; E254-K257 PolarHBondContact O-N 2.96Å; E254-K257 VanDerWaalsContact O-N 3.11Å; E255-K257 VanDerWaalsContact C-N 3.28Å; E255-K257 PolarHBondContact O-N 2.87Å; K257-K259 PolarHBondContact O-N 2.96Å
258K85.9Confident75.2Confident151 Ų151112.1 Ų112.166%0.65758%0.578SS**SBendtrans-58.7130.4170.6-60.7178.7-176.2178.90107.8R217 E254 E255R217-K258 PolarHBondContact NH1-O 3.24Å; E254-K258 PolarHBondContact O-N 2.81Å; E255-K258 PolarHBondContact O-N 2.81Å
259K72.4Confident73Confident192 Ų192117.4 Ų117.484%0.83561%0.613SS**  trans-53.2138.2168.8-66.2179.7-178.9179.50106K257 S261K257-K259 PolarHBondContact O-N 2.96Å; K259-S261 PolarHBondContact O-N 3.37Å
260P69.5Low70.9Confident92 Ų92117.6 Ų117.660%0.59763%0.627SS**  trans-60.197.317025.3-27.3000105.4A262P260-A262 PolarHBondContact O-N 3.15Å
261S54.7Low68.8Low111 Ų111116 Ų11678%0.77664%0.641SS**  trans-60.6114.6170.3-164.20000103.3K259 A263K259-S261 PolarHBondContact O-N 3.37Å; S261-A263 PolarHBondContact O-N 3.49Å
262A54.3Low66.4Low80 Ų80116.8 Ų116.866%0.66166%0.661SS**  trans-51.4110.8169.100000105.8P260 L264P260-A262 PolarHBondContact O-N 3.15Å; A262-L264 PolarHBondContact O-N 2.65Å
263A51.3Low64.3Low98 Ų98117.2 Ų117.281%0.8168%0.68SS**SBendtrans-69.984.6171.400000106.1S261S261-A263 PolarHBondContact O-N 3.49Å
264L50Low61.9Low141 Ų141126.3 Ų126.374%0.73872%0.72SS**  trans160.171.9162.8-91.5167.7000107.7A262 V266A262-L264 PolarHBondContact O-N 2.65Å; L264-V266 HydrophobicContact CD2-CB 4.11Å; L264-V266 HydrophobicContact CD2-CG2 4.29Å
265E45.1Very low60.5Low195 Ų195130.7 Ų130.791%0.91173%0.732SS**  trans-9267.6142.4-75.3-14516800107.4
266V51.7Low58.4Low117 Ų117136.2 Ų136.271%0.70975%0.748SS**SBendtrans-111.1102150.5-178.50000104.6L264L264-V266 HydrophobicContact CD2-CB 4.11Å; L264-V266 HydrophobicContact CD2-CG2 4.29Å
267M49Very low55.9Low177 Ų177143.3 Ų143.387%0.87278%0.777SS**  trans69.481.2164.5-14817188.900117.2
268L49.6Very low53.9Low163 Ų163147.2 Ų147.285%0.85380%0.798SS**  trans-118.6124.8149-141.677.5000108.7T270L268-T270 PolarHBondContact O-N 3.17Å
269P50.1Low52.3Low112 Ų112147 Ų14773%0.72781%0.805SS**  trans-64.6136.3-176.6-1326.3000110.3G271P269-G271 PolarHBondContact O-N 3.11Å
270T52.6Low51.2Low155 Ų155144.6 Ų144.695%0.95180%0.804SS**SBendtrans-36.8110.6164.3-55.60000111.3L268L268-T270 PolarHBondContact O-N 3.17Å
271G54.2Low50.2Low75 Ų75147.6 Ų147.677%0.77382%0.815SS**  trans134.761.6167.400000116.3P269P269-G271 PolarHBondContact O-N 3.11Å
272A46.8Very low50Low80 Ų80149.7 Ų149.766%0.66182%0.818SS**  trans-134.995.2154.800000108.8F274A272-F274 PolarHBondContact O-N 3.45Å
273A51.1Low49.7Very low93 Ų93154.1 Ų154.177%0.76983%0.827SS**  trans-64.6115.2167.300000108.1R275A273-R275 PolarHBondContact O-N 3.39Å
274F46.9Very low49.6Very low194 Ų194157.8 Ų157.885%0.85183%0.829SS**  trans-59.997173.3-71.5-90.1000109.7A272 W276A272-F274 PolarHBondContact O-N 3.45Å; F274-W276 PolarHBondContact O-N 2.84Å
275R64.8Low49.6Very low193 Ų193159 Ų15973%0.72884%0.835SS**  trans-82.189.3170.4-56.8-147.981.9-104.8-2.4108.5A273A273-R275 PolarHBondContact O-N 3.39Å
276W47.7Very low49.9Very low226 Ų226156.2 Ų156.286%0.85683%0.829SS**  trans-88.4140.7152.8-79.229.6000107F274F274-W276 PolarHBondContact O-N 2.84Å
277F38Very low49.7Very low192 Ų192159.5 Ų159.584%0.84284%0.839SS**  trans94.895.2-168.3-61.6-76.7000115.2
278Q46.2Very low49.8Very low254 Ų254157.9 Ų157.9100%1.18784%0.836SS**  trans-124.20146-170.398.987.600106.4

Retrieved 278 of 278 residues in 31.2 ms (Link to these results)