A0A060D1N0_MAIZE Loading...

AP2-EREBP transcription factor

AlphaFold DB , UniProt , Accession A0A060D1N0, Species MAIZE (Zea mays, Maize), Gene EREB142, Length 418 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
1M57.1Low50.5Low254 Ų254151.4 Ų151.4100%1.25183%0.827SS**  01350-73.9-172.4-178.500108.5
2A48.2Very low50.1Low93 Ų93145 Ų14577%0.76981%0.81SS**  trans-105.7135-165.500000112.4
3L61Low50.2Low181 Ų181145.5 Ų145.595%0.94881%0.81SS**  trans-154.199.5158.4-77167000104.9
4K53.8Low50Low151 Ų151146.2 Ų146.266%0.65781%0.811SS**  cis90.798.240.5-156.8163-174.1171.70114
5R51.5Low50.3Low202 Ų202147.1 Ų147.176%0.76281%0.814SS**  trans75.9144.8141.9-69.6174.9-176.5179.3-4.7116.8
6K53.6Low50Low190 Ų190147.8 Ų147.883%0.82681%0.809SS**  cis-165.912928.3-119.5168.5174.9-168.50107
7A47.8Very low49.5Very low90 Ų90146.9 Ų146.974%0.74481%0.814SS**  56.6134.593.600000115.5
8C49.9Very low49.1Very low117 Ų117146.5 Ų146.579%0.79181%0.81SS**  cis-171.7-163.3-0.6-84.20000106.7
9P48.5Very low48.4Very low112 Ų112143.6 Ų143.673%0.72781%0.807SS**  -135173.5-76.542.3-24.4000115.6
10S40.4Very low48.1Very low105 Ų105143.5 Ų143.573%0.73481%0.809SS**  trans10.8137.6152.764.10000123.5
11L43.2Very low48Very low170 Ų170140.6 Ų140.689%0.8980%0.804SS**  trans-155.3120.7134.4-114.9153000110.3
12A45.8Very low47.6Very low75 Ų75136.2 Ų136.262%0.6279%0.785SS**  trans-80.8160.1170.600000110.1
13D51.8Low47.6Very low151 Ų151138.2 Ų138.281%0.80779%0.792SS**  trans-171.4113.3139.5-87.2-30.8000110.2
14D46.8Very low46.6Very low156 Ų156140.1 Ų140.183%0.83479%0.793SS**  trans-73.5139.7167.6-65-66.2000110.4
15N55.5Low46.6Very low160 Ų160136.9 Ų136.986%0.85680%0.795SS**  trans-142.3101.9160.4-87.3-67000111
16H45.9Very low46.4Very low158 Ų158132.9 Ų132.973%0.73180%0.795SS**  trans-79.9127.3168.3-171.2-86.6000108.7
17C41.3Very low45.9Very low132 Ų132128.1 Ų128.189%0.89279%0.791SS**  trans-133.9119.9166.8-165.10000110
18L41.6Very low45.8Very low140 Ų140128.2 Ų128.273%0.73379%0.792SS**  trans-75.7155.2-172.4-78.5158.7000112.9
19A35.3Very low45.8Very low91 Ų91126.4 Ų126.475%0.75279%0.785SS**  trans-58.7147174.800000114.7
20T42.8Very low45.8Very low141 Ų141126 Ų12687%0.86578%0.78SS**  trans-159126.9137.6-24.70000112.9
21A45.9Very low45.7Very low84 Ų84122.6 Ų122.669%0.69476%0.762SS**  trans56.4115.8145.500000124
22N48.6Very low46.1Very low161 Ų161117.7 Ų117.786%0.86175%0.746SS**  trans47.9108.2131.4-77.223.5000121.9
23C48.5Very low46.4Very low135 Ų135118.9 Ų118.991%0.91275%0.745SS**  -150.5119.4128.65.40000110.5
24F40.7Very low46.3Very low222 Ų222112.9 Ų112.997%0.97472%0.717SS**  trans-88.3113-178-162.6-95.3000109
25A53.3Low46.4Very low83 Ų83108.2 Ų108.269%0.68670%0.7SS**  trans-158.8149.9169.700000109.7A27A25-A27 PolarHBondContact O-N 2.99Å
26P46.4Very low46.4Very low117 Ų117104.6 Ų104.676%0.7668%0.684SS**  trans-71.5123.1-144.627.5-34.3000114.2A28P26-A28 VanDerWaalsContact C-N 3.28Å; P26-A28 PolarHBondContact O-N 2.83Å; P26-A28 VanDerWaalsContact O-N 3.1Å
27A44Very low46.5Very low90 Ų90102.9 Ų102.974%0.74468%0.676SS**THydrogen-bonded Turntrans-75.210.7-167.700000116.8A25A25-A27 PolarHBondContact O-N 2.99Å
28A46.7Very low46.9Very low92 Ų92106.3 Ų106.376%0.7667%0.67SS**THydrogen-bonded Turntrans-86.6-38-171.800000114.3P26P26-A28 VanDerWaalsContact C-N 3.28Å; P26-A28 PolarHBondContact O-N 2.83Å; P26-A28 VanDerWaalsContact O-N 3.1Å
29A49.5Very low47.3Very low80 Ų80102.2 Ų102.266%0.66166%0.656SS**THydrogen-bonded Turntrans-85.3-28.8-176.400000113.5
30V48.1Very low48.2Very low102 Ų102107.3 Ų107.362%0.61866%0.656SS**Hα-helixtrans-79.3-22.1-178.9-162.20000111.7A32 V33 A34V30-A32 VanDerWaalsContact C-N 3.29Å; V30-A32 PolarHBondContact O-N 3.22Å; V30-V33 PolarHBondContact O-N 3.49Å; V30-A34 VanDerWaalsContact O-CB 3.25Å; V30-A34 WeakPolarHBondContact O-CB 3.13Å; V30-A34 PolarHBondContact O-N 3.33Å
31G39.2Very low49.4Very low34 Ų34109.8 Ų109.835%0.35166%0.655SS.*Hα-helixtrans-61.7-32.2176.700000114A35G31-A35 WeakPolarHBondContact O-CB 3.17Å; G31-A35 PolarHBondContact O-N 2.66Å
32A50.9Low51.3Low67 Ų67114.7 Ų114.755%0.55466%0.656SS**Hα-helixtrans-72.1-42.6179.400000112.4V30 A35 V36V30-A32 VanDerWaalsContact C-N 3.29Å; V30-A32 PolarHBondContact O-N 3.22Å; A32-A35 PolarHBondContact O-N 3.47Å; A32-V36 WeakPolarHBondContact O-CG2 3.1Å; A32-V36 PolarHBondContact O-N 3.4Å
33V51.1Low53.4Low100 Ų100109.8 Ų109.861%0.60663%0.626SS**Hα-helixtrans-74.1-31.1177.4-139.60000111.2V30 V36 Q37V30-V33 PolarHBondContact O-N 3.49Å; V33-V36 WeakPolarHBondContact O-CB 3.24Å; V33-V36 PolarHBondContact O-N 2.8Å; V33-Q37 PolarHBondContact O-N 3.48Å
34A49.7Very low55.4Low25 Ų25106.6 Ų106.621%0.20760%0.603CS.*Hα-helixtrans-77.4-24.2174.500000113.1V30 V36 Q37 R38V30-A34 VanDerWaalsContact O-CB 3.25Å; V30-A34 WeakPolarHBondContact O-CB 3.13Å; V30-A34 PolarHBondContact O-N 3.33Å; A34-V36 VanDerWaalsContact C-N 3.31Å; A34-Q37 PolarHBondContact O-N 3.03Å; A34-R38 WeakPolarHBondContact O-CB 3.4Å; A34-R38 WeakPolarHBondContact O-CG 3.39Å; A34-R38 PolarHBondContact O-N 3.41Å
35A50.5Low57.9Low59 Ų5997.2 Ų97.249%0.48857%0.569SS.*Hα-helixtrans-67.5-34.9167.400000111.4G31 A32 Q37 R38 A39G31-A35 WeakPolarHBondContact O-CB 3.17Å; G31-A35 PolarHBondContact O-N 2.66Å; A32-A35 PolarHBondContact O-N 3.47Å; A35-Q37 VanDerWaalsContact C-N 3.33Å; A35-R38 PolarHBondContact O-N 3.4Å; A35-A39 PolarHBondContact O-N 2.83Å
36V54Low59.9Low84 Ų8493.7 Ų93.751%0.50954%0.539SS..Hα-helixtrans-66-32.4173.9171.10000112A32 V33 A34A32-V36 WeakPolarHBondContact O-CG2 3.1Å; A32-V36 PolarHBondContact O-N 3.4Å; V33-V36 WeakPolarHBondContact O-CB 3.24Å; V33-V36 PolarHBondContact O-N 2.8Å; A34-V36 VanDerWaalsContact C-N 3.31Å
37Q49.5Very low62.2Low122 Ų12292.4 Ų92.457%0.5752%0.519SS*.Hα-helixtrans-94.5-17.9174.5-65.4-148.4-24.400115.1V33 A34 A35 A39 R40V33-Q37 PolarHBondContact O-N 3.48Å; A34-Q37 PolarHBondContact O-N 3.03Å; A35-Q37 VanDerWaalsContact C-N 3.33Å; Q37-A39 VanDerWaalsContact C-N 3.26Å; Q37-A39 PolarHBondContact O-N 2.96Å; Q37-R40 WeakPolarHBondContact O-CB 3.48Å; Q37-R40 VanDerWaalsContact O-CD 3.24Å; Q37-R40 WeakPolarHBondContact O-CD 3.47Å; Q37-R40 WeakPolarHBondContact O-CG 3.25Å
38R48.3Very low64.6Low203 Ų20394 Ų9477%0.76651%0.511SS*.Hα-helixtrans-76.4-13.3173.4-77.9172.6176.9127.10.1112.8A34 A35 R40A34-R38 WeakPolarHBondContact O-CB 3.4Å; A34-R38 WeakPolarHBondContact O-CG 3.39Å; A34-R38 PolarHBondContact O-N 3.41Å; A35-R38 PolarHBondContact O-N 3.4Å; R38-R40 VanDerWaalsContact C-N 3.25Å; R38-R40 PolarHBondContact O-N 3.06Å
39A50Low66.8Low54 Ų5496.2 Ų96.245%0.44650%0.499SS..THydrogen-bonded Turntrans-84.825.6171.400000114.4A35 Q37 K41 R42A35-A39 PolarHBondContact O-N 2.83Å; Q37-A39 VanDerWaalsContact C-N 3.26Å; Q37-A39 PolarHBondContact O-N 2.96Å; A39-K41 PolarHBondContact O-N 2.92Å; A39-R42 PolarHBondContact O-N 3.34Å
40R54.7Low68.9Low199 Ų19999.1 Ų99.175%0.75151%0.512SS*.THydrogen-bonded Turntrans-5716.6-171.2-104.9170.1170.1-148.5-5.7118.1Q37 R38Q37-R40 WeakPolarHBondContact O-CB 3.48Å; Q37-R40 VanDerWaalsContact O-CD 3.24Å; Q37-R40 WeakPolarHBondContact O-CD 3.47Å; Q37-R40 WeakPolarHBondContact O-CG 3.25Å; R38-R40 VanDerWaalsContact C-N 3.25Å; R38-R40 PolarHBondContact O-N 3.06Å
41K68.3Low71Confident192 Ų19298.4 Ų98.484%0.83551%0.511SS*.THydrogen-bonded Turntrans-143.7-7.3166.9-79.7113.2178.8-162.70115.8A39A39-K41 PolarHBondContact O-N 2.92Å
42R86.3Confident73.5Confident188 Ų18898.5 Ų98.571%0.70951%0.512SS*.  trans-145.5125.9-170.9-62178.767.8-161.50.3113.3A39A39-R42 PolarHBondContact O-N 3.34Å
43F91.6Very high75.6Confident57 Ų57100.1 Ų100.125%0.2550%0.504CS..  trans-85.4150.3174.8-58.8-80.2000112V46 A75 E76 A79 N97 F98F43-V46 HydrophobicContact CB-CB 3.98Å; F43-V46 HydrophobicContact CB-CG2 3.87Å; F43-V46 PolarHBondContact O-N 3.43Å; F43-A75 HydrophobicContact CD2-CB 3.78Å; F43-A75 HydrophobicContact CE2-CB 3.59Å; F43-E76 HydrophobicContact CE2-CG 4.32Å; F43-E76 HydrophobicContact CZ-CG 4.06Å; F43-A79 HydrophobicContact CB-CB 3.61Å; F43-A79 HydrophobicContact CD1-CB 3.76Å; F43-A79 HydrophobicContact CD2-CB 4.11Å; F43-A79 HydrophobicContact CE1-CB 4.44Å; F43-A79 HydrophobicContact CG-CB 3.56Å; F43-N97 HydrophobicContact CD1-CB 4.22Å; F43-F98 HydrophobicContact CD1-CZ 4.38Å; F43-F98 HydrophobicContact CE1-CE1 4Å; F43-F98 AromaticContact CE1-CZ 3.93Å; F43-F98 HydrophobicContact CE1-CZ 3.93Å; F43-F98 HydrophobicContact CZ-CZ 4.41Å
44V91.6Very high77.7Confident68 Ų6897.7 Ų97.741%0.41248%0.484SS..THydrogen-bonded Turntrans-65.8134.5175.6-176.60000109.6V46 Y82 N97V44-V46 PolarHBondContact O-N 3.35Å; V44-Y82 HydrophobicContact CB-CE1 4.36Å; V44-Y82 HydrophobicContact CG1-CE1 3.9Å; V44-N97 WeakPolarHBondContact CA-OD1 3.23Å; V44-N97 WeakPolarHBondContact CB-OD1 3.35Å; V44-N97 WeakPolarHBondContact CG2-OD1 3.38Å; V44-N97 PolarHBondContact N-OD1 2.91Å; V44-N97 PolarHBondContact O-ND2 3.21Å
45G92.2Very high79.9Confident26 Ų2696.6 Ų96.627%0.26848%0.475SS..THydrogen-bonded Turntrans76.6-0.7-179.200000114.7A56 E57G45-A56 WeakPolarHBondContact O-CA 3.36Å; G45-E57 PolarHBondContact O-N 3.35Å
46V94.7Very high82Confident9 Ų993.8 Ų93.86%0.05545%0.451CS..EExtended strand (participates in β ladder)trans-111.1129.4-177.1-179.80000110.9F43 V44 W54 V55 A78 A79F43-V46 HydrophobicContact CB-CB 3.98Å; F43-V46 HydrophobicContact CB-CG2 3.87Å; F43-V46 PolarHBondContact O-N 3.43Å; V44-V46 PolarHBondContact O-N 3.35Å; V46-W54 HydrophobicContact CG1-CB 4.32Å; V46-W54 HydrophobicContact CG1-CD2 4.35Å; V46-W54 HydrophobicContact CG1-CE3 3.51Å; V46-W54 HydrophobicContact CG1-CZ3 4.17Å; V46-V55 WeakPolarHBondContact CA-O 3.42Å; V46-A78 HydrophobicContact CB-CB 4.37Å; V46-A78 HydrophobicContact CG1-CB 3.74Å; V46-A78 HydrophobicContact CG2-CB 3.71Å; V46-A79 HydrophobicContact CG2-CB 4.02Å
47R94.6Very high84Confident90 Ų9094 Ų9434%0.3445%0.447SS..EExtended strand (participates in β ladder)trans-129.1148.2174.562.6-177.7171.485-3111.5V55 E57R47-V55 HydrophobicContact CG-CB 3.93Å; R47-V55 PolarHBondContact N-O 2.97Å; R47-V55 PolarHBondContact O-N 3.42Å; R47-E57 IonicContact CZ-OE2 3.96Å; R47-E57 IonicContact NE-OE2 3.07Å; R47-E57 PolarHBondContact NE-OE2 2.77Å; R47-E57 IonicContact NH2-OE2 3.99Å; R47-E57 PolarHBondContact NH2-OE2 2.74Å
48Q94.4Very high86.1Confident122 Ų12288.7 Ų88.757%0.5742%0.423SS*.EExtended strand (participates in β ladder)trans-98.4129.2176.2-162.5176.423.300110.1W54Q48-W54 HydrophobicContact CB-CE3 3.99Å; Q48-W54 HydrophobicContact CB-CH2 4.3Å; Q48-W54 HydrophobicContact CB-CZ3 3.91Å; Q48-W54 HydrophobicContact CG-CD2 4.4Å; Q48-W54 HydrophobicContact CG-CE3 4.35Å; Q48-W54 HydrophobicContact CG-CH2 4.41Å; Q48-W54 HydrophobicContact CG-CZ2 4.38Å; Q48-W54 HydrophobicContact CG-CZ3 4.39Å
49R93.4Very high88.3Confident139 Ų13985.1 Ų85.153%0.52541%0.413SS..  trans-85.2152.9171.3-173.5176.9-82.6-933.3109.1S51 G52 R53R49-S51 PolarHBondContact O-N 3.1Å; R49-G52 PolarHBondContact O-N 3.34Å; R49-R53 PolarHBondContact N-O 2.95Å
50P94.4Very high90.2Very high141 Ų14182.9 Ų82.992%0.91639%0.393SS*.THydrogen-bonded Turntrans-54.8-19.7171.419.6-35000114.5G52P50-G52 PolarHBondContact O-N 2.93Å
51S91.4Very high91.9Very high87 Ų8778.2 Ų78.261%0.60839%0.387SS*.THydrogen-bonded Turntrans-63.9-12.9170177.50000114.1R49 R53R49-S51 PolarHBondContact O-N 3.1Å; S51-R53 VanDerWaalsContact C-N 3.33Å; S51-R53 PolarHBondContact O-N 3.42Å
52G92.3Very high92.7Very high36 Ų3675.5 Ų75.537%0.37138%0.38SS..SBendtrans90.7-20.3-174.300000114.5R49 P50R49-G52 PolarHBondContact O-N 3.34Å; P50-G52 PolarHBondContact O-N 2.93Å
53R94.6Very high92.7Very high102 Ų10269 Ų6939%0.38536%0.357SS..  trans-70.8147.2178.5-56.1-163.877.8-169.23.3112.7R49 S51 T71 D73R49-R53 PolarHBondContact N-O 2.95Å; S51-R53 VanDerWaalsContact C-N 3.33Å; S51-R53 PolarHBondContact O-N 3.42Å; R53-T71 PolarHBondContact NH1-OG1 3.33Å; R53-D73 IonicContact CZ-OD1 3.41Å; R53-D73 IonicContact NE-OD1 2.95Å; R53-D73 PolarHBondContact NE-OD1 3.25Å; R53-D73 IonicContact NH2-OD1 2.93Å; R53-D73 PolarHBondContact NH2-OD1 2.85Å
54W95.5Very high92.6Very high48 Ų4875.4 Ų75.418%0.18239%0.385CS..EExtended strand (participates in β ladder)trans-93.2139.3176.6-60.990.4000110V46 Q48 T71 F72 D73 T74 A75 A78V46-W54 HydrophobicContact CG1-CB 4.32Å; V46-W54 HydrophobicContact CG1-CD2 4.35Å; V46-W54 HydrophobicContact CG1-CE3 3.51Å; V46-W54 HydrophobicContact CG1-CZ3 4.17Å; Q48-W54 HydrophobicContact CB-CE3 3.99Å; Q48-W54 HydrophobicContact CB-CH2 4.3Å; Q48-W54 HydrophobicContact CB-CZ3 3.91Å; Q48-W54 HydrophobicContact CG-CD2 4.4Å; Q48-W54 HydrophobicContact CG-CE3 4.35Å; Q48-W54 HydrophobicContact CG-CH2 4.41Å; Q48-W54 HydrophobicContact CG-CZ2 4.38Å; Q48-W54 HydrophobicContact CG-CZ3 4.39Å; W54-T71 CarbonylContact O-C 3.45Å; W54-T71 VanDerWaalsContact O-CA 3.23Å; W54-T71 WeakPolarHBondContact O-CA 3.44Å; W54-F72 WeakPolarHBondContact CB-O 3.21Å; W54-F72 PolarHBondContact N-O 3.2Å; W54-F72 PolarHBondContact O-N 3.19Å; W54-D73 VanDerWaalsContact CD1-O 3.31Å; W54-T74 VanDerWaalsContact CD1-C 3.44Å; W54-A75 HydrophobicContact CD2-CB 3.67Å; W54-A75 HydrophobicContact CE3-CB 3.87Å; W54-A75 HydrophobicContact CG-CB 4.31Å; W54-A75 HydrophobicContact CH2-CB 3.79Å; W54-A75 HydrophobicContact CZ2-CB 3.64Å; W54-A75 HydrophobicContact CZ3-CB 3.9Å; W54-A78 HydrophobicContact CB-CB 3.98Å
55V95Very high92.6Very high2 Ų273 Ų731%0.01237%0.37CS..EExtended strand (participates in β ladder)trans-121.9131.7179.8-173.20000108.6V46 R47 T71V46-V55 WeakPolarHBondContact CA-O 3.42Å; R47-V55 HydrophobicContact CG-CB 3.93Å; R47-V55 PolarHBondContact N-O 2.97Å; R47-V55 PolarHBondContact O-N 3.42Å; V55-T71 HydrophobicContact CG1-CG2 4.42Å; V55-T71 HydrophobicContact CG2-CG2 3.87Å
56A95.7Very high92.7Very high0 Ų081.4 Ų81.40%039%0.394CS..EExtended strand (participates in β ladder)trans-110.9136.1172.800000111.1G45 L69 G70 F72 A78G45-A56 WeakPolarHBondContact O-CA 3.36Å; A56-L69 HydrophobicContact CB-CB 4.12Å; A56-L69 HydrophobicContact CB-CD1 4.14Å; A56-L69 WeakPolarHBondContact O-CB 3.38Å; A56-L69 PolarHBondContact O-N 3.41Å; A56-G70 PolarHBondContact N-O 2.99Å; A56-G70 VanDerWaalsContact N-O 3.08Å; A56-G70 PolarHBondContact O-N 2.89Å; A56-F72 HydrophobicContact CB-CD2 4.16Å; A56-F72 HydrophobicContact CB-CE2 3.78Å; A56-A78 HydrophobicContact CB-CB 4.24Å; A56-A78 WeakPolarHBondContact CB-O 2.98Å
57E95Very high92.7Very high89 Ų8981.5 Ų81.542%0.41639%0.394SS..EExtended strand (participates in β ladder)trans-146143.717759.5-169.3-136.100109.7G45 R47 V67 Y82G45-E57 PolarHBondContact O-N 3.35Å; R47-E57 IonicContact CZ-OE2 3.96Å; R47-E57 IonicContact NE-OE2 3.07Å; R47-E57 PolarHBondContact NE-OE2 2.77Å; R47-E57 IonicContact NH2-OE2 3.99Å; R47-E57 PolarHBondContact NH2-OE2 2.74Å; E57-V67 WeakPolarHBondContact CA-O 3.25Å; E57-Y82 WeakPolarHBondContact O-CD2 3.13Å; E57-Y82 VanDerWaalsContact O-CE2 3.31Å; E57-Y82 WeakPolarHBondContact O-CE2 2.76Å
58I94.4Very high92.7Very high11 Ų1184.9 Ų84.96%0.05641%0.407CS..EExtended strand (participates in β ladder)trans-114.8133.8177.4-170.6154.3000110.6R66 V67 L69 Y82 A85 A86 L89 L136I58-R66 WeakPolarHBondContact O-CA 3.45Å; I58-V67 HydrophobicContact CG2-CB 3.8Å; I58-V67 PolarHBondContact N-O 3.24Å; I58-V67 PolarHBondContact O-N 3.27Å; I58-L69 HydrophobicContact CB-CD1 4.27Å; I58-L69 HydrophobicContact CG2-CD1 4.41Å; I58-L69 HydrophobicContact CG2-CD2 3.81Å; I58-L69 HydrophobicContact CG2-CG 4.23Å; I58-Y82 HydrophobicContact CB-CD2 4.34Å; I58-Y82 HydrophobicContact CB-CE2 4.06Å; I58-Y82 HydrophobicContact CD1-CE2 4.31Å; I58-Y82 HydrophobicContact CG1-CE2 4.06Å; I58-A85 HydrophobicContact CD1-CB 4.11Å; I58-A85 HydrophobicContact CG2-CB 4.44Å; I58-A86 HydrophobicContact CD1-CB 3.9Å; I58-L89 HydrophobicContact CD1-CD1 3.81Å; I58-L89 HydrophobicContact CG1-CD1 4.04Å; I58-L89 HydrophobicContact CG2-CD1 3.92Å; I58-L136 HydrophobicContact CG2-CD2 4.31Å
59K94.6Very high92.7Very high128 Ų12879.2 Ų79.256%0.55738%0.38SS*.EExtended strand (participates in β ladder)trans-122.5120.3175.3177.6-178.5176.6-171.50108.1R66K59-R66 HydrophobicContact CG-CG 4.21Å
60D90.1Very high92.8Very high7 Ų773.1 Ų73.14%0.03736%0.361CS..EExtended strand (participates in β ladder)trans-113.1121.2173.1-167.927.3000110.4Q63 K64 I65 R90D60-Q63 VanDerWaalsContact OD2-CG 3.3Å; D60-Q63 WeakPolarHBondContact OD2-CG 3.49Å; D60-Q63 PolarHBondContact OD2-N 3.02Å; D60-K64 WeakPolarHBondContact O-CA 3.37Å; D60-K64 PolarHBondContact O-N 3.32Å; D60-K64 VanDerWaalsContact O-N 3.08Å; D60-I65 HydrophobicContact CB-CD1 4.37Å; D60-I65 HydrophobicContact CB-CG1 3.81Å; D60-I65 PolarHBondContact N-O 2.9Å; D60-I65 PolarHBondContact O-N 3.25Å; D60-I65 VanDerWaalsContact O-N 3.11Å; D60-R90 IonicContact OD1-CZ 2.88Å; D60-R90 IonicContact OD1-NE 3.56Å; D60-R90 IonicContact OD1-NH2 3.31Å; D60-R90 PolarHBondContact OD1-NH2 3.29Å
61T89.4Confident92.8Very high101 Ų10168.8 Ų68.862%0.6233%0.332SS*.THydrogen-bonded Turntrans-77.7-29.2-177.851.40000112
62I86.3Confident93Very high135 Ų13565.4 Ų65.469%0.69231%0.306SS*.THydrogen-bonded Turntrans-69.5-51-179.4-58.2173.3000109.3K64I62-K64 VanDerWaalsContact C-N 3.3Å; I62-K64 PolarHBondContact O-N 3.34Å
63Q85.2Confident93.1Very high50 Ų5069 Ų6923%0.23432%0.317CS..THydrogen-bonded Turntrans-83.5-4.4178.7-62.3-18028.800113.5D60 I65 L89 A143D60-Q63 VanDerWaalsContact OD2-CG 3.3Å; D60-Q63 WeakPolarHBondContact OD2-CG 3.49Å; D60-Q63 PolarHBondContact OD2-N 3.02Å; Q63-I65 HydrophobicContact CB-CD1 4.25Å; Q63-I65 HydrophobicContact CB-CG1 4.02Å; Q63-I65 HydrophobicContact CB-CG2 4.05Å; Q63-I65 WeakPolarHBondContact O-CG2 3.48Å; Q63-I65 PolarHBondContact O-N 3.15Å; Q63-L89 PolarHBondContact NE2-O 3Å; Q63-A143 HydrophobicContact CG-CB 4.26Å
64K90.7Very high93Very high193 Ų19366.9 Ų66.984%0.83932%0.316SS*.THydrogen-bonded Turntrans5136.6-172.7-59.9-179.7-179.2177.70113.1D60 I62D60-K64 WeakPolarHBondContact O-CA 3.37Å; D60-K64 PolarHBondContact O-N 3.32Å; D60-K64 VanDerWaalsContact O-N 3.08Å; I62-K64 VanDerWaalsContact C-N 3.3Å; I62-K64 PolarHBondContact O-N 3.34Å
65I90.9Very high92.9Very high18 Ų1865 Ų659%0.09231%0.31CS..EExtended strand (participates in β ladder)trans-105.3147.8-179.763.8174.4000111.9D60 Q63 L89 H139D60-I65 HydrophobicContact CB-CD1 4.37Å; D60-I65 HydrophobicContact CB-CG1 3.81Å; D60-I65 PolarHBondContact N-O 2.9Å; D60-I65 PolarHBondContact O-N 3.25Å; D60-I65 VanDerWaalsContact O-N 3.11Å; Q63-I65 HydrophobicContact CB-CD1 4.25Å; Q63-I65 HydrophobicContact CB-CG1 4.02Å; Q63-I65 HydrophobicContact CB-CG2 4.05Å; Q63-I65 WeakPolarHBondContact O-CG2 3.48Å; Q63-I65 PolarHBondContact O-N 3.15Å; I65-L89 HydrophobicContact CD1-CD1 3.61Å; I65-L89 HydrophobicContact CD1-CD2 3.48Å; I65-L89 VanDerWaalsContact CD1-CD2 3.48Å; I65-L89 HydrophobicContact CD1-CG 4.17Å; I65-H139 HydrophobicContact CD1-CB 4.2Å
66R94.6Very high92.8Very high202 Ų20269 Ų6976%0.76233%0.329SS*.EExtended strand (participates in β ladder)trans-129.8122.4168.4-63.1-176-172.4-171.34.2107.6I58 K59I58-R66 WeakPolarHBondContact O-CA 3.45Å; K59-R66 HydrophobicContact CG-CG 4.21Å
67V94.5Very high92.7Very high10 Ų1072.1 Ų72.16%0.06134%0.343CS..EExtended strand (participates in β ladder)trans-126.8125.5-178.9-177.10000108.6E57 I58 L69 V132 L135 L136E57-V67 WeakPolarHBondContact CA-O 3.25Å; I58-V67 HydrophobicContact CG2-CB 3.8Å; I58-V67 PolarHBondContact N-O 3.24Å; I58-V67 PolarHBondContact O-N 3.27Å; V67-L69 HydrophobicContact CG1-CD2 4.26Å; V67-V132 HydrophobicContact CG1-CG1 4.17Å; V67-L135 HydrophobicContact CG1-CD2 4Å; V67-L135 HydrophobicContact CG2-CD2 4.46Å; V67-L136 HydrophobicContact CB-CD2 4.17Å; V67-L136 HydrophobicContact CG1-CD2 4.09Å; V67-L136 HydrophobicContact CG2-CD2 4.02Å
68W94.1Very high92.7Very high162 Ų16267.9 Ų67.961%0.61432%0.323SS*.EExtended strand (participates in β ladder)trans-80.3120.9170.2177.346.7000108.7G70 T71W68-G70 PolarHBondContact NE1-O 3.26Å; W68-T71 HydrophobicContact CZ2-CG2 3.93Å
69L95Very high92.7Very high2 Ų267.4 Ų67.41%0.0132%0.321CS..EExtended strand (participates in β ladder)trans-88.1-34.6-173.5-58.7177000112A56 I58 V67 Y82 A85 L128 V132 L136A56-L69 HydrophobicContact CB-CB 4.12Å; A56-L69 HydrophobicContact CB-CD1 4.14Å; A56-L69 WeakPolarHBondContact O-CB 3.38Å; A56-L69 PolarHBondContact O-N 3.41Å; I58-L69 HydrophobicContact CB-CD1 4.27Å; I58-L69 HydrophobicContact CG2-CD1 4.41Å; I58-L69 HydrophobicContact CG2-CD2 3.81Å; I58-L69 HydrophobicContact CG2-CG 4.23Å; V67-L69 HydrophobicContact CG1-CD2 4.26Å; L69-Y82 HydrophobicContact CD1-CD2 4.21Å; L69-A85 HydrophobicContact CD1-CB 3.68Å; L69-A85 HydrophobicContact CD2-CB 3.53Å; L69-A85 HydrophobicContact CG-CB 4.27Å; L69-L128 HydrophobicContact CB-CD2 4.01Å; L69-L128 HydrophobicContact CD1-CD2 4.41Å; L69-L128 HydrophobicContact CD2-CD2 3.96Å; L69-L128 HydrophobicContact CG-CD2 4.35Å; L69-V132 HydrophobicContact CD2-CG1 3.7Å; L69-L136 HydrophobicContact CD2-CD1 4.26Å
70G94.9Very high92.7Very high11 Ų1166.7 Ų66.711%0.11332%0.315CS..EExtended strand (participates in β ladder)trans152.3-174.6176.900000113.2A56 W68A56-G70 PolarHBondContact N-O 2.99Å; A56-G70 VanDerWaalsContact N-O 3.08Å; A56-G70 PolarHBondContact O-N 2.89Å; W68-G70 PolarHBondContact NE1-O 3.26Å
71T95.6Very high92.9Very high51 Ų5166.3 Ų66.331%0.31331%0.313SS..EExtended strand (participates in β ladder)trans-117.2132.1168.758.30000109.1R53 W54 V55 W68R53-T71 PolarHBondContact NH1-OG1 3.33Å; W54-T71 CarbonylContact O-C 3.45Å; W54-T71 VanDerWaalsContact O-CA 3.23Å; W54-T71 WeakPolarHBondContact O-CA 3.44Å; V55-T71 HydrophobicContact CG1-CG2 4.42Å; V55-T71 HydrophobicContact CG2-CG2 3.87Å; W68-T71 HydrophobicContact CZ2-CG2 3.93Å
72F94.5Very high93.2Very high15 Ų1563.2 Ų63.27%0.06629%0.29CS..EExtended strand (participates in β ladder)trans-123.2157.8-175.7-55.2-85000110W54 A56 E77 A78 A81 A127W54-F72 WeakPolarHBondContact CB-O 3.21Å; W54-F72 PolarHBondContact N-O 3.2Å; W54-F72 PolarHBondContact O-N 3.19Å; A56-F72 HydrophobicContact CB-CD2 4.16Å; A56-F72 HydrophobicContact CB-CE2 3.78Å; F72-E77 HydrophobicContact CB-CB 4.34Å; F72-E77 HydrophobicContact CB-CG 4.3Å; F72-E77 HydrophobicContact CD1-CB 4.48Å; F72-E77 HydrophobicContact CD1-CG 3.64Å; F72-E77 HydrophobicContact CE1-CG 4.35Å; F72-E77 HydrophobicContact CG-CG 4.22Å; F72-A78 HydrophobicContact CB-CB 3.99Å; F72-A78 VanDerWaalsContact CD2-CA 3.44Å; F72-A78 HydrophobicContact CD2-CB 3.65Å; F72-A78 HydrophobicContact CG-CB 4.08Å; F72-A81 HydrophobicContact CE1-CB 3.96Å; F72-A81 HydrophobicContact CE2-CB 3.66Å; F72-A81 HydrophobicContact CZ-CB 3.29Å; F72-A127 VanDerWaalsContact CE1-O 3.25Å; F72-A127 WeakPolarHBondContact CE1-O 3.47Å
73D93.8Very high93.5Very high113 Ų11357.4 Ų57.460%0.60426%0.26SS*.SBendtrans-87.5-23.7-176.9-59.7-28.7000111.4R53 W54R53-D73 IonicContact CZ-OD1 3.41Å; R53-D73 IonicContact NE-OD1 2.95Å; R53-D73 PolarHBondContact NE-OD1 3.25Å; R53-D73 IonicContact NH2-OD1 2.93Å; R53-D73 PolarHBondContact NH2-OD1 2.85Å; W54-D73 VanDerWaalsContact CD1-O 3.31Å
74T94.1Very high93.9Very high57 Ų5758 Ų5835%0.3526%0.263SS..SBendtrans-114.1151.9175.767.70000112.4W54 E76 E77 A78W54-T74 VanDerWaalsContact CD1-C 3.44Å; T74-E76 VanDerWaalsContact C-N 3.29Å; T74-E77 WeakPolarHBondContact OG1-CB 3.4Å; T74-E77 PolarHBondContact OG1-N 3.08Å; T74-E77 VanDerWaalsContact OG1-N 3.15Å; T74-A78 PolarHBondContact O-N 3.42Å
75A93.2Very high94.1Very high7 Ų748.8 Ų48.86%0.05822%0.223CC..Hα-helixtrans-68.5-35.5177.400000110.9F43 W54 A79F43-A75 HydrophobicContact CD2-CB 3.78Å; F43-A75 HydrophobicContact CE2-CB 3.59Å; W54-A75 HydrophobicContact CD2-CB 3.67Å; W54-A75 HydrophobicContact CE3-CB 3.87Å; W54-A75 HydrophobicContact CG-CB 4.31Å; W54-A75 HydrophobicContact CH2-CB 3.79Å; W54-A75 HydrophobicContact CZ2-CB 3.64Å; W54-A75 HydrophobicContact CZ3-CB 3.9Å; A75-A79 WeakPolarHBondContact O-CB 3.45Å; A75-A79 PolarHBondContact O-N 3.49Å
76E93.1Very high94.1Very high88 Ų8848.1 Ų48.141%0.41122%0.22SC..Hα-helixtrans-71.4-41-177.1-62.369.9-155.800111.3F43 T74 A79 R80 F98F43-E76 HydrophobicContact CE2-CG 4.32Å; F43-E76 HydrophobicContact CZ-CG 4.06Å; T74-E76 VanDerWaalsContact C-N 3.29Å; E76-A79 PolarHBondContact O-N 2.97Å; E76-R80 WeakPolarHBondContact O-CG 3.31Å; E76-R80 PolarHBondContact O-N 3.28Å; E76-F98 HydrophobicContact CB-CZ 4.18Å; E76-F98 WeakPolarHBondContact O-CE2 3.44Å
77E93.8Very high94Very high65 Ų6539.5 Ų39.530%0.30419%0.191SC..Hα-helixtrans-66.1-43.6174.5-174.3-175.6-170.300111.7F72 T74 A79 R80 A81F72-E77 HydrophobicContact CB-CB 4.34Å; F72-E77 HydrophobicContact CB-CG 4.3Å; F72-E77 HydrophobicContact CD1-CB 4.48Å; F72-E77 HydrophobicContact CD1-CG 3.64Å; F72-E77 HydrophobicContact CE1-CG 4.35Å; F72-E77 HydrophobicContact CG-CG 4.22Å; T74-E77 WeakPolarHBondContact OG1-CB 3.4Å; T74-E77 PolarHBondContact OG1-N 3.08Å; T74-E77 VanDerWaalsContact OG1-N 3.15Å; E77-A79 PolarHBondContact O-N 3.14Å; E77-R80 PolarHBondContact O-N 2.85Å; E77-R80 VanDerWaalsContact O-N 3.11Å; E77-A81 PolarHBondContact O-N 3.43Å
78A94.6Very high93.8Very high0 Ų041.8 Ų41.80%020%0.202CC..Hα-helixtrans-57.2-40.9173.200000111.9V46 W54 A56 F72 T74 Y82V46-A78 HydrophobicContact CB-CB 4.37Å; V46-A78 HydrophobicContact CG1-CB 3.74Å; V46-A78 HydrophobicContact CG2-CB 3.71Å; W54-A78 HydrophobicContact CB-CB 3.98Å; A56-A78 HydrophobicContact CB-CB 4.24Å; A56-A78 WeakPolarHBondContact CB-O 2.98Å; F72-A78 HydrophobicContact CB-CB 3.99Å; F72-A78 VanDerWaalsContact CD2-CA 3.44Å; F72-A78 HydrophobicContact CD2-CB 3.65Å; F72-A78 HydrophobicContact CG-CB 4.08Å; T74-A78 PolarHBondContact O-N 3.42Å; A78-Y82 PolarHBondContact O-N 3.06Å; A78-Y82 VanDerWaalsContact O-N 3.07Å
79A94.2Very high93.6Very high0 Ų034.4 Ų34.40%018%0.175CC..Hα-helixtrans-68.4-37.7177.200000111.9F43 V46 A75 E76 E77 Y82 D83 N97 F98F43-A79 HydrophobicContact CB-CB 3.61Å; F43-A79 HydrophobicContact CD1-CB 3.76Å; F43-A79 HydrophobicContact CD2-CB 4.11Å; F43-A79 HydrophobicContact CE1-CB 4.44Å; F43-A79 HydrophobicContact CG-CB 3.56Å; V46-A79 HydrophobicContact CG2-CB 4.02Å; A75-A79 WeakPolarHBondContact O-CB 3.45Å; A75-A79 PolarHBondContact O-N 3.49Å; E76-A79 PolarHBondContact O-N 2.97Å; E77-A79 PolarHBondContact O-N 3.14Å; A79-Y82 WeakPolarHBondContact O-CB 3.25Å; A79-Y82 PolarHBondContact O-N 2.92Å; A79-D83 PolarHBondContact O-N 3.3Å; A79-N97 HydrophobicContact CB-CB 4.08Å; A79-F98 HydrophobicContact CB-CD2 4.49Å; A79-F98 HydrophobicContact CB-CE2 3.45Å; A79-F98 VanDerWaalsContact CB-CE2 3.45Å; A79-F98 HydrophobicContact CB-CZ 3.77Å
80R94.1Very high93.4Very high113 Ų11341.1 Ų41.143%0.42620%0.2SC..Hα-helixtrans-65.7-42.2175.7-75.4-170.7-62-86.73.1111.4E76 E77 Y82 D83 E84 F98 A127E76-R80 WeakPolarHBondContact O-CG 3.31Å; E76-R80 PolarHBondContact O-N 3.28Å; E77-R80 PolarHBondContact O-N 2.85Å; E77-R80 VanDerWaalsContact O-N 3.11Å; R80-Y82 VanDerWaalsContact C-N 3.3Å; R80-Y82 PolarHBondContact O-N 2.96Å; R80-D83 WeakPolarHBondContact O-CB 3.41Å; R80-D83 PolarHBondContact O-N 2.84Å; R80-D83 VanDerWaalsContact O-N 3.14Å; R80-E84 PolarHBondContact O-N 3.29Å; R80-F98 HydrophobicContact CB-CE2 4.34Å; R80-F98 HydrophobicContact CG-CD2 3.76Å; R80-F98 HydrophobicContact CG-CE2 3.5Å; R80-F98 VanDerWaalsContact CG-CE2 3.5Å; R80-F98 HydrophobicContact CG-CZ 4.33Å; R80-A127 HydrophobicContact CB-CB 4.06Å
81A94.2Very high93Very high0 Ų041.8 Ų41.80%021%0.206CC..Hα-helixtrans-59.6-42.117400000111.7F72 E77 D83 A85 A127 L128F72-A81 HydrophobicContact CE1-CB 3.96Å; F72-A81 HydrophobicContact CE2-CB 3.66Å; F72-A81 HydrophobicContact CZ-CB 3.29Å; E77-A81 PolarHBondContact O-N 3.43Å; A81-D83 VanDerWaalsContact C-N 3.34Å; A81-D83 PolarHBondContact O-N 2.68Å; A81-A85 WeakPolarHBondContact O-CB 3.41Å; A81-A85 PolarHBondContact O-N 3.07Å; A81-A127 HydrophobicContact CB-CB 3.9Å; A81-L128 HydrophobicContact CB-CD2 3.84Å; A81-L128 HydrophobicContact CB-CG 4.37Å; A81-L128 WeakPolarHBondContact O-CD2 3.48Å
82Y95.2Very high92.5Very high36 Ų3644 Ų4414%0.14122%0.224CC..Hα-helixtrans-61.5-41.8173.8-176.6-91.2000112.3V44 E57 I58 L69 A78 A79 R80 A85 A86V44-Y82 HydrophobicContact CB-CE1 4.36Å; V44-Y82 HydrophobicContact CG1-CE1 3.9Å; E57-Y82 WeakPolarHBondContact O-CD2 3.13Å; E57-Y82 VanDerWaalsContact O-CE2 3.31Å; E57-Y82 WeakPolarHBondContact O-CE2 2.76Å; I58-Y82 HydrophobicContact CB-CD2 4.34Å; I58-Y82 HydrophobicContact CB-CE2 4.06Å; I58-Y82 HydrophobicContact CD1-CE2 4.31Å; I58-Y82 HydrophobicContact CG1-CE2 4.06Å; L69-Y82 HydrophobicContact CD1-CD2 4.21Å; A78-Y82 PolarHBondContact O-N 3.06Å; A78-Y82 VanDerWaalsContact O-N 3.07Å; A79-Y82 WeakPolarHBondContact O-CB 3.25Å; A79-Y82 PolarHBondContact O-N 2.92Å; R80-Y82 VanDerWaalsContact C-N 3.3Å; R80-Y82 PolarHBondContact O-N 2.96Å; Y82-A85 PolarHBondContact O-N 3.11Å; Y82-A86 HydrophobicContact CE1-CB 4.37Å; Y82-A86 VanDerWaalsContact O-CB 3.28Å; Y82-A86 WeakPolarHBondContact O-CB 3.28Å; Y82-A86 PolarHBondContact O-N 2.91Å
83D93.9Very high91.9Very high13 Ų1351 Ų517%0.0726%0.262CS..Hα-helixtrans-65.6-44.1-178.6-704.9000112.5A79 R80 A81 A85 A86 C87 T96 N97 F98A79-D83 PolarHBondContact O-N 3.3Å; R80-D83 WeakPolarHBondContact O-CB 3.41Å; R80-D83 PolarHBondContact O-N 2.84Å; R80-D83 VanDerWaalsContact O-N 3.14Å; A81-D83 VanDerWaalsContact C-N 3.34Å; A81-D83 PolarHBondContact O-N 2.68Å; D83-A85 VanDerWaalsContact C-N 3.35Å; D83-A86 PolarHBondContact O-N 3.24Å; D83-C87 WeakPolarHBondContact O-CB 3.44Å; D83-C87 PolarHBondContact O-N 3.08Å; D83-C87 PolarHBondContact O-SG 2.97Å; D83-T96 HydrophobicContact CB-CG2 4.17Å; D83-T96 VanDerWaalsContact OD1-C 3.31Å; D83-T96 WeakPolarHBondContact OD1-CB 3.32Å; D83-T96 WeakPolarHBondContact OD2-CB 3.43Å; D83-T96 PolarHBondContact OD2-OG1 3.31Å; D83-N97 WeakPolarHBondContact OD1-CB 3.27Å; D83-N97 PolarHBondContact OD1-N 3.44Å; D83-N97 PolarHBondContact OD1-ND2 3.35Å; D83-N97 WeakPolarHBondContact OD2-CA 3.5Å; D83-N97 PolarHBondContact OD2-N 3.02Å; D83-F98 VanDerWaalsContact OD2-CD2 3.25Å; D83-F98 WeakPolarHBondContact OD2-CD2 3.3Å; D83-F98 PolarHBondContact OD2-N 2.86Å
84E93.6Very high91.5Very high61 Ų6146.4 Ų46.429%0.28524%0.238SC..Hα-helixtrans-59.2-46.7172.3-72.8178.3-162.500110.8R80 A86 C87 L88 A127 L128R80-E84 PolarHBondContact O-N 3.29Å; E84-A86 PolarHBondContact O-N 3.05Å; E84-C87 PolarHBondContact O-N 3.3Å; E84-L88 VanDerWaalsContact O-CG 3.3Å; E84-L88 WeakPolarHBondContact O-CG 3.47Å; E84-L88 PolarHBondContact O-N 2.94Å; E84-A127 VanDerWaalsContact CD-N 3.34Å; E84-A127 PolarHBondContact OE1-N 2.99Å; E84-A127 PolarHBondContact OE2-N 3.26Å; E84-L128 HydrophobicContact CB-CD1 3.61Å; E84-L128 HydrophobicContact CB-CG 4.08Å; E84-L128 PolarHBondContact OE2-N 2.69Å
85A93.8Very high91.2Very high0 Ų052.8 Ų52.80%026%0.256CS..Hα-helixtrans-65.7-40.6-178.700000112.2I58 L69 A81 Y82 D83 L88 L89 L128 L136I58-A85 HydrophobicContact CD1-CB 4.11Å; I58-A85 HydrophobicContact CG2-CB 4.44Å; L69-A85 HydrophobicContact CD1-CB 3.68Å; L69-A85 HydrophobicContact CD2-CB 3.53Å; L69-A85 HydrophobicContact CG-CB 4.27Å; A81-A85 WeakPolarHBondContact O-CB 3.41Å; A81-A85 PolarHBondContact O-N 3.07Å; Y82-A85 PolarHBondContact O-N 3.11Å; D83-A85 VanDerWaalsContact C-N 3.35Å; A85-L88 PolarHBondContact O-N 2.96Å; A85-L89 PolarHBondContact O-N 3.28Å; A85-L128 HydrophobicContact CB-CD1 3.93Å; A85-L128 HydrophobicContact CB-CD2 4.41Å; A85-L136 HydrophobicContact CB-CD1 3.63Å
86A92.3Very high91.1Very high4 Ų453.1 Ų53.13%0.03326%0.257CS..Hα-helixtrans-64.5-42.5177.700000111I58 Y82 D83 E84 L88 L89 R90 T94I58-A86 HydrophobicContact CD1-CB 3.9Å; Y82-A86 HydrophobicContact CE1-CB 4.37Å; Y82-A86 VanDerWaalsContact O-CB 3.28Å; Y82-A86 WeakPolarHBondContact O-CB 3.28Å; Y82-A86 PolarHBondContact O-N 2.91Å; D83-A86 PolarHBondContact O-N 3.24Å; E84-A86 PolarHBondContact O-N 3.05Å; A86-L88 VanDerWaalsContact C-N 3.31Å; A86-L88 PolarHBondContact O-N 2.88Å; A86-L89 PolarHBondContact O-N 3.14Å; A86-R90 PolarHBondContact O-N 3.37Å; A86-T94 HydrophobicContact CB-CG2 3.65Å; A86-T94 PolarHBondContact O-OG1 3.49Å
87C91.2Very high90.9Very high22 Ų2250.1 Ų50.115%0.14924%0.244CC..Hα-helixtrans-61-38.8173.3-73.90000112.6D83 E84 G91D83-C87 WeakPolarHBondContact O-CB 3.44Å; D83-C87 PolarHBondContact O-N 3.08Å; D83-C87 PolarHBondContact O-SG 2.97Å; E84-C87 PolarHBondContact O-N 3.3Å; C87-G91 WeakPolarHBondContact CA-O 3.42Å; C87-G91 CarbonylContact O-C 3.54Å; C87-G91 VanDerWaalsContact O-C 3.3Å; C87-G91 WeakPolarHBondContact O-CA 3.46Å; C87-G91 PolarHBondContact O-N 3.11Å
88L91.1Very high90.6Very high57 Ų5750.5 Ų50.530%0.29825%0.245SC..Hα-helixtrans-72.2-35.3179.2-71.4170.4000113.2E84 A85 A86 L128 T133 L136 L140E84-L88 VanDerWaalsContact O-CG 3.3Å; E84-L88 WeakPolarHBondContact O-CG 3.47Å; E84-L88 PolarHBondContact O-N 2.94Å; A85-L88 PolarHBondContact O-N 2.96Å; A86-L88 VanDerWaalsContact C-N 3.31Å; A86-L88 PolarHBondContact O-N 2.88Å; L88-L128 HydrophobicContact CD1-CD1 4.14Å; L88-T133 HydrophobicContact CD1-CG2 3.91Å; L88-L136 HydrophobicContact CB-CB 4.35Å; L88-L136 HydrophobicContact CD1-CD1 4.21Å; L88-L140 WeakPolarHBondContact O-CD1 3.32Å
89L90.2Very high89.3Confident7 Ų757.4 Ų57.44%0.03727%0.271CS..Hα-helixtrans-84.6-41.6-177.5-76.4176.3000113.9I58 Q63 I65 A85 A86 L136 H139I58-L89 HydrophobicContact CD1-CD1 3.81Å; I58-L89 HydrophobicContact CG1-CD1 4.04Å; I58-L89 HydrophobicContact CG2-CD1 3.92Å; Q63-L89 PolarHBondContact NE2-O 3Å; I65-L89 HydrophobicContact CD1-CD1 3.61Å; I65-L89 HydrophobicContact CD1-CD2 3.48Å; I65-L89 VanDerWaalsContact CD1-CD2 3.48Å; I65-L89 HydrophobicContact CD1-CG 4.17Å; A85-L89 PolarHBondContact O-N 3.28Å; A86-L89 PolarHBondContact O-N 3.14Å; L89-L136 HydrophobicContact CD1-CD2 3.57Å; L89-L136 HydrophobicContact CD2-CB 4.15Å; L89-L136 HydrophobicContact CD2-CD2 3.77Å; L89-L136 HydrophobicContact CG-CB 4.38Å; L89-L136 HydrophobicContact CG-CD2 3.65Å; L89-H139 HydrophobicContact CD2-CB 4Å
90R89.3Confident87.5Confident144 Ų14463 Ų6354%0.54331%0.307SS..Hα-helixtrans-110.1-11.9-170.7-173.5179.6-64179.8-0.2113D60 A86 T94D60-R90 IonicContact OD1-CZ 2.88Å; D60-R90 IonicContact OD1-NE 3.56Å; D60-R90 IonicContact OD1-NH2 3.31Å; D60-R90 PolarHBondContact OD1-NH2 3.29Å; A86-R90 PolarHBondContact O-N 3.37Å; R90-T94 HydrophobicContact CB-CG2 4.19Å; R90-T94 VanDerWaalsContact CB-OG1 3.27Å; R90-T94 WeakPolarHBondContact CB-OG1 3.33Å; R90-T94 HydrophobicContact CG-CG2 4.47Å
91G87.1Confident85.6Confident24 Ų2465 Ų6525%0.24732%0.315CS..  trans103.9-177.4175.800000113.6C87 N93 T94C87-G91 WeakPolarHBondContact CA-O 3.42Å; C87-G91 CarbonylContact O-C 3.54Å; C87-G91 VanDerWaalsContact O-C 3.3Å; C87-G91 WeakPolarHBondContact O-CA 3.46Å; C87-G91 PolarHBondContact O-N 3.11Å; G91-N93 VanDerWaalsContact C-N 3.26Å; G91-N93 PolarHBondContact O-N 3.25Å; G91-T94 WeakPolarHBondContact O-CB 2.98Å; G91-T94 PolarHBondContact O-N 2.9Å; G91-T94 PolarHBondContact O-OG1 2.87Å
92S84.7Confident83.3Confident97 Ų9769.1 Ų69.168%0.67835%0.349SS*.THydrogen-bonded Turntrans-65-24-175.649.70000114.7T94S92-T94 PolarHBondContact O-N 3.49Å
93N82.7Confident80.9Confident163 Ų16371.6 Ų71.687%0.87238%0.376SS*.THydrogen-bonded Turntrans-89.228.3179.9-164.47000113.1G91G91-N93 VanDerWaalsContact C-N 3.26Å; G91-N93 PolarHBondContact O-N 3.25Å
94T85.3Confident78.5Confident17 Ų1775.2 Ų75.210%0.10441%0.408CS..  trans-87.7138.6-177.8-56.90000110.7A86 R90 G91 S92 T96A86-T94 HydrophobicContact CB-CG2 3.65Å; A86-T94 PolarHBondContact O-OG1 3.49Å; R90-T94 HydrophobicContact CB-CG2 4.19Å; R90-T94 VanDerWaalsContact CB-OG1 3.27Å; R90-T94 WeakPolarHBondContact CB-OG1 3.33Å; R90-T94 HydrophobicContact CG-CG2 4.47Å; G91-T94 WeakPolarHBondContact O-CB 2.98Å; G91-T94 PolarHBondContact O-N 2.9Å; G91-T94 PolarHBondContact O-OG1 2.87Å; S92-T94 PolarHBondContact O-N 3.49Å; T94-T96 WeakPolarHBondContact O-CG2 3.4Å; T94-T96 PolarHBondContact O-N 3.4Å
95R87.4Confident76.1Confident191 Ų19177.5 Ų77.572%0.72143%0.426SS*.  trans-69.7113.3171.3-164.3178.278.1167.11.9109.5W99R95-W99 HydrophobicContact CB-CZ2 4.34Å; R95-W99 HydrophobicContact CG-CH2 3.9Å; R95-W99 HydrophobicContact CG-CZ2 3.26Å
96T90.7Very high73.6Confident13 Ų1381.4 Ų81.48%0.0845%0.451CS..  trans-98-143.4-173.669.40000112.3D83 T94 F98 W99D83-T96 HydrophobicContact CB-CG2 4.17Å; D83-T96 VanDerWaalsContact OD1-C 3.31Å; D83-T96 WeakPolarHBondContact OD1-CB 3.32Å; D83-T96 WeakPolarHBondContact OD2-CB 3.43Å; D83-T96 PolarHBondContact OD2-OG1 3.31Å; T94-T96 WeakPolarHBondContact O-CG2 3.4Å; T94-T96 PolarHBondContact O-N 3.4Å; T96-F98 PolarHBondContact OG1-O 3.46Å; T96-W99 WeakPolarHBondContact O-CH2 3.3Å; T96-W99 WeakPolarHBondContact O-CZ3 3.45Å; T96-W99 WeakPolarHBondContact OG1-CZ3 3.43Å
97N90Very high71.5Confident25 Ų2585.1 Ų85.113%0.13448%0.482CS..SBendtrans-111.5-32.3159.2-68.7-68.7000114.2F43 V44 A79 D83 W99F43-N97 HydrophobicContact CD1-CB 4.22Å; V44-N97 WeakPolarHBondContact CA-OD1 3.23Å; V44-N97 WeakPolarHBondContact CB-OD1 3.35Å; V44-N97 WeakPolarHBondContact CG2-OD1 3.38Å; V44-N97 PolarHBondContact N-OD1 2.91Å; V44-N97 PolarHBondContact O-ND2 3.21Å; A79-N97 HydrophobicContact CB-CB 4.08Å; D83-N97 WeakPolarHBondContact OD1-CB 3.27Å; D83-N97 PolarHBondContact OD1-N 3.44Å; D83-N97 PolarHBondContact OD1-ND2 3.35Å; D83-N97 WeakPolarHBondContact OD2-CA 3.5Å; D83-N97 PolarHBondContact OD2-N 3.02Å; N97-W99 VanDerWaalsContact CA-CZ3 3.46Å
98F86.6Confident69.5Low74 Ų7488.8 Ų88.833%0.32550%0.504SS..SBendtrans-106.5101.3177.6-55.8-75.4000112.1F43 E76 A79 R80 D83 T96F43-F98 HydrophobicContact CD1-CZ 4.38Å; F43-F98 HydrophobicContact CE1-CE1 4Å; F43-F98 AromaticContact CE1-CZ 3.93Å; F43-F98 HydrophobicContact CE1-CZ 3.93Å; F43-F98 HydrophobicContact CZ-CZ 4.41Å; E76-F98 HydrophobicContact CB-CZ 4.18Å; E76-F98 WeakPolarHBondContact O-CE2 3.44Å; A79-F98 HydrophobicContact CB-CD2 4.49Å; A79-F98 HydrophobicContact CB-CE2 3.45Å; A79-F98 VanDerWaalsContact CB-CE2 3.45Å; A79-F98 HydrophobicContact CB-CZ 3.77Å; R80-F98 HydrophobicContact CB-CE2 4.34Å; R80-F98 HydrophobicContact CG-CD2 3.76Å; R80-F98 HydrophobicContact CG-CE2 3.5Å; R80-F98 VanDerWaalsContact CG-CE2 3.5Å; R80-F98 HydrophobicContact CG-CZ 4.33Å; D83-F98 VanDerWaalsContact OD2-CD2 3.25Å; D83-F98 WeakPolarHBondContact OD2-CD2 3.3Å; D83-F98 PolarHBondContact OD2-N 2.86Å; T96-F98 PolarHBondContact OG1-O 3.46Å
99W67.1Low67.5Low145 Ų14588.8 Ų88.855%0.54951%0.512SS..SBendtrans-91.1129.9167.8-69.2-170.5000106.1R95 T96 N97R95-W99 HydrophobicContact CB-CZ2 4.34Å; R95-W99 HydrophobicContact CG-CH2 3.9Å; R95-W99 HydrophobicContact CG-CZ2 3.26Å; T96-W99 WeakPolarHBondContact O-CH2 3.3Å; T96-W99 WeakPolarHBondContact O-CZ3 3.45Å; T96-W99 WeakPolarHBondContact OG1-CZ3 3.43Å; N97-W99 VanDerWaalsContact CA-CZ3 3.46Å
100P57.5Low65.6Low117 Ų11792.2 Ų92.276%0.7654%0.541SS*.  cis-104.9138.49.129.4-14.3000111.8A102P100-A102 PolarHBondContact O-N 3.46Å
101R54.6Low63.8Low156 Ų15689.3 Ų89.359%0.58955%0.548SS*.  trans-48.1114.3155175.8173.3176.7169.8-2.3104.9A103R101-A103 PolarHBondContact O-N 2.98Å
102A45.2Very low61.9Low86 Ų8696.5 Ų96.571%0.71158%0.577SS**  trans-49.8104.4172.300000104.8P100 A104P100-A102 PolarHBondContact O-N 3.46Å; A102-A104 PolarHBondContact O-N 3.24Å
103A43.9Very low60.2Low87 Ų8795.4 Ų95.472%0.71957%0.574SS**  trans-48.8118.4167.900000102.1R101 V105R101-A103 PolarHBondContact O-N 2.98Å; A103-V105 PolarHBondContact O-N 2.99Å
104A44.5Very low58.7Low90 Ų9092 Ų9274%0.74456%0.561SS**  trans-36.4113.2177.900000105.2A102 P106A102-A104 PolarHBondContact O-N 3.24Å; A104-P106 WeakPolarHBondContact O-CA 3.43Å
105V43.2Very low56.8Low108 Ų10897.1 Ų97.166%0.65560%0.595SS**  trans-41.9114.8-178.9-133.20000103.2A103 A107 A109A103-V105 PolarHBondContact O-N 2.99Å; V105-A107 PolarHBondContact O-N 3.33Å; V105-A109 HydrophobicContact CG1-CB 4.13Å
106P41.2Very low54.7Low82 Ų8295.5 Ų95.553%0.53260%0.595SS.*  trans-55.1126.4-172.226.1-35.1000103.3A104 V108 A109A104-P106 WeakPolarHBondContact O-CA 3.43Å; P106-V108 HydrophobicContact CB-CG2 3.75Å; P106-V108 HydrophobicContact CG-CG2 3.81Å; P106-V108 CarbonylContact O-C 3.3Å; P106-V108 WeakPolarHBondContact O-CA 3.41Å; P106-V108 WeakPolarHBondContact O-CG2 3.42Å; P106-V108 PolarHBondContact O-N 3.21Å; P106-A109 PolarHBondContact O-N 3.31Å
107A48.6Very low52.5Low82 Ų82103.7 Ų103.768%0.67863%0.632SS**Hα-helixtrans-51-14.8-165.800000113.3V105 A110 A111V105-A107 PolarHBondContact O-N 3.33Å; A107-A110 PolarHBondContact O-N 3.06Å; A107-A111 WeakPolarHBondContact O-CB 3.27Å; A107-A111 PolarHBondContact O-N 3.16Å; A107-A111 VanDerWaalsContact O-N 3.1Å
108V49.7Very low50.1Low100 Ų100110.8 Ų110.861%0.60666%0.664SS**Hα-helixtrans-59.3-29.4167.8-55.20000116.1P106P106-V108 HydrophobicContact CB-CG2 3.75Å; P106-V108 HydrophobicContact CG-CG2 3.81Å; P106-V108 CarbonylContact O-C 3.3Å; P106-V108 WeakPolarHBondContact O-CA 3.41Å; P106-V108 WeakPolarHBondContact O-CG2 3.42Å; P106-V108 PolarHBondContact O-N 3.21Å
109A47.5Very low47.9Very low56 Ų56114.9 Ų114.946%0.46369%0.689SS.*Hα-helixtrans-81.6-29.7175.400000112.4V105 P106 A111V105-A109 HydrophobicContact CG1-CB 4.13Å; P106-A109 PolarHBondContact O-N 3.31Å; A109-A111 VanDerWaalsContact C-N 3.3Å
110A51.1Low47Very low79 Ų79114.8 Ų114.865%0.65370%0.704SS**Hα-helixtrans-73.4-25.1170.700000112A107A107-A110 PolarHBondContact O-N 3.06Å
111A50.5Low46.8Very low84 Ų84113.1 Ų113.169%0.69470%0.7SS**THydrogen-bonded Turntrans-82.5-9.9178.200000114.7A107 A109A107-A111 WeakPolarHBondContact O-CB 3.27Å; A107-A111 PolarHBondContact O-N 3.16Å; A107-A111 VanDerWaalsContact O-N 3.1Å; A109-A111 VanDerWaalsContact C-N 3.3Å
112M48.9Very low46.4Very low174 Ų174111 Ų11186%0.85771%0.706SS**THydrogen-bonded Turntrans-106.65.5-176.4-83.5-171.2148.900115
113A48.6Very low46.8Very low74 Ų74111.4 Ų111.461%0.61271%0.71SS**SBendtrans-96.7126.9176.900000111.6
114P50.9Low47.7Very low93 Ų93111.6 Ų111.660%0.60471%0.712SS**  trans-71.5151.1-177.128.4-33.2000112.5H116P114-H116 PolarHBondContact O-N 2.92Å
115P45Very low49Very low124 Ų124112.7 Ų112.781%0.80571%0.711SS**  trans-79.688.2-174.633.8-32.6000110.1
116H44.6Very low50.7Low157 Ų157111.2 Ų111.273%0.72771%0.705SS**  trans-125.2120.8167.4-64.7-63.2000109.3P114 Q118P114-H116 PolarHBondContact O-N 2.92Å; H116-Q118 PolarHBondContact O-N 3.21Å
117H44.4Very low52.9Low184 Ų184108 Ų10885%0.85269%0.686SS**SBendtrans-39.798.6-177.9-59.9-100.3000114.7
118Q39Very low54.9Low174 Ų174104.3 Ų104.381%0.81366%0.655SS**  trans-175.2118.7154.8-111.3159.261.300112.9H116H116-Q118 PolarHBondContact O-N 3.21Å
119L41Very low56.8Low161 Ų161102.6 Ų102.684%0.84365%0.645SS**  trans57.281.9155-64.9146.7000116.4A121L119-A121 PolarHBondContact O-N 2.72Å
120V47.5Very low58.8Low142 Ų142104.3 Ų104.386%0.86165%0.654SS**  trans-52.6108.3154.4170.80000107.3
121A52.1Low60.7Low83 Ų83109.1 Ų109.169%0.68666%0.66SS**  trans-55.7124.2167.100000106.8L119 A123L119-A121 PolarHBondContact O-N 2.72Å; A121-A123 PolarHBondContact O-N 3.4Å
122P46.5Very low62.7Low110 Ų110106.2 Ų106.271%0.71463%0.634SS**  trans-59.9120.7177.825.4-31.8000106.4A124P122-A124 PolarHBondContact O-N 3.3Å
123A55.2Low64.8Low95 Ų9599.9 Ų99.979%0.78561%0.605SS**  trans-45.7119.8165.900000106.2A121 P125A121-A123 PolarHBondContact O-N 3.4Å; A123-P125 VanDerWaalsContact O-N 3.08Å
124A62.5Low67Low92 Ų92101 Ų10176%0.7660%0.6SS**PPolyproline II helixtrans-48.9123.6-168.100000108.7P122 S126P122-A124 PolarHBondContact O-N 3.3Å; A124-S126 PolarHBondContact O-N 3.24Å
125P70.5Confident68.9Low113 Ų113100 Ų10073%0.73459%0.59SS**PPolyproline II helixtrans-58.4129.7-178.724-32.6000107.5A123 A127A123-P125 VanDerWaalsContact O-N 3.08Å; P125-A127 PolarHBondContact O-N 2.98Å; P125-A127 VanDerWaalsContact O-N 3.16Å
126S80Confident71.1Confident76 Ų7694.1 Ų94.153%0.53155%0.552SS.*PPolyproline II helixtrans-53.2124.8174.5550000108.4A124 L128A124-S126 PolarHBondContact O-N 3.24Å; S126-L128 PolarHBondContact O-N 2.97Å
127A87Confident73.3Confident15 Ų1591.1 Ų91.112%0.12454%0.54CS..SBendtrans-69-13.8-179.700000111.9F72 R80 A81 E84 P125F72-A127 VanDerWaalsContact CE1-O 3.25Å; F72-A127 WeakPolarHBondContact CE1-O 3.47Å; R80-A127 HydrophobicContact CB-CB 4.06Å; A81-A127 HydrophobicContact CB-CB 3.9Å; E84-A127 VanDerWaalsContact CD-N 3.34Å; E84-A127 PolarHBondContact OE1-N 2.99Å; E84-A127 PolarHBondContact OE2-N 3.26Å; P125-A127 PolarHBondContact O-N 2.98Å; P125-A127 VanDerWaalsContact O-N 3.16Å
128L89.5Confident75.5Confident4 Ų487.8 Ų87.82%0.02153%0.528CS..SBendtrans-91.2136178-68.8173.6000113.8L69 A81 E84 A85 L88 S126 V132 T133 L136L69-L128 HydrophobicContact CB-CD2 4.01Å; L69-L128 HydrophobicContact CD1-CD2 4.41Å; L69-L128 HydrophobicContact CD2-CD2 3.96Å; L69-L128 HydrophobicContact CG-CD2 4.35Å; A81-L128 HydrophobicContact CB-CD2 3.84Å; A81-L128 HydrophobicContact CB-CG 4.37Å; A81-L128 WeakPolarHBondContact O-CD2 3.48Å; E84-L128 HydrophobicContact CB-CD1 3.61Å; E84-L128 HydrophobicContact CB-CG 4.08Å; E84-L128 PolarHBondContact OE2-N 2.69Å; A85-L128 HydrophobicContact CB-CD1 3.93Å; A85-L128 HydrophobicContact CB-CD2 4.41Å; L88-L128 HydrophobicContact CD1-CD1 4.14Å; S126-L128 PolarHBondContact O-N 2.97Å; L128-V132 HydrophobicContact CD2-CG1 4.33Å; L128-T133 WeakPolarHBondContact CB-OG1 3.5Å; L128-L136 HydrophobicContact CD1-CD1 4.14Å
129P89.5Confident77.9Confident64 Ų6481.9 Ų81.942%0.41650%0.501SS..  trans-60.4139.9166.9-21.932.7000112.1K131 V132 T133P129-K131 PolarHBondContact O-N 3.4Å; P129-K131 VanDerWaalsContact O-N 3.07Å; P129-V132 HydrophobicContact CB-CG2 4.3Å; P129-V132 HydrophobicContact CG-CG2 4.41Å; P129-V132 WeakPolarHBondContact O-CB 3.42Å; P129-V132 PolarHBondContact O-N 3.5Å; P129-T133 PolarHBondContact O-N 2.93Å; P129-T133 VanDerWaalsContact O-N 3.15Å; P129-T133 PolarHBondContact O-OG1 3.29Å
130S90.9Very high80.2Confident92 Ų9275.6 Ų75.664%0.64347%0.468SS*.Hα-helixtrans-53.9-36-175.4-47.80000114.1V132 T133 N134S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 3.06Å; S130-T133 PolarHBondContact O-N 2.94Å; S130-N134 PolarHBondContact O-N 3.07Å; S130-N134 PolarHBondContact O-ND2 3.19Å
131K90.8Very high82.2Confident181 Ų18176.5 Ų76.579%0.78746%0.46SS*.Hα-helixtrans-62.5-41177.4-172.2173-176.4175.60112P129 L135P129-K131 PolarHBondContact O-N 3.4Å; P129-K131 VanDerWaalsContact O-N 3.07Å; K131-L135 PolarHBondContact O-N 3.37Å; K131-L135 VanDerWaalsContact O-N 3.13Å
132V93.1Very high84Confident22 Ų2280.3 Ų80.313%0.13346%0.461CS..Hα-helixtrans-69.8-44.6178.9-179.90000109.7V67 L69 L128 P129 S130 N134 L135 L136V67-V132 HydrophobicContact CG1-CG1 4.17Å; L69-V132 HydrophobicContact CD2-CG1 3.7Å; L128-V132 HydrophobicContact CD2-CG1 4.33Å; P129-V132 HydrophobicContact CB-CG2 4.3Å; P129-V132 HydrophobicContact CG-CG2 4.41Å; P129-V132 WeakPolarHBondContact O-CB 3.42Å; P129-V132 PolarHBondContact O-N 3.5Å; S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 3.06Å; V132-N134 VanDerWaalsContact C-N 3.34Å; V132-N134 PolarHBondContact O-N 2.88Å; V132-L135 WeakPolarHBondContact O-CB 3.29Å; V132-L135 PolarHBondContact O-N 3.32Å; V132-L135 VanDerWaalsContact O-N 3.15Å; V132-L136 HydrophobicContact CG1-CD1 4.06Å; V132-L136 HydrophobicContact CG1-CG 4.38Å; V132-L136 VanDerWaalsContact O-CG 3.29Å; V132-L136 WeakPolarHBondContact O-CG 3.16Å; V132-L136 PolarHBondContact O-N 3.46Å
133T93.2Very high85.8Confident41 Ų4176.8 Ų76.825%0.25244%0.441SS..Hα-helixtrans-55.8-47.1176.1-55.90000112.2L88 L128 P129 S130 L135 L136 L137L88-T133 HydrophobicContact CD1-CG2 3.91Å; L128-T133 WeakPolarHBondContact CB-OG1 3.5Å; P129-T133 PolarHBondContact O-N 2.93Å; P129-T133 VanDerWaalsContact O-N 3.15Å; P129-T133 PolarHBondContact O-OG1 3.29Å; S130-T133 PolarHBondContact O-N 2.94Å; T133-L135 PolarHBondContact O-N 2.87Å; T133-L136 PolarHBondContact O-N 3.47Å; T133-L137 PolarHBondContact O-N 2.92Å
134N92.8Very high87.3Confident97 Ų9780.8 Ų80.852%0.51944%0.436SS..Hα-helixtrans-62.5-41.4177.1-75.7-47.1000112.5S130 V132 L136 L137 L138S130-N134 PolarHBondContact O-N 3.07Å; S130-N134 PolarHBondContact O-ND2 3.19Å; V132-N134 VanDerWaalsContact C-N 3.34Å; V132-N134 PolarHBondContact O-N 2.88Å; N134-L136 PolarHBondContact O-N 3.15Å; N134-L137 PolarHBondContact O-N 3.07Å; N134-L138 WeakPolarHBondContact O-CG 3.49Å; N134-L138 PolarHBondContact O-N 3.18Å
135L91.8Very high88.1Confident74 Ų7478.4 Ų78.439%0.38742%0.421SS..Hα-helixtrans-60.1-45.9176.1-178.967.5000111.6V67 K131 V132 T133 L137 L138 H139V67-L135 HydrophobicContact CG1-CD2 4Å; V67-L135 HydrophobicContact CG2-CD2 4.46Å; K131-L135 PolarHBondContact O-N 3.37Å; K131-L135 VanDerWaalsContact O-N 3.13Å; V132-L135 WeakPolarHBondContact O-CB 3.29Å; V132-L135 PolarHBondContact O-N 3.32Å; V132-L135 VanDerWaalsContact O-N 3.15Å; T133-L135 PolarHBondContact O-N 2.87Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L135-L137 PolarHBondContact O-N 3.1Å; L135-L138 WeakPolarHBondContact O-CB 2.97Å; L135-L138 PolarHBondContact O-N 3.1Å; L135-H139 PolarHBondContact O-CD2 3.25Å; L135-H139 PolarHBondContact O-N 3.29Å; L135-H139 VanDerWaalsContact O-N 3.1Å
136L91Very high88.1Confident0 Ų076.6 Ų76.60%042%0.415CS..Hα-helixtrans-63.6-40.1178.7-62.6169.7000111.5I58 V67 L69 A85 L88 L89 L128 V132 T133 N134 H139 L140I58-L136 HydrophobicContact CG2-CD2 4.31Å; V67-L136 HydrophobicContact CB-CD2 4.17Å; V67-L136 HydrophobicContact CG1-CD2 4.09Å; V67-L136 HydrophobicContact CG2-CD2 4.02Å; L69-L136 HydrophobicContact CD2-CD1 4.26Å; A85-L136 HydrophobicContact CB-CD1 3.63Å; L88-L136 HydrophobicContact CB-CB 4.35Å; L88-L136 HydrophobicContact CD1-CD1 4.21Å; L89-L136 HydrophobicContact CD1-CD2 3.57Å; L89-L136 HydrophobicContact CD2-CB 4.15Å; L89-L136 HydrophobicContact CD2-CD2 3.77Å; L89-L136 HydrophobicContact CG-CB 4.38Å; L89-L136 HydrophobicContact CG-CD2 3.65Å; L128-L136 HydrophobicContact CD1-CD1 4.14Å; V132-L136 HydrophobicContact CG1-CD1 4.06Å; V132-L136 HydrophobicContact CG1-CG 4.38Å; V132-L136 VanDerWaalsContact O-CG 3.29Å; V132-L136 WeakPolarHBondContact O-CG 3.16Å; V132-L136 PolarHBondContact O-N 3.46Å; T133-L136 PolarHBondContact O-N 3.47Å; N134-L136 PolarHBondContact O-N 3.15Å; L136-H139 PolarHBondContact O-N 3.13Å; L136-L140 PolarHBondContact O-N 3.47Å
137L91.6Very high87.2Confident93 Ų9377.4 Ų77.449%0.48742%0.421SS..Hα-helixtrans-65.1-38.9176.9-17461000112.2T133 N134 L135 H139 L140 K141T133-L137 PolarHBondContact O-N 2.92Å; N134-L137 PolarHBondContact O-N 3.07Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L135-L137 PolarHBondContact O-N 3.1Å; L137-H139 VanDerWaalsContact C-N 3.34Å; L137-H139 PolarHBondContact O-N 3Å; L137-L140 HydrophobicContact CD1-CD2 4.43Å; L137-L140 PolarHBondContact O-N 3.02Å; L137-K141 PolarHBondContact O-N 3.32Å
138L90.9Very high85.9Confident115 Ų11580.5 Ų80.560%0.60245%0.446SS*.Hα-helixtrans-61.2-42.1173.4-73169.6000111.6N134 L135 K141 K142N134-L138 WeakPolarHBondContact O-CG 3.49Å; N134-L138 PolarHBondContact O-N 3.18Å; L135-L138 WeakPolarHBondContact O-CB 2.97Å; L135-L138 PolarHBondContact O-N 3.1Å; L138-K141 PolarHBondContact O-N 3.32Å; L138-K142 PolarHBondContact O-N 3.49Å
139H89Confident84.2Confident50 Ų5086 Ų8623%0.23148%0.48CS..Hα-helixtrans-63-44175.7-76-64.2000112.3I65 L89 L135 L136 L137 K141 K142 A143I65-H139 HydrophobicContact CD1-CB 4.2Å; L89-H139 HydrophobicContact CD2-CB 4Å; L135-H139 PolarHBondContact O-CD2 3.25Å; L135-H139 PolarHBondContact O-N 3.29Å; L135-H139 VanDerWaalsContact O-N 3.1Å; L136-H139 PolarHBondContact O-N 3.13Å; L137-H139 VanDerWaalsContact C-N 3.34Å; L137-H139 PolarHBondContact O-N 3Å; H139-K141 VanDerWaalsContact C-N 3.34Å; H139-K141 PolarHBondContact O-N 2.98Å; H139-K142 PolarHBondContact O-N 3.38Å; H139-A143 WeakPolarHBondContact O-CB 3.4Å; H139-A143 PolarHBondContact O-N 3.15Å
140L88.6Confident82.3Confident29 Ų2986.1 Ų86.115%0.15249%0.493CS..Hα-helixtrans-60.6-42.6174.8175.9144.6000111.7L88 L136 L137 K142 A143 R144L88-L140 WeakPolarHBondContact O-CD1 3.32Å; L136-L140 PolarHBondContact O-N 3.47Å; L137-L140 HydrophobicContact CD1-CD2 4.43Å; L137-L140 PolarHBondContact O-N 3.02Å; L140-K142 PolarHBondContact O-N 3.03Å; L140-A143 PolarHBondContact O-N 2.98Å; L140-R144 WeakPolarHBondContact O-CG 3.32Å; L140-R144 PolarHBondContact O-N 3.28Å
141K90Very high80.3Confident161 Ų16187.9 Ų87.970%0.750%0.499SS*.Hα-helixtrans-63-41.4176.9-172.6172.6179.31740111.6L137 L138 H139 R144 G145L137-K141 PolarHBondContact O-N 3.32Å; L138-K141 PolarHBondContact O-N 3.32Å; H139-K141 VanDerWaalsContact C-N 3.34Å; H139-K141 PolarHBondContact O-N 2.98Å; K141-R144 PolarHBondContact O-N 3.03Å; K141-G145 PolarHBondContact O-N 2.81Å; K141-G145 VanDerWaalsContact O-N 3.09Å
142K89Confident78Confident163 Ų16385.6 Ų85.671%0.70950%0.501SS*.Hα-helixtrans-63.2-43.3175.3-174.5176.5-179.5179.10112L138 H139 L140 G145 A146L138-K142 PolarHBondContact O-N 3.49Å; H139-K142 PolarHBondContact O-N 3.38Å; L140-K142 PolarHBondContact O-N 3.03Å; K142-G145 PolarHBondContact O-N 3.43Å; K142-A146 PolarHBondContact O-N 3.41Å; K142-A146 VanDerWaalsContact O-N 3.09Å
143A84.9Confident75.7Confident36 Ų3695.9 Ų95.930%0.29854%0.537SS..Hα-helixtrans-63.6-41.2178.700000112.2Q63 H139 L140 A146 S147Q63-A143 HydrophobicContact CG-CB 4.26Å; H139-A143 WeakPolarHBondContact O-CB 3.4Å; H139-A143 PolarHBondContact O-N 3.15Å; L140-A143 PolarHBondContact O-N 2.98Å; A143-A146 PolarHBondContact O-N 3.06Å; A143-S147 PolarHBondContact O-N 3.02Å
144R85.8Confident73Confident179 Ų179103 Ų10368%0.67557%0.567SS**Hα-helixtrans-64.7-39.2175-71.9-179.4175.7-176.1-0.6112.7L140 K141 S147 A148L140-R144 WeakPolarHBondContact O-CG 3.32Å; L140-R144 PolarHBondContact O-N 3.28Å; K141-R144 PolarHBondContact O-N 3.03Å; R144-S147 PolarHBondContact O-N 3.45Å; R144-A148 PolarHBondContact O-N 3.44Å
145G80Confident70.7Confident42 Ų42102.7 Ų102.743%0.43358%0.578SS.*Hα-helixtrans-64.6-38.8176.200000113.3K141 K142 A148K141-G145 PolarHBondContact O-N 2.81Å; K141-G145 VanDerWaalsContact O-N 3.09Å; K142-G145 PolarHBondContact O-N 3.43Å; G145-A148 PolarHBondContact O-N 2.92Å
146A71.3Confident68.5Low74 Ų74105 Ų10561%0.61260%0.598SS**Hα-helixtrans-67.7-35.6176.900000112.7K142 A143 A148K142-A146 PolarHBondContact O-N 3.41Å; K142-A146 VanDerWaalsContact O-N 3.09Å; A143-A146 PolarHBondContact O-N 3.06Å; A146-A148 VanDerWaalsContact C-N 3.31Å; A146-A148 PolarHBondContact O-N 2.97Å
147S60.7Low65.9Low93 Ų93109.9 Ų109.965%0.6564%0.638SS**Hα-helixtrans-70.7-24.2179.4-168.70000113.7A143 R144 V149A143-S147 PolarHBondContact O-N 3.02Å; R144-S147 PolarHBondContact O-N 3.45Å; S147-V149 VanDerWaalsContact C-N 3.35Å
148A58.9Low64.2Low80 Ų80114.6 Ų114.666%0.66166%0.658SS**Hα-helixtrans-76.9-18.8-177.700000113.7R144 G145 A146R144-A148 PolarHBondContact O-N 3.44Å; G145-A148 PolarHBondContact O-N 2.92Å; A146-A148 VanDerWaalsContact C-N 3.31Å; A146-A148 PolarHBondContact O-N 2.97Å
149V54.8Low61.9Low120 Ų120116.8 Ų116.873%0.72766%0.664SS**THydrogen-bonded Turntrans-85.9-9.5-175.9-176.40000112.6S147S147-V149 VanDerWaalsContact C-N 3.35Å
150G49.6Very low59.8Low67 Ų67123.2 Ų123.269%0.69169%0.694SS**THydrogen-bonded Turntrans-90.43.6-173.300000117.3
151V47.6Very low57.8Low128 Ų128128 Ų12878%0.77672%0.716SS**  trans-114.870-177.3-168.30000110.6
152T43.1Very low55.6Low133 Ų133129 Ų12982%0.81672%0.723SS**  trans-127.782.9155.227.70000106.5
153R45.1Very low53.2Low238 Ų238124.8 Ų124.890%0.89873%0.726SS**  trans-92107.4172.7-177.7173.6160.3147.8-4.4107.8
154E37.3Very low51.1Low190 Ų190134.3 Ų134.389%0.88876%0.756SS**  trans-42131.8164.4-64.2-117.2144.900111.6
155A43.9Very low49Very low91 Ų91129.4 Ų129.475%0.75276%0.761SS**  trans-125.6133.4167.200000109
156P44.4Very low47Very low123 Ų123131.3 Ų131.380%0.79978%0.781SS**  trans-84.5149.5-159.233.3-35.7000114
157A36.3Very low45.4Very low102 Ų102132 Ų13284%0.84380%0.795SS**  trans-61.6126.1177.200000113.1
158Q56.2Low44.3Very low192 Ų192131.3 Ų131.390%0.89780%0.803SS**  trans-121.8100.5160.5-72.5-160.1-3200110.9H160Q158-H160 PolarHBondContact O-N 3.08Å
159H42.9Very low43.3Very low161 Ų161131.6 Ų131.675%0.74581%0.813SS**  trans-5.6107.1145.3-166.3-96.4000117.3
160H45.1Very low42.5Very low185 Ų185130 Ų13086%0.85682%0.822SS**  trans-145.7126.7148.6-159.273.2000110.8Q158Q158-H160 PolarHBondContact O-N 3.08Å
161Q45.9Very low42.2Very low129 Ų129130.2 Ų130.260%0.60382%0.823SS**  trans-77.5163.4-177.5-69.1-178.920.600111.8
162Q44.3Very low42.4Very low183 Ų183130.4 Ų130.486%0.85583%0.827SS**  trans101.7111.1142.4-135.8154.945.200116.4
163G38.5Very low42.5Very low75 Ų75132.2 Ų132.277%0.77383%0.826SS**  trans155.690.4166.700000113.6
164Y41.9Very low42.6Very low235 Ų235130.2 Ų130.292%0.92283%0.827SS**  trans-69.3147.6176.8-62.9-99.6000112.2
165G40.3Very low42.8Very low77 Ų77130.3 Ų130.379%0.79482%0.821SS**  trans14286.1151.400000117.7
166G38.8Very low42.9Very low81 Ų81130.5 Ų130.584%0.83582%0.817SS**  66.5114.8122.800000122.4
167G37.9Very low42.8Very low88 Ų88132.4 Ų132.491%0.90781%0.813SS**  trans73.5136.6142.400000116.6
168G37.1Very low43.5Very low80 Ų80135.6 Ų135.683%0.82581%0.81SS**  cis143123.716.300000107.4
169G37.8Very low43Very low85 Ų85131.1 Ų131.188%0.87680%0.796SS**  trans85.3129.217500000113.7
170G38.1Very low42.9Very low88 Ų88130.7 Ų130.791%0.90780%0.799SS**  cis118.698.824.300000108.5
171G43.1Very low43.2Very low70 Ų70128.8 Ų128.872%0.72280%0.795SS**  trans160.8125.8172.800000112.6
172P52.7Low43.2Very low132 Ų132132.4 Ų132.486%0.85781%0.809SS**  trans-79.3143.7-163.232.2-34.7000113.5E174P172-E174 PolarHBondContact O-N 3.1Å
173E45.3Very low43Very low171 Ų171132.1 Ų132.180%0.79981%0.813SS**  trans-66.5122.6177.5-62.4-164.8164.700112.7Y175E173-Y175 PolarHBondContact O-N 3.1Å
174E47.4Very low43.5Very low197 Ų197133.4 Ų133.492%0.92181%0.81SS**  trans-75.393.3152.3-80.6-175.5142.100108.3P172 S176P172-E174 PolarHBondContact O-N 3.1Å; E174-S176 PolarHBondContact O-N 2.86Å
175Y40.8Very low43.6Very low191 Ų191131.6 Ų131.675%0.74980%0.803SS**  trans-87.291.7172.7-159.2-96.2000110.1E173 F177E173-Y175 PolarHBondContact O-N 3.1Å; Y175-F177 PolarHBondContact O-N 2.96Å
176S46.3Very low43.8Very low96 Ų96134.5 Ų134.567%0.67180%0.8SS**  trans-67113.3166.5-178.90000109.7E174 Q178E174-S176 PolarHBondContact O-N 2.86Å; S176-Q178 PolarHBondContact O-N 3.36Å; S176-Q178 VanDerWaalsContact O-N 3.15Å
177F43.2Very low43.7Very low162 Ų162135.3 Ų135.371%0.71179%0.793SS**  trans-74.594.7175.5-176.8-110.9000109.6Y175 V179Y175-F177 PolarHBondContact O-N 2.96Å; F177-V179 HydrophobicContact CD1-CG1 3.71Å; F177-V179 HydrophobicContact CE1-CB 4.41Å; F177-V179 HydrophobicContact CE1-CG1 3.09Å; F177-V179 HydrophobicContact CE2-CG1 4.22Å; F177-V179 HydrophobicContact CZ-CG1 3.38Å
178Q50.2Low44.2Very low170 Ų170136 Ų13679%0.79478%0.78SS**  trans-84.9116.2167.5-80.8177-16.200109.3S176S176-Q178 PolarHBondContact O-N 3.36Å; S176-Q178 VanDerWaalsContact O-N 3.15Å
179V46.3Very low44.4Very low98 Ų98137.3 Ų137.359%0.59478%0.777SS**  trans-102.286172.7-82.50000108.8F177F177-V179 HydrophobicContact CD1-CG1 3.71Å; F177-V179 HydrophobicContact CE1-CB 4.41Å; F177-V179 HydrophobicContact CE1-CG1 3.09Å; F177-V179 HydrophobicContact CE2-CG1 4.22Å; F177-V179 HydrophobicContact CZ-CG1 3.38Å
180D41Very low45.1Very low152 Ų152140.1 Ų140.181%0.81377%0.771SS**  trans-141140.2167.1-72.9-63.5000109
181D50.6Low45.7Very low144 Ų144143.4 Ų143.477%0.7776%0.763SS**  trans93.167.8161.7-138.634.6000119.1
182F45.6Very low45.8Very low206 Ų206148.7 Ų148.790%0.90477%0.769SS**  trans-140.229.6149.5-154.2-103.9000113.6
183L40.6Very low45Very low176 Ų176145.9 Ų145.992%0.92176%0.764SS**  trans-117.883.7167.7-65.2-178.7000109.3
184S48.2Very low44.7Very low103 Ų103144.9 Ų144.972%0.7277%0.769SS**  trans-151.492.6167.5174.20000106.5
185Y43.7Very low44.2Very low196 Ų196141.4 Ų141.477%0.76976%0.761SS**  60.794.592.6-159.7-90.4000112.5
186D44.3Very low44.3Very low138 Ų138138.4 Ų138.474%0.73876%0.763SS**  trans-148109.2137.8-157.31000110.2T188D186-T188 PolarHBondContact OD1-OG1 3.49Å
187S37.1Very low44.1Very low98 Ų98141.5 Ų141.569%0.68576%0.764SS**  trans-14296.2168.2-142.70000104.6
188T48.6Very low44Very low102 Ų102140.3 Ų140.363%0.62676%0.76SS**  trans-126111.2167.646.60000107.6D186D186-T188 PolarHBondContact OD1-OG1 3.49Å
189S42.5Very low43.7Very low109 Ų109137.5 Ų137.576%0.76275%0.747SS**  trans-88.7127.4166.9-59.70000107
190D51.1Low43.8Very low143 Ų143141.2 Ų141.277%0.76576%0.758SS**  trans-123.497.8166-81.2-61000110.4
191E50.4Low43.8Very low157 Ų157137.5 Ų137.573%0.73476%0.756SS**  57.1111.5118.5-36.4-131.713100120.8
192H45.4Very low43.8Very low181 Ų181136.6 Ų136.684%0.83876%0.76SS**  55.489128.4-67.8-75000121.3
193G36.4Very low43.4Very low74 Ų74132.9 Ų132.976%0.76376%0.755SS**  56.3117.3110.400000121.2
194V39Very low43.1Very low150 Ų150129.6 Ų129.691%0.90975%0.745SS**  trans-149.1134.2141165.40000110.3
195V36Very low42.9Very low123 Ų123129.6 Ų129.675%0.74575%0.746SS**  trans-55.9148.1174.1167.50000113.7
196V43.5Very low42.7Very low129 Ų129127.1 Ų127.178%0.78274%0.741SS**  176.9104.8122.4177.80000110.5
197K43.2Very low42.6Very low161 Ų161127.5 Ų127.570%0.774%0.738SS**  41.8147.2119.1-134.3177.9-179.3-174.70123.2
198H41Very low43.1Very low136 Ų136129.6 Ų129.663%0.6375%0.747SS**  trans88.6140.9164.4-75-94.9000117.1
199E42.8Very low43.1Very low111 Ų111133.4 Ų133.452%0.51976%0.758SS.*  cis176.3141.2-25.7-110.9158.4-125.700105
200E47.9Very low44Very low177 Ų177136.2 Ų136.283%0.82776%0.764SS**  trans53.3117157.55.2-167.1159.100118
201G42Very low44Very low74 Ų74136.7 Ų136.776%0.76377%0.767SS**  121.616362.100000108.6
202S49.6Very low44Very low124 Ų124132.8 Ų132.887%0.86777%0.769SS**  trans113.8131.8165-151.80000116.8
203T38.7Very low44.4Very low128 Ų128130.6 Ų130.679%0.78576%0.763SS**  trans-116.1179.1-157.250.80000110.8
204C34.8Very low45Very low107 Ų107135.2 Ų135.272%0.72377%0.765SS**  trans97.7103.2161.7-1440000113.7
205S42.6Very low45.5Very low104 Ų104131.3 Ų131.373%0.72776%0.755SS**  70.914294.2-44.70000111.2
206Q39.9Very low45.9Very low143 Ų143133.9 Ų133.967%0.66876%0.759SS**  cis176141.741-167.7159.3-12.600107.7
207E42.9Very low46.2Very low147 Ų147133.7 Ų133.769%0.68776%0.758SS**  trans49131.7143.3-60.3158.2-157.800122.5
208T47.8Very low46.4Very low142 Ų142131.5 Ų131.587%0.87176%0.758SS**  -176.9152.899.425.20000112.5
209E48Very low46.9Very low181 Ų181131 Ų13185%0.84676%0.764SS**  trans-92.9156.4-164.3-54.4162.2146.900111.5
210D61.5Low47.1Very low169 Ų169129.8 Ų129.890%0.90477%0.773SS**  trans-157.6130.8153.4-161.145000111
211D50.7Low46.9Very low153 Ų153127.2 Ų127.282%0.81877%0.773SS**  trans-101.3162.3-167.7-80.5-68.7000113.5
212G50.3Low47.3Very low75 Ų75132.6 Ų132.677%0.77378%0.776SS**  trans113.3142.2159.600000114
213D53.8Low47Very low134 Ų134135.1 Ų135.172%0.71777%0.774SS**  cis-171163.64.4-176.234.1000107.6
214E50.2Low47.7Very low171 Ų171134.9 Ų134.980%0.79977%0.772SS**  trans-42.1147.1-171.547.4-126.7170.900121.9
215G48.1Very low48.4Very low69 Ų69136.5 Ų136.571%0.71177%0.773SS**  trans-162.375.8173.800000112.6V217G215-V217 PolarHBondContact O-N 2.95Å
216E45.4Very low48.7Very low176 Ų176139 Ų13982%0.82278%0.779SS**  trans-55.2119.2170.4-176.2-170.2160.300111.4V218E216-V218 HydrophobicContact CG-CG2 4.19Å
217V50.2Low49.4Very low126 Ų126137.9 Ų137.976%0.76478%0.781SS**  trans-126.797.8167.6-154.20000109.3G215 V219G215-V217 PolarHBondContact O-N 2.95Å; V217-V219 PolarHBondContact O-N 3.48Å
218V46.8Very low50Low114 Ų114138.3 Ų138.369%0.69179%0.789SS**  trans-63.5108.8171-179.30000108.8E216E216-V218 HydrophobicContact CG-CG2 4.19Å
219V50.5Low50.7Low127 Ų127135.3 Ų135.377%0.7778%0.778SS**  trans-102.9104.8168.2-174.40000108V217 C221V217-V219 PolarHBondContact O-N 3.48Å; V219-C221 PolarHBondContact O-N 2.9Å
220A46.8Very low51.7Low85 Ų85132.4 Ų132.470%0.70278%0.775SS**  trans-51.5116.5-178.500000112.3K222A220-K222 PolarHBondContact O-N 3.32Å; A220-K222 VanDerWaalsContact O-N 3.14Å
221C44.7Very low51.5Low123 Ų123131.6 Ų131.683%0.83177%0.77SS**  trans-65.7107.1158.2-59.70000107.1V219 E223V219-C221 PolarHBondContact O-N 2.9Å; C221-E223 PolarHBondContact O-N 3.39Å
222K50.2Low52.3Low186 Ų186131.3 Ų131.381%0.80977%0.768SS**  trans-73.298169.9-169.8158.7-179.8155.80107.4A220 V224A220-K222 PolarHBondContact O-N 3.32Å; A220-K222 VanDerWaalsContact O-N 3.14Å; K222-V224 PolarHBondContact O-N 3.44Å
223E44Very low52.8Low177 Ų177135.4 Ų135.483%0.82777%0.765SS**  trans-49.6119.9161.1-67.7178.6145.700107.7C221C221-E223 PolarHBondContact O-N 3.39Å
224V52.8Low53.1Low123 Ų123130.1 Ų130.175%0.74574%0.742SS**  trans-104.7102.7165.3-83.90000105.4K222 D226K222-V224 PolarHBondContact O-N 3.44Å; V224-D226 PolarHBondContact O-N 3.31Å
225D50.3Low53.7Low142 Ų142130.9 Ų130.976%0.75974%0.743SS**  trans-48.5119.6170.5-90.8-77.2000110.6T227D225-T227 VanDerWaalsContact C-N 3.26Å; D225-T227 HydrophobicContact CB-CG2 4.43Å; D225-T227 PolarHBondContact O-N 3.02Å
226D49.1Very low54.1Low156 Ų156134.9 Ų134.983%0.83475%0.745SS**  trans-6784.6161.8-72.4-61000108.5V224 D228V224-D226 PolarHBondContact O-N 3.31Å; D226-D228 PolarHBondContact O-N 3.43Å
227T52.9Low54.9Low119 Ų119133.3 Ų133.373%0.7374%0.742SS**  trans-8488.3165.449.70000109.4D225 A229D225-T227 VanDerWaalsContact C-N 3.26Å; D225-T227 HydrophobicContact CB-CG2 4.43Å; D225-T227 PolarHBondContact O-N 3.02Å; T227-A229 PolarHBondContact O-N 3.23Å
228D57Low55Low157 Ų157135.9 Ų135.984%0.8474%0.743SS**  trans-64.678.7160.4-78.9-53.6000109.3D226D226-D228 PolarHBondContact O-N 3.43Å
229A61.2Low55.2Low78 Ų78141.4 Ų141.465%0.64575%0.752SS**  trans-78.3123.3167.100000108.6T227 L231T227-A229 PolarHBondContact O-N 3.23Å; A229-L231 PolarHBondContact O-N 2.92Å
230P69.3Low55.3Low121 Ų121141.3 Ų141.379%0.78675%0.754SS**  trans-59.9129.6174.324.5-31.8000109.3D232P230-D232 PolarHBondContact O-N 3.05Å
231L57.1Low55.3Low151 Ų151142.5 Ų142.579%0.79176%0.757SS**  trans-59.6104.8173.9-66.3172.8000108.8A229 F233A229-L231 PolarHBondContact O-N 2.92Å; L231-F233 WeakPolarHBondContact O-CD2 3.49Å; L231-F233 PolarHBondContact O-N 3.35Å
232D67.9Low55.3Low147 Ų147143 Ų14379%0.78676%0.758SS**  trans-73.1112.1174.9179.317.6000109.5P230 G234P230-D232 PolarHBondContact O-N 3.05Å; D232-G234 PolarHBondContact O-N 3.22Å; D232-G234 VanDerWaalsContact O-N 3.1Å; D232-G234 PolarHBondContact OD1-N 3.39Å; D232-G234 VanDerWaalsContact OD1-N 3.1Å
233F61.4Low55Low162 Ų162139 Ų13971%0.71176%0.76SS**  trans-75.820.3176-68.3-83.3000113.1L231 F235 M236L231-F233 WeakPolarHBondContact O-CD2 3.49Å; L231-F233 PolarHBondContact O-N 3.35Å; F233-F235 PolarHBondContact O-N 3Å; F233-M236 PolarHBondContact O-N 3Å
234G58.5Low54.9Low22 Ų22134.4 Ų134.423%0.22776%0.76CS.*THydrogen-bonded Turntrans-57.2-4.7177.600000116D232 M236D232-G234 PolarHBondContact O-N 3.22Å; D232-G234 VanDerWaalsContact O-N 3.1Å; D232-G234 PolarHBondContact OD1-N 3.39Å; D232-G234 VanDerWaalsContact OD1-N 3.1Å; G234-M236 VanDerWaalsContact C-N 3.31Å
235F63.2Low54.3Low187 Ų187131.9 Ų131.982%0.8276%0.759SS**THydrogen-bonded Turntrans-65.5-28.3166.1159.6-104.2000113.1F233F233-F235 PolarHBondContact O-N 3Å
236M56.7Low53.6Low154 Ų154133.1 Ų133.176%0.75977%0.766SS**SBendtrans-80-17.4179.9-64.7-169.680.300113.9F233 G234F233-M236 PolarHBondContact O-N 3Å; G234-M236 VanDerWaalsContact C-N 3.31Å
237D61.5Low53.6Low143 Ų143130.3 Ų130.377%0.76576%0.764SS**SBendtrans-97.4-5.6-176.7-80.4-30.2000114.3R239D237-R239 PolarHBondContact O-N 3.4Å
238K53.5Low53Low180 Ų180133.1 Ų133.178%0.78378%0.775SS**  trans-79.987.3176-68.1-161.9-178.4-174.80111P240K238-P240 WeakPolarHBondContact O-CD 3.39Å
239R50.9Low52.2Low230 Ų230129.1 Ų129.187%0.86877%0.771SS**PPolyproline II helixtrans-62.3121.9160.7-69.2-165.1-172-153.43.5109.1D237 S241D237-R239 PolarHBondContact O-N 3.4Å; R239-S241 PolarHBondContact O-N 3.41Å; R239-S241 VanDerWaalsContact O-N 3.15Å
240P52.9Low51.2Low125 Ų125130.7 Ų130.781%0.81278%0.784SS**PPolyproline II helixtrans-64.3117.7169.824.5-29.1000108.7K238K238-P240 WeakPolarHBondContact O-CD 3.39Å
241S47.2Very low50Low110 Ų110129.6 Ų129.677%0.76979%0.785SS**PPolyproline II helixtrans-66.9135.2171.7-70.70000109.5R239 A243R239-S241 PolarHBondContact O-N 3.41Å; R239-S241 VanDerWaalsContact O-N 3.15Å; S241-A243 PolarHBondContact O-N 3.09Å
242P44.9Very low49.4Very low132 Ų132125.5 Ų125.586%0.85778%0.779SS**  trans-79.6110.9-17731.2-30.8000109.4
243A43.7Very low48.3Very low103 Ų103127.4 Ų127.485%0.85179%0.788SS**  trans-98.9103.4169.600000109.5S241S241-A243 PolarHBondContact O-N 3.09Å
244G40.7Very low48Very low80 Ų80124.8 Ų124.883%0.82577%0.774SS**  trans87.1125.5149.800000118
245G39.8Very low47.9Very low70 Ų70126.2 Ų126.272%0.72278%0.781SS**  trans112.583.6149.800000116.1
246D37Very low47.5Very low168 Ų168121.3 Ų121.390%0.89877%0.768SS**  trans24.3105.9134.1-48-42.1000118.3
247A48.9Very low47.3Very low98 Ų98120.7 Ų120.781%0.8176%0.761SS**  trans172.1130.1133.100000110.6G249A247-G249 PolarHBondContact O-N 3.31Å
248D38.8Very low47.3Very low177 Ų177118.7 Ų118.795%0.94775%0.747SS**  trans-49.7124.6174.7-61.6-68.7000113.5
249G40.9Very low47.4Very low73 Ų73115 Ų11575%0.75373%0.734SS**  trans172.999.3173.100000113.3A247 A251A247-G249 PolarHBondContact O-N 3.31Å; G249-A251 PolarHBondContact O-N 3.03Å
250A39.3Very low47.6Very low112 Ų112107.2 Ų107.293%0.92671%0.712SS**  trans-64.1115.4178.300000112.7
251A45Very low47.8Very low97 Ų97104.8 Ų104.880%0.80270%0.702SS**  trans-166.688.7158.300000107.6G249G249-A251 PolarHBondContact O-N 3.03Å
252G44.1Very low48.4Very low65 Ų65102.7 Ų102.767%0.6769%0.692SS**  7597.961.200000107.7Y254G252-Y254 PolarHBondContact O-N 3.47Å
253L44.7Very low49.1Very low188 Ų188103.4 Ų103.498%0.98469%0.689SS**  trans-4899.2178.3-67.6160.7000110.2
254Y55.8Low49.7Very low106 Ų106104 Ų10442%0.41668%0.677SS.*  trans-79.1123.3-171-162.9-121.3000109.7G252 E258 M259G252-Y254 PolarHBondContact O-N 3.47Å; Y254-E258 HydrophobicContact CD1-CB 4.24Å; Y254-E258 HydrophobicContact CD2-CB 3.89Å; Y254-E258 HydrophobicContact CD2-CG 4.01Å; Y254-E258 WeakPolarHBondContact CD2-OE2 3.35Å; Y254-E258 VanDerWaalsContact CE1-C 3.41Å; Y254-E258 HydrophobicContact CE1-CB 3.84Å; Y254-E258 HydrophobicContact CE1-CG 4.46Å; Y254-E258 HydrophobicContact CE2-CB 3.43Å; Y254-E258 VanDerWaalsContact CE2-CB 3.43Å; Y254-E258 HydrophobicContact CE2-CG 3.27Å; Y254-E258 VanDerWaalsContact CE2-OE2 3.24Å; Y254-E258 WeakPolarHBondContact CE2-OE2 3.4Å; Y254-E258 HydrophobicContact CG-CB 4.27Å; Y254-E258 PolarHBondContact OH-O 3.33Å; Y254-M259 HydrophobicContact CD1-CB 4.1Å; Y254-M259 HydrophobicContact CD1-CE 4.21Å; Y254-M259 HydrophobicContact CD1-CG 3.75Å; Y254-M259 HydrophobicContact CE1-CB 3.74Å; Y254-M259 HydrophobicContact CE1-CG 3.55Å
255S55.4Low49.8Very low53 Ų53102.8 Ų102.837%0.37166%0.664SS.*  trans-66.6136.3179.7-1800000109.4F257 E258S255-F257 PolarHBondContact O-N 2.9Å; S255-E258 VanDerWaalsContact O-CB 3.31Å; S255-E258 WeakPolarHBondContact O-CB 3.22Å; S255-E258 PolarHBondContact O-N 3.24Å
256P55.9Low50.1Low83 Ų83107.4 Ų107.454%0.53967%0.672SS.*Hα-helixtrans-52.5-24.2175.8-28.235.1000114.3V260P256-V260 WeakPolarHBondContact O-CG2 3.48Å
257F52.4Low50.7Low142 Ų142105.4 Ų105.462%0.62367%0.666SS**Hα-helixtrans-70.3-29.2174-67.3-81.6000113.5S255 A261S255-F257 PolarHBondContact O-N 2.9Å; F257-A261 PolarHBondContact O-N 3.49Å; F257-A261 VanDerWaalsContact O-N 3.17Å
258E60.4Low50.3Low100 Ų100108 Ų10847%0.46767%0.667SS.*Hα-helixtrans-78.3-35.9-176.7-144.5176.5175.900110.5Y254 S255 V260 A261 A262Y254-E258 HydrophobicContact CD1-CB 4.24Å; Y254-E258 HydrophobicContact CD2-CB 3.89Å; Y254-E258 HydrophobicContact CD2-CG 4.01Å; Y254-E258 WeakPolarHBondContact CD2-OE2 3.35Å; Y254-E258 VanDerWaalsContact CE1-C 3.41Å; Y254-E258 HydrophobicContact CE1-CB 3.84Å; Y254-E258 HydrophobicContact CE1-CG 4.46Å; Y254-E258 HydrophobicContact CE2-CB 3.43Å; Y254-E258 VanDerWaalsContact CE2-CB 3.43Å; Y254-E258 HydrophobicContact CE2-CG 3.27Å; Y254-E258 VanDerWaalsContact CE2-OE2 3.24Å; Y254-E258 WeakPolarHBondContact CE2-OE2 3.4Å; Y254-E258 HydrophobicContact CG-CB 4.27Å; Y254-E258 PolarHBondContact OH-O 3.33Å; S255-E258 VanDerWaalsContact O-CB 3.31Å; S255-E258 WeakPolarHBondContact O-CB 3.22Å; S255-E258 PolarHBondContact O-N 3.24Å; E258-V260 VanDerWaalsContact C-N 3.31Å; E258-V260 PolarHBondContact O-N 3.33Å; E258-A261 WeakPolarHBondContact O-CB 3.46Å; E258-A261 PolarHBondContact O-N 3.34Å; E258-A262 PolarHBondContact O-N 3.5Å
259M55.9Low50.4Low102 Ų102104.3 Ų104.350%0.50266%0.66SS.*Hα-helixtrans-60.7-39.4171.7-115.4177.9-56.300112.3Y254 A262 D263Y254-M259 HydrophobicContact CD1-CB 4.1Å; Y254-M259 HydrophobicContact CD1-CE 4.21Å; Y254-M259 HydrophobicContact CD1-CG 3.75Å; Y254-M259 HydrophobicContact CE1-CB 3.74Å; Y254-M259 HydrophobicContact CE1-CG 3.55Å; M259-A262 PolarHBondContact O-N 2.95Å; M259-D263 PolarHBondContact O-N 3.44Å; M259-D263 VanDerWaalsContact O-N 3.12Å
260V56.7Low50.7Low68 Ų68106.7 Ų106.741%0.41266%0.66SS.*Hα-helixtrans-74.7-29.6178.4176.30000111.4P256 E258 L264P256-V260 WeakPolarHBondContact O-CG2 3.48Å; E258-V260 VanDerWaalsContact C-N 3.31Å; E258-V260 PolarHBondContact O-N 3.33Å; V260-L264 HydrophobicContact CG1-CD1 3.64Å; V260-L264 HydrophobicContact CG1-CG 4.41Å; V260-L264 WeakPolarHBondContact O-CB 3.35Å; V260-L264 WeakPolarHBondContact O-CG 3.49Å; V260-L264 PolarHBondContact O-N 2.95Å; V260-L264 VanDerWaalsContact O-N 3.09Å
261A56.7Low50.9Low73 Ų73107.8 Ų107.860%0.60365%0.646SS**Hα-helixtrans-71.6-29.7172.400000112.7F257 E258F257-A261 PolarHBondContact O-N 3.49Å; F257-A261 VanDerWaalsContact O-N 3.17Å; E258-A261 WeakPolarHBondContact O-CB 3.46Å; E258-A261 PolarHBondContact O-N 3.34Å
262A58.9Low51.1Low67 Ų67109 Ų10955%0.55464%0.636SS**Hα-helixtrans-76.9-32.4174.400000113.3E258 M259E258-A262 PolarHBondContact O-N 3.5Å; M259-A262 PolarHBondContact O-N 2.95Å
263D59.2Low51.2Low147 Ų147112.2 Ų112.279%0.78663%0.634SS**Hα-helixtrans-86.8-19.3180-84.5-13.5000114.1M259 G265M259-D263 PolarHBondContact O-N 3.44Å; M259-D263 VanDerWaalsContact O-N 3.12Å; D263-G265 VanDerWaalsContact C-N 3.34Å; D263-G265 PolarHBondContact O-N 2.99Å
264L58.3Low51.1Low115 Ų115108.9 Ų108.960%0.60262%0.623SS**SBendtrans-91.470.1171.3-73.4165.5000109.9V260 D266V260-L264 HydrophobicContact CG1-CD1 3.64Å; V260-L264 HydrophobicContact CG1-CG 4.41Å; V260-L264 WeakPolarHBondContact O-CB 3.35Å; V260-L264 WeakPolarHBondContact O-CG 3.49Å; V260-L264 PolarHBondContact O-N 2.95Å; V260-L264 VanDerWaalsContact O-N 3.09Å; L264-D266 PolarHBondContact O-N 2.95Å
265G42.4Very low50.6Low55 Ų55111 Ų11157%0.56764%0.642SS**  trans-54123.7172.600000112.3D263 V267D263-G265 VanDerWaalsContact C-N 3.34Å; D263-G265 PolarHBondContact O-N 2.99Å; G265-V267 PolarHBondContact O-N 2.67Å
266D46Very low50Low166 Ų166114.4 Ų114.489%0.88866%0.662SS**SBendtrans45.350.5139.9-115.82.8000117.1L264L264-D266 PolarHBondContact O-N 2.95Å
267V48.2Very low49.5Very low126 Ų126116.7 Ų116.776%0.76468%0.675SS**SBendtrans-139.2109.4161.9-73.10000109.7G265G265-V267 PolarHBondContact O-N 2.67Å
268D42.4Very low48.7Very low154 Ų154120.9 Ų120.982%0.82469%0.688SS**  trans55.965.3178.5-63-31.1000115.8V270D268-V270 PolarHBondContact O-N 2.8Å
269A39.1Very low47.6Very low98 Ų98119.3 Ų119.381%0.8170%0.698SS**  trans-6077.7147.800000109.4E271A269-E271 PolarHBondContact O-N 3.1Å
270V47.9Very low47.1Very low124 Ų124120.3 Ų120.375%0.75272%0.716SS**  trans-70.684.3154.2-179.10000105.3D268 M272D268-V270 PolarHBondContact O-N 2.8Å; V270-M272 PolarHBondContact O-N 3.4Å
271E44.4Very low46.2Very low135 Ų135126.4 Ų126.463%0.63174%0.739SS**  trans-16.793.3158.7-165.2-176.5159.300110.9A269 Q273A269-E271 PolarHBondContact O-N 3.1Å; E271-Q273 HydrophobicContact CG-CG 3.69Å; E271-Q273 PolarHBondContact O-N 2.98Å; E271-Q273 WeakPolarHBondContact OE1-CG 3.48Å; E271-Q273 PolarHBondContact OE1-NE2 3.45Å
272M48.8Very low45.5Very low121 Ų121126.4 Ų126.460%0.59675%0.747SS**  trans-70.482162.2-84.3-77.6-174.600105.3V270 R296V270-M272 PolarHBondContact O-N 3.4Å; M272-R296 HydrophobicContact CE-CG 4.46Å; M272-R296 PolarHBondContact SD-NH2 3.34Å
273Q46.3Very low44.7Very low133 Ų133128.9 Ų128.962%0.62177%0.767SS**  trans-51.9133.2179.6-82.1-161.44.200109.5E271 L275E271-Q273 HydrophobicContact CG-CG 3.69Å; E271-Q273 PolarHBondContact O-N 2.98Å; E271-Q273 WeakPolarHBondContact OE1-CG 3.48Å; E271-Q273 PolarHBondContact OE1-NE2 3.45Å; Q273-L275 PolarHBondContact O-N 3.16Å
274P42.2Very low44.2Very low118 Ų118125.1 Ų125.177%0.76676%0.763SS**  trans-58.7133.4172.6-13.826.9000108.6
275L46.2Very low44Very low152 Ų152126.6 Ų126.680%0.79677%0.767SS**  trans-18.9117.4170.8-151.596.7000113.8Q273 T277Q273-L275 PolarHBondContact O-N 3.16Å; L275-T277 PolarHBondContact O-N 3Å; L275-T277 VanDerWaalsContact O-N 3.16Å
276P42.2Very low44.7Very low123 Ų123128.9 Ų128.980%0.79977%0.772SS**  trans-64.4122.5166.524.8-29.5000108.4Y278P276-Y278 PolarHBondContact O-N 3.19Å
277T44.5Very low45.7Very low132 Ų132124.3 Ų124.381%0.8175%0.753SS**  trans-61.8127.5176-63.40000109.8L275L275-T277 PolarHBondContact O-N 3Å; L275-T277 VanDerWaalsContact O-N 3.16Å
278Y36.8Very low46.8Very low230 Ų230121.4 Ų121.490%0.90274%0.742SS**SBendtrans7.6116.8161.4-156-95.4000118.2P276P276-Y278 PolarHBondContact O-N 3.19Å
279G36.7Very low48.4Very low66 Ų66117.1 Ų117.168%0.6873%0.728SS**  trans161.7127.3156.400000114.2
280S45.5Very low50.1Low124 Ų124116.9 Ų116.987%0.86771%0.712SS**  trans92.298.5164.9-153.30000117.4
281E37.4Very low51.7Low195 Ų195116.8 Ų116.891%0.91170%0.703SS**  trans-19.6121.8152.7-49-172148.400115
282G42.7Very low53.4Low73 Ų73113.2 Ų113.275%0.75369%0.687SS**  trans-17796.7174.600000110.2G284G282-G284 PolarHBondContact O-N 2.9Å
283A41.2Very low55.1Low119 Ų119111.9 Ų111.998%0.98369%0.685SS**  trans-59.999.5178.900000111.2
284G48.6Very low56.8Low68 Ų68110.2 Ų110.270%0.70168%0.678SS**  trans-146.793.4-178.900000112.2G282G282-G284 PolarHBondContact O-N 2.9Å
285E54Low58.8Low146 Ų146110.7 Ų110.768%0.68267%0.668SS**  trans40.8106.8164.7-73.8-143116.900121S287 A288E285-S287 PolarHBondContact O-N 3.06Å; E285-A288 PolarHBondContact O-N 2.99Å
286P58.7Low60.8Low104 Ų104109.2 Ų109.268%0.67565%0.652SS**Hα-helixtrans-62.1-14.8167.726.9-34.7000113.7I290P286-I290 WeakPolarHBondContact O-CD1 3.45Å; P286-I290 VanDerWaalsContact O-CG1 3.27Å; P286-I290 WeakPolarHBondContact O-CG1 3.48Å; P286-I290 PolarHBondContact O-N 3.17Å
287S65.1Low62.6Low70 Ų70106.5 Ų106.549%0.4963%0.629SS.*Hα-helixtrans-64-40.4-178.1-166.40000112.9E285 I290 H291E285-S287 PolarHBondContact O-N 3.06Å; S287-I290 PolarHBondContact O-N 3.29Å; S287-H291 WeakPolarHBondContact O-CB 3.45Å; S287-H291 PolarHBondContact O-N 3.29Å
288A72.5Confident64.5Low65 Ų65107.2 Ų107.254%0.53762%0.622SS.*Hα-helixtrans-68.3-40.8-178.900000112.3E285 H291 E292E285-A288 PolarHBondContact O-N 2.99Å; A288-H291 PolarHBondContact O-N 3.13Å; A288-E292 PolarHBondContact O-N 3Å
289A75Confident66.7Low63 Ų63103.1 Ų103.152%0.52161%0.605SS.*Hα-helixtrans-64.7-41.3176.100000111.8E292 V293A289-E292 PolarHBondContact O-N 2.8Å; A289-V293 WeakPolarHBondContact O-CG2 3.32Å; A289-V293 PolarHBondContact O-N 3.46Å; A289-V293 VanDerWaalsContact O-N 3.08Å
290I76.2Confident69.2Low94 Ų94105.2 Ų105.248%0.48260%0.598SS.*Hα-helixtrans-65.4-43.3176.4-65.5165000110.9P286 S287 E292 V293 M294P286-I290 WeakPolarHBondContact O-CD1 3.45Å; P286-I290 VanDerWaalsContact O-CG1 3.27Å; P286-I290 WeakPolarHBondContact O-CG1 3.48Å; P286-I290 PolarHBondContact O-N 3.17Å; S287-I290 PolarHBondContact O-N 3.29Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.93Å; I290-V293 PolarHBondContact O-N 3.37Å; I290-M294 HydrophobicContact CG2-CE 4.2Å; I290-M294 HydrophobicContact CG2-CG 4.43Å; I290-M294 WeakPolarHBondContact O-CG 3.46Å; I290-M294 PolarHBondContact O-N 3.38Å
291H80Confident71.2Confident122 Ų122106.6 Ų106.657%0.56558%0.584SS**Hα-helixtrans-60.2-41.9177.8-179.5-95.9000111.8S287 A288 M294 K295S287-H291 WeakPolarHBondContact O-CB 3.45Å; S287-H291 PolarHBondContact O-N 3.29Å; A288-H291 PolarHBondContact O-N 3.13Å; H291-M294 PolarHBondContact O-N 2.98Å; H291-K295 WeakPolarHBondContact O-CB 3.49Å; H291-K295 PolarHBondContact O-N 3.13Å
292E81.9Confident73.4Confident60 Ų60104.8 Ų104.828%0.2857%0.573SS.*Hα-helixtrans-67.3-40.7177.9-16856.4-147.900112.3A288 A289 I290 M294 K295 R296A288-E292 PolarHBondContact O-N 3Å; A289-E292 PolarHBondContact O-N 2.8Å; I290-E292 VanDerWaalsContact C-N 3.32Å; I290-E292 PolarHBondContact O-N 2.93Å; E292-M294 VanDerWaalsContact C-N 3.35Å; E292-M294 PolarHBondContact O-N 3.44Å; E292-K295 WeakPolarHBondContact O-CB 3.39Å; E292-K295 PolarHBondContact O-N 2.86Å; E292-R296 PolarHBondContact O-N 2.84Å
293V83.7Confident75.3Confident92 Ų92103.5 Ų103.556%0.55855%0.548SS*.Hα-helixtrans-61.6-43.1172.8172.30000111.1A289 I290 K295 R296 M297A289-V293 WeakPolarHBondContact O-CG2 3.32Å; A289-V293 PolarHBondContact O-N 3.46Å; A289-V293 VanDerWaalsContact O-N 3.08Å; I290-V293 PolarHBondContact O-N 3.37Å; V293-K295 VanDerWaalsContact C-N 3.32Å; V293-K295 PolarHBondContact O-N 3.5Å; V293-R296 PolarHBondContact O-N 2.87Å; V293-M297 WeakPolarHBondContact O-CB 3.33Å; V293-M297 PolarHBondContact O-N 2.82Å
294M82.3Confident77.5Confident99 Ų99101.1 Ų101.149%0.48852%0.524SS..Hα-helixtrans-63.7-37176.1-75-166.5171.300112.4I290 H291 E292 M297 K298I290-M294 HydrophobicContact CG2-CE 4.2Å; I290-M294 HydrophobicContact CG2-CG 4.43Å; I290-M294 WeakPolarHBondContact O-CG 3.46Å; I290-M294 PolarHBondContact O-N 3.38Å; H291-M294 PolarHBondContact O-N 2.98Å; E292-M294 VanDerWaalsContact C-N 3.35Å; E292-M294 PolarHBondContact O-N 3.44Å; M294-M297 PolarHBondContact O-N 3.15Å; M294-K298 WeakPolarHBondContact O-CG 3.38Å; M294-K298 PolarHBondContact O-N 2.82Å
295K83.5Confident78.9Confident127 Ų127100.8 Ų100.855%0.55252%0.515SS*.Hα-helixtrans-64.8-45.8176.9-168.7-179.3177.8-172.10111.3H291 E292 V293 K298 Y299H291-K295 WeakPolarHBondContact O-CB 3.49Å; H291-K295 PolarHBondContact O-N 3.13Å; E292-K295 WeakPolarHBondContact O-CB 3.39Å; E292-K295 PolarHBondContact O-N 2.86Å; V293-K295 VanDerWaalsContact C-N 3.32Å; V293-K295 PolarHBondContact O-N 3.5Å; K295-K298 PolarHBondContact O-N 3.39Å; K295-Y299 PolarHBondContact O-N 2.89Å; K295-Y299 VanDerWaalsContact O-N 3.13Å
296R88.2Confident80.2Confident121 Ų12197.1 Ų97.146%0.45751%0.506SS..Hα-helixtrans-60.5-47.4173.8-72.1-176.3-178.4143.80.6112M272 E292 V293 K298 Y299 E300M272-R296 HydrophobicContact CE-CG 4.46Å; M272-R296 PolarHBondContact SD-NH2 3.34Å; E292-R296 PolarHBondContact O-N 2.84Å; V293-R296 PolarHBondContact O-N 2.87Å; R296-K298 VanDerWaalsContact C-N 3.3Å; R296-K298 PolarHBondContact O-N 3.46Å; R296-Y299 WeakPolarHBondContact O-CB 3.17Å; R296-Y299 PolarHBondContact O-N 3.09Å; R296-E300 PolarHBondContact O-N 3.38Å
297M79.4Confident81.1Confident66 Ų6696.7 Ų96.733%0.32550%0.497SS..Hα-helixtrans-61.1-36.6179.2-172.1-178.664.900112.7V293 M294 R301V293-M297 WeakPolarHBondContact O-CB 3.33Å; V293-M297 PolarHBondContact O-N 2.82Å; M294-M297 PolarHBondContact O-N 3.15Å; M297-R301 VanDerWaalsContact CE-CZ 3.49Å; M297-R301 VanDerWaalsContact CE-NH2 3.3Å; M297-R301 WeakPolarHBondContact O-CB 3.45Å; M297-R301 WeakPolarHBondContact O-CG 3.45Å; M297-R301 PolarHBondContact O-N 2.8Å; M297-R301 VanDerWaalsContact SD-CZ 3.53Å; M297-R301 PolarHBondContact SD-NH2 2.84Å
298K84.9Confident81.9Confident148 Ų148101.8 Ų101.864%0.64351%0.507SS*.Hα-helixtrans-65-42.8173.4-77.9177-178177.90111.9M294 K295 R296 K302M294-K298 WeakPolarHBondContact O-CG 3.38Å; M294-K298 PolarHBondContact O-N 2.82Å; K295-K298 PolarHBondContact O-N 3.39Å; R296-K298 VanDerWaalsContact C-N 3.3Å; R296-K298 PolarHBondContact O-N 3.46Å; K298-K302 WeakPolarHBondContact O-CB 3.43Å; K298-K302 PolarHBondContact O-N 2.81Å
299Y84.4Confident82.2Confident144 Ų144101.2 Ų101.257%0.56550%0.502SS*.Hα-helixtrans-64.2-48.7178.5-177.6-101.4000111.5K295 R296 R301 K302 I303K295-Y299 PolarHBondContact O-N 2.89Å; K295-Y299 VanDerWaalsContact O-N 3.13Å; R296-Y299 WeakPolarHBondContact O-CB 3.17Å; R296-Y299 PolarHBondContact O-N 3.09Å; Y299-R301 PolarHBondContact O-N 3.44Å; Y299-K302 WeakPolarHBondContact O-CB 3.25Å; Y299-K302 PolarHBondContact O-N 3.35Å; Y299-K302 VanDerWaalsContact O-N 3.13Å; Y299-I303 HydrophobicContact CD1-CD1 3.77Å; Y299-I303 HydrophobicContact CD1-CG1 4.48Å; Y299-I303 HydrophobicContact CE1-CD1 3.16Å; Y299-I303 HydrophobicContact CE1-CG1 4.2Å; Y299-I303 HydrophobicContact CE2-CD1 4.19Å; Y299-I303 VanDerWaalsContact CZ-CD1 3.41Å; Y299-I303 PolarHBondContact O-N 2.69Å
300E87.9Confident82.2Confident110 Ų110103.9 Ų103.951%0.51451%0.507SS..Hα-helixtrans-58.9-48.1176.4-72175.8175.500111.5R296 K302 I303 S304R296-E300 PolarHBondContact O-N 3.38Å; E300-K302 VanDerWaalsContact C-N 3.27Å; E300-K302 PolarHBondContact O-N 3.1Å; E300-I303 PolarHBondContact O-N 3.03Å; E300-S304 WeakPolarHBondContact O-CB 3.48Å; E300-S304 PolarHBondContact O-N 3.39Å; E300-S304 PolarHBondContact O-OG 3.36Å
301R87.3Confident82.2Confident153 Ų153102.3 Ų102.358%0.57750%0.504SS*.Hα-helixtrans-58.6-38.9175.6-75.7176.1-172.5165-1.1112.5M297 Y299 A305M297-R301 VanDerWaalsContact CE-CZ 3.49Å; M297-R301 VanDerWaalsContact CE-NH2 3.3Å; M297-R301 WeakPolarHBondContact O-CB 3.45Å; M297-R301 WeakPolarHBondContact O-CG 3.45Å; M297-R301 PolarHBondContact O-N 2.8Å; M297-R301 VanDerWaalsContact SD-CZ 3.53Å; M297-R301 PolarHBondContact SD-NH2 2.84Å; Y299-R301 PolarHBondContact O-N 3.44Å; R301-A305 WeakPolarHBondContact O-CB 3.37Å; R301-A305 PolarHBondContact O-N 3.36Å
302K83.6Confident82Confident156 Ų15696.9 Ų96.968%0.67848%0.481SS*.Hα-helixtrans-67.5-41.1178.5-169.1175.7-179.9-178.20111.2K298 Y299 E300 S306K298-K302 WeakPolarHBondContact O-CB 3.43Å; K298-K302 PolarHBondContact O-N 2.81Å; Y299-K302 WeakPolarHBondContact O-CB 3.25Å; Y299-K302 PolarHBondContact O-N 3.35Å; Y299-K302 VanDerWaalsContact O-N 3.13Å; E300-K302 VanDerWaalsContact C-N 3.27Å; E300-K302 PolarHBondContact O-N 3.1Å; K302-S306 WeakPolarHBondContact O-CB 3.44Å; K302-S306 PolarHBondContact O-N 3.18Å; K302-S306 PolarHBondContact O-OG 2.71Å
303I83.4Confident81.3Confident47 Ų4796.6 Ų96.624%0.24148%0.484CS..Hα-helixtrans-65.4-50.6174.3-69-177.6000110.6Y299 E300 A305 S306 L307Y299-I303 HydrophobicContact CD1-CD1 3.77Å; Y299-I303 HydrophobicContact CD1-CG1 4.48Å; Y299-I303 HydrophobicContact CE1-CD1 3.16Å; Y299-I303 HydrophobicContact CE1-CG1 4.2Å; Y299-I303 HydrophobicContact CE2-CD1 4.19Å; Y299-I303 VanDerWaalsContact CZ-CD1 3.41Å; Y299-I303 PolarHBondContact O-N 2.69Å; E300-I303 PolarHBondContact O-N 3.03Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 2.98Å; I303-S306 WeakPolarHBondContact O-CB 3.44Å; I303-S306 PolarHBondContact O-N 3.47Å; I303-S306 VanDerWaalsContact O-N 3.1Å; I303-L307 WeakPolarHBondContact O-CB 3.29Å; I303-L307 PolarHBondContact O-N 2.63Å
304S87Confident80.5Confident68 Ų6893.5 Ų93.548%0.47647%0.466SS..Hα-helixtrans-60.6-41.5-179.8-55.50000112E300 S306 L307 Y308E300-S304 WeakPolarHBondContact O-CB 3.48Å; E300-S304 PolarHBondContact O-N 3.39Å; E300-S304 PolarHBondContact O-OG 3.36Å; S304-S306 VanDerWaalsContact C-N 3.34Å; S304-S306 PolarHBondContact O-N 2.92Å; S304-L307 PolarHBondContact O-N 3.14Å; S304-Y308 WeakPolarHBondContact O-CB 3.17Å; S304-Y308 PolarHBondContact O-N 3.45Å
305A77Confident79.8Confident61 Ų6193.9 Ų93.950%0.50447%0.467SS..Hα-helixtrans-63.9-39.7175.100000111.9R301 I303 A309R301-A305 WeakPolarHBondContact O-CB 3.37Å; R301-A305 PolarHBondContact O-N 3.36Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 2.98Å; A305-A309 VanDerWaalsContact O-CB 3.32Å; A305-A309 WeakPolarHBondContact O-CB 3.43Å; A305-A309 PolarHBondContact O-N 3.5Å
306S81.6Confident78.7Confident70 Ų7092 Ų9249%0.4947%0.468SS..Hα-helixtrans-67.4-41.2176.2-55.60000111.7K302 I303 S304 A309 L310K302-S306 WeakPolarHBondContact O-CB 3.44Å; K302-S306 PolarHBondContact O-N 3.18Å; K302-S306 PolarHBondContact O-OG 2.71Å; I303-S306 WeakPolarHBondContact O-CB 3.44Å; I303-S306 PolarHBondContact O-N 3.47Å; I303-S306 VanDerWaalsContact O-N 3.1Å; S304-S306 VanDerWaalsContact C-N 3.34Å; S304-S306 PolarHBondContact O-N 2.92Å; S306-A309 PolarHBondContact O-N 2.95Å; S306-L310 WeakPolarHBondContact O-CB 3.14Å; S306-L310 PolarHBondContact O-N 3.16Å
307L79.4Confident77.5Confident94 Ų9488.8 Ų88.849%0.49246%0.46SS..Hα-helixtrans-67.3-39.9177-174.565.5000111.6I303 S304 L310 S311I303-L307 WeakPolarHBondContact O-CB 3.29Å; I303-L307 PolarHBondContact O-N 2.63Å; S304-L307 PolarHBondContact O-N 3.14Å; L307-L310 PolarHBondContact O-N 3.31Å; L307-S311 VanDerWaalsContact O-CB 3.25Å; L307-S311 WeakPolarHBondContact O-CB 3.38Å; L307-S311 PolarHBondContact O-N 3.3Å; L307-S311 PolarHBondContact O-OG 3.23Å
308Y81.3Confident76.8Confident177 Ų17792.6 Ų92.669%0.69447%0.471SS*.Hα-helixtrans-69-36.1174.1-171.8-94.1000111.7S304 G312S304-Y308 WeakPolarHBondContact O-CB 3.17Å; S304-Y308 PolarHBondContact O-N 3.45Å; Y308-G312 WeakPolarHBondContact O-CA 3.44Å; Y308-G312 PolarHBondContact O-N 3.41Å
309A78.4Confident75.9Confident54 Ų5493 Ų9345%0.44648%0.477SS..Hα-helixtrans-64.2-45.5171.700000110.7A305 S306 V313A305-A309 VanDerWaalsContact O-CB 3.32Å; A305-A309 WeakPolarHBondContact O-CB 3.43Å; A305-A309 PolarHBondContact O-N 3.5Å; S306-A309 PolarHBondContact O-N 2.95Å; A309-V313 WeakPolarHBondContact O-CB 3.17Å; A309-V313 WeakPolarHBondContact O-CG2 2.95Å; A309-V313 PolarHBondContact O-N 2.88Å
310L74.8Confident74.8Confident118 Ų11896.8 Ų96.862%0.61849%0.49SS*.Hα-helixtrans-66.3-46.2179.8-170.966.5000112.2S306 L307S306-L310 WeakPolarHBondContact O-CB 3.14Å; S306-L310 PolarHBondContact O-N 3.16Å; L307-L310 PolarHBondContact O-N 3.31Å
311S76.6Confident73.3Confident61 Ų6195.3 Ų95.343%0.42749%0.489SS..Hα-helixtrans-74.8-44.2-178.9-50.30000111.4L307 V313 S314 E315L307-S311 VanDerWaalsContact O-CB 3.25Å; L307-S311 WeakPolarHBondContact O-CB 3.38Å; L307-S311 PolarHBondContact O-N 3.3Å; L307-S311 PolarHBondContact O-OG 3.23Å; S311-V313 PolarHBondContact O-N 2.88Å; S311-S314 PolarHBondContact O-N 2.87Å; S311-S314 PolarHBondContact O-OG 3.22Å; S311-E315 PolarHBondContact O-N 2.95Å
312G74.6Confident71.7Confident8 Ų890 Ų908%0.08248%0.481CS..Hα-helixtrans-70.9-27-179.700000113.6Y308 S314 E315 C316Y308-G312 WeakPolarHBondContact O-CA 3.44Å; Y308-G312 PolarHBondContact O-N 3.41Å; G312-S314 VanDerWaalsContact C-N 3.31Å; G312-S314 PolarHBondContact O-N 2.85Å; G312-E315 PolarHBondContact O-N 3.17Å; G312-C316 VanDerWaalsContact O-CB 3.29Å; G312-C316 WeakPolarHBondContact O-CB 3.45Å; G312-C316 PolarHBondContact O-N 3.38Å; G312-C316 PolarHBondContact O-SG 3.12Å
313V67.7Low70.4Confident54 Ų5489.8 Ų89.833%0.32749%0.488SS..Hα-helixtrans-62.6-40.4169.81650000110.4A309 S311 E315 C316 L317 L337A309-V313 WeakPolarHBondContact O-CB 3.17Å; A309-V313 WeakPolarHBondContact O-CG2 2.95Å; A309-V313 PolarHBondContact O-N 2.88Å; S311-V313 PolarHBondContact O-N 2.88Å; V313-E315 VanDerWaalsContact C-N 3.34Å; V313-E315 PolarHBondContact O-N 2.8Å; V313-C316 PolarHBondContact O-N 3.26Å; V313-L317 HydrophobicContact CG1-CD1 3.62Å; V313-L317 HydrophobicContact CG1-CG 4.24Å; V313-L317 VanDerWaalsContact O-CB 3.32Å; V313-L317 WeakPolarHBondContact O-CB 3.32Å; V313-L317 WeakPolarHBondContact O-CD1 3.24Å; V313-L317 WeakPolarHBondContact O-CG 3.18Å; V313-L317 PolarHBondContact O-N 2.83Å; V313-L337 HydrophobicContact CG1-CD2 4.15Å
314S68.2Low69Low28 Ų2889.1 Ų89.120%0.19649%0.492CS..Hα-helixtrans-64.5-38.2177.675.20000112.7S311 G312 R318 H333S311-S314 PolarHBondContact O-N 2.87Å; S311-S314 PolarHBondContact O-OG 3.22Å; G312-S314 VanDerWaalsContact C-N 3.31Å; G312-S314 PolarHBondContact O-N 2.85Å; S314-R318 WeakPolarHBondContact O-CB 3.25Å; S314-R318 PolarHBondContact O-N 2.8Å; S314-H333 VanDerWaalsContact CA-NE2 3.34Å; S314-H333 WeakPolarHBondContact CA-NE2 3.34Å; S314-H333 VanDerWaalsContact CB-NE2 3.25Å; S314-H333 WeakPolarHBondContact CB-NE2 3.46Å
315E66.6Low67.7Low107 Ų10793.7 Ų93.750%0.551%0.511SS..Hα-helixtrans-72.9-42176.9-165.8179.8-176.900112.2S311 G312 V313 L317 R318 M319S311-E315 PolarHBondContact O-N 2.95Å; G312-E315 PolarHBondContact O-N 3.17Å; V313-E315 VanDerWaalsContact C-N 3.34Å; V313-E315 PolarHBondContact O-N 2.8Å; E315-L317 VanDerWaalsContact C-N 3.29Å; E315-L317 PolarHBondContact O-N 3.38Å; E315-R318 WeakPolarHBondContact O-CB 3.34Å; E315-R318 PolarHBondContact O-N 2.75Å; E315-R318 VanDerWaalsContact O-N 3.14Å; E315-M319 WeakPolarHBondContact O-CG 3.12Å; E315-M319 PolarHBondContact O-N 2.8Å
316C61.4Low66.7Low86 Ų8696 Ų9658%0.58152%0.515SS*.Hα-helixtrans-61.5-37.8173.6-72.10000111.9G312 V313 R320G312-C316 VanDerWaalsContact O-CB 3.29Å; G312-C316 WeakPolarHBondContact O-CB 3.45Å; G312-C316 PolarHBondContact O-N 3.38Å; G312-C316 PolarHBondContact O-SG 3.12Å; V313-C316 PolarHBondContact O-N 3.26Å; C316-R320 WeakPolarHBondContact O-CB 3.31Å; C316-R320 PolarHBondContact O-N 3.41Å
317L62.3Low65.7Low55 Ų55101.3 Ų101.329%0.28853%0.532SS..Hα-helixtrans-67.9-40.7174.3-72.8166.5000110.9V313 E315 R320 V321V313-L317 HydrophobicContact CG1-CD1 3.62Å; V313-L317 HydrophobicContact CG1-CG 4.24Å; V313-L317 VanDerWaalsContact O-CB 3.32Å; V313-L317 WeakPolarHBondContact O-CB 3.32Å; V313-L317 WeakPolarHBondContact O-CD1 3.24Å; V313-L317 WeakPolarHBondContact O-CG 3.18Å; V313-L317 PolarHBondContact O-N 2.83Å; E315-L317 VanDerWaalsContact C-N 3.29Å; E315-L317 PolarHBondContact O-N 3.38Å; L317-R320 PolarHBondContact O-N 3.12Å; L317-V321 WeakPolarHBondContact O-CG2 3.46Å; L317-V321 PolarHBondContact O-N 3.3Å; L317-V321 VanDerWaalsContact O-N 3.12Å
318R65Low64.8Low146 Ų14699.7 Ų99.755%0.55153%0.532SS*.Hα-helixtrans-60.7-45.6175.8-162.1-178.8-63.7126.31.4111.9S314 E315 R320 V321 G322S314-R318 WeakPolarHBondContact O-CB 3.25Å; S314-R318 PolarHBondContact O-N 2.8Å; E315-R318 WeakPolarHBondContact O-CB 3.34Å; E315-R318 PolarHBondContact O-N 2.75Å; E315-R318 VanDerWaalsContact O-N 3.14Å; R318-R320 VanDerWaalsContact C-N 3.26Å; R318-R320 PolarHBondContact O-N 3.39Å; R318-V321 PolarHBondContact O-N 2.87Å; R318-G322 PolarHBondContact O-N 3.01Å
319M64.4Low63.7Low157 Ų15792.9 Ų92.977%0.77351%0.509SS*.Hα-helixtrans-63.9-29.8176.9-67.5-171.884.100113.4E315E315-M319 WeakPolarHBondContact O-CG 3.12Å; E315-M319 PolarHBondContact O-N 2.8Å
320R61.2Low62.9Low222 Ų22293.1 Ų93.184%0.83851%0.511SS*.Hα-helixtrans-85.5-22.3-176.5-156.9160-169.992.1-0.2113.5C316 L317 R318C316-R320 WeakPolarHBondContact O-CB 3.31Å; C316-R320 PolarHBondContact O-N 3.41Å; L317-R320 PolarHBondContact O-N 3.12Å; R318-R320 VanDerWaalsContact C-N 3.26Å; R318-R320 PolarHBondContact O-N 3.39Å
321V58.4Low62.5Low80 Ų8089.7 Ų89.749%0.48550%0.5SS..Hα-helixtrans-96.1-10.2-179178.40000112.3L317 R318 T329L317-V321 WeakPolarHBondContact O-CG2 3.46Å; L317-V321 PolarHBondContact O-N 3.3Å; L317-V321 VanDerWaalsContact O-N 3.12Å; R318-V321 PolarHBondContact O-N 2.87Å; V321-T329 HydrophobicContact CG1-CG2 3.64Å
322G52.1Low62.2Low41 Ų4193.4 Ų93.442%0.42351%0.508SS..  trans77.2146.5-178.400000110.9R318 G324R318-G322 PolarHBondContact O-N 3.01Å; G322-G324 PolarHBondContact O-N 3.17Å
323D57.4Low61.7Low152 Ų15295.8 Ų95.881%0.81352%0.517SS*.SBendtrans-74.657.6-176.7-157.837.8000111
324G54.6Low62Low32 Ų3299.9 Ų99.933%0.3353%0.533SS..  trans-100.5115175.300000109.6G322 D326 T329G322-G324 PolarHBondContact O-N 3.17Å; G324-D326 PolarHBondContact O-N 3.09Å; G324-T329 PolarHBondContact O-OG1 3.26Å
325D57.7Low62.3Low165 Ų165104.4 Ų104.488%0.88255%0.554SS**  trans-61.435.1175.6-73.7-45.4000114.5
326D57.5Low62.7Low108 Ų108101.6 Ų101.658%0.57855%0.549SS*.  trans-89.1118.5179.6-66.1-38.5000109.4G324 A328 T329G324-D326 PolarHBondContact O-N 3.09Å; D326-A328 PolarHBondContact O-N 3.07Å; D326-T329 HydrophobicContact CB-CG2 4.06Å; D326-T329 PolarHBondContact O-N 2.79Å; D326-T329 PolarHBondContact O-OG1 2.8Å
327H60.4Low63.4Low182 Ų18299.6 Ų99.684%0.84353%0.532SS*.Hα-helixtrans-49.9-21.7170.9-82.1-75.3000113.8A331H327-A331 PolarHBondContact O-N 3.34Å
328A60.4Low64.2Low60 Ų6099 Ų9950%0.49653%0.533SS..Hα-helixtrans-69.3-27.9173.300000114.2D326 K332D326-A328 PolarHBondContact O-N 3.07Å; A328-K332 WeakPolarHBondContact O-CG 3.4Å; A328-K332 PolarHBondContact O-N 2.99Å
329T57.9Low65.1Low35 Ų3594 Ų9422%0.21553%0.526CS..Hα-helixtrans-77.2-36177.662.70000111.2V321 G324 D326 K332 H333V321-T329 HydrophobicContact CG1-CG2 3.64Å; G324-T329 PolarHBondContact O-OG1 3.26Å; D326-T329 HydrophobicContact CB-CG2 4.06Å; D326-T329 PolarHBondContact O-N 2.79Å; D326-T329 PolarHBondContact O-OG1 2.8Å; T329-K332 WeakPolarHBondContact O-CB 3.23Å; T329-K332 PolarHBondContact O-N 3.17Å; T329-H333 PolarHBondContact O-N 2.85Å
330A61.5Low65.8Low58 Ų5891 Ų9148%0.47951%0.513SS..Hα-helixtrans-62.2-43.8172.800000112.2K332 H333 E334A330-K332 VanDerWaalsContact C-N 3.31Å; A330-K332 PolarHBondContact O-N 3.03Å; A330-H333 WeakPolarHBondContact O-CB 3.49Å; A330-H333 PolarHBondContact O-N 3.39Å; A330-E334 PolarHBondContact O-N 3.27Å
331A66.5Low66.8Low47 Ų4788 Ų8839%0.38850%0.502SS..Hα-helixtrans-62.4-36.7175.800000112.5H327 E334 L335H327-A331 PolarHBondContact O-N 3.34Å; A331-E334 PolarHBondContact O-N 2.98Å; A331-L335 WeakPolarHBondContact O-CB 3.43Å; A331-L335 PolarHBondContact O-N 3.35Å
332K69.8Low68.1Low139 Ų13988.1 Ų88.160%0.60450%0.5SS*.Hα-helixtrans-66.1-39.2174.3-71.8170.3-175.5172.60112A328 T329 A330 L335 A336A328-K332 WeakPolarHBondContact O-CG 3.4Å; A328-K332 PolarHBondContact O-N 2.99Å; T329-K332 WeakPolarHBondContact O-CB 3.23Å; T329-K332 PolarHBondContact O-N 3.17Å; A330-K332 VanDerWaalsContact C-N 3.31Å; A330-K332 PolarHBondContact O-N 3.03Å; K332-L335 PolarHBondContact O-N 3.43Å; K332-A336 WeakPolarHBondContact O-CB 3.36Å; K332-A336 PolarHBondContact O-N 3.02Å
333H64.2Low69.6Low57 Ų5788.9 Ų88.926%0.26450%0.502SS..Hα-helixtrans-63-44.5175.2177.6-100.3000111.3S314 T329 A330 A336 L337S314-H333 VanDerWaalsContact CA-NE2 3.34Å; S314-H333 WeakPolarHBondContact CA-NE2 3.34Å; S314-H333 VanDerWaalsContact CB-NE2 3.25Å; S314-H333 WeakPolarHBondContact CB-NE2 3.46Å; T329-H333 PolarHBondContact O-N 2.85Å; A330-H333 WeakPolarHBondContact O-CB 3.49Å; A330-H333 PolarHBondContact O-N 3.39Å; H333-A336 PolarHBondContact O-N 3.33Å; H333-L337 WeakPolarHBondContact CE1-CD1 3.46Å; H333-L337 WeakPolarHBondContact O-CG 3.5Å; H333-L337 PolarHBondContact O-N 3.48Å
334E74.1Confident70.7Confident141 Ų14185.4 Ų85.466%0.65949%0.489SS*.Hα-helixtrans-64-43177-166.7-178.3178.300112.3A330 A331 A336 L337 S338A330-E334 PolarHBondContact O-N 3.27Å; A331-E334 PolarHBondContact O-N 2.98Å; E334-A336 PolarHBondContact O-N 3.07Å; E334-L337 PolarHBondContact O-N 3.22Å; E334-S338 WeakPolarHBondContact O-CB 3.42Å; E334-S338 PolarHBondContact O-N 3.45Å; E334-S338 PolarHBondContact O-OG 2.82Å
335L75.8Confident72.3Confident122 Ų12290 Ų9064%0.63950%0.496SS*.Hα-helixtrans-62.2-38.6174.5-86.9159.3000113.1A331 K332 S338 G339A331-L335 WeakPolarHBondContact O-CB 3.43Å; A331-L335 PolarHBondContact O-N 3.35Å; K332-L335 PolarHBondContact O-N 3.43Å; L335-S338 WeakPolarHBondContact CA-OG 3.43Å; L335-S338 PolarHBondContact O-OG 2.86Å; L335-G339 PolarHBondContact O-N 2.93Å
336A74.5Confident73.6Confident49 Ų4985.3 Ų85.341%0.40548%0.477SS..Hα-helixtrans-68.6-41.6177.300000111.6K332 H333 E334 L340K332-A336 WeakPolarHBondContact O-CB 3.36Å; K332-A336 PolarHBondContact O-N 3.02Å; H333-A336 PolarHBondContact O-N 3.33Å; E334-A336 PolarHBondContact O-N 3.07Å; A336-L340 PolarHBondContact O-N 3.47Å; A336-L340 VanDerWaalsContact O-N 3.07Å
337L75.3Confident75.1Confident43 Ų4386.9 Ų86.923%0.22548%0.478CS..Hα-helixtrans-69.8-37.5176.4-70-177.8000112.4V313 H333 E334 L340 R341V313-L337 HydrophobicContact CG1-CD2 4.15Å; H333-L337 WeakPolarHBondContact CE1-CD1 3.46Å; H333-L337 WeakPolarHBondContact O-CG 3.5Å; H333-L337 PolarHBondContact O-N 3.48Å; E334-L337 PolarHBondContact O-N 3.22Å; L337-L340 PolarHBondContact O-N 3.11Å; L337-R341 WeakPolarHBondContact O-CB 3.4Å; L337-R341 PolarHBondContact O-N 3.36Å
338S79.8Confident76.4Confident42 Ų4286.2 Ų86.229%0.29447%0.468SS..Hα-helixtrans-66.5-44.4175.6670000111.2E334 L335 L340 R341 D342E334-S338 WeakPolarHBondContact O-CB 3.42Å; E334-S338 PolarHBondContact O-N 3.45Å; E334-S338 PolarHBondContact O-OG 2.82Å; L335-S338 WeakPolarHBondContact CA-OG 3.43Å; L335-S338 PolarHBondContact O-OG 2.86Å; S338-L340 VanDerWaalsContact C-N 3.31Å; S338-L340 PolarHBondContact O-N 2.98Å; S338-R341 WeakPolarHBondContact O-CB 3.32Å; S338-R341 PolarHBondContact O-N 2.98Å; S338-R341 VanDerWaalsContact O-N 3.11Å; S338-D342 WeakPolarHBondContact O-CB 3.43Å; S338-D342 PolarHBondContact O-N 3.04Å
339G84.2Confident77.7Confident41 Ų4188.8 Ų88.842%0.42347%0.47SS..Hα-helixtrans-58.2-41.617400000112.8L335 A343L335-G339 PolarHBondContact O-N 2.93Å; G339-A343 WeakPolarHBondContact O-CB 3.37Å; G339-A343 PolarHBondContact O-N 3.46Å
340L77.6Confident79.1Confident95 Ų9592.3 Ų92.350%0.49748%0.484SS..Hα-helixtrans-65.3-43.2174.4-176.262.3000111.9A336 L337 S338 D342 A343 C344A336-L340 PolarHBondContact O-N 3.47Å; A336-L340 VanDerWaalsContact O-N 3.07Å; L337-L340 PolarHBondContact O-N 3.11Å; S338-L340 VanDerWaalsContact C-N 3.31Å; S338-L340 PolarHBondContact O-N 2.98Å; L340-D342 VanDerWaalsContact C-N 3.32Å; L340-D342 PolarHBondContact O-N 3.25Å; L340-A343 PolarHBondContact O-N 3.36Å; L340-C344 PolarHBondContact O-N 3.44Å; L340-C344 PolarHBondContact O-SG 3.38Å; L340-C344 VanDerWaalsContact O-SG 3.38Å
341R82.8Confident80.2Confident159 Ų15994.4 Ų94.460%0.648%0.484SS*.Hα-helixtrans-62.4-40.2178.6-167.1-174.8-72.2174-4.5111.7L337 S338 C344 R345L337-R341 WeakPolarHBondContact O-CB 3.4Å; L337-R341 PolarHBondContact O-N 3.36Å; S338-R341 WeakPolarHBondContact O-CB 3.32Å; S338-R341 PolarHBondContact O-N 2.98Å; S338-R341 VanDerWaalsContact O-N 3.11Å; R341-C344 PolarHBondContact O-N 3.14Å; R341-R345 PolarHBondContact O-N 2.96Å
342D86.8Confident81.1Confident82 Ų8296.8 Ų96.844%0.43949%0.487SS..Hα-helixtrans-74.1-36179.2-66.2-19.8000111.9S338 L340 C344 R345 S346S338-D342 WeakPolarHBondContact O-CB 3.43Å; S338-D342 PolarHBondContact O-N 3.04Å; L340-D342 VanDerWaalsContact C-N 3.32Å; L340-D342 PolarHBondContact O-N 3.25Å; D342-C344 VanDerWaalsContact C-N 3.33Å; D342-C344 PolarHBondContact O-N 3.26Å; D342-R345 PolarHBondContact O-N 3.41Å; D342-R345 IonicContact OD1-CZ 3.94Å; D342-R345 IonicContact OD1-NE 2.87Å; D342-R345 PolarHBondContact OD1-NE 3.46Å; D342-R345 IonicContact OD1-NH2 3.83Å; D342-R345 PolarHBondContact OD1-NH2 3.38Å; D342-S346 WeakPolarHBondContact O-CB 3.31Å; D342-S346 PolarHBondContact O-N 3.4Å
343A83.2Confident81.8Confident58 Ų5896.2 Ų96.248%0.47949%0.487SS..Hα-helixtrans-60.4-41.6169.700000112G339 L340 S346 K347G339-A343 WeakPolarHBondContact O-CB 3.37Å; G339-A343 PolarHBondContact O-N 3.46Å; L340-A343 PolarHBondContact O-N 3.36Å; A343-S346 PolarHBondContact O-N 3.26Å; A343-K347 WeakPolarHBondContact O-CB 3.47Å; A343-K347 PolarHBondContact O-N 2.97Å
344C79.2Confident82.7Confident79 Ų7998.3 Ų98.353%0.53450%0.496SS..Hα-helixtrans-63.1-42.3174.4-72.40000112.5L340 R341 D342 R348L340-C344 PolarHBondContact O-N 3.44Å; L340-C344 PolarHBondContact O-SG 3.38Å; L340-C344 VanDerWaalsContact O-SG 3.38Å; R341-C344 PolarHBondContact O-N 3.14Å; D342-C344 VanDerWaalsContact C-N 3.33Å; D342-C344 PolarHBondContact O-N 3.26Å; C344-R348 PolarHBondContact O-N 3.48Å; C344-R348 VanDerWaalsContact O-N 3.14Å
345R88.3Confident82.9Confident128 Ų12897.2 Ų97.248%0.48349%0.492SS..Hα-helixtrans-64.5-43.7175.4-81.7-173.8-89.7-114.110.4112.5R341 D342 R348 Q349R341-R345 PolarHBondContact O-N 2.96Å; D342-R345 PolarHBondContact O-N 3.41Å; D342-R345 IonicContact OD1-CZ 3.94Å; D342-R345 IonicContact OD1-NE 2.87Å; D342-R345 PolarHBondContact OD1-NE 3.46Å; D342-R345 IonicContact OD1-NH2 3.83Å; D342-R345 PolarHBondContact OD1-NH2 3.38Å; R345-R348 PolarHBondContact O-N 3.17Å; R345-Q349 WeakPolarHBondContact O-CG 3.38Å; R345-Q349 PolarHBondContact O-N 2.87Å
346S85.5Confident82.9Confident67 Ų67100.7 Ų100.747%0.46950%0.496SS..Hα-helixtrans-62.8-43177.9-178.30000111.6D342 A343 R348 Q349 Q350D342-S346 WeakPolarHBondContact O-CB 3.31Å; D342-S346 PolarHBondContact O-N 3.4Å; A343-S346 PolarHBondContact O-N 3.26Å; S346-R348 VanDerWaalsContact C-N 3.31Å; S346-R348 PolarHBondContact O-N 2.84Å; S346-Q349 PolarHBondContact O-N 3.37Å; S346-Q350 WeakPolarHBondContact O-CB 3.34Å; S346-Q350 PolarHBondContact O-N 3.43Å
347K88.6Confident82.6Confident140 Ų140103.5 Ų103.561%0.60950%0.504SS*.Hα-helixtrans-62.3-37.3175.8-167.2-179-179.2-1790112.6A343 Q350 Q351A343-K347 WeakPolarHBondContact O-CB 3.47Å; A343-K347 PolarHBondContact O-N 2.97Å; K347-Q350 PolarHBondContact O-N 3.05Å; K347-Q351 PolarHBondContact O-N 2.95Å
348R87.9Confident82Confident168 Ų168108.2 Ų108.263%0.63453%0.525SS*.Hα-helixtrans-65.5-46.3174.6-177.9177.6176.1164.35.1111.7C344 R345 S346 Q350 Q351 E352C344-R348 PolarHBondContact O-N 3.48Å; C344-R348 VanDerWaalsContact O-N 3.14Å; R345-R348 PolarHBondContact O-N 3.17Å; S346-R348 VanDerWaalsContact C-N 3.31Å; S346-R348 PolarHBondContact O-N 2.84Å; R348-Q350 VanDerWaalsContact C-N 3.26Å; R348-Q350 PolarHBondContact O-N 3.21Å; R348-Q351 PolarHBondContact O-N 2.96Å; R348-E352 WeakPolarHBondContact CG-OE1 3.44Å; R348-E352 IonicContact CZ-OE1 3.46Å; R348-E352 IonicContact NE-OE1 3.2Å; R348-E352 PolarHBondContact NE-OE1 2.89Å; R348-E352 IonicContact NH2-OE1 2.85Å; R348-E352 WeakPolarHBondContact O-CG 3.37Å; R348-E352 PolarHBondContact O-N 3.47Å
349Q88Confident81.2Confident115 Ų115110.1 Ų110.154%0.53753%0.534SS..Hα-helixtrans-61.9-36175.8-71177.24.100112.1R345 S346 E352 Q353R345-Q349 WeakPolarHBondContact O-CG 3.38Å; R345-Q349 PolarHBondContact O-N 2.87Å; S346-Q349 PolarHBondContact O-N 3.37Å; Q349-E352 PolarHBondContact O-N 3.15Å; Q349-Q353 WeakPolarHBondContact O-CG 3.47Å; Q349-Q353 PolarHBondContact O-N 2.97Å
350Q86.5Confident79.8Confident109 Ų109115.3 Ų115.351%0.50955%0.545SS..Hα-helixtrans-65.3-45.1175.8-168.7175.50.900111.6S346 K347 R348 E352 Q353 E354S346-Q350 WeakPolarHBondContact O-CB 3.34Å; S346-Q350 PolarHBondContact O-N 3.43Å; K347-Q350 PolarHBondContact O-N 3.05Å; R348-Q350 VanDerWaalsContact C-N 3.26Å; R348-Q350 PolarHBondContact O-N 3.21Å; Q350-E352 VanDerWaalsContact C-N 3.34Å; Q350-E352 PolarHBondContact O-N 3.44Å; Q350-Q353 PolarHBondContact O-N 3.28Å; Q350-E354 WeakPolarHBondContact O-CB 3.5Å; Q350-E354 WeakPolarHBondContact O-CG 3.43Å; Q350-E354 PolarHBondContact O-N 3.22Å
351Q84.8Confident78.8Confident102 Ų102117.5 Ų117.548%0.47756%0.557SS.*Hα-helixtrans-62.3-39173.6-82.7-175.4-22.900112.8K347 R348 E354 Q355K347-Q351 PolarHBondContact O-N 2.95Å; R348-Q351 PolarHBondContact O-N 2.96Å; Q351-E354 PolarHBondContact O-N 3.4Å; Q351-Q355 WeakPolarHBondContact O-CB 3.5Å; Q351-Q355 WeakPolarHBondContact O-CG 3.39Å; Q351-Q355 PolarHBondContact O-N 3.35Å
352E86.5Confident77.6Confident96 Ų96115.2 Ų115.245%0.44956%0.561SS.*Hα-helixtrans-66.7-36.2176.1-72.8169.5-17300111.6R348 Q349 Q350 R356R348-E352 WeakPolarHBondContact CG-OE1 3.44Å; R348-E352 IonicContact CZ-OE1 3.46Å; R348-E352 IonicContact NE-OE1 3.2Å; R348-E352 PolarHBondContact NE-OE1 2.89Å; R348-E352 IonicContact NH2-OE1 2.85Å; R348-E352 WeakPolarHBondContact O-CG 3.37Å; R348-E352 PolarHBondContact O-N 3.47Å; Q349-E352 PolarHBondContact O-N 3.15Å; Q350-E352 VanDerWaalsContact C-N 3.34Å; Q350-E352 PolarHBondContact O-N 3.44Å; E352-R356 VanDerWaalsContact O-CB 3.31Å; E352-R356 WeakPolarHBondContact O-CB 3.46Å; E352-R356 PolarHBondContact O-N 3.07Å
353Q83.7Confident76.1Confident128 Ų128119.1 Ų119.160%0.59858%0.577SS**Hα-helixtrans-70.1-43.1173.2-77.6-17413.400112.7Q349 Q350 R356 L357Q349-Q353 WeakPolarHBondContact O-CG 3.47Å; Q349-Q353 PolarHBondContact O-N 2.97Å; Q350-Q353 PolarHBondContact O-N 3.28Å; Q353-R356 PolarHBondContact O-N 2.97Å; Q353-R356 VanDerWaalsContact O-N 3.17Å; Q353-L357 WeakPolarHBondContact O-CG 3.36Å; Q353-L357 PolarHBondContact O-N 2.88Å
354E83.3Confident74.4Confident100 Ų100119.8 Ų119.847%0.46759%0.59SS.*Hα-helixtrans-59.4-47.3175.5-75.5170.2-179.400110.6Q350 Q351 R356 L357 E358Q350-E354 WeakPolarHBondContact O-CB 3.5Å; Q350-E354 WeakPolarHBondContact O-CG 3.43Å; Q350-E354 PolarHBondContact O-N 3.22Å; Q351-E354 PolarHBondContact O-N 3.4Å; E354-R356 VanDerWaalsContact C-N 3.3Å; E354-R356 PolarHBondContact O-N 2.84Å; E354-L357 PolarHBondContact O-N 3.31Å; E354-E358 PolarHBondContact O-N 2.92Å
355Q78.6Confident72.6Confident119 Ų119123.3 Ų123.356%0.55660%0.603SS**Hα-helixtrans-60.9-37.4174.3-74.9176.847.500112.5Q351 V359Q351-Q355 WeakPolarHBondContact O-CB 3.5Å; Q351-Q355 WeakPolarHBondContact O-CG 3.39Å; Q351-Q355 PolarHBondContact O-N 3.35Å; Q355-V359 VanDerWaalsContact O-CG2 3.31Å; Q355-V359 WeakPolarHBondContact O-CG2 3.44Å; Q355-V359 PolarHBondContact O-N 2.97Å
356R75.9Confident70.4Confident194 Ų194123.7 Ų123.773%0.73262%0.62SS**Hα-helixtrans-73.1-28.7179.1-165.5171.7-171.9-119.83113.1E352 Q353 E354 K360E352-R356 VanDerWaalsContact O-CB 3.31Å; E352-R356 WeakPolarHBondContact O-CB 3.46Å; E352-R356 PolarHBondContact O-N 3.07Å; Q353-R356 PolarHBondContact O-N 2.97Å; Q353-R356 VanDerWaalsContact O-N 3.17Å; E354-R356 VanDerWaalsContact C-N 3.3Å; E354-R356 PolarHBondContact O-N 2.84Å; R356-K360 PolarHBondContact O-N 3Å
357L68.6Low68.6Low109 Ų109127.6 Ų127.657%0.57164%0.64SS**Hα-helixtrans-75.6-42173.8-71.1170.2000110.9Q353 E354 V359 K360 D361Q353-L357 WeakPolarHBondContact O-CG 3.36Å; Q353-L357 PolarHBondContact O-N 2.88Å; E354-L357 PolarHBondContact O-N 3.31Å; L357-V359 VanDerWaalsContact C-N 3.33Å; L357-V359 PolarHBondContact O-N 3.04Å; L357-K360 PolarHBondContact O-N 3.25Å; L357-D361 PolarHBondContact O-N 3.44Å; L357-D361 VanDerWaalsContact O-N 3.13Å
358E62.7Low66.4Low141 Ų141124.6 Ų124.666%0.65965%0.649SS**Hα-helixtrans-60.2-39.5175.9-75-169.2131.200112.6E354 K360 T362E354-E358 PolarHBondContact O-N 2.92Å; E358-K360 VanDerWaalsContact C-N 3.28Å; E358-K360 PolarHBondContact O-N 3.25Å; E358-T362 PolarHBondContact O-OG1 3.17Å
359V61.5Low64.2Low82 Ų82123.8 Ų123.850%0.49765%0.652SS.*Hα-helixtrans-66.8-30.6175.9174.20000112Q355 L357 T362Q355-V359 VanDerWaalsContact O-CG2 3.31Å; Q355-V359 WeakPolarHBondContact O-CG2 3.44Å; Q355-V359 PolarHBondContact O-N 2.97Å; L357-V359 VanDerWaalsContact C-N 3.33Å; L357-V359 PolarHBondContact O-N 3.04Å; V359-T362 WeakPolarHBondContact CA-OG1 3.31Å; V359-T362 PolarHBondContact O-N 3.35Å; V359-T362 PolarHBondContact O-OG1 3.48Å
360K56Low62.1Low151 Ų151125.2 Ų125.266%0.65766%0.658SS**Hα-helixtrans-80.7-26.8-175.9-144.7173.3-174.6-175.20113.2R356 L357 E358 T362R356-K360 PolarHBondContact O-N 3Å; L357-K360 PolarHBondContact O-N 3.25Å; E358-K360 VanDerWaalsContact C-N 3.28Å; E358-K360 PolarHBondContact O-N 3.25Å; K360-T362 VanDerWaalsContact C-N 3.31Å
361D57Low59.9Low140 Ų140129.1 Ų129.175%0.74968%0.677SS**Hα-helixtrans-77.6-18.6173.8-67.8-29.5000112.3L357L357-D361 PolarHBondContact O-N 3.44Å; L357-D361 VanDerWaalsContact O-N 3.13Å
362T57.5Low57.5Low112 Ų112130 Ų13069%0.68769%0.693SS**SBendtrans-86.6-12.2176.2440000115.6E358 V359 K360E358-T362 PolarHBondContact O-OG1 3.17Å; V359-T362 WeakPolarHBondContact CA-OG1 3.31Å; V359-T362 PolarHBondContact O-N 3.35Å; V359-T362 PolarHBondContact O-OG1 3.48Å; K360-T362 VanDerWaalsContact C-N 3.31Å
363E54.3Low55.5Low163 Ų163130.6 Ų130.676%0.76271%0.708SS**SBendtrans-107.28.3-175.2-67.5-171.5147.900114.7
364G47.3Very low53.5Low73 Ų73130 Ų13075%0.75372%0.718SS**SBendtrans-100.23.6-17200000117.8
365N41.4Very low51.4Low153 Ų153130.3 Ų130.382%0.81873%0.73SS**  trans-132.492.9-172.4-165.218000111
366V42.5Very low49.8Very low136 Ų136129.6 Ų129.682%0.82474%0.738SS**  trans16486.7154.3157.80000108.8
367V47.9Very low48.1Very low149 Ų149128.3 Ų128.390%0.90375%0.746SS**  trans-152.3113.4156.6174.50000109.2
368G42.5Very low46.9Very low76 Ų76128.3 Ų128.378%0.78476%0.755SS**  trans62.2157.4150.700000118.3
369H41.4Very low45.8Very low152 Ų152130.7 Ų130.770%0.70476%0.763SS**  cis-172.1153.7-10.5-172.6-113.9000103.2
370E44Very low44.9Very low144 Ų144131.1 Ų131.167%0.67377%0.77SS**  trans54.7111.2157.975.9-148.7127.700123
371E39.8Very low44.5Very low191 Ų191127.7 Ų127.789%0.89377%0.765SS**  42.3116.9123-51.3-174141.900119.9
372C36Very low43.8Very low120 Ų120129.8 Ų129.881%0.81177%0.77SS**  175.1112.1115.2-166.20000112.5
373S44.1Very low43.1Very low109 Ų109128.3 Ų128.376%0.76277%0.769SS**  trans23.4139137.5-56.70000124.1
374S41.9Very low42.6Very low116 Ų116127.1 Ų127.181%0.81177%0.773SS**  trans70.7139149.5-100.20000116.8
375C37.9Very low42.6Very low107 Ų107128.3 Ų128.372%0.72377%0.77SS**  cis-165.2140.818.933.30000110.5
376S45.3Very low42.8Very low103 Ų103126.2 Ų126.272%0.7277%0.768SS**  trans25.3126.3137.1-31.70000120.6
377N41.1Very low43.1Very low168 Ų168125.3 Ų125.390%0.89877%0.767SS**  -166.2133.9104.6-102.1-8.7000113.9
378S42.1Very low43.3Very low109 Ų109123.6 Ų123.676%0.76276%0.759SS**  trans-95.5157.4-177.7-51.30000112.6
379F39.9Very low43.3Very low190 Ų190129.2 Ų129.283%0.83377%0.765SS**  trans-169.8105.2132.8-148.1-108.5000107.8
380S42.1Very low43.3Very low92 Ų92126.4 Ų126.464%0.64377%0.768SS**  56.3133.183.2-63.40000112.8
381S48.9Very low43.5Very low78 Ų78123.8 Ų123.855%0.54577%0.771SS.*  cis-166.114734.9-27.40000112.6
382E41.6Very low43.9Very low185 Ų185122.3 Ų122.386%0.86477%0.769SS**  65.4138.3125.1-58.8167.8149.800119.6
383A43.8Very low44.2Very low81 Ų81124.4 Ų124.467%0.66977%0.773SS**  cis-163.6146.831.900000113.4
384T43.2Very low45.2Very low137 Ų137124.6 Ų124.684%0.8477%0.771SS**  trans57.9141.2134.658.40000121.8
385S47.2Very low45.5Very low98 Ų98124.8 Ų124.869%0.68577%0.77SS**  cis-171.6158.4-7.470.10000110.5
386S46.5Very low45.6Very low110 Ų110125.8 Ų125.877%0.76978%0.775SS**  trans74.2135.7148.9-50.30000118.2
387S48Very low45.5Very low116 Ų116130 Ų13081%0.81178%0.783SS**  cis-167163.13.3-124.30000109.9
388P51.1Low45.3Very low114 Ų114131.5 Ų131.574%0.7479%0.785SS**  trans-119.9159.7-167.539.5-25.5000115.8
389E42.3Very low45.6Very low193 Ų193130.3 Ų130.390%0.90278%0.782SS**  trans-162.7106153.1-106.8-169.3105.300107
390A42.3Very low45.8Very low93 Ų93130 Ų13077%0.76978%0.78SS**  70.496.171.100000114.5
391A47.9Very low46.1Very low90 Ų90131 Ų13174%0.74479%0.794SS**  164.3127.8113.400000113.6
392N48.6Very low46.2Very low159 Ų159132.3 Ų132.385%0.8580%0.798SS**  trans86.589.3152.1-58-26.9000120.4
393N41.4Very low46.8Very low165 Ų165129.1 Ų129.188%0.88279%0.787SS**  trans-106.2144.9148.4-96.2-42000109.4
394P65.8Low47.5Very low112 Ų112129.7 Ų129.773%0.72779%0.786SS**  trans-96.1162.4150.734.2-25.5000112.1
395P48.4Very low48.1Very low121 Ų121129 Ų12979%0.78678%0.778SS**  trans-87.5174.1-160.9-2.724000114.8
396P40.8Very low48.6Very low128 Ų128131 Ų13183%0.83178%0.778SS**  trans-83.9144.3-160.335.1-33.2000112.5
397Q43.4Very low49.2Very low192 Ų192131.6 Ų131.690%0.89777%0.772SS**  trans-121.2124166.4-75.3-164-51.900111.1
398E36.2Very low50Low198 Ų198132 Ų13293%0.92576%0.764SS**  trans-44128.1164.1-62.7164.6123.900111.8
399A47.7Very low50.2Low85 Ų85135.6 Ų135.670%0.70276%0.763SS**  trans-170.9107.6147.300000112.7
400K45.1Very low51.2Low184 Ų184131 Ų13180%0.875%0.752SS**  trans75.8106.8133.3-55.4-171.9179.6-179.40118.5V402K400-V402 HydrophobicContact CB-CG2 3.86Å; K400-V402 WeakPolarHBondContact O-CG2 3.38Å; K400-V402 PolarHBondContact O-N 2.91Å
401A47.1Very low52.1Low112 Ų112131.6 Ų131.693%0.92675%0.75SS**  trans-56.792.7154.800000110.9
402V51.7Low52.8Low106 Ų106132.1 Ų132.164%0.64274%0.74SS**  trans-152.687.9170-94.70000105.6K400K400-V402 HydrophobicContact CB-CG2 3.86Å; K400-V402 WeakPolarHBondContact O-CG2 3.38Å; K400-V402 PolarHBondContact O-N 2.91Å
403D53.3Low53.5Low117 Ų117132.6 Ų132.663%0.62674%0.743SS**  trans-174.610.5160.7-93-24.5000115.9
404S58.7Low55.1Low94 Ų94130.9 Ų130.966%0.65773%0.733SS**Hα-helixtrans-74.8-26.6174.774.70000113.4
405D57.1Low55.4Low123 Ų123130.5 Ų130.566%0.65873%0.731SS**Hα-helixtrans-84.2-18.9-177.7-72.5-19.2000113.6W409D405-W409 VanDerWaalsContact O-CD1 3.24Å
406M57.9Low56.5Low139 Ų139130 Ų13069%0.68573%0.727SS**Hα-helixtrans-77.9-24.8173.1-85-147.4160.100113.1L408 S410M406-L408 VanDerWaalsContact C-N 3.35Å; M406-S410 PolarHBondContact O-OG 3.48Å
407L59.3Low57.9Low123 Ų123131.9 Ų131.964%0.64473%0.729SS**Hα-helixtrans-75.1-24178.7-71.3162000112.8
408L63.7Low58.7Low124 Ų124136.4 Ų136.465%0.64974%0.739SS**Hα-helixtrans-72.9-34.9179.7-170.663.5000112.8M406M406-L408 VanDerWaalsContact C-N 3.35Å
409W55.8Low59.8Low190 Ų190133.3 Ų133.372%0.7273%0.73SS**Hα-helixtrans-83.4-20.6179.9-63.995.7000113.4D405 S411 L412D405-W409 VanDerWaalsContact O-CD1 3.24Å; W409-S411 PolarHBondContact O-N 3.13Å; W409-L412 HydrophobicContact CE3-CD1 3.75Å; W409-L412 HydrophobicContact CZ3-CD1 4.03Å; W409-L412 PolarHBondContact O-N 3.04Å
410S62.3Low60.5Low97 Ų97135.8 Ų135.868%0.67873%0.732SS**THydrogen-bonded Turntrans-73.3-11.6178.7-56.60000113.6M406M406-S410 PolarHBondContact O-OG 3.48Å
411S61.2Low61.3Low104 Ų104133.2 Ų133.273%0.72773%0.728SS**THydrogen-bonded Turntrans-943.1176.7-65.80000114W409 D413W409-S411 PolarHBondContact O-N 3.13Å; S411-D413 PolarHBondContact O-N 3.36Å
412L63Low62.2Low102 Ų102134.4 Ų134.453%0.53472%0.716SS.*  trans-93.182.3174.5-76.5169.7000109.6W409 L414W409-L412 HydrophobicContact CE3-CD1 3.75Å; W409-L412 HydrophobicContact CZ3-CD1 4.03Å; W409-L412 PolarHBondContact O-N 3.04Å; L412-L414 HydrophobicContact CB-CD1 3.92Å; L412-L414 PolarHBondContact O-N 3.31Å
413D63.6Low62.8Low169 Ų169136.2 Ų136.290%0.90472%0.721SS**  trans-71.278174.4-149.912.6000109.4S411S411-D413 PolarHBondContact O-N 3.36Å
414L74.7Confident63.5Low129 Ų129137.5 Ų137.568%0.67573%0.727SS**PPolyproline II helixtrans-84.7134169.9-83.498.1000109.6L412L412-L414 HydrophobicContact CB-CD1 3.92Å; L412-L414 PolarHBondContact O-N 3.31Å
415P72.7Confident63.8Low104 Ų104140.6 Ų140.668%0.67573%0.732SS**PPolyproline II helixtrans-64.1146.9174.527.8-33.6000110.6I417P415-I417 PolarHBondContact O-N 3.26Å
416P72Confident64.3Low111 Ų111141.9 Ų141.972%0.72174%0.738SS**PPolyproline II helixtrans-60.9127174.324.5-31.8000109.8Y418P416-Y418 PolarHBondContact O-N 3.5Å
417I70.4Confident64.9Low167 Ų167142.2 Ų142.286%0.85674%0.742SS**  trans-76.4115.2170-41.3173.2000105.6P415P415-I417 PolarHBondContact O-N 3.26Å
418Y59.6Low65.4Low286 Ų286143.9 Ų143.9100%1.12275%0.751SS**  trans-760174.4-103-86.1000111.8P416P416-Y418 PolarHBondContact O-N 3.5Å

Retrieved 418 of 418 residues in 147.4 ms (Link to these results)