METRN_HUMAN Loading...

Meteorin

Involved in both glial cell differentiation and axonal network formation during neurogenesis. Promotes astrocyte differentiation and transforms cerebellar astrocytes into radial glia. Also induces axonal extension in small and intermediate neurons of sensory ganglia by activating nearby satellite glia (By similarity).

AlphaFold DB , UniProt , Accession Q9UJH8, Species HUMAN (Homo sapiens, Human), Gene METRN, Length 293 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.8Very low46.4Very low251 Ų251137.7 Ų137.7100%1.23688%0.876SS**  0125.90-68.1178.4-175.200107.7
2G45.2Very low46.4Very low82 Ų82139.9 Ų139.985%0.84588%0.875SS**  trans81.6108.7162.800000118.2
3F47Very low46.2Very low216 Ų216139.2 Ų139.295%0.94788%0.875SS**  trans-73.2171.6170.2-90.6-89.7000113.5
4P50.3Low46.2Very low115 Ų115136.6 Ų136.675%0.74786%0.863SS**  trans-113.1-160.9-147.746.4-40.7000114.8
5A46.2Very low46.2Very low98 Ų98132.6 Ų132.681%0.8186%0.857SS**  trans118.7120.7153.400000115.6
6A47.2Very low46.4Very low100 Ų100134.6 Ų134.683%0.82686%0.857SS**  178117.9127.800000112.4
7A46.3Very low46.5Very low101 Ų101136.6 Ų136.684%0.83586%0.859SS**  trans65.1121.9134.300000122.3
8L45.5Very low46.7Very low156 Ų156134.2 Ų134.282%0.81785%0.854SS**  trans-64.4166.7163.7-79.790.5000114
9L43.6Very low46.6Very low164 Ų164133.6 Ų133.686%0.85985%0.851SS**  trans93.495.1152.8-65.8128.8000118.3
10C47.1Very low46.7Very low135 Ų135131.7 Ų131.791%0.91285%0.848SS**  trans-169.3109.6141.8-1100000111
11A48.2Very low46.6Very low97 Ų97130.1 Ų130.180%0.80285%0.847SS**  trans173.975.5143.100000110.3C13A11-C13 PolarHBondContact O-N 3.5Å
12L46.3Very low46.3Very low164 Ų164129.8 Ų129.886%0.85983%0.831SS**  trans-75.6109.2150.9-91.594.8000107.3
13C43.6Very low46.1Very low130 Ų130130.1 Ų130.188%0.87883%0.827SS**  trans-97.890.1161.2-89.80000108.8A11 G15A11-C13 PolarHBondContact O-N 3.5Å; C13-G15 PolarHBondContact O-N 3.22Å
14C47Very low45.4Very low104 Ų104123.3 Ų123.370%0.70382%0.817SS**  trans-69.2101.5163-75.40000109.5L16C14-L16 PolarHBondContact O-N 3.28Å
15G46.2Very low44.8Very low76 Ų76126.8 Ų126.878%0.78482%0.817SS**  trans-76.898163.100000110C13 L17C13-G15 PolarHBondContact O-N 3.22Å; G15-L17 PolarHBondContact O-N 3.28Å
16L48.3Very low44.5Very low164 Ų164126.2 Ų126.286%0.85981%0.807SS**  trans-63.2111.1174.3-75.4150.2000110.8C14C14-L16 PolarHBondContact O-N 3.28Å
17L48Very low44.5Very low170 Ų170130.7 Ų130.789%0.8981%0.81SS**  trans-112.292.7156.7-76.9169.1000107.3G15G15-L17 PolarHBondContact O-N 3.28Å
18A50.7Low45Very low93 Ų93131.6 Ų131.677%0.76980%0.797SS**PPolyproline II helixtrans-75.7124.6169.200000108.8
19P45.1Very low46.3Very low122 Ų122130.8 Ų130.879%0.79278%0.783SS**PPolyproline II helixtrans-72.8130.5173.630-30000108.7A21P19-A21 PolarHBondContact O-N 3.02Å; P19-A21 VanDerWaalsContact O-N 3.08Å
20A49.4Very low48.5Very low96 Ų96125.4 Ų125.479%0.79376%0.759SS**PPolyproline II helixtrans-54.3116.7170.600000109.4R22A20-R22 PolarHBondContact O-N 3.08Å
21A43.7Very low50.7Low99 Ų99121.3 Ų121.382%0.81873%0.732SS**  trans-58.1110.4172.900000108.6P19 A23P19-A21 PolarHBondContact O-N 3.02Å; P19-A21 VanDerWaalsContact O-N 3.08Å; A21-A23 PolarHBondContact O-N 3.07Å; A21-A23 VanDerWaalsContact O-N 3.07Å
22R37.3Very low53Low243 Ų243119.3 Ų119.392%0.91770%0.704SS**  trans-63.9108168.5-74.4-174.2164.9109.9-2.1107.3A20 G24A20-R22 PolarHBondContact O-N 3.08Å; R22-G24 PolarHBondContact O-N 3.03Å
23A41.4Very low55.3Low90 Ų90118 Ų11874%0.74469%0.687SS**  trans-58.7109.316300000107.3A21 Y25A21-A23 PolarHBondContact O-N 3.07Å; A21-A23 VanDerWaalsContact O-N 3.07Å; A23-Y25 PolarHBondContact O-N 3.09Å; A23-Y25 VanDerWaalsContact O-N 3.09Å
24G33.1Very low57.6Low72 Ų72112.5 Ų112.574%0.74265%0.653SS**  trans-59.7113.3175.300000109R22 S26R22-G24 PolarHBondContact O-N 3.03Å; G24-S26 VanDerWaalsContact C-N 3.26Å; G24-S26 PolarHBondContact O-N 2.91Å
25Y37.9Very low59.8Low189 Ų189109.3 Ų109.374%0.74163%0.632SS**  trans-65.290.6166-100.5-75.1000107.6A23 R29A23-Y25 PolarHBondContact O-N 3.09Å; A23-Y25 VanDerWaalsContact O-N 3.09Å; Y25-R29 VanDerWaalsContact CD1-CZ 3.46Å
26S39.8Very low61.9Low86 Ų86105.7 Ų105.760%0.60160%0.595SS**  trans-69.1133.9171.6-173.90000109.4G24 E28G24-S26 VanDerWaalsContact C-N 3.26Å; G24-S26 PolarHBondContact O-N 2.91Å; S26-E28 PolarHBondContact O-N 2.64Å
27E45.5Very low63.7Low193 Ų193103.9 Ų103.990%0.90259%0.585SS**SBendtrans-67.3-8.9-177.4-73.5-156139.500114.1R29E27-R29 PolarHBondContact O-N 3.31Å
28E57.1Low65.5Low120 Ų120101.6 Ų101.656%0.56158%0.579SS**  trans-94.268.6177.5-57-170166.900111.2S26 C30 S31S26-E28 PolarHBondContact O-N 2.64Å; E28-C30 VanDerWaalsContact C-N 3.29Å; E28-C30 PolarHBondContact O-N 2.98Å; E28-S31 VanDerWaalsContact CB-O 3.31Å; E28-S31 WeakPolarHBondContact CB-O 3.19Å
29R73Confident67Low139 Ų13999 Ų9953%0.52555%0.55SS.*SBendtrans-74.9-15.9-177.5-65.9-167-167.7-164.610.4114.9Y25 E27 A50Y25-R29 VanDerWaalsContact CD1-CZ 3.46Å; E27-R29 PolarHBondContact O-N 3.31Å; R29-A50 PolarHBondContact O-N 3.06Å
30C90.3Very high68.9Low52 Ų52100 Ų10035%0.35155%0.545SS..SBendtrans-104.5-38.1-175.9-560000112.4E28 C51 G54 F148E28-C30 VanDerWaalsContact C-N 3.29Å; E28-C30 PolarHBondContact O-N 2.98Å; C30-C51 WeakPolarHBondContact CA-SG 3.11Å; C30-C51 HydrophobicContact CB-CB 3.49Å; C30-C51 VanDerWaalsContact CB-CB 3.49Å; C30-C51 WeakPolarHBondContact CB-SG 3.32Å; C30-C51 WeakPolarHBondContact SG-CB 3.39Å; C30-C51 CovalentContact SG-SG 2.03Å; C30-C51 PolarHBondContact SG-SG 2.85Å; C30-G54 WeakPolarHBondContact O-CA 3.38Å; C30-F148 WeakPolarHBondContact O-CE1 3.27Å; C30-F148 WeakPolarHBondContact O-CZ 2.99Å
31S94.1Very high70.5Confident48 Ų48101.4 Ų101.434%0.33655%0.546SS..  trans-118.8153-178.9-61.90000110.1E28 A55E28-S31 VanDerWaalsContact CB-O 3.31Å; E28-S31 WeakPolarHBondContact CB-O 3.19Å; S31-A55 CarbonylContact C-O 3.5Å; S31-A55 WeakPolarHBondContact CA-O 3.28Å; S31-A55 WeakPolarHBondContact CB-O 3.31Å; S31-A55 PolarHBondContact OG-N 3.3Å
32W94.9Very high72.4Confident56 Ų56100.6 Ų100.621%0.21255%0.547CS..EExtended strand (participates in β ladder)trans-133.4136.2175.9175.286000110.5G34 L47 L49 A55 V56 E57 W58 L65W32-G34 VanDerWaalsContact CZ2-CA 3.47Å; W32-L47 HydrophobicContact CD2-CD1 3.53Å; W32-L47 HydrophobicContact CD2-CD2 4.23Å; W32-L47 HydrophobicContact CE3-CD1 3.78Å; W32-L47 HydrophobicContact CG-CD1 4.01Å; W32-L47 HydrophobicContact CG-CD2 4.23Å; W32-L47 HydrophobicContact CH2-CD1 4.06Å; W32-L47 HydrophobicContact CZ2-CD1 3.85Å; W32-L47 HydrophobicContact CZ2-CD2 4.19Å; W32-L47 HydrophobicContact CZ3-CD1 4.04Å; W32-L49 HydrophobicContact CB-CD1 4.41Å; W32-L49 HydrophobicContact CB-CD2 4.14Å; W32-A55 PolarHBondContact N-O 3.19Å; W32-V56 HydrophobicContact CE3-CG1 3.88Å; W32-V56 HydrophobicContact CZ3-CG1 4.24Å; W32-V56 CarbonylContact O-C 3.52Å; W32-V56 WeakPolarHBondContact O-CA 3.24Å; W32-E57 PolarHBondContact O-N 3.12Å; W32-W58 HydrophobicContact CH2-CB 4.42Å; W32-W58 AromaticContact CH2-CD1 3.65Å; W32-W58 HydrophobicContact CH2-CG 4.12Å; W32-W58 HydrophobicContact CZ3-CB 3.88Å; W32-W58 HydrophobicContact CZ3-CG 4.05Å; W32-L65 HydrophobicContact CH2-CD1 3.53Å; W32-L65 HydrophobicContact CZ2-CD1 4.39Å; W32-L65 HydrophobicContact CZ3-CD1 3.74Å
33R95.1Very high74.7Confident135 Ų13591.2 Ų91.251%0.50952%0.518SS..EExtended strand (participates in β ladder)trans-129.7128.2169.5-179.9171.8168143.3-14.7109.5E57 L59R33-E57 WeakPolarHBondContact CA-O 3.32Å; R33-E57 HydrophobicContact CB-CB 4.17Å; R33-E57 HydrophobicContact CG-CB 3.99Å; R33-E57 IonicContact CZ-OE2 2.76Å; R33-E57 IonicContact NE-OE2 3.02Å; R33-E57 IonicContact NH1-OE2 3.76Å; R33-E57 PolarHBondContact NH1-OE2 2.78Å; R33-L59 HydrophobicContact CG-CD1 4.39Å
34G93Very high77.2Confident16 Ų1689.9 Ų89.917%0.16550%0.501CS..EExtended strand (participates in β ladder)trans-160.4168.6179.900000113.4W32 E57 L59W32-G34 VanDerWaalsContact CZ2-CA 3.47Å; G34-E57 PolarHBondContact N-O 3.27Å; G34-E57 VanDerWaalsContact N-O 3.08Å; G34-L59 PolarHBondContact O-N 3.23Å
35S92.7Very high80.1Confident36 Ų3687.4 Ų87.425%0.25248%0.475SS..EExtended strand (participates in β ladder)trans-105.5137.7-178.2-173.40000111.2L37 T38 L59S35-L37 VanDerWaalsContact C-N 3.28Å; S35-L37 PolarHBondContact OG-N 3.25Å; S35-T38 PolarHBondContact O-OG1 3.3Å; S35-T38 VanDerWaalsContact O-OG1 3.11Å; S35-L59 CarbonylContact C-O 3.42Å; S35-L59 VanDerWaalsContact CA-O 3.24Å; S35-L59 WeakPolarHBondContact CA-O 3.41Å
36G90.7Very high82.7Confident1 Ų184 Ų841%0.0147%0.466CS..G310 helixtrans-72.7-19.5170.100000113.4T38 Q39 L59 Y60G36-T38 PolarHBondContact O-N 3.11Å; G36-Q39 VanDerWaalsContact O-CB 3.28Å; G36-Q39 WeakPolarHBondContact O-CB 3.39Å; G36-Q39 PolarHBondContact O-N 2.8Å; G36-Q39 VanDerWaalsContact O-N 3.12Å; G36-L59 PolarHBondContact N-O 3.18Å; G36-Y60 VanDerWaalsContact CA-O 3.26Å; G36-Y60 WeakPolarHBondContact CA-O 3.39Å; G36-Y60 PolarHBondContact N-O 3.41Å
37L85.7Confident85.1Confident125 Ų12581.4 Ų81.465%0.65445%0.445SS*.G310 helixtrans-69-18.9-177.6-59177.1000113.9S35 Q39 Y60S35-L37 VanDerWaalsContact C-N 3.28Å; S35-L37 PolarHBondContact OG-N 3.25Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; L37-Y60 HydrophobicContact CD1-CD1 4.27Å; L37-Y60 HydrophobicContact CD1-CD2 4.01Å; L37-Y60 HydrophobicContact CD1-CG 3.8Å; L37-Y60 HydrophobicContact CG-CG 4.11Å
38T84.9Confident87.3Confident123 Ų12376 Ų7676%0.75543%0.434SS*.G310 helixtrans-90.10.9177.153.60000112.8S35 G36S35-T38 PolarHBondContact O-OG1 3.3Å; S35-T38 VanDerWaalsContact O-OG1 3.11Å; G36-T38 PolarHBondContact O-N 3.11Å
39Q82.8Confident89Confident37 Ų3770.6 Ų70.617%0.17341%0.409CS..SBendtrans-90.4134.7-176.4-174.8169.7-3.700110.9G36 L37 S43 A62 A64G36-Q39 VanDerWaalsContact O-CB 3.28Å; G36-Q39 WeakPolarHBondContact O-CB 3.39Å; G36-Q39 PolarHBondContact O-N 2.8Å; G36-Q39 VanDerWaalsContact O-N 3.12Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; Q39-S43 WeakPolarHBondContact CG-OG 3.41Å; Q39-S43 PolarHBondContact NE2-O 2.87Å; Q39-A62 PolarHBondContact OE1-O 2.77Å; Q39-A64 PolarHBondContact NE2-O 2.89Å
40E85.6Confident89.7Confident145 Ų14566.7 Ų66.768%0.67841%0.406SS*.PPolyproline II helixtrans-59.7131.2175.8-72.6-62.615600110.6G42 S43E40-G42 PolarHBondContact O-N 3.02Å; E40-S43 VanDerWaalsContact O-CB 3.27Å; E40-S43 WeakPolarHBondContact O-CB 3.34Å; E40-S43 PolarHBondContact O-N 2.79Å; E40-S43 PolarHBondContact O-OG 2.03Å
41P82Confident89.7Confident125 Ų12565.7 Ų65.781%0.81240%0.399SS*.THydrogen-bonded Turntrans-53.6130.3178.2-26.834.8000112.1S43P41-S43 PolarHBondContact O-N 2.82Å
42G83.3Confident89.5Confident82 Ų8266.5 Ų66.585%0.84541%0.409SS*.THydrogen-bonded Turntrans78.1-5.4-178.300000115.3E40E40-G42 PolarHBondContact O-N 3.02Å
43S87.1Confident89.4Confident45 Ų4567.8 Ų67.832%0.31542%0.417SS..  trans-79.1158.2172.174.60000111.9Q39 E40 P41Q39-S43 WeakPolarHBondContact CG-OG 3.41Å; Q39-S43 PolarHBondContact NE2-O 2.87Å; E40-S43 VanDerWaalsContact O-CB 3.27Å; E40-S43 WeakPolarHBondContact O-CB 3.34Å; E40-S43 PolarHBondContact O-N 2.79Å; E40-S43 PolarHBondContact O-OG 2.03Å; P41-S43 PolarHBondContact O-N 2.82Å
44V93.1Very high89.3Confident62 Ų6261.7 Ų61.738%0.37640%0.397SS..EExtended strand (participates in β ladder)trans-114.3112.6170.8-177.40000108.8A64 R66 F130V44-A64 WeakPolarHBondContact CA-O 3.35Å; V44-A64 HydrophobicContact CG1-CB 4.28Å; V44-A64 HydrophobicContact CG2-CB 4.31Å; V44-R66 HydrophobicContact CG1-CB 3.91Å; V44-F130 HydrophobicContact CG1-CE2 4.05Å; V44-F130 HydrophobicContact CG2-CE2 4.46Å
45G92.8Very high89.4Confident20 Ų2062.1 Ų62.121%0.20640%0.399CS..EExtended strand (participates in β ladder)trans-66.1133.5177.800000110.2A64 L65 R66G45-A64 PolarHBondContact N-O 3.13Å; G45-L65 CarbonylContact O-C 3.55Å; G45-L65 WeakPolarHBondContact O-CA 3.06Å; G45-R66 PolarHBondContact O-N 3.27Å
46Q92.5Very high89.6Confident119 Ų11960.5 Ų60.556%0.55639%0.387SS*.EExtended strand (participates in β ladder)trans-102128.1179.5-60.9-67.4-44.200109.5
47L92Very high89.9Confident30 Ų3063.7 Ų63.716%0.15740%0.402CS..EExtended strand (participates in β ladder)trans-127.8143.6177.4-60.4175.8000109.8W32 L65 R66 L67 T68W32-L47 HydrophobicContact CD2-CD1 3.53Å; W32-L47 HydrophobicContact CD2-CD2 4.23Å; W32-L47 HydrophobicContact CE3-CD1 3.78Å; W32-L47 HydrophobicContact CG-CD1 4.01Å; W32-L47 HydrophobicContact CG-CD2 4.23Å; W32-L47 HydrophobicContact CH2-CD1 4.06Å; W32-L47 HydrophobicContact CZ2-CD1 3.85Å; W32-L47 HydrophobicContact CZ2-CD2 4.19Å; W32-L47 HydrophobicContact CZ3-CD1 4.04Å; L47-L65 HydrophobicContact CD1-CD1 3.95Å; L47-L65 HydrophobicContact CD1-CD2 4.44Å; L47-R66 PolarHBondContact N-O 2.76Å; L47-L67 HydrophobicContact CB-CD1 3.83Å; L47-L67 CarbonylContact O-C 3.5Å; L47-L67 WeakPolarHBondContact O-CA 3.3Å; L47-T68 PolarHBondContact O-N 3.17Å
48A91.6Very high90.4Very high80 Ų8057.8 Ų57.866%0.66137%0.371SS*.EExtended strand (participates in β ladder)trans-133.9118.6174.500000109.3T68A48-T68 WeakPolarHBondContact CA-O 3.26Å
49L92.3Very high90.8Very high7 Ų753.1 Ų53.14%0.03734%0.341CS..EExtended strand (participates in β ladder)trans-113.2116.7177.6-65178.6000108.6W32 V56 L67 T68 L69 G70 F148W32-L49 HydrophobicContact CB-CD1 4.41Å; W32-L49 HydrophobicContact CB-CD2 4.14Å; L49-V56 HydrophobicContact CD1-CG2 3.9Å; L49-L67 HydrophobicContact CB-CD1 4.19Å; L49-L67 HydrophobicContact CD1-CD1 3.72Å; L49-L67 HydrophobicContact CD1-CD2 4.36Å; L49-L67 HydrophobicContact CG-CD1 3.66Å; L49-T68 PolarHBondContact N-O 3.11Å; L49-L69 HydrophobicContact CB-CD2 4.48Å; L49-L69 CarbonylContact O-C 3.51Å; L49-G70 PolarHBondContact O-N 2.78Å; L49-F148 HydrophobicContact CB-CE1 4.42Å; L49-F148 HydrophobicContact CB-CZ 4.01Å; L49-F148 HydrophobicContact CD1-CE1 3.57Å; L49-F148 HydrophobicContact CD1-CZ 4.02Å
50A88.3Confident91.3Very high57 Ų5755.6 Ų55.647%0.47135%0.349SS..  trans-87.5-17.5-168.600000113.8R29R29-A50 PolarHBondContact O-N 3.06Å
51C90.1Very high91.7Very high30 Ų3049.6 Ų49.620%0.20332%0.323CS..SBendtrans-77.6159.5-172.5-54.50000112.7C30 E53C30-C51 WeakPolarHBondContact CA-SG 3.11Å; C30-C51 HydrophobicContact CB-CB 3.49Å; C30-C51 VanDerWaalsContact CB-CB 3.49Å; C30-C51 WeakPolarHBondContact CB-SG 3.32Å; C30-C51 WeakPolarHBondContact SG-CB 3.39Å; C30-C51 CovalentContact SG-SG 2.03Å; C30-C51 PolarHBondContact SG-SG 2.85Å; C51-E53 VanDerWaalsContact C-N 3.28Å; C51-E53 WeakPolarHBondContact CB-O 3.38Å
52A88.9Confident92.2Very high65 Ų6545.5 Ų45.554%0.53730%0.3SS..SBendtrans-73.8-19.6173.700000112.6E149 L150A52-E149 CarbonylContact O-C 3.54Å; A52-E149 WeakPolarHBondContact O-CA 3.26Å; A52-L150 PolarHBondContact O-N 2.83Å
53E91.9Very high92.6Very high83 Ų8343.6 Ų43.639%0.38828%0.281SS..EExtended strand (participates in β ladder)trans-142.3149175.6-171.9-173.9165.500109.3C51 R147 F148 E149C51-E53 VanDerWaalsContact C-N 3.28Å; C51-E53 WeakPolarHBondContact CB-O 3.38Å; E53-R147 IonicContact OE1-CZ 2.73Å; E53-R147 IonicContact OE1-NE 2.79Å; E53-R147 IonicContact OE1-NH2 3.06Å; E53-R147 PolarHBondContact OE1-NH2 2.71Å; E53-F148 WeakPolarHBondContact CA-O 3.49Å; E53-F148 WeakPolarHBondContact CG-O 3.41Å; E53-E149 HydrophobicContact CB-CG 4.41Å; E53-E149 HydrophobicContact CG-CG 3.9Å
54G94.1Very high93Very high8 Ų841.9 Ų41.98%0.08227%0.269CS..EExtended strand (participates in β ladder)trans-179.3-167.5172.100000113.3C30 R147 F148C30-G54 WeakPolarHBondContact O-CA 3.38Å; G54-R147 WeakPolarHBondContact O-CA 3.43Å; G54-F148 PolarHBondContact N-O 3.08Å; G54-F148 VanDerWaalsContact N-O 3.13Å; G54-F148 WeakPolarHBondContact O-CD1 3.27Å; G54-F148 PolarHBondContact O-N 2.88Å
55A95.5Very high93.1Very high25 Ų2539.2 Ų39.221%0.20725%0.252CS..EExtended strand (participates in β ladder)trans-134.7149.8-179.500000112S31 W32 F146 R147S31-A55 CarbonylContact C-O 3.5Å; S31-A55 WeakPolarHBondContact CA-O 3.28Å; S31-A55 WeakPolarHBondContact CB-O 3.31Å; S31-A55 PolarHBondContact OG-N 3.3Å; W32-A55 PolarHBondContact N-O 3.19Å; A55-F146 WeakPolarHBondContact CA-O 3.34Å; A55-R147 HydrophobicContact CB-CG 4.24Å
56V96.4Very high93.2Very high1 Ų140.7 Ų40.71%0.00625%0.252CS..EExtended strand (participates in β ladder)trans-121.8126.2174.21780000107.2W32 L49 L67 L131 A145 F146W32-V56 HydrophobicContact CE3-CG1 3.88Å; W32-V56 HydrophobicContact CZ3-CG1 4.24Å; W32-V56 CarbonylContact O-C 3.52Å; W32-V56 WeakPolarHBondContact O-CA 3.24Å; L49-V56 HydrophobicContact CD1-CG2 3.9Å; V56-L67 HydrophobicContact CG2-CD2 3.63Å; V56-L131 HydrophobicContact CG1-CD2 4.21Å; V56-A145 CarbonylContact O-C 3.59Å; V56-A145 WeakPolarHBondContact O-CA 3.5Å; V56-F146 HydrophobicContact CB-CD1 4.39Å; V56-F146 HydrophobicContact CB-CD2 4.45Å; V56-F146 HydrophobicContact CB-CE1 3.97Å; V56-F146 HydrophobicContact CB-CE2 4.03Å; V56-F146 HydrophobicContact CB-CZ 3.78Å; V56-F146 HydrophobicContact CG1-CE1 4.03Å; V56-F146 HydrophobicContact CG1-CZ 4.06Å; V56-F146 HydrophobicContact CG2-CE1 4.48Å; V56-F146 HydrophobicContact CG2-CE2 3.82Å; V56-F146 HydrophobicContact CG2-CZ 3.79Å; V56-F146 PolarHBondContact N-O 3.33Å; V56-F146 PolarHBondContact O-N 2.82Å
57E96.7Very high93.3Very high69 Ų6935 Ų3532%0.32223%0.225SC..EExtended strand (participates in β ladder)trans-125.8101.9173.5-74.9-176.6-136.400109.8W32 R33 G34 A145W32-E57 PolarHBondContact O-N 3.12Å; R33-E57 WeakPolarHBondContact CA-O 3.32Å; R33-E57 HydrophobicContact CB-CB 4.17Å; R33-E57 HydrophobicContact CG-CB 3.99Å; R33-E57 IonicContact CZ-OE2 2.76Å; R33-E57 IonicContact NE-OE2 3.02Å; R33-E57 IonicContact NH1-OE2 3.76Å; R33-E57 PolarHBondContact NH1-OE2 2.78Å; G34-E57 PolarHBondContact N-O 3.27Å; G34-E57 VanDerWaalsContact N-O 3.08Å; E57-A145 HydrophobicContact CG-CB 3.99Å
58W95.7Very high93.4Very high1 Ų135.5 Ų35.50%0.00423%0.229CC..EExtended strand (participates in β ladder)trans-99.2103.5177.4-164.714.7000110.5W32 P61 A62 L65 A92 L131 A133 V143 A144W32-W58 HydrophobicContact CH2-CB 4.42Å; W32-W58 AromaticContact CH2-CD1 3.65Å; W32-W58 HydrophobicContact CH2-CG 4.12Å; W32-W58 HydrophobicContact CZ3-CB 3.88Å; W32-W58 HydrophobicContact CZ3-CG 4.05Å; W58-P61 HydrophobicContact CB-CG 4.32Å; W58-P61 HydrophobicContact CD2-CB 3.67Å; W58-P61 HydrophobicContact CD2-CG 3.94Å; W58-P61 HydrophobicContact CE3-CB 3.63Å; W58-P61 HydrophobicContact CE3-CG 4.03Å; W58-P61 HydrophobicContact CG-CB 4.28Å; W58-P61 HydrophobicContact CG-CG 4.07Å; W58-P61 HydrophobicContact CH2-CB 4.07Å; W58-P61 HydrophobicContact CZ2-CB 4.14Å; W58-P61 HydrophobicContact CZ3-CB 3.83Å; W58-P61 WeakPolarHBondContact O-CG 3.16Å; W58-A62 VanDerWaalsContact CZ2-O 3.26Å; W58-A62 WeakPolarHBondContact CZ2-O 3.48Å; W58-L65 HydrophobicContact CB-CD1 4.44Å; W58-L65 HydrophobicContact CD2-CD1 3.38Å; W58-L65 HydrophobicContact CD2-CG 4.05Å; W58-L65 VanDerWaalsContact CE2-CD1 3.45Å; W58-L65 HydrophobicContact CE3-CD1 3.8Å; W58-L65 HydrophobicContact CE3-CG 4.26Å; W58-L65 HydrophobicContact CG-CD1 3.7Å; W58-L65 HydrophobicContact CH2-CD1 4.32Å; W58-L65 HydrophobicContact CH2-CG 3.92Å; W58-L65 HydrophobicContact CZ2-CD1 3.93Å; W58-L65 HydrophobicContact CZ2-CD2 4.3Å; W58-L65 HydrophobicContact CZ2-CG 3.64Å; W58-L65 HydrophobicContact CZ3-CD1 4.26Å; W58-L65 HydrophobicContact CZ3-CG 4.21Å; W58-A92 HydrophobicContact CE3-CB 4.18Å; W58-A92 HydrophobicContact CZ3-CB 4.15Å; W58-L131 HydrophobicContact CE3-CB 4.27Å; W58-L131 HydrophobicContact CE3-CD2 4.38Å; W58-L131 HydrophobicContact CZ3-CB 3.98Å; W58-A133 HydrophobicContact CH2-CB 3.91Å; W58-A133 HydrophobicContact CZ3-CB 4.26Å; W58-V143 WeakPolarHBondContact O-CA 3.49Å; W58-A144 HydrophobicContact CB-CB 4.33Å; W58-A144 PolarHBondContact N-O 2.91Å; W58-A144 PolarHBondContact O-N 2.79Å
59L94.6Very high93.3Very high25 Ų2531.7 Ų31.713%0.13120%0.198CC..EExtended strand (participates in β ladder)trans-80.2138.5176.9-57.1172.5000109.7R33 G34 S35 G36 V143R33-L59 HydrophobicContact CG-CD1 4.39Å; G34-L59 PolarHBondContact O-N 3.23Å; S35-L59 CarbonylContact C-O 3.42Å; S35-L59 VanDerWaalsContact CA-O 3.24Å; S35-L59 WeakPolarHBondContact CA-O 3.41Å; G36-L59 PolarHBondContact N-O 3.18Å; L59-V143 HydrophobicContact CD2-CB 4.37Å; L59-V143 HydrophobicContact CD2-CG1 3.9Å; L59-V143 HydrophobicContact CD2-CG2 3.57Å
60Y92.6Very high93Very high88 Ų8831.8 Ų31.835%0.34520%0.2SC..SBendtrans44.258-179.4-53.7-81.8000112.7G36 L37 A62 R141 R142G36-Y60 VanDerWaalsContact CA-O 3.26Å; G36-Y60 WeakPolarHBondContact CA-O 3.39Å; G36-Y60 PolarHBondContact N-O 3.41Å; L37-Y60 HydrophobicContact CD1-CD1 4.27Å; L37-Y60 HydrophobicContact CD1-CD2 4.01Å; L37-Y60 HydrophobicContact CD1-CG 3.8Å; L37-Y60 HydrophobicContact CG-CG 4.11Å; Y60-A62 PolarHBondContact O-N 2.77Å; Y60-R141 HydrophobicContact CE1-CB 3.99Å; Y60-R141 HydrophobicContact CE1-CG 4.12Å; Y60-R142 PolarHBondContact N-O 3.42Å
61P94Very high92.2Very high20 Ų2030.6 Ų30.613%0.1319%0.194CC..  trans-51.1129.8-177.9-28.637000112.2W58 G91 A133 R142 A144W58-P61 HydrophobicContact CB-CG 4.32Å; W58-P61 HydrophobicContact CD2-CB 3.67Å; W58-P61 HydrophobicContact CD2-CG 3.94Å; W58-P61 HydrophobicContact CE3-CB 3.63Å; W58-P61 HydrophobicContact CE3-CG 4.03Å; W58-P61 HydrophobicContact CG-CB 4.28Å; W58-P61 HydrophobicContact CG-CG 4.07Å; W58-P61 HydrophobicContact CH2-CB 4.07Å; W58-P61 HydrophobicContact CZ2-CB 4.14Å; W58-P61 HydrophobicContact CZ3-CB 3.83Å; W58-P61 WeakPolarHBondContact O-CG 3.16Å; P61-G91 VanDerWaalsContact CB-O 3.25Å; P61-G91 WeakPolarHBondContact CB-O 3.37Å; P61-A133 VanDerWaalsContact C-CB 3.49Å; P61-A133 HydrophobicContact CB-CB 3.74Å; P61-R142 WeakPolarHBondContact CD-O 3.04Å; P61-A144 HydrophobicContact CG-CB 3.94Å
62A91.9Very high91Very high38 Ų3835.6 Ų35.631%0.31423%0.226SC..  trans-146136.2176.700000109.7Q39 W58 Y60Q39-A62 PolarHBondContact OE1-O 2.77Å; W58-A62 VanDerWaalsContact CZ2-O 3.26Å; W58-A62 WeakPolarHBondContact CZ2-O 3.48Å; Y60-A62 PolarHBondContact O-N 2.77Å
63G92.8Very high89.8Confident43 Ų4336.1 Ų36.144%0.44322%0.22SC..SBendtrans70-128.1-174.200000112.2A133G63-A133 WeakPolarHBondContact O-CB 3.45Å; G63-A133 PolarHBondContact O-N 2.84Å
64A95.2Very high87.9Confident8 Ų838.2 Ų38.27%0.06624%0.241CC..EExtended strand (participates in β ladder)trans-147.2155-18000000113Q39 V44 G45 F130 L131Q39-A64 PolarHBondContact NE2-O 2.89Å; V44-A64 WeakPolarHBondContact CA-O 3.35Å; V44-A64 HydrophobicContact CG1-CB 4.28Å; V44-A64 HydrophobicContact CG2-CB 4.31Å; G45-A64 PolarHBondContact N-O 3.13Å; A64-F130 HydrophobicContact CB-CE1 4.09Å; A64-F130 HydrophobicContact CB-CE2 3.68Å; A64-F130 HydrophobicContact CB-CZ 3.35Å; A64-L131 CarbonylContact C-O 3.51Å; A64-L131 WeakPolarHBondContact CA-O 3.39Å; A64-L131 WeakPolarHBondContact CB-O 3.38Å
65L95.6Very high86.3Confident6 Ų648 Ų483%0.03128%0.275CS..EExtended strand (participates in β ladder)trans-120.2140.2170.3-60.2173.2000110.2W32 G45 L47 W58 L131W32-L65 HydrophobicContact CH2-CD1 3.53Å; W32-L65 HydrophobicContact CZ2-CD1 4.39Å; W32-L65 HydrophobicContact CZ3-CD1 3.74Å; G45-L65 CarbonylContact O-C 3.55Å; G45-L65 WeakPolarHBondContact O-CA 3.06Å; L47-L65 HydrophobicContact CD1-CD1 3.95Å; L47-L65 HydrophobicContact CD1-CD2 4.44Å; W58-L65 HydrophobicContact CB-CD1 4.44Å; W58-L65 HydrophobicContact CD2-CD1 3.38Å; W58-L65 HydrophobicContact CD2-CG 4.05Å; W58-L65 VanDerWaalsContact CE2-CD1 3.45Å; W58-L65 HydrophobicContact CE3-CD1 3.8Å; W58-L65 HydrophobicContact CE3-CG 4.26Å; W58-L65 HydrophobicContact CG-CD1 3.7Å; W58-L65 HydrophobicContact CH2-CD1 4.32Å; W58-L65 HydrophobicContact CH2-CG 3.92Å; W58-L65 HydrophobicContact CZ2-CD1 3.93Å; W58-L65 HydrophobicContact CZ2-CD2 4.3Å; W58-L65 HydrophobicContact CZ2-CG 3.64Å; W58-L65 HydrophobicContact CZ3-CD1 4.26Å; W58-L65 HydrophobicContact CZ3-CG 4.21Å; L65-L131 HydrophobicContact CB-CB 4.23Å; L65-L131 PolarHBondContact N-O 2.92Å; L65-L131 PolarHBondContact O-N 3.21Å
66R95.2Very high84.7Confident51 Ų5147.8 Ų47.819%0.19227%0.273CS..EExtended strand (participates in β ladder)trans-110108.6169.5-176170.3-171.4-83.9-7.1108.9V44 G45 L47 E97 L129V44-R66 HydrophobicContact CG1-CB 3.91Å; G45-R66 PolarHBondContact O-N 3.27Å; L47-R66 PolarHBondContact N-O 2.76Å; R66-E97 VanDerWaalsContact CD-OE1 3.27Å; R66-E97 WeakPolarHBondContact CD-OE1 3.39Å; R66-E97 WeakPolarHBondContact CG-OE1 3.46Å; R66-E97 IonicContact CZ-OE1 2.91Å; R66-E97 IonicContact CZ-OE2 3.96Å; R66-E97 VanDerWaalsContact NE-CD 3.32Å; R66-E97 IonicContact NE-OE1 3.14Å; R66-E97 PolarHBondContact NE-OE1 3.38Å; R66-E97 IonicContact NE-OE2 2.78Å; R66-E97 PolarHBondContact NE-OE2 2.73Å; R66-E97 IonicContact NH2-OE1 3.86Å; R66-E97 IonicContact NH2-OE2 3.67Å; R66-E97 PolarHBondContact NH2-OE2 3.06Å; R66-L129 CarbonylContact C-O 3.44Å; R66-L129 WeakPolarHBondContact CA-O 3.49Å
67L94.4Very high83.6Confident1 Ų154.7 Ų54.71%0.00530%0.299CS..EExtended strand (participates in β ladder)trans-102.8117.4-177.5171.361.4000110.4L47 L49 V56 L69 A128 L129 L131 F146L47-L67 HydrophobicContact CB-CD1 3.83Å; L47-L67 CarbonylContact O-C 3.5Å; L47-L67 WeakPolarHBondContact O-CA 3.3Å; L49-L67 HydrophobicContact CB-CD1 4.19Å; L49-L67 HydrophobicContact CD1-CD1 3.72Å; L49-L67 HydrophobicContact CD1-CD2 4.36Å; L49-L67 HydrophobicContact CG-CD1 3.66Å; V56-L67 HydrophobicContact CG2-CD2 3.63Å; L67-L69 HydrophobicContact CD1-CD2 4.25Å; L67-L69 HydrophobicContact CD2-CD2 3.88Å; L67-L69 HydrophobicContact CG-CD2 3.9Å; L67-L69 HydrophobicContact CG-CG 4.45Å; L67-A128 CarbonylContact O-C 3.57Å; L67-A128 WeakPolarHBondContact O-CA 3.43Å; L67-L129 HydrophobicContact CB-CB 4.35Å; L67-L129 HydrophobicContact CD2-CD1 4.33Å; L67-L129 PolarHBondContact N-O 2.99Å; L67-L129 PolarHBondContact O-N 2.78Å; L67-L131 HydrophobicContact CB-CD1 4.02Å; L67-F146 HydrophobicContact CD2-CE2 4.48Å; L67-F146 HydrophobicContact CD2-CZ 4.19Å
68T92.7Very high82.7Confident39 Ų3952 Ų5224%0.23929%0.287CS..EExtended strand (participates in β ladder)trans-93.8127.4171-55.10000110L47 A48 L49L47-T68 PolarHBondContact O-N 3.17Å; A48-T68 WeakPolarHBondContact CA-O 3.26Å; L49-T68 PolarHBondContact N-O 3.11Å
69L91.3Very high82.2Confident1 Ų151.9 Ų51.91%0.00529%0.287CS..EExtended strand (participates in β ladder)trans-100.1136.3179.6-61.2178.7000111.7L49 L67 A81 R127 L129 F148 L150L49-L69 HydrophobicContact CB-CD2 4.48Å; L49-L69 CarbonylContact O-C 3.51Å; L67-L69 HydrophobicContact CD1-CD2 4.25Å; L67-L69 HydrophobicContact CD2-CD2 3.88Å; L67-L69 HydrophobicContact CG-CD2 3.9Å; L67-L69 HydrophobicContact CG-CG 4.45Å; L69-A81 HydrophobicContact CD1-CB 3.8Å; L69-R127 HydrophobicContact CB-CB 4.38Å; L69-R127 PolarHBondContact N-O 2.82Å; L69-R127 WeakPolarHBondContact O-CB 3.35Å; L69-R127 PolarHBondContact O-NE 2.94Å; L69-R127 VanDerWaalsContact O-NE 3.11Å; L69-L129 HydrophobicContact CD1-CD1 3.8Å; L69-L129 HydrophobicContact CD1-CG 4.21Å; L69-L129 HydrophobicContact CG-CD1 4.42Å; L69-F148 HydrophobicContact CD1-CD2 4.5Å; L69-F148 HydrophobicContact CD2-CD1 4.32Å; L69-F148 HydrophobicContact CD2-CD2 3.95Å; L69-F148 HydrophobicContact CD2-CE1 4.36Å; L69-F148 HydrophobicContact CD2-CE2 3.99Å; L69-F148 HydrophobicContact CD2-CG 4.12Å; L69-F148 HydrophobicContact CD2-CZ 4.2Å; L69-L150 HydrophobicContact CB-CD2 4.41Å
70G84.6Confident81.8Confident8 Ų851.2 Ų51.28%0.08228%0.284CS..SBendtrans82.3175.7-179.800000113.8L49L49-G70 PolarHBondContact O-N 2.78Å
71G71.7Confident81.7Confident32 Ų3247 Ų4733%0.3327%0.267SS..  trans-66.6160.4178.500000113.5D73 R127G71-D73 PolarHBondContact O-N 2.78Å; G71-R127 PolarHBondContact O-NH2 2.8Å
72P64.6Low81.6Confident136 Ų13646.6 Ų46.688%0.88326%0.264SS*.  trans-73.220.6-177.732.6-37.5000114.2P74P72-P74 WeakPolarHBondContact O-CD 3.38Å; P72-P74 VanDerWaalsContact O-N 3.14Å
73D64.6Low81.6Confident76 Ų7644.8 Ų44.841%0.40625%0.25SC..  trans-55.5117.5-169.3-177.84.7000111.7G71 R75 A76G71-D73 PolarHBondContact O-N 2.78Å; D73-R75 PolarHBondContact O-N 2.83Å; D73-R75 VanDerWaalsContact O-N 3.13Å; D73-R75 PolarHBondContact OD1-N 2.97Å; D73-A76 WeakPolarHBondContact O-CB 3.37Å; D73-A76 PolarHBondContact O-N 3.13Å
74P51.4Low81.6Confident127 Ų12745 Ų4583%0.82524%0.237SC*.THydrogen-bonded Turntrans-64.4-13.9178.225.7-34.3000113.5P72 A76P72-P74 WeakPolarHBondContact O-CD 3.38Å; P72-P74 VanDerWaalsContact O-N 3.14Å; P74-A76 VanDerWaalsContact C-N 3.31Å
75R60.8Low81.4Confident212 Ų21245.2 Ų45.280%0.824%0.238SC*.THydrogen-bonded Turntrans-91.612.2172.6-61.5-169.2-176.6-147.42113.5D73 R77D73-R75 PolarHBondContact O-N 2.83Å; D73-R75 VanDerWaalsContact O-N 3.13Å; D73-R75 PolarHBondContact OD1-N 2.97Å; R75-R77 PolarHBondContact O-N 2.91Å
76A62.6Low81.2Confident21 Ų2148.9 Ų48.917%0.17426%0.26CS..  trans-24.494.4-174.400000112.5D73 P74 R124D73-A76 WeakPolarHBondContact O-CB 3.37Å; D73-A76 PolarHBondContact O-N 3.13Å; P74-A76 VanDerWaalsContact C-N 3.31Å; A76-R124 PolarHBondContact O-N 2.86Å
77R73.2Confident80.9Confident147 Ų14752.7 Ų52.756%0.55528%0.275SS*.  trans-59.4154173.4-72.6175.2174.5179.5-3.4108.4R75 G79 E152R75-R77 PolarHBondContact O-N 2.91Å; R77-G79 PolarHBondContact O-N 2.86Å; R77-E152 VanDerWaalsContact CD-OE2 3.31Å; R77-E152 WeakPolarHBondContact CD-OE2 3.43Å; R77-E152 IonicContact CZ-OE2 2.76Å; R77-E152 IonicContact NH1-OE2 3.33Å; R77-E152 PolarHBondContact NH1-OE2 3.02Å
78P77.8Confident80.5Confident11 Ų1157.8 Ų57.87%0.07131%0.308CS..  trans-44.1137166.8-28.738.1000110W121 P123 D153 P156P78-W121 WeakPolarHBondContact CA-O 3.48Å; P78-P123 HydrophobicContact CG-CB 4.23Å; P78-P123 HydrophobicContact CG-CG 3.71Å; P78-D153 HydrophobicContact CB-CB 3.83Å; P78-D153 WeakPolarHBondContact O-CB 3.17Å; P78-D153 PolarHBondContact O-N 2.95Å; P78-P156 HydrophobicContact CB-CB 4.14Å; P78-P156 HydrophobicContact CG-CB 3.82Å; P78-P156 HydrophobicContact CG-CG 4.16Å
79G83.8Confident80.5Confident0 Ų056.4 Ų56.40%030%0.298CS..EExtended strand (participates in β ladder)trans-134.4140.5-172.300000110.2R77 R120 W121 R151R77-G79 PolarHBondContact O-N 2.86Å; G79-R120 WeakPolarHBondContact O-CA 3.37Å; G79-W121 PolarHBondContact N-O 3.35Å; G79-W121 VanDerWaalsContact N-O 3.11Å; G79-W121 PolarHBondContact O-N 3.34Å; G79-R151 WeakPolarHBondContact CA-O 3.49Å
80I87.7Confident80.5Confident11 Ų1157.5 Ų57.56%0.05631%0.308CS..EExtended strand (participates in β ladder)trans-114.8122.4173.9-60163.6000106.9C118 V119 R120 L150 R151 D153 H163 L165I80-C118 HydrophobicContact CG2-CB 4.5Å; I80-V119 WeakPolarHBondContact CA-O 3.17Å; I80-R120 HydrophobicContact CG1-CB 4.36Å; I80-R120 HydrophobicContact CG1-CG 4.09Å; I80-L150 WeakPolarHBondContact O-CA 3.42Å; I80-R151 PolarHBondContact N-O 3.31Å; I80-R151 PolarHBondContact O-N 2.73Å; I80-D153 HydrophobicContact CD1-CB 3.99Å; I80-D153 HydrophobicContact CG1-CB 4.08Å; I80-H163 HydrophobicContact CD1-CB 3.91Å; I80-L165 HydrophobicContact CD1-CD1 3.74Å; I80-L165 HydrophobicContact CD1-CG 4.49Å; I80-L165 HydrophobicContact CG1-CD1 3.85Å; I80-L165 HydrophobicContact CG2-CD1 3.9Å; I80-L165 HydrophobicContact CG2-CD2 3.38Å; I80-L165 HydrophobicContact CG2-CG 4.23Å
81A90.4Very high80.9Confident0 Ų057.2 Ų57.20%031%0.305CS..EExtended strand (participates in β ladder)trans-110.5136.6165.500000110.4L69 C118 V119 W121 E149 L150L69-A81 HydrophobicContact CD1-CB 3.8Å; A81-C118 CarbonylContact O-C 3.48Å; A81-C118 WeakPolarHBondContact O-CA 3.25Å; A81-V119 PolarHBondContact N-O 3.23Å; A81-V119 PolarHBondContact O-N 3.34Å; A81-W121 HydrophobicContact CB-CH2 4.06Å; A81-W121 HydrophobicContact CB-CZ3 3.53Å; A81-E149 CarbonylContact C-O 3.27Å; A81-E149 VanDerWaalsContact CA-O 3.22Å; A81-E149 WeakPolarHBondContact CA-O 3.33Å; A81-L150 HydrophobicContact CB-CD1 4.27Å
82C91.3Very high82.1Confident11 Ų1155.7 Ų55.77%0.07429%0.289CS..EExtended strand (participates in β ladder)trans-108.6137.1168.4-67.80000108.8R117 C118 F148 E149 R258 F259C82-R117 CarbonylContact C-O 3.46Å; C82-R117 WeakPolarHBondContact CA-O 3.38Å; C82-C118 VanDerWaalsContact CA-SG 3.6Å; C82-C118 HydrophobicContact CB-CB 4.07Å; C82-C118 WeakPolarHBondContact CB-SG 3.25Å; C82-C118 WeakPolarHBondContact SG-CB 3.39Å; C82-C118 CovalentContact SG-SG 2.04Å; C82-C118 PolarHBondContact SG-SG 2.86Å; C82-F148 CarbonylContact O-C 3.5Å; C82-F148 VanDerWaalsContact O-CA 3.23Å; C82-F148 WeakPolarHBondContact O-CA 3.18Å; C82-E149 PolarHBondContact N-O 3Å; C82-E149 PolarHBondContact O-N 2.89Å; C82-R258 HydrophobicContact CB-CG 4.26Å; C82-R258 PolarHBondContact SG-NE 2.97Å; C82-R258 VanDerWaalsContact SG-NE 3.43Å; C82-F259 HydrophobicContact CB-CE2 4.08Å; C82-F259 HydrophobicContact CB-CZ 4.22Å; C82-F259 WeakPolarHBondContact O-CZ 3.21Å
83L92.6Very high83.5Confident0 Ų052.2 Ų52.20%026%0.261CS..EExtended strand (participates in β ladder)trans-115.6132.9177.6-51.3-176000109.3V94 L106 L107 G116 R117 L129 F146 R147 F148L83-V94 HydrophobicContact CD1-CG1 3.87Å; L83-L106 HydrophobicContact CD1-CB 4.26Å; L83-L106 HydrophobicContact CD1-CD1 3.64Å; L83-L106 HydrophobicContact CG-CD1 4.4Å; L83-L107 HydrophobicContact CB-CD1 4.06Å; L83-L107 HydrophobicContact CB-CG 4.47Å; L83-L107 HydrophobicContact CD1-CD1 4.2Å; L83-L107 HydrophobicContact CD1-CG 4.4Å; L83-G116 CarbonylContact O-C 3.58Å; L83-G116 WeakPolarHBondContact O-CA 3.43Å; L83-R117 PolarHBondContact N-O 2.66Å; L83-R117 PolarHBondContact O-N 3.23Å; L83-L129 HydrophobicContact CD1-CD1 3.84Å; L83-L129 HydrophobicContact CD1-CD2 4.3Å; L83-L129 HydrophobicContact CD2-CD1 3.86Å; L83-L129 HydrophobicContact CG-CD1 4.47Å; L83-F146 HydrophobicContact CB-CD2 4.44Å; L83-F146 HydrophobicContact CD1-CE2 4.5Å; L83-F146 HydrophobicContact CD2-CD2 4.01Å; L83-F146 HydrophobicContact CD2-CE2 3.94Å; L83-R147 CarbonylContact C-O 3.48Å; L83-R147 WeakPolarHBondContact CA-O 3.38Å; L83-F148 HydrophobicContact CD2-CB 3.61Å
84R91.3Very high85Confident46 Ų4648.6 Ų48.617%0.17424%0.242CC..EExtended strand (participates in β ladder)trans-118.3110.9172.4177.7176-70.3-176.6-3.9109F146 R147 R258 F259 E261R84-F146 CarbonylContact O-C 3.52Å; R84-F146 VanDerWaalsContact O-CA 3.25Å; R84-F146 WeakPolarHBondContact O-CA 3.17Å; R84-F146 WeakPolarHBondContact O-CB 3.22Å; R84-R147 PolarHBondContact N-O 2.76Å; R84-R147 PolarHBondContact O-N 2.68Å; R84-R258 PolarHBondContact NH2-O 3.08Å; R84-F259 HydrophobicContact CB-CD1 4.46Å; R84-F259 HydrophobicContact CB-CD2 3.81Å; R84-F259 HydrophobicContact CB-CE1 4.12Å; R84-F259 HydrophobicContact CB-CE2 3.46Å; R84-F259 VanDerWaalsContact CB-CE2 3.46Å; R84-F259 HydrophobicContact CB-CG 4.32Å; R84-F259 HydrophobicContact CB-CZ 3.61Å; R84-F259 VanDerWaalsContact CZ-CD2 3.5Å; R84-F259 VanDerWaalsContact NE-CD2 3.3Å; R84-E261 IonicContact CZ-OE1 3.65Å; R84-E261 VanDerWaalsContact CZ-OE1 3.28Å; R84-E261 IonicContact CZ-OE2 3.66Å; R84-E261 IonicContact NH1-OE1 2.94Å; R84-E261 PolarHBondContact NH1-OE1 2.79Å; R84-E261 IonicContact NH1-OE2 3.86Å; R84-E261 IonicContact NH2-OE1 3.97Å; R84-E261 PolarHBondContact NH2-OE1 2.88Å; R84-E261 IonicContact NH2-OE2 2.81Å; R84-E261 PolarHBondContact NH2-OE2 3.47Å
85P92.4Very high87.2Confident13 Ų1343.8 Ų43.88%0.08421%0.208CC..EExtended strand (participates in β ladder)trans-68.3147.6178.627.7-32.7000111.5F89 L107P85-F89 HydrophobicContact CB-CB 3.84Å; P85-F89 HydrophobicContact CB-CD2 3.75Å; P85-F89 HydrophobicContact CB-CG 3.96Å; P85-L107 HydrophobicContact CB-CD1 4.25Å; P85-L107 HydrophobicContact CB-CD2 4.39Å; P85-L107 HydrophobicContact CG-CD2 4.07Å
86V91.6Very high88.8Confident83 Ų8333.7 Ų33.750%0.50317%0.17SC..PPolyproline II helixtrans-70.1134.7156.1177.70000107.2P88 F89 A145V86-P88 CarbonylContact O-C 3.56Å; V86-P88 VanDerWaalsContact O-C 3.25Å; V86-F89 WeakPolarHBondContact O-CA 3.37Å; V86-F89 PolarHBondContact O-N 2.53Å; V86-A145 HydrophobicContact CB-CB 3.94Å; V86-A145 HydrophobicContact CG2-CB 3.64Å; V86-A145 PolarHBondContact N-O 3.19Å
87R87Confident90.3Very high132 Ų13234.5 Ų34.550%0.49817%0.17SC..SBendtrans-102.4141.8-176.3-64.1-159.4-58-96.73.4112.1A114R87-A114 PolarHBondContact NH1-O 2.94Å
88P87.7Confident91.1Very high108 Ų10830.7 Ų30.770%0.70116%0.155SC*.SBendcis-65.8144.9-13.229.6-34.7000111.2V86V86-P88 CarbonylContact O-C 3.56Å; V86-P88 VanDerWaalsContact O-C 3.25Å
89F91.5Very high91.5Very high9 Ų933.5 Ų33.54%0.03918%0.18CC..BIsolated β-bridgetrans-80.8124.8175.2-170.8-109.8000109.3P85 V86 A92 V94 L107 G110 A144 A145 F146P85-F89 HydrophobicContact CB-CB 3.84Å; P85-F89 HydrophobicContact CB-CD2 3.75Å; P85-F89 HydrophobicContact CB-CG 3.96Å; V86-F89 WeakPolarHBondContact O-CA 3.37Å; V86-F89 PolarHBondContact O-N 2.53Å; F89-A92 WeakPolarHBondContact CE1-O 3.31Å; F89-V94 HydrophobicContact CE1-CG2 4.1Å; F89-V94 HydrophobicContact CZ-CG2 3.64Å; F89-L107 HydrophobicContact CD1-CB 4.11Å; F89-L107 HydrophobicContact CE1-CB 3.83Å; F89-L107 HydrophobicContact CE2-CD1 4.36Å; F89-L107 HydrophobicContact CZ-CB 4.32Å; F89-L107 HydrophobicContact CZ-CD1 4.3Å; F89-G110 PolarHBondContact O-N 2.75Å; F89-A144 HydrophobicContact CE2-CB 4.19Å; F89-A144 HydrophobicContact CZ-CB 4.13Å; F89-A145 WeakPolarHBondContact CD2-O 3.47Å; F89-A145 WeakPolarHBondContact CE2-O 2.95Å; F89-F146 HydrophobicContact CE2-CD1 4.1Å; F89-F146 HydrophobicContact CZ-CD1 4.42Å
90A92.4Very high91.6Very high25 Ų2537.9 Ų37.921%0.20723%0.225CC..  trans-146.9152.3-17000000113.2A92 V143 A144A90-A92 VanDerWaalsContact C-N 3.32Å; A90-A92 PolarHBondContact O-N 2.97Å; A90-V143 CarbonylContact O-C 3.33Å; A90-V143 VanDerWaalsContact O-C 3.27Å; A90-V143 VanDerWaalsContact O-O 3.11Å; A90-A144 WeakPolarHBondContact O-CA 3.45Å; A90-A144 WeakPolarHBondContact O-CB 3.33Å; A90-A144 PolarHBondContact O-N 3.03Å
91G93.4Very high91.5Very high2 Ų240.3 Ų40.32%0.02125%0.252CS..SBendtrans88.3-9.5170.900000114.5P61 E109 A133 T134P61-G91 VanDerWaalsContact CB-O 3.25Å; P61-G91 WeakPolarHBondContact CB-O 3.37Å; G91-E109 WeakPolarHBondContact CA-OE2 3.23Å; G91-E109 PolarHBondContact N-OE2 2.92Å; G91-A133 WeakPolarHBondContact O-CA 3.37Å; G91-T134 PolarHBondContact O-N 3.2Å
92A95.2Very high91.6Very high0 Ų043.1 Ų43.10%028%0.276CS..EExtended strand (participates in β ladder)trans-153.6169.5175.300000112.4W58 F89 A90 Q132 A144W58-A92 HydrophobicContact CE3-CB 4.18Å; W58-A92 HydrophobicContact CZ3-CB 4.15Å; F89-A92 WeakPolarHBondContact CE1-O 3.31Å; A90-A92 VanDerWaalsContact C-N 3.32Å; A90-A92 PolarHBondContact O-N 2.97Å; A92-Q132 CarbonylContact C-O 3.59Å; A92-Q132 WeakPolarHBondContact CA-O 3.42Å; A92-Q132 VanDerWaalsContact CB-O 3.3Å; A92-Q132 WeakPolarHBondContact CB-O 3.41Å; A92-A144 HydrophobicContact CB-CB 3.52Å
93Q95.3Very high91.8Very high63 Ų6346.5 Ų46.529%0.29429%0.293SS..EExtended strand (participates in β ladder)trans-119144.5164.2-62.1176.940.600108.6F95 L105 L107 L131 Q132Q93-F95 HydrophobicContact CB-CD2 4.45Å; Q93-F95 HydrophobicContact CB-CE2 3.58Å; Q93-F95 HydrophobicContact CB-CZ 3.9Å; Q93-L105 HydrophobicContact CB-CD1 4.14Å; Q93-L107 CarbonylContact C-O 3.57Å; Q93-L107 WeakPolarHBondContact CA-O 3.16Å; Q93-L131 CarbonylContact O-C 3.34Å; Q93-L131 VanDerWaalsContact O-CA 3.31Å; Q93-L131 WeakPolarHBondContact O-CA 3.5Å; Q93-Q132 PolarHBondContact N-O 2.83Å; Q93-Q132 PolarHBondContact O-N 2.91Å
94V96.2Very high91.8Very high0 Ų050.4 Ų50.40%031%0.311CS..EExtended strand (participates in β ladder)trans-117.5124.5-179.2-171.20000109.3L83 F89 L106 L107 L129 L131 F146L83-V94 HydrophobicContact CD1-CG1 3.87Å; F89-V94 HydrophobicContact CE1-CG2 4.1Å; F89-V94 HydrophobicContact CZ-CG2 3.64Å; V94-L106 WeakPolarHBondContact O-CA 3.3Å; V94-L106 PolarHBondContact O-N 2.89Å; V94-L107 HydrophobicContact CB-CB 3.97Å; V94-L107 HydrophobicContact CB-CD1 4.35Å; V94-L107 HydrophobicContact CB-CG 4.32Å; V94-L107 HydrophobicContact CG2-CB 4.03Å; V94-L107 HydrophobicContact CG2-CD1 4.06Å; V94-L107 HydrophobicContact CG2-CG 4.45Å; V94-L107 PolarHBondContact N-O 3.07Å; V94-L107 PolarHBondContact O-N 2.86Å; V94-L107 VanDerWaalsContact O-N 3.1Å; V94-L129 HydrophobicContact CG1-CB 4.25Å; V94-L129 HydrophobicContact CG1-CD1 4.23Å; V94-L129 HydrophobicContact CG1-CD2 4.39Å; V94-L131 HydrophobicContact CG1-CD1 4.3Å; V94-L131 HydrophobicContact CG1-CG 4.24Å; V94-L131 HydrophobicContact CG2-CG 4.11Å; V94-F146 HydrophobicContact CG1-CZ 4.49Å; V94-F146 HydrophobicContact CG2-CD1 4.2Å; V94-F146 HydrophobicContact CG2-CE1 3.86Å
95F96Very high91.9Very high26 Ų2652.3 Ų52.311%0.11432%0.324CS..EExtended strand (participates in β ladder)trans-116.7146.9179.5-55.6-95.9000110.2Q93 L103 E104 L105 L129 F130 Q132Q93-F95 HydrophobicContact CB-CD2 4.45Å; Q93-F95 HydrophobicContact CB-CE2 3.58Å; Q93-F95 HydrophobicContact CB-CZ 3.9Å; F95-L103 HydrophobicContact CB-CB 3.97Å; F95-L103 HydrophobicContact CB-CD2 4.24Å; F95-L103 HydrophobicContact CB-CG 4.5Å; F95-L103 HydrophobicContact CD1-CB 3.99Å; F95-L103 HydrophobicContact CG-CB 4.16Å; F95-E104 CarbonylContact C-O 3.59Å; F95-E104 WeakPolarHBondContact CA-O 3.12Å; F95-L105 HydrophobicContact CD1-CB 3.91Å; F95-L105 HydrophobicContact CD1-CD1 3.98Å; F95-L105 HydrophobicContact CE1-CB 3.87Å; F95-L105 HydrophobicContact CE1-CD1 3.59Å; F95-L105 HydrophobicContact CE1-CG 4.28Å; F95-L105 HydrophobicContact CE2-CD1 4.43Å; F95-L105 HydrophobicContact CZ-CD1 3.83Å; F95-L129 CarbonylContact O-C 3.59Å; F95-L129 WeakPolarHBondContact O-CA 3.16Å; F95-F130 HydrophobicContact CB-CB 4.38Å; F95-F130 HydrophobicContact CD2-CD1 4.22Å; F95-F130 WeakPolarHBondContact CD2-O 3.07Å; F95-F130 PolarHBondContact N-O 3.35Å; F95-F130 PolarHBondContact O-N 2.78Å; F95-Q132 HydrophobicContact CE2-CB 4.15Å
96A95Very high91.8Very high0 Ų052.3 Ų52.30%032%0.323CS..EExtended strand (participates in β ladder)trans-87132.1161.600000110.3L103 E104 L106 V119 W121 L129A96-L103 WeakPolarHBondContact O-CA 3.37Å; A96-E104 HydrophobicContact CB-CB 4.39Å; A96-E104 PolarHBondContact N-O 2.8Å; A96-E104 PolarHBondContact O-N 3.29Å; A96-L106 HydrophobicContact CB-CD1 3.98Å; A96-L106 HydrophobicContact CB-CD2 4.41Å; A96-L106 HydrophobicContact CB-CG 4.2Å; A96-V119 HydrophobicContact CB-CB 4.32Å; A96-V119 HydrophobicContact CB-CG1 4.21Å; A96-V119 HydrophobicContact CB-CG2 3.68Å; A96-W121 HydrophobicContact CB-CZ2 3.73Å; A96-L129 HydrophobicContact CB-CD2 4.25Å
97E93.8Very high91.9Very high37 Ų3748.7 Ų48.717%0.17330%0.301CS..EExtended strand (participates in β ladder)trans-74.8124.4168.1-68-179.3-156.500109.4R66 L103 W121 A128 F130R66-E97 VanDerWaalsContact CD-OE1 3.27Å; R66-E97 WeakPolarHBondContact CD-OE1 3.39Å; R66-E97 WeakPolarHBondContact CG-OE1 3.46Å; R66-E97 IonicContact CZ-OE1 2.91Å; R66-E97 IonicContact CZ-OE2 3.96Å; R66-E97 VanDerWaalsContact NE-CD 3.32Å; R66-E97 IonicContact NE-OE1 3.14Å; R66-E97 PolarHBondContact NE-OE1 3.38Å; R66-E97 IonicContact NE-OE2 2.78Å; R66-E97 PolarHBondContact NE-OE2 2.73Å; R66-E97 IonicContact NH2-OE1 3.86Å; R66-E97 IonicContact NH2-OE2 3.67Å; R66-E97 PolarHBondContact NH2-OE2 3.06Å; E97-L103 HydrophobicContact CB-CD2 4.48Å; E97-L103 HydrophobicContact CG-CD2 3.75Å; E97-W121 PolarHBondContact O-NE1 2.82Å; E97-A128 HydrophobicContact CB-CB 4.14Å; E97-A128 HydrophobicContact CG-CB 4.22Å; E97-A128 PolarHBondContact N-O 2.94Å; E97-F130 HydrophobicContact CG-CB 4.35Å
98R91.5Very high92.1Very high67 Ų6744.3 Ų44.325%0.25329%0.294SS..PPolyproline II helixtrans-97.1162.8176-56.4-52.7-54.6-164.420.1111.2G100 G101 A102 E104 R120 E125R98-G100 PolarHBondContact O-N 2.79Å; R98-G101 PolarHBondContact O-N 2.94Å; R98-A102 HydrophobicContact CB-CB 4.24Å; R98-A102 WeakPolarHBondContact CB-O 3.31Å; R98-A102 PolarHBondContact N-O 2.81Å; R98-E104 WeakPolarHBondContact CD-OE2 3.42Å; R98-E104 HydrophobicContact CG-CB 4.12Å; R98-E104 IonicContact CZ-OE2 3.62Å; R98-E104 IonicContact NE-OE2 3.66Å; R98-E104 IonicContact NH1-OE2 3.05Å; R98-E104 PolarHBondContact NH1-OE2 3.45Å; R98-R120 PolarHBondContact NH1-O 3.43Å; R98-R120 PolarHBondContact NH2-O 3.29Å; R98-E125 IonicContact CZ-OE2 3.68Å; R98-E125 IonicContact NE-OE2 3.24Å; R98-E125 IonicContact NH2-OE1 3.36Å; R98-E125 IonicContact NH2-OE2 2.69Å; R98-E125 PolarHBondContact NH2-OE2 2.83Å
99A85.4Confident92.2Very high70 Ų7042.4 Ų42.458%0.57928%0.275SS*.G310 helixtrans-50.5133.3164.900000110.3E125A99-E125 HydrophobicContact CB-CG 4.09Å
100G85.1Confident91.8Very high93 Ų9343.1 Ų43.196%0.95929%0.285SS*.G310 helixtrans85.20.8-176.100000115.6R98R98-G100 PolarHBondContact O-N 2.79Å
101G87.2Confident90.8Very high61 Ų6148.6 Ų48.663%0.62932%0.318SS*.G310 helixtrans86.54.9173.700000115.1R98R98-G101 PolarHBondContact O-N 2.94Å
102A92.5Very high89.5Confident60 Ų6050 Ų5050%0.49633%0.333SS..  trans-66147171.200000111R98R98-A102 HydrophobicContact CB-CB 4.24Å; R98-A102 WeakPolarHBondContact CB-O 3.31Å; R98-A102 PolarHBondContact N-O 2.81Å
103L94.2Very high88Confident82 Ų8252.8 Ų52.843%0.42935%0.351SS..EExtended strand (participates in β ladder)trans-109.8120.4178.8-65.7-178.4000110.1F95 A96 E97 F130F95-L103 HydrophobicContact CB-CB 3.97Å; F95-L103 HydrophobicContact CB-CD2 4.24Å; F95-L103 HydrophobicContact CB-CG 4.5Å; F95-L103 HydrophobicContact CD1-CB 3.99Å; F95-L103 HydrophobicContact CG-CB 4.16Å; A96-L103 WeakPolarHBondContact O-CA 3.37Å; E97-L103 HydrophobicContact CB-CD2 4.48Å; E97-L103 HydrophobicContact CG-CD2 3.75Å; L103-F130 HydrophobicContact CD1-CD1 3.97Å; L103-F130 HydrophobicContact CD1-CE1 4.48Å; L103-F130 HydrophobicContact CD1-CG 4.45Å; L103-F130 HydrophobicContact CD2-CB 4.02Å
104E93.7Very high86.4Confident81 Ų8150.3 Ų50.338%0.37934%0.341SS..EExtended strand (participates in β ladder)trans-99.2116.4176.4-178.1-171160.600109.5F95 A96 R98 L106F95-E104 CarbonylContact C-O 3.59Å; F95-E104 WeakPolarHBondContact CA-O 3.12Å; A96-E104 HydrophobicContact CB-CB 4.39Å; A96-E104 PolarHBondContact N-O 2.8Å; A96-E104 PolarHBondContact O-N 3.29Å; R98-E104 WeakPolarHBondContact CD-OE2 3.42Å; R98-E104 HydrophobicContact CG-CB 4.12Å; R98-E104 IonicContact CZ-OE2 3.62Å; R98-E104 IonicContact NE-OE2 3.66Å; R98-E104 IonicContact NH1-OE2 3.05Å; R98-E104 PolarHBondContact NH1-OE2 3.45Å; E104-L106 PolarHBondContact O-N 2.68Å
105L92.7Very high85Confident86 Ų8650.8 Ų50.845%0.4535%0.346SS..EExtended strand (participates in β ladder)trans-67.6123.4-179.1179.965.8000111.4Q93 F95 L107 A108Q93-L105 HydrophobicContact CB-CD1 4.14Å; F95-L105 HydrophobicContact CD1-CB 3.91Å; F95-L105 HydrophobicContact CD1-CD1 3.98Å; F95-L105 HydrophobicContact CE1-CB 3.87Å; F95-L105 HydrophobicContact CE1-CD1 3.59Å; F95-L105 HydrophobicContact CE1-CG 4.28Å; F95-L105 HydrophobicContact CE2-CD1 4.43Å; F95-L105 HydrophobicContact CZ-CD1 3.83Å; L105-L107 WeakPolarHBondContact CD1-O 3.33Å; L105-A108 HydrophobicContact CD2-CB 4.24Å
106L91.2Very high84.1Confident13 Ų1349.9 Ų49.97%0.06835%0.345CS..EExtended strand (participates in β ladder)trans-104.8-50176.7-58.6-176.5000112.3L83 V94 A96 E104 R117 V119 L129L83-L106 HydrophobicContact CD1-CB 4.26Å; L83-L106 HydrophobicContact CD1-CD1 3.64Å; L83-L106 HydrophobicContact CG-CD1 4.4Å; V94-L106 WeakPolarHBondContact O-CA 3.3Å; V94-L106 PolarHBondContact O-N 2.89Å; A96-L106 HydrophobicContact CB-CD1 3.98Å; A96-L106 HydrophobicContact CB-CD2 4.41Å; A96-L106 HydrophobicContact CB-CG 4.2Å; E104-L106 PolarHBondContact O-N 2.68Å; L106-R117 WeakPolarHBondContact O-CG 3.34Å; L106-V119 HydrophobicContact CD1-CB 4.08Å; L106-V119 HydrophobicContact CD1-CG1 3.66Å; L106-V119 HydrophobicContact CD2-CB 3.84Å; L106-V119 HydrophobicContact CD2-CG1 4.36Å; L106-V119 HydrophobicContact CD2-CG2 4.39Å; L106-L129 HydrophobicContact CD1-CD2 3.68Å
107L92.8Very high83.6Confident7 Ų754.1 Ų54.14%0.03736%0.361CS..EExtended strand (participates in β ladder)trans-124.4126.4-179.9-56.3176.8000109.3L83 P85 F89 Q93 V94 L105 R117 F146L83-L107 HydrophobicContact CB-CD1 4.06Å; L83-L107 HydrophobicContact CB-CG 4.47Å; L83-L107 HydrophobicContact CD1-CD1 4.2Å; L83-L107 HydrophobicContact CD1-CG 4.4Å; P85-L107 HydrophobicContact CB-CD1 4.25Å; P85-L107 HydrophobicContact CB-CD2 4.39Å; P85-L107 HydrophobicContact CG-CD2 4.07Å; F89-L107 HydrophobicContact CD1-CB 4.11Å; F89-L107 HydrophobicContact CE1-CB 3.83Å; F89-L107 HydrophobicContact CE2-CD1 4.36Å; F89-L107 HydrophobicContact CZ-CB 4.32Å; F89-L107 HydrophobicContact CZ-CD1 4.3Å; Q93-L107 CarbonylContact C-O 3.57Å; Q93-L107 WeakPolarHBondContact CA-O 3.16Å; V94-L107 HydrophobicContact CB-CB 3.97Å; V94-L107 HydrophobicContact CB-CD1 4.35Å; V94-L107 HydrophobicContact CB-CG 4.32Å; V94-L107 HydrophobicContact CG2-CB 4.03Å; V94-L107 HydrophobicContact CG2-CD1 4.06Å; V94-L107 HydrophobicContact CG2-CG 4.45Å; V94-L107 PolarHBondContact N-O 3.07Å; V94-L107 PolarHBondContact O-N 2.86Å; V94-L107 VanDerWaalsContact O-N 3.1Å; L105-L107 WeakPolarHBondContact CD1-O 3.33Å; L107-R117 HydrophobicContact CD2-CB 4.36Å; L107-R117 HydrophobicContact CD2-CG 4.37Å; L107-F146 HydrophobicContact CD1-CB 4.02Å; L107-F146 HydrophobicContact CD1-CD1 4.28Å; L107-F146 HydrophobicContact CD1-CG 4.16Å
108A91.1Very high83.4Confident41 Ų4153.7 Ų53.734%0.33936%0.361SS..  trans-107.8151173.800000109.9L105L105-A108 HydrophobicContact CD2-CB 4.24Å
109E90.3Very high83.2Confident67 Ų6750.6 Ų50.631%0.31335%0.35SS..SBendtrans-62.3139.4170.4175.7166.8141.900111.5G91 T134 R142G91-E109 WeakPolarHBondContact CA-OE2 3.23Å; G91-E109 PolarHBondContact N-OE2 2.92Å; E109-T134 WeakPolarHBondContact OE2-CB 3.32Å; E109-T134 WeakPolarHBondContact OE2-CG2 3.33Å; E109-T134 PolarHBondContact OE2-OG1 2.81Å; E109-R142 IonicContact OE1-CZ 2.88Å; E109-R142 IonicContact OE1-NH1 2.7Å; E109-R142 PolarHBondContact OE1-NH1 2.84Å; E109-R142 IonicContact OE1-NH2 2.75Å; E109-R142 PolarHBondContact OE1-NH2 2.72Å; E109-R142 IonicContact OE2-CZ 2.73Å; E109-R142 IonicContact OE2-NH1 3.46Å; E109-R142 IonicContact OE2-NH2 3.59Å; E109-R142 PolarHBondContact OE2-NH2 2.83Å
110G83.3Confident83.3Confident24 Ų2450.3 Ų50.325%0.24733%0.334CS..BIsolated β-bridgetrans113.5-158.1174.900000113.4F89 G112F89-G110 PolarHBondContact O-N 2.75Å; G110-G112 PolarHBondContact O-N 2.68Å
111P71.4Confident83.4Confident140 Ų14045.9 Ų45.991%0.90929%0.288SS*.SBendtrans-77.35917835-34.6000109.2
112G66.5Low83.2Confident32 Ų3243.8 Ų43.833%0.3327%0.266SS..  trans-61.7168.4173.400000111.1G110 A114G110-G112 PolarHBondContact O-N 2.68Å; G112-A114 PolarHBondContact O-N 3.05Å; G112-A114 VanDerWaalsContact O-N 3.13Å
113P63.2Low82.6Confident59 Ų5945.1 Ų45.138%0.38327%0.27SS..  trans-53.2124.7177.227.9-38.4000109.5G115 R117P113-G115 PolarHBondContact O-N 3.46Å; P113-G115 VanDerWaalsContact O-O 3.14Å; P113-R117 HydrophobicContact CG-CG 4.37Å; P113-R117 VanDerWaalsContact CG-NH1 3.33Å
114A62Low81.9Confident10 Ų1052.1 Ų52.18%0.08329%0.291CS..SBendtrans-71.3-24.9-171.500000112.3R87 G112 L203R87-A114 PolarHBondContact NH1-O 2.94Å; G112-A114 PolarHBondContact O-N 3.05Å; G112-A114 VanDerWaalsContact O-N 3.13Å; A114-L203 HydrophobicContact CB-CB 4.37Å; A114-L203 HydrophobicContact CB-CD2 3.26Å; A114-L203 HydrophobicContact CB-CG 4.34Å
115G66.1Low81.5Confident10 Ų1050.3 Ų50.310%0.10328%0.282CS..SBendtrans-75.4147.5170.100000112.2P113 R117P113-G115 PolarHBondContact O-N 3.46Å; P113-G115 VanDerWaalsContact O-O 3.14Å; G115-R117 PolarHBondContact O-NH1 2.83Å
116G76.8Confident81.1Confident8 Ų855 Ų558%0.08229%0.294CS..  trans-60.4155.8179.700000113.8L83L83-G116 CarbonylContact O-C 3.58Å; L83-G116 WeakPolarHBondContact O-CA 3.43Å
117R85.9Confident81Confident89 Ų8955.5 Ų55.534%0.33630%0.295SS..EExtended strand (participates in β ladder)trans-110.1135.8176.8-74.4-75.1-177.5-82.614109.4C82 L83 L106 L107 P113 G115C82-R117 CarbonylContact C-O 3.46Å; C82-R117 WeakPolarHBondContact CA-O 3.38Å; L83-R117 PolarHBondContact N-O 2.66Å; L83-R117 PolarHBondContact O-N 3.23Å; L106-R117 WeakPolarHBondContact O-CG 3.34Å; L107-R117 HydrophobicContact CD2-CB 4.36Å; L107-R117 HydrophobicContact CD2-CG 4.37Å; P113-R117 HydrophobicContact CG-CG 4.37Å; P113-R117 VanDerWaalsContact CG-NH1 3.33Å; G115-R117 PolarHBondContact O-NH1 2.83Å
118C87.8Confident81Confident27 Ų2755.2 Ų55.218%0.18229%0.293CS..EExtended strand (participates in β ladder)trans-119.1146.5179.5-50.60000110.4I80 A81 C82 L165 R258I80-C118 HydrophobicContact CG2-CB 4.5Å; A81-C118 CarbonylContact O-C 3.48Å; A81-C118 WeakPolarHBondContact O-CA 3.25Å; C82-C118 VanDerWaalsContact CA-SG 3.6Å; C82-C118 HydrophobicContact CB-CB 4.07Å; C82-C118 WeakPolarHBondContact CB-SG 3.25Å; C82-C118 WeakPolarHBondContact SG-CB 3.39Å; C82-C118 CovalentContact SG-SG 2.04Å; C82-C118 PolarHBondContact SG-SG 2.86Å; C118-L165 HydrophobicContact CB-CD2 3.41Å; C118-L165 VanDerWaalsContact CB-CD2 3.41Å; C118-R258 PolarHBondContact SG-NE 3.23Å; C118-R258 PolarHBondContact SG-NH1 2.63Å; C118-R258 PolarHBondContact SG-NH2 3.35Å
119V88.3Confident81.2Confident3 Ų353.2 Ų53.22%0.01828%0.277CS..EExtended strand (participates in β ladder)trans-130.9146.5178.157.90000108.8I80 A81 A96 L106 W121I80-V119 WeakPolarHBondContact CA-O 3.17Å; A81-V119 PolarHBondContact N-O 3.23Å; A81-V119 PolarHBondContact O-N 3.34Å; A96-V119 HydrophobicContact CB-CB 4.32Å; A96-V119 HydrophobicContact CB-CG1 4.21Å; A96-V119 HydrophobicContact CB-CG2 3.68Å; L106-V119 HydrophobicContact CD1-CB 4.08Å; L106-V119 HydrophobicContact CD1-CG1 3.66Å; L106-V119 HydrophobicContact CD2-CB 3.84Å; L106-V119 HydrophobicContact CD2-CG1 4.36Å; L106-V119 HydrophobicContact CD2-CG2 4.39Å; V119-W121 HydrophobicContact CB-CH2 4.49Å; V119-W121 HydrophobicContact CG1-CE3 4.13Å; V119-W121 HydrophobicContact CG1-CH2 3.2Å; V119-W121 HydrophobicContact CG1-CZ2 3.71Å; V119-W121 HydrophobicContact CG1-CZ3 3.44Å; V119-W121 VanDerWaalsContact CG1-CZ3 3.44Å; V119-W121 HydrophobicContact CG2-CZ2 4.38Å
120R87.3Confident81.5Confident63 Ų6351.9 Ų51.924%0.23827%0.27CS..EExtended strand (participates in β ladder)trans-116127.9177.4-175.2175.7179.2-151.5-13.8109.7G79 I80 R98 D153 P156 L165G79-R120 WeakPolarHBondContact O-CA 3.37Å; I80-R120 HydrophobicContact CG1-CB 4.36Å; I80-R120 HydrophobicContact CG1-CG 4.09Å; R98-R120 PolarHBondContact NH1-O 3.43Å; R98-R120 PolarHBondContact NH2-O 3.29Å; R120-D153 IonicContact CZ-OD2 3.69Å; R120-D153 IonicContact NE-OD2 3.2Å; R120-D153 PolarHBondContact NE-OD2 3.32Å; R120-D153 IonicContact NH2-OD2 2.75Å; R120-D153 PolarHBondContact NH2-OD2 3.48Å; R120-P156 VanDerWaalsContact NH2-C 3.26Å; R120-P156 VanDerWaalsContact NH2-CB 3.25Å; R120-P156 PolarHBondContact NH2-O 3.03Å; R120-L165 HydrophobicContact CB-CD1 4.09Å
121W87.6Confident82.2Confident1 Ų150.8 Ų50.80%0.00426%0.259CS..EExtended strand (participates in β ladder)trans-101.8136.3169.5-70.7-81.7000109.8P78 G79 A81 A96 E97 V119 E125 R126 R127 L129P78-W121 WeakPolarHBondContact CA-O 3.48Å; G79-W121 PolarHBondContact N-O 3.35Å; G79-W121 VanDerWaalsContact N-O 3.11Å; G79-W121 PolarHBondContact O-N 3.34Å; A81-W121 HydrophobicContact CB-CH2 4.06Å; A81-W121 HydrophobicContact CB-CZ3 3.53Å; A96-W121 HydrophobicContact CB-CZ2 3.73Å; E97-W121 PolarHBondContact O-NE1 2.82Å; V119-W121 HydrophobicContact CB-CH2 4.49Å; V119-W121 HydrophobicContact CG1-CE3 4.13Å; V119-W121 HydrophobicContact CG1-CH2 3.2Å; V119-W121 HydrophobicContact CG1-CZ2 3.71Å; V119-W121 HydrophobicContact CG1-CZ3 3.44Å; V119-W121 VanDerWaalsContact CG1-CZ3 3.44Å; V119-W121 HydrophobicContact CG2-CZ2 4.38Å; W121-E125 HydrophobicContact CB-CB 3.83Å; W121-E125 HydrophobicContact CG-CB 4.28Å; W121-R126 PolarHBondContact NE1-O 3.21Å; W121-R127 HydrophobicContact CB-CG 4.32Å; W121-R127 HydrophobicContact CD2-CB 4.27Å; W121-R127 HydrophobicContact CD2-CG 4.17Å; W121-R127 HydrophobicContact CE3-CB 4.12Å; W121-R127 HydrophobicContact CE3-CG 3.96Å; W121-R127 HydrophobicContact CG-CG 4.35Å; W121-R127 HydrophobicContact CZ3-CB 4.32Å; W121-L129 HydrophobicContact CH2-CD2 3.89Å; W121-L129 HydrophobicContact CH2-CG 4.48Å; W121-L129 HydrophobicContact CZ2-CD2 3.97Å
122G83Confident83.3Confident16 Ų1648 Ų4817%0.16523%0.234CC..  trans-70179.1174.900000113.2R124 E125G122-R124 PolarHBondContact O-N 3.45Å; G122-E125 VanDerWaalsContact N-CD 3.27Å; G122-E125 PolarHBondContact N-OE1 2.88Å; G122-E125 PolarHBondContact N-OE2 3.34Å; G122-E125 PolarHBondContact O-N 3.11Å
123P79.5Confident84.7Confident89 Ų8947.1 Ų47.158%0.57822%0.223SC*.THydrogen-bonded Turntrans-57.4137.4172.6-13.824.4000110.2P78 E125P78-P123 HydrophobicContact CG-CB 4.23Å; P78-P123 HydrophobicContact CG-CG 3.71Å; P123-E125 PolarHBondContact O-N 2.87Å; P123-E125 VanDerWaalsContact O-N 3.07Å
124R78.8Confident86.1Confident228 Ų22845.6 Ų45.686%0.8621%0.213SC*.THydrogen-bonded Turntrans66-3.3179.4-48.9176.3177.4169.6-0.7116A76 G122A76-R124 PolarHBondContact O-N 2.86Å; G122-R124 PolarHBondContact O-N 3.45Å
125E85.1Confident87.3Confident43 Ų4350.7 Ų50.720%0.20125%0.245CC..  trans-68.7137.5169.4-75.9-178.6-141.700109.6R98 A99 W121 G122 P123 R127R98-E125 IonicContact CZ-OE2 3.68Å; R98-E125 IonicContact NE-OE2 3.24Å; R98-E125 IonicContact NH2-OE1 3.36Å; R98-E125 IonicContact NH2-OE2 2.69Å; R98-E125 PolarHBondContact NH2-OE2 2.83Å; A99-E125 HydrophobicContact CB-CG 4.09Å; W121-E125 HydrophobicContact CB-CB 3.83Å; W121-E125 HydrophobicContact CG-CB 4.28Å; G122-E125 VanDerWaalsContact N-CD 3.27Å; G122-E125 PolarHBondContact N-OE1 2.88Å; G122-E125 PolarHBondContact N-OE2 3.34Å; G122-E125 PolarHBondContact O-N 3.11Å; P123-E125 PolarHBondContact O-N 2.87Å; P123-E125 VanDerWaalsContact O-N 3.07Å; E125-R127 PolarHBondContact O-N 3.17Å
126R84.6Confident88.2Confident184 Ų18454.5 Ų54.569%0.69426%0.26SS*.  trans-74.7123.3174-68.6-177-178.9-101.22.8108.1W121 A128W121-R126 PolarHBondContact NE1-O 3.21Å; R126-A128 HydrophobicContact CB-CB 4.45Å; R126-A128 PolarHBondContact O-N 2.9Å
127R90Very high88.3Confident25 Ų2564 Ų649%0.09430%0.302CS..  trans-72.168.7173.6-59.8174.1-68-156.8-6.6109.8L69 G71 W121 E125L69-R127 HydrophobicContact CB-CB 4.38Å; L69-R127 PolarHBondContact N-O 2.82Å; L69-R127 WeakPolarHBondContact O-CB 3.35Å; L69-R127 PolarHBondContact O-NE 2.94Å; L69-R127 VanDerWaalsContact O-NE 3.11Å; G71-R127 PolarHBondContact O-NH2 2.8Å; W121-R127 HydrophobicContact CB-CG 4.32Å; W121-R127 HydrophobicContact CD2-CB 4.27Å; W121-R127 HydrophobicContact CD2-CG 4.17Å; W121-R127 HydrophobicContact CE3-CB 4.12Å; W121-R127 HydrophobicContact CE3-CG 3.96Å; W121-R127 HydrophobicContact CG-CG 4.35Å; W121-R127 HydrophobicContact CZ3-CB 4.32Å; E125-R127 PolarHBondContact O-N 3.17Å
128A92.8Very high88.2Confident0 Ų063.9 Ų63.90%031%0.308CS..EExtended strand (participates in β ladder)trans-113.8136.6-174.800000110.6L67 E97 R126L67-A128 CarbonylContact O-C 3.57Å; L67-A128 WeakPolarHBondContact O-CA 3.43Å; E97-A128 HydrophobicContact CB-CB 4.14Å; E97-A128 HydrophobicContact CG-CB 4.22Å; E97-A128 PolarHBondContact N-O 2.94Å; R126-A128 HydrophobicContact CB-CB 4.45Å; R126-A128 PolarHBondContact O-N 2.9Å
129L95.9Very high87.7Confident0 Ų070.9 Ų70.90%034%0.342CS..EExtended strand (participates in β ladder)trans-109.3136170.9-61.6176.5000108.9R66 L67 L69 L83 V94 F95 A96 L106 W121 L131 F146R66-L129 CarbonylContact C-O 3.44Å; R66-L129 WeakPolarHBondContact CA-O 3.49Å; L67-L129 HydrophobicContact CB-CB 4.35Å; L67-L129 HydrophobicContact CD2-CD1 4.33Å; L67-L129 PolarHBondContact N-O 2.99Å; L67-L129 PolarHBondContact O-N 2.78Å; L69-L129 HydrophobicContact CD1-CD1 3.8Å; L69-L129 HydrophobicContact CD1-CG 4.21Å; L69-L129 HydrophobicContact CG-CD1 4.42Å; L83-L129 HydrophobicContact CD1-CD1 3.84Å; L83-L129 HydrophobicContact CD1-CD2 4.3Å; L83-L129 HydrophobicContact CD2-CD1 3.86Å; L83-L129 HydrophobicContact CG-CD1 4.47Å; V94-L129 HydrophobicContact CG1-CB 4.25Å; V94-L129 HydrophobicContact CG1-CD1 4.23Å; V94-L129 HydrophobicContact CG1-CD2 4.39Å; F95-L129 CarbonylContact O-C 3.59Å; F95-L129 WeakPolarHBondContact O-CA 3.16Å; A96-L129 HydrophobicContact CB-CD2 4.25Å; L106-L129 HydrophobicContact CD1-CD2 3.68Å; W121-L129 HydrophobicContact CH2-CD2 3.89Å; W121-L129 HydrophobicContact CH2-CG 4.48Å; W121-L129 HydrophobicContact CZ2-CD2 3.97Å; L129-L131 HydrophobicContact CB-CD1 3.98Å; L129-F146 HydrophobicContact CD1-CE2 4.34Å; L129-F146 HydrophobicContact CD1-CZ 4.42Å
130F96.5Very high87.7Confident38 Ų3873.3 Ų73.317%0.16736%0.359CS..EExtended strand (participates in β ladder)trans-104.8118.9170.3-173.5-101.2000108.6V44 A64 F95 E97 L103 Q132V44-F130 HydrophobicContact CG1-CE2 4.05Å; V44-F130 HydrophobicContact CG2-CE2 4.46Å; A64-F130 HydrophobicContact CB-CE1 4.09Å; A64-F130 HydrophobicContact CB-CE2 3.68Å; A64-F130 HydrophobicContact CB-CZ 3.35Å; F95-F130 HydrophobicContact CB-CB 4.38Å; F95-F130 HydrophobicContact CD2-CD1 4.22Å; F95-F130 WeakPolarHBondContact CD2-O 3.07Å; F95-F130 PolarHBondContact N-O 3.35Å; F95-F130 PolarHBondContact O-N 2.78Å; E97-F130 HydrophobicContact CG-CB 4.35Å; L103-F130 HydrophobicContact CD1-CD1 3.97Å; L103-F130 HydrophobicContact CD1-CE1 4.48Å; L103-F130 HydrophobicContact CD1-CG 4.45Å; L103-F130 HydrophobicContact CD2-CB 4.02Å; F130-Q132 HydrophobicContact CD1-CB 4.36Å; F130-Q132 HydrophobicContact CE1-CB 3.94Å; F130-Q132 HydrophobicContact CE1-CG 4.45Å
131L96.8Very high87.8Confident1 Ų178.1 Ų78.11%0.00538%0.377CS..EExtended strand (participates in β ladder)trans-104.7118.1177.2-65.368000107.4V56 W58 A64 L65 L67 Q93 V94 L129 F146V56-L131 HydrophobicContact CG1-CD2 4.21Å; W58-L131 HydrophobicContact CE3-CB 4.27Å; W58-L131 HydrophobicContact CE3-CD2 4.38Å; W58-L131 HydrophobicContact CZ3-CB 3.98Å; A64-L131 CarbonylContact C-O 3.51Å; A64-L131 WeakPolarHBondContact CA-O 3.39Å; A64-L131 WeakPolarHBondContact CB-O 3.38Å; L65-L131 HydrophobicContact CB-CB 4.23Å; L65-L131 PolarHBondContact N-O 2.92Å; L65-L131 PolarHBondContact O-N 3.21Å; L67-L131 HydrophobicContact CB-CD1 4.02Å; Q93-L131 CarbonylContact O-C 3.34Å; Q93-L131 VanDerWaalsContact O-CA 3.31Å; Q93-L131 WeakPolarHBondContact O-CA 3.5Å; V94-L131 HydrophobicContact CG1-CD1 4.3Å; V94-L131 HydrophobicContact CG1-CG 4.24Å; V94-L131 HydrophobicContact CG2-CG 4.11Å; L129-L131 HydrophobicContact CB-CD1 3.98Å; L131-F146 HydrophobicContact CD2-CE1 3.68Å; L131-F146 HydrophobicContact CD2-CZ 4.05Å; L131-F146 HydrophobicContact CG-CE1 4.31Å
132Q95.7Very high88Confident83 Ų8379.9 Ų79.939%0.38838%0.384SS..EExtended strand (participates in β ladder)trans-107126.4177.7-173.7178.3-44.600109.2A92 Q93 F95 F130A92-Q132 CarbonylContact C-O 3.59Å; A92-Q132 WeakPolarHBondContact CA-O 3.42Å; A92-Q132 VanDerWaalsContact CB-O 3.3Å; A92-Q132 WeakPolarHBondContact CB-O 3.41Å; Q93-Q132 PolarHBondContact N-O 2.83Å; Q93-Q132 PolarHBondContact O-N 2.91Å; F95-Q132 HydrophobicContact CE2-CB 4.15Å; F130-Q132 HydrophobicContact CD1-CB 4.36Å; F130-Q132 HydrophobicContact CE1-CB 3.94Å; F130-Q132 HydrophobicContact CE1-CG 4.45Å
133A94.8Very high88.6Confident12 Ų1281.1 Ų81.110%0.09939%0.388CS..EExtended strand (participates in β ladder)trans-64.3137.6174.100000110.5W58 P61 G63 G91W58-A133 HydrophobicContact CH2-CB 3.91Å; W58-A133 HydrophobicContact CZ3-CB 4.26Å; P61-A133 VanDerWaalsContact C-CB 3.49Å; P61-A133 HydrophobicContact CB-CB 3.74Å; G63-A133 WeakPolarHBondContact O-CB 3.45Å; G63-A133 PolarHBondContact O-N 2.84Å; G91-A133 WeakPolarHBondContact O-CA 3.37Å
134T93.1Very high89.4Confident28 Ų2876.9 Ų76.917%0.17236%0.361CS..PPolyproline II helixtrans-77.8124.3171.6-53.90000108.3G91 E109 H136G91-T134 PolarHBondContact O-N 3.2Å; E109-T134 WeakPolarHBondContact OE2-CB 3.32Å; E109-T134 WeakPolarHBondContact OE2-CG2 3.33Å; E109-T134 PolarHBondContact OE2-OG1 2.81Å; T134-H136 PolarHBondContact O-N 2.75Å
135P87.3Confident90.2Very high116 Ų11666.4 Ų66.475%0.75332%0.323SS*.PPolyproline II helixtrans-55.8133.1175.8-23.933.7000110.8
136H84Confident90.7Very high91 Ų9164.4 Ų64.442%0.42131%0.314SS..  trans-143.7139.3-179.9-160.568.7000109.3T134 D138 R142T134-H136 PolarHBondContact O-N 2.75Å; H136-D138 IonicContact CD2-OD1 3.76Å; H136-D138 PolarHBondContact CD2-OD1 3.1Å; H136-D138 IonicContact CD2-OD2 3.82Å; H136-D138 IonicContact CE1-OD2 3.62Å; H136-D138 IonicContact NE2-OD1 3.95Å; H136-D138 PolarHBondContact NE2-OD1 2.8Å; H136-D138 IonicContact NE2-OD2 3.68Å; H136-D138 PolarHBondContact NE2-OD2 2.85Å; H136-R142 PolarHBondContact ND1-NH1 3.24Å
137Q79.9Confident91.2Very high206 Ų20661 Ų6196%0.96330%0.301SS*.SBendtrans-94.9-19.6-170.5-67.5-172.2-4.800114
138D83Confident91.3Very high88 Ų8859.8 Ų59.847%0.47130%0.296SS..SBendtrans-93.3166.4176.973.436.3000111.9H136 S140H136-D138 IonicContact CD2-OD1 3.76Å; H136-D138 PolarHBondContact CD2-OD1 3.1Å; H136-D138 IonicContact CD2-OD2 3.82Å; H136-D138 IonicContact CE1-OD2 3.62Å; H136-D138 IonicContact NE2-OD1 3.95Å; H136-D138 PolarHBondContact NE2-OD1 2.8Å; H136-D138 IonicContact NE2-OD2 3.68Å; H136-D138 PolarHBondContact NE2-OD2 2.85Å; D138-S140 PolarHBondContact O-N 2.82Å; D138-S140 WeakPolarHBondContact OD1-CA 3.44Å; D138-S140 WeakPolarHBondContact OD1-CB 3.38Å; D138-S140 PolarHBondContact OD1-N 2.86Å; D138-S140 PolarHBondContact OD1-OG 2.79Å
139I78.8Confident91.3Very high173 Ų17361.3 Ų61.389%0.88730%0.303SS*.  trans-87.717176.758.8170.9000112.6
140S87Confident91Very high55 Ų5562.1 Ų62.139%0.38531%0.307SS..  trans-63.7147.8-178.4700000110.7D138 R142D138-S140 PolarHBondContact O-N 2.82Å; D138-S140 WeakPolarHBondContact OD1-CA 3.44Å; D138-S140 WeakPolarHBondContact OD1-CB 3.38Å; D138-S140 PolarHBondContact OD1-N 2.86Å; D138-S140 PolarHBondContact OD1-OG 2.79Å; S140-R142 PolarHBondContact O-N 3.43Å
141R90.2Very high90.4Very high163 Ų16365.2 Ų65.262%0.61532%0.318SS*.  trans-69.8115.7175.2-178.4179.3176-170.5-1.5109.3Y60 V143Y60-R141 HydrophobicContact CE1-CB 3.99Å; Y60-R141 HydrophobicContact CE1-CG 4.12Å; R141-V143 HydrophobicContact CG-CG2 4.21Å
142R92.2Very high89.6Confident39 Ų3970.2 Ų70.215%0.14734%0.341CS..  trans-114.9140.9170.7-50.4-165.769.4-179.90.7109.4Y60 P61 E109 H136 S140Y60-R142 PolarHBondContact N-O 3.42Å; P61-R142 WeakPolarHBondContact CD-O 3.04Å; E109-R142 IonicContact OE1-CZ 2.88Å; E109-R142 IonicContact OE1-NH1 2.7Å; E109-R142 PolarHBondContact OE1-NH1 2.84Å; E109-R142 IonicContact OE1-NH2 2.75Å; E109-R142 PolarHBondContact OE1-NH2 2.72Å; E109-R142 IonicContact OE2-CZ 2.73Å; E109-R142 IonicContact OE2-NH1 3.46Å; E109-R142 IonicContact OE2-NH2 3.59Å; E109-R142 PolarHBondContact OE2-NH2 2.83Å; H136-R142 PolarHBondContact ND1-NH1 3.24Å; S140-R142 PolarHBondContact O-N 3.43Å
143V94.6Very high88.5Confident42 Ų4266.5 Ų66.526%0.25532%0.324SS..EExtended strand (participates in β ladder)trans-135.6114.4179.8-175.60000109W58 L59 A90 R141 A145W58-V143 WeakPolarHBondContact O-CA 3.49Å; L59-V143 HydrophobicContact CD2-CB 4.37Å; L59-V143 HydrophobicContact CD2-CG1 3.9Å; L59-V143 HydrophobicContact CD2-CG2 3.57Å; A90-V143 CarbonylContact O-C 3.33Å; A90-V143 VanDerWaalsContact O-C 3.27Å; A90-V143 VanDerWaalsContact O-O 3.11Å; R141-V143 HydrophobicContact CG-CG2 4.21Å; V143-A145 HydrophobicContact CG1-CB 4.19Å
144A95.9Very high87.2Confident0 Ų069 Ų690%035%0.35CS..EExtended strand (participates in β ladder)trans-90.1108.3170.800000108.2W58 P61 F89 A90 A92W58-A144 HydrophobicContact CB-CB 4.33Å; W58-A144 PolarHBondContact N-O 2.91Å; W58-A144 PolarHBondContact O-N 2.79Å; P61-A144 HydrophobicContact CG-CB 3.94Å; F89-A144 HydrophobicContact CE2-CB 4.19Å; F89-A144 HydrophobicContact CZ-CB 4.13Å; A90-A144 WeakPolarHBondContact O-CA 3.45Å; A90-A144 WeakPolarHBondContact O-CB 3.33Å; A90-A144 PolarHBondContact O-N 3.03Å; A92-A144 HydrophobicContact CB-CB 3.52Å
145A95.9Very high85.9Confident8 Ų872.9 Ų72.97%0.06636%0.362CS..EExtended strand (participates in β ladder)trans-130.5137.8-176.900000112.8V56 E57 V86 F89 V143V56-A145 CarbonylContact O-C 3.59Å; V56-A145 WeakPolarHBondContact O-CA 3.5Å; E57-A145 HydrophobicContact CG-CB 3.99Å; V86-A145 HydrophobicContact CB-CB 3.94Å; V86-A145 HydrophobicContact CG2-CB 3.64Å; V86-A145 PolarHBondContact N-O 3.19Å; F89-A145 WeakPolarHBondContact CD2-O 3.47Å; F89-A145 WeakPolarHBondContact CE2-O 2.95Å; V143-A145 HydrophobicContact CG1-CB 4.19Å
146F95.3Very high84.7Confident1 Ų169.4 Ų69.40%0.00434%0.339CS..EExtended strand (participates in β ladder)trans-153.5154.1174.360.8-92.3000111.3A55 V56 L67 L83 R84 F89 V94 L107 L129 L131A55-F146 WeakPolarHBondContact CA-O 3.34Å; V56-F146 HydrophobicContact CB-CD1 4.39Å; V56-F146 HydrophobicContact CB-CD2 4.45Å; V56-F146 HydrophobicContact CB-CE1 3.97Å; V56-F146 HydrophobicContact CB-CE2 4.03Å; V56-F146 HydrophobicContact CB-CZ 3.78Å; V56-F146 HydrophobicContact CG1-CE1 4.03Å; V56-F146 HydrophobicContact CG1-CZ 4.06Å; V56-F146 HydrophobicContact CG2-CE1 4.48Å; V56-F146 HydrophobicContact CG2-CE2 3.82Å; V56-F146 HydrophobicContact CG2-CZ 3.79Å; V56-F146 PolarHBondContact N-O 3.33Å; V56-F146 PolarHBondContact O-N 2.82Å; L67-F146 HydrophobicContact CD2-CE2 4.48Å; L67-F146 HydrophobicContact CD2-CZ 4.19Å; L83-F146 HydrophobicContact CB-CD2 4.44Å; L83-F146 HydrophobicContact CD1-CE2 4.5Å; L83-F146 HydrophobicContact CD2-CD2 4.01Å; L83-F146 HydrophobicContact CD2-CE2 3.94Å; R84-F146 CarbonylContact O-C 3.52Å; R84-F146 VanDerWaalsContact O-CA 3.25Å; R84-F146 WeakPolarHBondContact O-CA 3.17Å; R84-F146 WeakPolarHBondContact O-CB 3.22Å; F89-F146 HydrophobicContact CE2-CD1 4.1Å; F89-F146 HydrophobicContact CZ-CD1 4.42Å; V94-F146 HydrophobicContact CG1-CZ 4.49Å; V94-F146 HydrophobicContact CG2-CD1 4.2Å; V94-F146 HydrophobicContact CG2-CE1 3.86Å; L107-F146 HydrophobicContact CD1-CB 4.02Å; L107-F146 HydrophobicContact CD1-CD1 4.28Å; L107-F146 HydrophobicContact CD1-CG 4.16Å; L129-F146 HydrophobicContact CD1-CE2 4.34Å; L129-F146 HydrophobicContact CD1-CZ 4.42Å; L131-F146 HydrophobicContact CD2-CE1 3.68Å; L131-F146 HydrophobicContact CD2-CZ 4.05Å; L131-F146 HydrophobicContact CG-CE1 4.31Å
147R95Very high83.7Confident112 Ų11272.5 Ų72.542%0.42335%0.354SS..EExtended strand (participates in β ladder)trans-94151.5166.4-67.8177.167.2170.80.4109.8E53 G54 A55 L83 R84 F259E53-R147 IonicContact OE1-CZ 2.73Å; E53-R147 IonicContact OE1-NE 2.79Å; E53-R147 IonicContact OE1-NH2 3.06Å; E53-R147 PolarHBondContact OE1-NH2 2.71Å; G54-R147 WeakPolarHBondContact O-CA 3.43Å; A55-R147 HydrophobicContact CB-CG 4.24Å; L83-R147 CarbonylContact C-O 3.48Å; L83-R147 WeakPolarHBondContact CA-O 3.38Å; R84-R147 PolarHBondContact N-O 2.76Å; R84-R147 PolarHBondContact O-N 2.68Å; R147-F259 HydrophobicContact CB-CD1 4.26Å; R147-F259 HydrophobicContact CB-CE1 3.85Å
148F93.4Very high82.7Confident0 Ų064.1 Ų64.10%032%0.316CS..EExtended strand (participates in β ladder)trans-128.4148172.671.3-88.2000111.2C30 L49 E53 G54 L69 C82 L83C30-F148 WeakPolarHBondContact O-CE1 3.27Å; C30-F148 WeakPolarHBondContact O-CZ 2.99Å; L49-F148 HydrophobicContact CB-CE1 4.42Å; L49-F148 HydrophobicContact CB-CZ 4.01Å; L49-F148 HydrophobicContact CD1-CE1 3.57Å; L49-F148 HydrophobicContact CD1-CZ 4.02Å; E53-F148 WeakPolarHBondContact CA-O 3.49Å; E53-F148 WeakPolarHBondContact CG-O 3.41Å; G54-F148 PolarHBondContact N-O 3.08Å; G54-F148 VanDerWaalsContact N-O 3.13Å; G54-F148 WeakPolarHBondContact O-CD1 3.27Å; G54-F148 PolarHBondContact O-N 2.88Å; L69-F148 HydrophobicContact CD1-CD2 4.5Å; L69-F148 HydrophobicContact CD2-CD1 4.32Å; L69-F148 HydrophobicContact CD2-CD2 3.95Å; L69-F148 HydrophobicContact CD2-CE1 4.36Å; L69-F148 HydrophobicContact CD2-CE2 3.99Å; L69-F148 HydrophobicContact CD2-CG 4.12Å; L69-F148 HydrophobicContact CD2-CZ 4.2Å; C82-F148 CarbonylContact O-C 3.5Å; C82-F148 VanDerWaalsContact O-CA 3.23Å; C82-F148 WeakPolarHBondContact O-CA 3.18Å; L83-F148 HydrophobicContact CD2-CB 3.61Å
149E92.2Very high81.6Confident31 Ų3162.5 Ų62.515%0.14531%0.31CS..EExtended strand (participates in β ladder)trans-126.5130.4165.5-80.1179163.300107.9A52 E53 A81 C82 R258 F259A52-E149 CarbonylContact O-C 3.54Å; A52-E149 WeakPolarHBondContact O-CA 3.26Å; E53-E149 HydrophobicContact CB-CG 4.41Å; E53-E149 HydrophobicContact CG-CG 3.9Å; A81-E149 CarbonylContact C-O 3.27Å; A81-E149 VanDerWaalsContact CA-O 3.22Å; A81-E149 WeakPolarHBondContact CA-O 3.33Å; C82-E149 PolarHBondContact N-O 3Å; C82-E149 PolarHBondContact O-N 2.89Å; E149-R258 WeakPolarHBondContact OE2-CA 2.9Å; E149-F259 HydrophobicContact CB-CE1 4.08Å; E149-F259 HydrophobicContact CB-CZ 4.37Å; E149-F259 HydrophobicContact CG-CD1 3.64Å; E149-F259 HydrophobicContact CG-CE1 3.61Å; E149-F259 HydrophobicContact CG-CG 4.39Å; E149-F259 HydrophobicContact CG-CZ 4.32Å; E149-F259 WeakPolarHBondContact OE1-CA 3.39Å; E149-F259 PolarHBondContact OE1-N 2.91Å; E149-F259 PolarHBondContact OE2-N 3.14Å
150L89.5Confident80.7Confident17 Ų1757.3 Ų57.39%0.08929%0.287CS..EExtended strand (participates in β ladder)trans-115.2130.1179.5174.668.1000108.6A52 L69 I80 A81A52-L150 PolarHBondContact O-N 2.83Å; L69-L150 HydrophobicContact CB-CD2 4.41Å; I80-L150 WeakPolarHBondContact O-CA 3.42Å; A81-L150 HydrophobicContact CB-CD1 4.27Å
151R84.2Confident79.2Confident104 Ų10457.8 Ų57.839%0.39228%0.284SS..EExtended strand (participates in β ladder)trans-124.2140.9173.5-65.5176.265.8156.85.3109.3G79 I80 D187G79-R151 WeakPolarHBondContact CA-O 3.49Å; I80-R151 PolarHBondContact N-O 3.31Å; I80-R151 PolarHBondContact O-N 2.73Å; R151-D187 IonicContact CZ-OD1 3.35Å; R151-D187 IonicContact CZ-OD2 2.63Å; R151-D187 IonicContact NH1-OD1 2.71Å; R151-D187 PolarHBondContact NH1-OD1 3.3Å; R151-D187 IonicContact NH1-OD2 3.13Å; R151-D187 PolarHBondContact NH1-OD2 3.22Å; R151-D187 IonicContact NH2-OD1 3.43Å; R151-D187 PolarHBondContact NH2-OD1 2.04Å; R151-D187 IonicContact NH2-OD2 3.9Å
152E80.1Confident77.3Confident106 Ų10650.9 Ų50.950%0.49526%0.261SS..EExtended strand (participates in β ladder)trans-68.8131.3161.4-65.9-169.6176.400108.5R77 G154R77-E152 VanDerWaalsContact CD-OE2 3.31Å; R77-E152 WeakPolarHBondContact CD-OE2 3.43Å; R77-E152 IonicContact CZ-OE2 2.76Å; R77-E152 IonicContact NH1-OE2 3.33Å; R77-E152 PolarHBondContact NH1-OE2 3.02Å; E152-G154 PolarHBondContact O-N 3.43Å
153D72.8Confident75.6Confident5 Ų550.5 Ų50.53%0.02726%0.261CS..  trans-85.290.4169.717016000107.8P78 I80 R120 R155 P156 H163P78-D153 HydrophobicContact CB-CB 3.83Å; P78-D153 WeakPolarHBondContact O-CB 3.17Å; P78-D153 PolarHBondContact O-N 2.95Å; I80-D153 HydrophobicContact CD1-CB 3.99Å; I80-D153 HydrophobicContact CG1-CB 4.08Å; R120-D153 IonicContact CZ-OD2 3.69Å; R120-D153 IonicContact NE-OD2 3.2Å; R120-D153 PolarHBondContact NE-OD2 3.32Å; R120-D153 IonicContact NH2-OD2 2.75Å; R120-D153 PolarHBondContact NH2-OD2 3.48Å; D153-R155 PolarHBondContact O-N 3.47Å; D153-R155 PolarHBondContact OD1-N 3.28Å; D153-P156 WeakPolarHBondContact OD1-CA 3.08Å; D153-P156 WeakPolarHBondContact OD2-CA 3.36Å; D153-H163 IonicContact OD1-CD2 2.66Å; D153-H163 IonicContact OD1-CE1 3.79Å; D153-H163 IonicContact OD1-NE2 3.66Å; D153-H163 PolarHBondContact OD1-NE2 3.24Å; D153-H163 VanDerWaalsContact OD1-NE2 3.14Å
154G66.1Low73.8Confident63 Ų6349.4 Ų49.465%0.64926%0.259SS*.SBendtrans-74.6-3.5179.900000114.1E152E152-G154 PolarHBondContact O-N 3.43Å
155R66.4Low72Confident111 Ų11151 Ų5142%0.41927%0.267SS..  trans-142.967.7-179.3-62.3-172.4-177.9-165.50.6109.9D153 E157 L158 H163D153-R155 PolarHBondContact O-N 3.47Å; D153-R155 PolarHBondContact OD1-N 3.28Å; R155-E157 PolarHBondContact O-N 2.78Å; R155-L158 HydrophobicContact CB-CB 4.49Å; R155-L158 HydrophobicContact CB-CD1 3.57Å; R155-L158 HydrophobicContact CB-CG 3.77Å; R155-L158 HydrophobicContact CG-CD1 4.2Å; R155-L158 WeakPolarHBondContact O-CB 3.04Å; R155-L158 PolarHBondContact O-N 2.7Å; R155-H163 PolarHBondContact O-CE1 2.74Å; R155-H163 PolarHBondContact O-NE2 3.22Å
156P61.9Low69.9Low42 Ų4251.7 Ų51.727%0.27328%0.275SS..THydrogen-bonded Turntrans-65.2-16.4-172.127.5-35.6000114P78 R120 D153 L158P78-P156 HydrophobicContact CB-CB 4.14Å; P78-P156 HydrophobicContact CG-CB 3.82Å; P78-P156 HydrophobicContact CG-CG 4.16Å; R120-P156 VanDerWaalsContact NH2-C 3.26Å; R120-P156 VanDerWaalsContact NH2-CB 3.25Å; R120-P156 PolarHBondContact NH2-O 3.03Å; D153-P156 WeakPolarHBondContact OD1-CA 3.08Å; D153-P156 WeakPolarHBondContact OD2-CA 3.36Å; P156-L158 PolarHBondContact O-N 3.36Å
157E62.7Low67.9Low157 Ų15754.9 Ų54.973%0.73430%0.295SS*.THydrogen-bonded Turntrans-69.1-18.2174.9-52.277-162.800112R155R155-E157 PolarHBondContact O-N 2.78Å
158L60.4Low65.5Low29 Ų2957.3 Ų57.315%0.15232%0.316CS..SBendtrans-79145.5-175-64.5-177.3000112.8R155 P156 A162 H163 L181 T185R155-L158 HydrophobicContact CB-CB 4.49Å; R155-L158 HydrophobicContact CB-CD1 3.57Å; R155-L158 HydrophobicContact CB-CG 3.77Å; R155-L158 HydrophobicContact CG-CD1 4.2Å; R155-L158 WeakPolarHBondContact O-CB 3.04Å; R155-L158 PolarHBondContact O-N 2.7Å; P156-L158 PolarHBondContact O-N 3.36Å; L158-A162 HydrophobicContact CB-CB 4Å; L158-A162 HydrophobicContact CD1-CB 4.45Å; L158-H163 VanDerWaalsContact CB-CE1 3.45Å; L158-H163 WeakPolarHBondContact CB-CE1 3.18Å; L158-H163 PolarHBondContact O-CE1 3.45Å; L158-H163 VanDerWaalsContact O-CE1 3.22Å; L158-H163 PolarHBondContact O-ND1 2.86Å; L158-L181 HydrophobicContact CD1-CD1 4.02Å; L158-L181 HydrophobicContact CD1-CD2 4.14Å; L158-L181 HydrophobicContact CD1-CG 4.39Å; L158-L181 HydrophobicContact CD2-CD1 3.91Å; L158-L181 HydrophobicContact CD2-CD2 3.31Å; L158-L181 HydrophobicContact CD2-CG 4.19Å; L158-L181 HydrophobicContact CG-CD2 4.25Å; L158-T185 HydrophobicContact CD1-CG2 3.87Å
159P58.9Low63.6Low54 Ų5458.1 Ų58.135%0.35132%0.324SS..  trans-57150.9177.7-2432.8000112.2Q161 A162 H163P159-Q161 PolarHBondContact O-N 2.85Å; P159-A162 WeakPolarHBondContact O-CB 3.5Å; P159-A162 PolarHBondContact O-N 3.47Å; P159-H163 PolarHBondContact O-ND1 2.69Å
160P59.9Low62.3Low64 Ų6458.2 Ų58.242%0.41633%0.33SS..G310 helixtrans-53.8-29.1173.8-25.733.7000113.4H163 G164 L165P160-H163 CarbonylContact O-C 3.59Å; P160-H163 WeakPolarHBondContact O-CB 3.31Å; P160-H163 PolarHBondContact O-N 2.9Å; P160-H163 VanDerWaalsContact O-N 3.17Å; P160-G164 PolarHBondContact O-N 2.75Å; P160-L165 HydrophobicContact CB-CB 4.12Å; P160-L165 WeakPolarHBondContact O-CB 3.44Å; P160-L165 PolarHBondContact O-N 3.29Å
161Q56.6Low62Low66 Ų6660.1 Ų60.131%0.30834%0.344SS..G310 helixtrans-63.9-40.9175.2-66.8154.836.600111.9P159 H163 G164 W256P159-Q161 PolarHBondContact O-N 2.85Å; Q161-H163 PolarHBondContact O-N 3.11Å; Q161-H163 VanDerWaalsContact O-N 3.13Å; Q161-G164 PolarHBondContact O-N 3.42Å; Q161-W256 WeakPolarHBondContact O-CH2 3.26Å; Q161-W256 VanDerWaalsContact O-CZ2 3.31Å; Q161-W256 WeakPolarHBondContact O-CZ2 3.27Å
162A49.2Very low62.2Low17 Ų1760.6 Ų60.614%0.1435%0.346CS..G310 helixtrans-66.2-12.8175.500000113.2L158 P159 L181 W256L158-A162 HydrophobicContact CB-CB 4Å; L158-A162 HydrophobicContact CD1-CB 4.45Å; P159-A162 WeakPolarHBondContact O-CB 3.5Å; P159-A162 PolarHBondContact O-N 3.47Å; A162-L181 HydrophobicContact CB-CD2 4.35Å; A162-W256 VanDerWaalsContact O-CE2 3.27Å; A162-W256 WeakPolarHBondContact O-CZ2 3.32Å; A162-W256 PolarHBondContact O-NE1 3.07Å
163H55.9Low62.6Low31 Ų3161.1 Ų61.114%0.14436%0.358CS..G310 helixtrans-105.53174.9-58.8105.6000112.8I80 D153 R155 L158 P159 P160 Q161 L165I80-H163 HydrophobicContact CD1-CB 3.91Å; D153-H163 IonicContact OD1-CD2 2.66Å; D153-H163 IonicContact OD1-CE1 3.79Å; D153-H163 IonicContact OD1-NE2 3.66Å; D153-H163 PolarHBondContact OD1-NE2 3.24Å; D153-H163 VanDerWaalsContact OD1-NE2 3.14Å; R155-H163 PolarHBondContact O-CE1 2.74Å; R155-H163 PolarHBondContact O-NE2 3.22Å; L158-H163 VanDerWaalsContact CB-CE1 3.45Å; L158-H163 WeakPolarHBondContact CB-CE1 3.18Å; L158-H163 PolarHBondContact O-CE1 3.45Å; L158-H163 VanDerWaalsContact O-CE1 3.22Å; L158-H163 PolarHBondContact O-ND1 2.86Å; P159-H163 PolarHBondContact O-ND1 2.69Å; P160-H163 CarbonylContact O-C 3.59Å; P160-H163 WeakPolarHBondContact O-CB 3.31Å; P160-H163 PolarHBondContact O-N 2.9Å; P160-H163 VanDerWaalsContact O-N 3.17Å; Q161-H163 PolarHBondContact O-N 3.11Å; Q161-H163 VanDerWaalsContact O-N 3.13Å; H163-L165 HydrophobicContact CB-CD1 3.79Å; H163-L165 HydrophobicContact CB-CG 3.7Å; H163-L165 PolarHBondContact O-N 2.82Å
164G57.2Low63.4Low20 Ų2062.4 Ų62.421%0.20637%0.367CS..THydrogen-bonded Turntrans65.920.4-175.500000114.6P160 Q161 W256 R258P160-G164 PolarHBondContact O-N 2.75Å; Q161-G164 PolarHBondContact O-N 3.42Å; G164-W256 VanDerWaalsContact CA-CZ3 3.46Å; G164-R258 PolarHBondContact O-NH2 3.2Å
165L59Low64.5Low32 Ų3262 Ų6217%0.16836%0.355CS..  trans-94.3-20-175.2-54.6177.7000113.8I80 C118 R120 P160 H163 V167I80-L165 HydrophobicContact CD1-CD1 3.74Å; I80-L165 HydrophobicContact CD1-CG 4.49Å; I80-L165 HydrophobicContact CG1-CD1 3.85Å; I80-L165 HydrophobicContact CG2-CD1 3.9Å; I80-L165 HydrophobicContact CG2-CD2 3.38Å; I80-L165 HydrophobicContact CG2-CG 4.23Å; C118-L165 HydrophobicContact CB-CD2 3.41Å; C118-L165 VanDerWaalsContact CB-CD2 3.41Å; R120-L165 HydrophobicContact CB-CD1 4.09Å; P160-L165 HydrophobicContact CB-CB 4.12Å; P160-L165 WeakPolarHBondContact O-CB 3.44Å; P160-L165 PolarHBondContact O-N 3.29Å; H163-L165 HydrophobicContact CB-CD1 3.79Å; H163-L165 HydrophobicContact CB-CG 3.7Å; H163-L165 PolarHBondContact O-N 2.82Å; L165-V167 PolarHBondContact O-N 3.06Å
166G52.2Low65.8Low23 Ų2361.1 Ų61.124%0.23736%0.358CS..  trans-76.3116.2-176.100000112.1A170G166-A170 WeakPolarHBondContact O-CB 3.36Å
167V52Low67.2Low69 Ų6962.5 Ų62.542%0.41837%0.374SS..SBendtrans-72.4-42.4166-179.70000109.4L165 R241L165-V167 PolarHBondContact O-N 3.06Å; V167-R241 VanDerWaalsContact CG1-NH2 3.31Å; V167-R241 PolarHBondContact O-NH2 3.13Å
168D44.7Very low68.5Low163 Ų16356.9 Ų56.987%0.87235%0.347SS*.THydrogen-bonded Turntrans-83.1-23.7-170.8-56.6-35.8000114.3
169G52.7Low70Confident16 Ų1655.7 Ų55.717%0.16534%0.341CS..THydrogen-bonded Turntrans-94.2-0.9175.800000114.9C171G169-C171 VanDerWaalsContact C-N 3.26Å; G169-C171 PolarHBondContact O-N 3.38Å
170A66.7Low71.6Confident34 Ų3453.9 Ų53.928%0.28133%0.328SS..THydrogen-bonded Turntrans-65.1-24.1-165.600000115.1G166 P239G166-A170 WeakPolarHBondContact O-CB 3.36Å; A170-P239 HydrophobicContact CB-CG 4.12Å
171C83.4Confident73.1Confident56 Ų5652.4 Ų52.438%0.37832%0.317SS..THydrogen-bonded Turntrans-111.5-4.3-167.1-53.40000114.4G169 C242G169-C171 VanDerWaalsContact C-N 3.26Å; G169-C171 PolarHBondContact O-N 3.38Å; C171-C242 VanDerWaalsContact CA-SG 3.5Å; C171-C242 HydrophobicContact CB-CB 3.67Å; C171-C242 WeakPolarHBondContact CB-SG 3.39Å; C171-C242 WeakPolarHBondContact SG-CA 3.45Å; C171-C242 WeakPolarHBondContact SG-CB 2.88Å; C171-C242 PolarHBondContact SG-N 3.1Å; C171-C242 CovalentContact SG-SG 2.04Å; C171-C242 PolarHBondContact SG-SG 2.91Å
172R87.1Confident74.7Confident115 Ų11549.6 Ų49.643%0.43431%0.305SS..SBendtrans-76.3149.3176.670.7170.4178.590.9-5.2110.2C174 E178R172-C174 PolarHBondContact O-N 3.35Å; R172-E178 IonicContact CZ-OE1 3.35Å; R172-E178 IonicContact CZ-OE2 3.45Å; R172-E178 IonicContact NH1-OE1 3.45Å; R172-E178 IonicContact NH1-OE2 2.73Å; R172-E178 PolarHBondContact NH1-OE2 3.44Å; R172-E178 VanDerWaalsContact NH2-CD 3.33Å; R172-E178 IonicContact NH2-OE1 3.56Å; R172-E178 PolarHBondContact NH2-OE1 3.45Å; R172-E178 IonicContact NH2-OE2 2.68Å; R172-E178 PolarHBondContact NH2-OE2 3.13Å
173P87.8Confident76.8Confident116 Ų11649 Ų4975%0.75330%0.3SS*.PPolyproline II helixtrans-56137.6167.4-23.834.4000111
174C89.9Confident78.4Confident32 Ų3247.9 Ų47.922%0.21630%0.295CS..PPolyproline II helixtrans-71.8137.3173-60.70000109.3R172 E178 L179 C266R172-C174 PolarHBondContact O-N 3.35Å; C174-E178 HydrophobicContact CB-CB 4.05Å; C174-L179 HydrophobicContact CB-CD2 3.54Å; C174-L179 HydrophobicContact CB-CG 4.04Å; C174-C266 HydrophobicContact CB-CB 3.97Å; C174-C266 WeakPolarHBondContact CB-SG 3.09Å; C174-C266 WeakPolarHBondContact SG-CB 3.25Å; C174-C266 CovalentContact SG-SG 2.05Å; C174-C266 PolarHBondContact SG-SG 3.13Å
175S90.7Very high79.9Confident55 Ų5548 Ų4839%0.38529%0.292SS..PPolyproline II helixtrans-72.6163.1170.461.50000111.5A177 E178 L179S175-A177 VanDerWaalsContact C-N 3.27Å; S175-A177 PolarHBondContact O-N 3.46Å; S175-E178 WeakPolarHBondContact CB-OE2 3.5Å; S175-E178 PolarHBondContact N-OE2 2.98Å; S175-E178 CarbonylContact O-C 3.57Å; S175-E178 WeakPolarHBondContact O-CA 3.38Å; S175-E178 WeakPolarHBondContact O-CB 3.45Å; S175-E178 PolarHBondContact O-N 2.93Å; S175-E178 VanDerWaalsContact OG-CD 3.28Å; S175-E178 VanDerWaalsContact OG-CG 3.26Å; S175-E178 WeakPolarHBondContact OG-CG 3.37Å; S175-E178 PolarHBondContact OG-OE2 3.22Å; S175-L179 WeakPolarHBondContact O-CG 3.45Å; S175-L179 PolarHBondContact O-N 2.92Å
176D92.7Very high81.4Confident92 Ų9246.5 Ų46.549%0.49228%0.284SS..Hα-helixtrans-52.2-44.7178.5-71.8-9.4000112.6E178 L179 L180 A276D176-E178 VanDerWaalsContact C-N 3.26Å; D176-E178 PolarHBondContact O-N 3.04Å; D176-L179 WeakPolarHBondContact O-CB 3.01Å; D176-L179 PolarHBondContact O-N 3.04Å; D176-L180 WeakPolarHBondContact O-CG 3.01Å; D176-L180 PolarHBondContact O-N 2.72Å; D176-A276 HydrophobicContact CB-CB 4.12Å
177A90.6Very high83.2Confident72 Ų7245.9 Ų45.960%0.59528%0.276SS*.Hα-helixtrans-59.1-38.3176.700000112.3S175 L181S175-A177 VanDerWaalsContact C-N 3.27Å; S175-A177 PolarHBondContact O-N 3.46Å; A177-L181 VanDerWaalsContact O-CB 3.3Å; A177-L181 WeakPolarHBondContact O-CB 3.45Å; A177-L181 PolarHBondContact O-N 3.35Å; A177-L181 VanDerWaalsContact O-N 3.08Å
178E90.2Very high85.1Confident39 Ų3942.6 Ų42.618%0.18226%0.256CS..Hα-helixtrans-75.6-35.4178.9-66.4171.9130.700112.5R172 C174 S175 D176 L181 A182R172-E178 IonicContact CZ-OE1 3.35Å; R172-E178 IonicContact CZ-OE2 3.45Å; R172-E178 IonicContact NH1-OE1 3.45Å; R172-E178 IonicContact NH1-OE2 2.73Å; R172-E178 PolarHBondContact NH1-OE2 3.44Å; R172-E178 VanDerWaalsContact NH2-CD 3.33Å; R172-E178 IonicContact NH2-OE1 3.56Å; R172-E178 PolarHBondContact NH2-OE1 3.45Å; R172-E178 IonicContact NH2-OE2 2.68Å; R172-E178 PolarHBondContact NH2-OE2 3.13Å; C174-E178 HydrophobicContact CB-CB 4.05Å; S175-E178 WeakPolarHBondContact CB-OE2 3.5Å; S175-E178 PolarHBondContact N-OE2 2.98Å; S175-E178 CarbonylContact O-C 3.57Å; S175-E178 WeakPolarHBondContact O-CA 3.38Å; S175-E178 WeakPolarHBondContact O-CB 3.45Å; S175-E178 PolarHBondContact O-N 2.93Å; S175-E178 VanDerWaalsContact OG-CD 3.28Å; S175-E178 VanDerWaalsContact OG-CG 3.26Å; S175-E178 WeakPolarHBondContact OG-CG 3.37Å; S175-E178 PolarHBondContact OG-OE2 3.22Å; D176-E178 VanDerWaalsContact C-N 3.26Å; D176-E178 PolarHBondContact O-N 3.04Å; E178-L181 PolarHBondContact O-N 2.98Å; E178-A182 WeakPolarHBondContact O-CB 3.46Å; E178-A182 PolarHBondContact O-N 2.96Å
179L92.6Very high87.5Confident3 Ų335 Ų352%0.01622%0.215CC..Hα-helixtrans-60.6-49.7173.3-68.4-177.2000110.9C174 S175 D176 L181 A182 A183 M254 C266 P268 F273C174-L179 HydrophobicContact CB-CD2 3.54Å; C174-L179 HydrophobicContact CB-CG 4.04Å; S175-L179 WeakPolarHBondContact O-CG 3.45Å; S175-L179 PolarHBondContact O-N 2.92Å; D176-L179 WeakPolarHBondContact O-CB 3.01Å; D176-L179 PolarHBondContact O-N 3.04Å; L179-L181 VanDerWaalsContact C-N 3.33Å; L179-L181 PolarHBondContact O-N 3.18Å; L179-A182 PolarHBondContact O-N 2.01Å; L179-A183 PolarHBondContact O-N 2.86Å; L179-M254 HydrophobicContact CD2-CE 3.81Å; L179-C266 HydrophobicContact CD2-CB 3.82Å; L179-P268 HydrophobicContact CD1-CB 3.81Å; L179-P268 HydrophobicContact CD1-CG 4.12Å; L179-P268 HydrophobicContact CD2-CB 3.92Å; L179-P268 HydrophobicContact CD2-CG 3.62Å; L179-P268 HydrophobicContact CG-CG 4.45Å; L179-F273 HydrophobicContact CB-CD2 4.11Å; L179-F273 HydrophobicContact CB-CE2 4.38Å
180L93.3Very high89.4Confident17 Ų1734.2 Ų34.29%0.08921%0.207CC..Hα-helixtrans-60.9-44.9179-64.6169.5000111.2D176 C184 Y277 A280 P287D176-L180 WeakPolarHBondContact O-CG 3.01Å; D176-L180 PolarHBondContact O-N 2.72Å; L180-C184 PolarHBondContact O-SG 3.22Å; L180-Y277 HydrophobicContact CD2-CD2 3.84Å; L180-Y277 HydrophobicContact CD2-CG 4.42Å; L180-A280 HydrophobicContact CD1-CB 3.46Å; L180-A280 VanDerWaalsContact CD1-CB 3.46Å; L180-A280 HydrophobicContact CD2-CB 4.1Å; L180-A280 HydrophobicContact CG-CB 4.44Å; L180-P287 HydrophobicContact CB-CG 3.98Å; L180-P287 WeakPolarHBondContact O-CG 3.28Å
181L90Very high90.7Very high32 Ų3234 Ų3417%0.16820%0.201CC..Hα-helixtrans-65.1-46.4177.8177.764.4000111.9L158 A162 A177 E178 L179 A183 C184 T185L158-L181 HydrophobicContact CD1-CD1 4.02Å; L158-L181 HydrophobicContact CD1-CD2 4.14Å; L158-L181 HydrophobicContact CD1-CG 4.39Å; L158-L181 HydrophobicContact CD2-CD1 3.91Å; L158-L181 HydrophobicContact CD2-CD2 3.31Å; L158-L181 HydrophobicContact CD2-CG 4.19Å; L158-L181 HydrophobicContact CG-CD2 4.25Å; A162-L181 HydrophobicContact CB-CD2 4.35Å; A177-L181 VanDerWaalsContact O-CB 3.3Å; A177-L181 WeakPolarHBondContact O-CB 3.45Å; A177-L181 PolarHBondContact O-N 3.35Å; A177-L181 VanDerWaalsContact O-N 3.08Å; E178-L181 PolarHBondContact O-N 2.98Å; L179-L181 VanDerWaalsContact C-N 3.33Å; L179-L181 PolarHBondContact O-N 3.18Å; L181-A183 VanDerWaalsContact C-N 3.3Å; L181-A183 PolarHBondContact O-N 3.07Å; L181-C184 CarbonylContact O-C 3.58Å; L181-C184 WeakPolarHBondContact O-CA 3.08Å; L181-C184 WeakPolarHBondContact O-CB 3.31Å; L181-C184 PolarHBondContact O-N 3.05Å; L181-T185 HydrophobicContact CD1-CG2 3.73Å; L181-T185 HydrophobicContact CG-CG2 4.28Å; L181-T185 PolarHBondContact O-N 3.13Å; L181-T185 PolarHBondContact O-OG1 2.84Å; L181-T185 VanDerWaalsContact O-OG1 3.07Å
182A90.7Very high91.2Very high8 Ų831.4 Ų31.47%0.06618%0.183CC..Hα-helixtrans-59.1-41.2179.600000111.5E178 L179 C184 T185 S186 M254 C266E178-A182 WeakPolarHBondContact O-CB 3.46Å; E178-A182 PolarHBondContact O-N 2.96Å; L179-A182 PolarHBondContact O-N 2.01Å; A182-C184 PolarHBondContact O-N 2.96Å; A182-C184 VanDerWaalsContact O-N 3.08Å; A182-T185 PolarHBondContact O-N 3.17Å; A182-S186 WeakPolarHBondContact O-CB 3.11Å; A182-S186 PolarHBondContact O-N 2.74Å; A182-S186 PolarHBondContact O-OG 3.08Å; A182-M254 HydrophobicContact CB-CB 4.29Å; A182-M254 HydrophobicContact CB-CE 4.44Å; A182-M254 HydrophobicContact CB-SD 4.07Å; A182-C266 HydrophobicContact CB-CB 4.48Å
183A93Very high91.5Very high5 Ų530 Ų304%0.04118%0.183CC..Hα-helixtrans-56.3-29.717500000112.8L179 L181 M254 F273 V290L179-A183 PolarHBondContact O-N 2.86Å; L181-A183 VanDerWaalsContact C-N 3.3Å; L181-A183 PolarHBondContact O-N 3.07Å; A183-M254 VanDerWaalsContact CA-SD 3.55Å; A183-M254 HydrophobicContact CB-SD 3.74Å; A183-M254 PolarHBondContact N-SD 2.96Å; A183-M254 VanDerWaalsContact N-SD 3.38Å; A183-F273 HydrophobicContact CB-CE2 3.8Å; A183-F273 HydrophobicContact CB-CZ 3.63Å; A183-V290 HydrophobicContact CB-CG2 4.04Å
184C90.8Very high91.9Very high6 Ų625.6 Ų25.64%0.04115%0.153CC..Hα-helixtrans-95-19.8-178.2-57.60000114.5L180 L181 A182 R217 C288L180-C184 PolarHBondContact O-SG 3.22Å; L181-C184 CarbonylContact O-C 3.58Å; L181-C184 WeakPolarHBondContact O-CA 3.08Å; L181-C184 WeakPolarHBondContact O-CB 3.31Å; L181-C184 PolarHBondContact O-N 3.05Å; A182-C184 PolarHBondContact O-N 2.96Å; A182-C184 VanDerWaalsContact O-N 3.08Å; C184-R217 PolarHBondContact O-NH1 3.47Å; C184-C288 WeakPolarHBondContact CA-SG 3.39Å; C184-C288 HydrophobicContact CB-CB 3.83Å; C184-C288 WeakPolarHBondContact CB-SG 3.35Å; C184-C288 WeakPolarHBondContact SG-CB 3.29Å; C184-C288 PolarHBondContact SG-N 3.47Å; C184-C288 CovalentContact SG-SG 2.01Å; C184-C288 PolarHBondContact SG-SG 3.27Å
185T88.2Confident92Very high23 Ų2329.7 Ų29.714%0.14117%0.169CC..Hα-helixtrans-115.2-18-174.358.50000114.4L158 L181 A182L158-T185 HydrophobicContact CD1-CG2 3.87Å; L181-T185 HydrophobicContact CD1-CG2 3.73Å; L181-T185 HydrophobicContact CG-CG2 4.28Å; L181-T185 PolarHBondContact O-N 3.13Å; L181-T185 PolarHBondContact O-OG1 2.84Å; L181-T185 VanDerWaalsContact O-OG1 3.07Å; A182-T185 PolarHBondContact O-N 3.17Å
186S89.9Confident92.2Very high0 Ų027.9 Ų27.90%016%0.159CC..SBendtrans-64.1147.2178.3-74.80000111.7A182 F188 R217 G255A182-S186 WeakPolarHBondContact O-CB 3.11Å; A182-S186 PolarHBondContact O-N 2.74Å; A182-S186 PolarHBondContact O-OG 3.08Å; S186-F188 VanDerWaalsContact CB-O 3.26Å; S186-F188 WeakPolarHBondContact CB-O 3.18Å; S186-F188 PolarHBondContact O-N 3.42Å; S186-R217 PolarHBondContact O-NE 3.48Å; S186-G255 CarbonylContact C-O 3.56Å; S186-G255 WeakPolarHBondContact CA-O 3.35Å; S186-G255 WeakPolarHBondContact CB-O 3.4Å; S186-G255 PolarHBondContact OG-N 2.78Å
187D89.9Confident92.4Very high11 Ų1124.7 Ų24.76%0.05914%0.143CC..SBendtrans-67.1-30.4174-63.7-31.1000110.4R151 Q218 T219 G255 W256 S257R151-D187 IonicContact CZ-OD1 3.35Å; R151-D187 IonicContact CZ-OD2 2.63Å; R151-D187 IonicContact NH1-OD1 2.71Å; R151-D187 PolarHBondContact NH1-OD1 3.3Å; R151-D187 IonicContact NH1-OD2 3.13Å; R151-D187 PolarHBondContact NH1-OD2 3.22Å; R151-D187 IonicContact NH2-OD1 3.43Å; R151-D187 PolarHBondContact NH2-OD1 2.04Å; R151-D187 IonicContact NH2-OD2 3.9Å; D187-Q218 CarbonylContact O-C 3.45Å; D187-Q218 WeakPolarHBondContact O-CA 2.97Å; D187-T219 PolarHBondContact O-N 3.37Å; D187-T219 PolarHBondContact O-OG1 2.8Å; D187-G255 PolarHBondContact N-O 3.36Å; D187-W256 VanDerWaalsContact OD2-CA 3.31Å; D187-W256 WeakPolarHBondContact OD2-CA 3.5Å; D187-W256 WeakPolarHBondContact OD2-CB 3.45Å; D187-S257 PolarHBondContact OD2-N 3.26Å
188F92.4Very high92.6Very high0 Ų025.3 Ų25.30%014%0.139CC..EExtended strand (participates in β ladder)trans-136.6150.417568.7-97.7000113S186 I190 R217 Q218 L222 F223 I236 F253 M254 G255 A262S186-F188 VanDerWaalsContact CB-O 3.26Å; S186-F188 WeakPolarHBondContact CB-O 3.18Å; S186-F188 PolarHBondContact O-N 3.42Å; F188-I190 HydrophobicContact CD2-CG2 4.43Å; F188-R217 CarbonylContact C-O 3.57Å; F188-R217 VanDerWaalsContact CA-O 3.25Å; F188-R217 WeakPolarHBondContact CA-O 3.31Å; F188-Q218 HydrophobicContact CB-CB 4.39Å; F188-L222 HydrophobicContact CD1-CD1 4.09Å; F188-F223 HydrophobicContact CB-CD2 4.28Å; F188-F223 HydrophobicContact CB-CE2 3.59Å; F188-F223 HydrophobicContact CD1-CE2 4.04Å; F188-F223 HydrophobicContact CD1-CZ 4.18Å; F188-F223 AromaticContact CD2-CE2 3.51Å; F188-F223 HydrophobicContact CD2-CE2 3.51Å; F188-F223 AromaticContact CD2-CZ 3.94Å; F188-F223 HydrophobicContact CD2-CZ 3.94Å; F188-F223 HydrophobicContact CE1-CZ 4.34Å; F188-F223 HydrophobicContact CE2-CE2 4.15Å; F188-F223 HydrophobicContact CE2-CZ 4.11Å; F188-F223 AromaticContact CG-CE2 3.44Å; F188-F223 HydrophobicContact CG-CE2 3.44Å; F188-F223 VanDerWaalsContact CG-CE2 3.44Å; F188-F223 AromaticContact CG-CZ 3.98Å; F188-F223 HydrophobicContact CG-CZ 3.98Å; F188-F223 HydrophobicContact CZ-CZ 4.31Å; F188-I236 HydrophobicContact CE2-CD1 4.05Å; F188-I236 HydrophobicContact CZ-CD1 4.41Å; F188-I236 HydrophobicContact CZ-CG2 4.23Å; F188-F253 HydrophobicContact CE2-CB 4.46Å; F188-M254 WeakPolarHBondContact O-CA 3.44Å; F188-G255 VanDerWaalsContact CZ-CA 3.49Å; F188-G255 PolarHBondContact N-O 2.92Å; F188-G255 PolarHBondContact O-N 2.81Å; F188-A262 HydrophobicContact CD1-CB 4.42Å; F188-A262 HydrophobicContact CE1-CB 3.69Å; F188-A262 HydrophobicContact CZ-CB 3.93Å
189V94.6Very high92.9Very high2 Ų228 Ų281%0.01215%0.152CC..EExtended strand (participates in β ladder)trans-138.2113.6170.7-177.60000107.2L216 R217 L252 F253 M254V189-L216 HydrophobicContact CB-CB 4.2Å; V189-L216 HydrophobicContact CG1-CB 4.03Å; V189-L216 HydrophobicContact CG1-CD2 4.31Å; V189-L216 PolarHBondContact O-N 3.03Å; V189-R217 HydrophobicContact CB-CB 4.14Å; V189-R217 HydrophobicContact CG2-CB 4.18Å; V189-R217 PolarHBondContact N-O 3.38Å; V189-R217 PolarHBondContact O-N 3.38Å; V189-R217 VanDerWaalsContact O-N 3.16Å; V189-L252 HydrophobicContact CG1-CD1 3.78Å; V189-L252 HydrophobicContact CG1-CD2 4.01Å; V189-L252 HydrophobicContact CG1-CG 3.88Å; V189-F253 CarbonylContact C-O 3.52Å; V189-F253 WeakPolarHBondContact CA-O 3.26Å; V189-M254 HydrophobicContact CB-CG 4.39Å; V189-M254 HydrophobicContact CG1-CG 3.94Å; V189-M254 HydrophobicContact CG2-CG 4.08Å
190I93.9Very high92.8Very high0 Ų030.3 Ų30.30%016%0.164CC..EExtended strand (participates in β ladder)trans-125.3138.8-179.168.7167.5000111.3F188 V210 A212 R214 V215 F223 T234 I236 L252 F253F188-I190 HydrophobicContact CD2-CG2 4.43Å; I190-V210 HydrophobicContact CD1-CG1 4.11Å; I190-A212 HydrophobicContact CD1-CB 4.47Å; I190-R214 CarbonylContact C-O 3.53Å; I190-R214 WeakPolarHBondContact CA-O 3.45Å; I190-V215 HydrophobicContact CG2-CB 4.36Å; I190-V215 HydrophobicContact CG2-CG1 4.17Å; I190-V215 HydrophobicContact CG2-CG2 3.99Å; I190-F223 HydrophobicContact CD1-CE2 4.29Å; I190-F223 HydrophobicContact CD1-CZ 4.41Å; I190-F223 HydrophobicContact CG2-CD2 3.46Å; I190-F223 VanDerWaalsContact CG2-CD2 3.46Å; I190-F223 HydrophobicContact CG2-CE2 3.63Å; I190-F223 HydrophobicContact CG2-CG 4.36Å; I190-T234 HydrophobicContact CD1-CG2 3.99Å; I190-I236 HydrophobicContact CD1-CD1 3.86Å; I190-I236 HydrophobicContact CG1-CD1 4.44Å; I190-L252 CarbonylContact O-C 3.52Å; I190-L252 WeakPolarHBondContact O-CA 3.21Å; I190-F253 HydrophobicContact CD1-CB 4.35Å; I190-F253 HydrophobicContact CD1-CD2 4.27Å; I190-F253 HydrophobicContact CG1-CB 3.71Å; I190-F253 HydrophobicContact CG1-CD2 3.95Å; I190-F253 HydrophobicContact CG1-CG 4.25Å; I190-F253 PolarHBondContact N-O 3Å; I190-F253 PolarHBondContact O-N 2.84Å
191H94Very high92.5Very high31 Ų3134.2 Ų34.214%0.14419%0.188CC..EExtended strand (participates in β ladder)trans-98.5127.7169.2172-129.2000108.6A213 R214 L216 T250 F251 L252 F270H191-A213 PolarHBondContact O-N 3.16Å; H191-R214 HydrophobicContact CB-CB 4.42Å; H191-R214 PolarHBondContact N-O 2.84Å; H191-R214 PolarHBondContact O-N 3.37Å; H191-L216 HydrophobicContact CB-CD1 3.74Å; H191-T250 VanDerWaalsContact NE2-CB 3.34Å; H191-T250 WeakPolarHBondContact NE2-CB 3.33Å; H191-T250 PolarHBondContact NE2-OG1 2.84Å; H191-F251 WeakPolarHBondContact CA-O 3.25Å; H191-L252 HydrophobicContact CB-CD1 4.15Å; H191-F270 AromaticContact CD2-CD2 3.48Å; H191-F270 VanDerWaalsContact CD2-CD2 3.48Å; H191-F270 WeakPolarHBondContact CD2-CD2 3.11Å; H191-F270 AromaticContact CD2-CG 3.74Å; H191-F270 AromaticContact NE2-CD2 3.89Å; H191-F270 AromaticContact NE2-CG 3.71Å
192G93.2Very high92.2Very high1 Ų140.3 Ų40.31%0.0122%0.216CC..EExtended strand (participates in β ladder)trans-170.1-172.6-175.900000114.2V211 T250 F251G192-V211 WeakPolarHBondContact CA-O 3.38Å; G192-T250 WeakPolarHBondContact O-CA 3.38Å; G192-F251 PolarHBondContact N-O 2.85Å; G192-F251 PolarHBondContact O-N 2.71Å
193I94Very high91.8Very high84 Ų8441 Ų4143%0.43122%0.218SC..EExtended strand (participates in β ladder)trans-122.3140.6-178.8-60.4169.7000108.6H195 V210 V211 T250I193-H195 PolarHBondContact O-N 3.48Å; I193-V210 CarbonylContact O-C 3.58Å; I193-V210 WeakPolarHBondContact O-CA 3.3Å; I193-V211 PolarHBondContact N-O 3.24Å; I193-V211 VanDerWaalsContact N-O 3.07Å; I193-V211 PolarHBondContact O-N 3.49Å; I193-T250 HydrophobicContact CD1-CG2 4.29Å; I193-T250 HydrophobicContact CG1-CG2 3.88Å
194I94.9Very high91.5Very high24 Ų2446.2 Ų46.212%0.12324%0.242CC..EExtended strand (participates in β ladder)trans-71114.3172.2-57.4174.6000108.1V197 I208 F251 F253I194-V197 HydrophobicContact CG2-CG2 3.94Å; I194-I208 HydrophobicContact CG1-CG2 4.12Å; I194-I208 HydrophobicContact CG2-CG2 3.98Å; I194-F251 HydrophobicContact CD1-CD2 4.15Å; I194-F251 HydrophobicContact CD1-CE2 3.87Å; I194-F251 HydrophobicContact CD1-CZ 4.24Å; I194-F251 HydrophobicContact CG1-CD2 4.07Å; I194-F251 HydrophobicContact CG1-CE2 4.12Å; I194-F253 HydrophobicContact CD1-CZ 4.5Å; I194-F253 HydrophobicContact CG1-CE1 4.18Å; I194-F253 HydrophobicContact CG1-CZ 3.73Å
195H93.3Very high91.4Very high118 Ų11846.4 Ų46.455%0.54624%0.242SC..EExtended strand (participates in β ladder)trans-79.2-40.4172.7-177.671.6000111.4I193 T209 V211 L233I193-H195 PolarHBondContact O-N 3.48Å; H195-T209 HydrophobicContact CB-CG2 4.17Å; H195-T209 WeakPolarHBondContact CB-O 3.45Å; H195-T209 PolarHBondContact N-O 2.69Å; H195-V211 HydrophobicContact CB-CG2 4.14Å; H195-L233 HydrophobicContact CB-CD2 3.89Å
196G94.4Very high91.6Very high18 Ų1845.3 Ų45.319%0.18624%0.235CC..EExtended strand (participates in β ladder)trans-171.1167.3179.900000111.8T209G196-T209 PolarHBondContact N-O 3.34Å; G196-T209 PolarHBondContact O-N 2.77Å
197V96.3Very high91.8Very high24 Ų2446.1 Ų46.115%0.14524%0.24CC..EExtended strand (participates in β ladder)trans-132.9130.6174.9-176.60000107.8I194 V207 I208 V244 P246I194-V197 HydrophobicContact CG2-CG2 3.94Å; V197-V207 WeakPolarHBondContact CA-O 3.34Å; V197-I208 HydrophobicContact CG2-CG1 4.48Å; V197-I208 HydrophobicContact CG2-CG2 4.35Å; V197-V244 HydrophobicContact CG1-CG1 4.49Å; V197-V244 HydrophobicContact CG2-CG1 4.19Å; V197-P246 HydrophobicContact CB-CG 4.1Å; V197-P246 HydrophobicContact CG2-CG 3.95Å
198T96Very high92Very high85 Ų8545.8 Ų45.852%0.52124%0.238SC..EExtended strand (participates in β ladder)trans-120.1155.5172.560.80000109.4S206 V207T198-S206 CarbonylContact O-C 3.57Å; T198-S206 WeakPolarHBondContact O-CA 3.41Å; T198-V207 PolarHBondContact N-O 3.2Å; T198-V207 PolarHBondContact O-N 3.1Å
199H94.8Very high92.2Very high97 Ų9747.2 Ų47.245%0.44925%0.247SC..EExtended strand (participates in β ladder)trans-118.2127.5-177-56.6-62.6000110.1S206 L240H199-S206 PolarHBondContact ND1-OG 2.85Å; H199-L240 HydrophobicContact CB-CD1 3.76Å; H199-L240 WeakPolarHBondContact ND1-CD1 3.39Å
200D90.5Very high92.1Very high50 Ų5047.1 Ų47.127%0.26725%0.247SC..EExtended strand (participates in β ladder)trans-104.898.3172.6-170.8-33.2000108.2E202 L203 Q204 E205D200-E202 VanDerWaalsContact C-N 3.31Å; D200-E202 PolarHBondContact OD1-N 2.81Å; D200-E202 VanDerWaalsContact OD1-N 3.16Å; D200-L203 HydrophobicContact CB-CB 4.08Å; D200-L203 HydrophobicContact CB-CD1 4.38Å; D200-L203 HydrophobicContact CB-CG 4.36Å; D200-L203 VanDerWaalsContact CG-CG 3.45Å; D200-L203 PolarHBondContact O-N 3.02Å; D200-L203 WeakPolarHBondContact OD1-CG 3.48Å; D200-L203 PolarHBondContact OD1-N 3.47Å; D200-L203 WeakPolarHBondContact OD2-CD1 3.42Å; D200-L203 VanDerWaalsContact OD2-CG 3.25Å; D200-L203 WeakPolarHBondContact OD2-CG 2.98Å; D200-Q204 WeakPolarHBondContact O-CA 3.42Å; D200-Q204 PolarHBondContact O-N 3.41Å; D200-E205 PolarHBondContact N-O 2.78Å; D200-E205 PolarHBondContact O-N 3.16Å
201V88.2Confident92Very high99 Ų9949.5 Ų49.560%0.626%0.261SS*.THydrogen-bonded Turntrans-70-28.6-177.2-65.20000112.4Q204 L240V201-Q204 PolarHBondContact O-N 2.88Å; V201-Q204 PolarHBondContact O-NE2 2.87Å; V201-L240 HydrophobicContact CG1-CD2 4.3Å
202E83.5Confident91.8Very high160 Ų16048.7 Ų48.775%0.74826%0.26SS*.THydrogen-bonded Turntrans-71-41.6176.2-62.5-174.1176.200110.2D200 Q204D200-E202 VanDerWaalsContact C-N 3.31Å; D200-E202 PolarHBondContact OD1-N 2.81Å; D200-E202 VanDerWaalsContact OD1-N 3.16Å; E202-Q204 VanDerWaalsContact C-N 3.3Å
203L82Confident91.6Very high22 Ų2252.2 Ų52.212%0.11529%0.289CS..THydrogen-bonded Turntrans-77.6-16.1177.2-63-176.7000114.2A114 D200 E205A114-L203 HydrophobicContact CB-CB 4.37Å; A114-L203 HydrophobicContact CB-CD2 3.26Å; A114-L203 HydrophobicContact CB-CG 4.34Å; D200-L203 HydrophobicContact CB-CB 4.08Å; D200-L203 HydrophobicContact CB-CD1 4.38Å; D200-L203 HydrophobicContact CB-CG 4.36Å; D200-L203 VanDerWaalsContact CG-CG 3.45Å; D200-L203 PolarHBondContact O-N 3.02Å; D200-L203 WeakPolarHBondContact OD1-CG 3.48Å; D200-L203 PolarHBondContact OD1-N 3.47Å; D200-L203 WeakPolarHBondContact OD2-CD1 3.42Å; D200-L203 VanDerWaalsContact OD2-CG 3.25Å; D200-L203 WeakPolarHBondContact OD2-CG 2.98Å; L203-E205 HydrophobicContact CB-CB 4.05Å; L203-E205 HydrophobicContact CB-CG 4.02Å; L203-E205 PolarHBondContact O-N 2.95Å
204Q86.5Confident91.5Very high116 Ų11651.8 Ų51.854%0.54228%0.282SS..THydrogen-bonded Turntrans55.141.8-166.6-64.6-71.6-6000111.3D200 V201 E202 L240D200-Q204 WeakPolarHBondContact O-CA 3.42Å; D200-Q204 PolarHBondContact O-N 3.41Å; V201-Q204 PolarHBondContact O-N 2.88Å; V201-Q204 PolarHBondContact O-NE2 2.87Å; E202-Q204 VanDerWaalsContact C-N 3.3Å; Q204-L240 WeakPolarHBondContact O-CB 3.41Å; Q204-L240 PolarHBondContact O-N 3.05Å
205E88.3Confident91.2Very high9 Ų952.2 Ų52.24%0.04229%0.285CS..EExtended strand (participates in β ladder)trans-127.6148.5-177.9-69.1-179.8175.800111.6D200 L203 R237 T238 R263D200-E205 PolarHBondContact N-O 2.78Å; D200-E205 PolarHBondContact O-N 3.16Å; L203-E205 HydrophobicContact CB-CB 4.05Å; L203-E205 HydrophobicContact CB-CG 4.02Å; L203-E205 PolarHBondContact O-N 2.95Å; E205-R237 WeakPolarHBondContact OE2-CD 3.39Å; E205-R237 IonicContact OE2-CZ 3.61Å; E205-R237 IonicContact OE2-NH1 2.72Å; E205-R237 PolarHBondContact OE2-NH1 2.88Å; E205-T238 CarbonylContact C-O 3.25Å; E205-T238 WeakPolarHBondContact CA-O 3.15Å; E205-R263 IonicContact OE1-CZ 3.28Å; E205-R263 IonicContact OE1-NH1 3.84Å; E205-R263 PolarHBondContact OE1-NH1 3.39Å; E205-R263 IonicContact OE1-NH2 3.79Å; E205-R263 PolarHBondContact OE1-NH2 3.3Å; E205-R263 IonicContact OE2-NH1 3.17Å; E205-R263 PolarHBondContact OE2-NH1 3.44Å
206S92.6Very high91.1Very high0 Ų048.6 Ų48.60%027%0.27CS..EExtended strand (participates in β ladder)trans-105.6136.7163.6-59.60000109.1T198 H199 R237 T238 L240T198-S206 CarbonylContact O-C 3.57Å; T198-S206 WeakPolarHBondContact O-CA 3.41Å; H199-S206 PolarHBondContact ND1-OG 2.85Å; S206-R237 WeakPolarHBondContact O-CA 3.36Å; S206-T238 PolarHBondContact N-O 3.25Å; S206-T238 PolarHBondContact O-N 3.02Å; S206-L240 WeakPolarHBondContact OG-CD1 3.45Å
207V94.5Very high90.9Very high18 Ų1852.3 Ų52.311%0.10928%0.278CS..EExtended strand (participates in β ladder)trans-106.4113.4176.9-173.90000107.9V197 T198 R237V197-V207 WeakPolarHBondContact CA-O 3.34Å; T198-V207 PolarHBondContact N-O 3.2Å; T198-V207 PolarHBondContact O-N 3.1Å; V207-R237 HydrophobicContact CG2-CG 4.37Å
208I95.1Very high90.6Very high3 Ų354.4 Ų54.42%0.01529%0.286CS..EExtended strand (participates in β ladder)trans-92.1114.2176.2-50.3170.2000107I194 V197 V210 S235 I236 T238 V244 F253 L264I194-I208 HydrophobicContact CG1-CG2 4.12Å; I194-I208 HydrophobicContact CG2-CG2 3.98Å; V197-I208 HydrophobicContact CG2-CG1 4.48Å; V197-I208 HydrophobicContact CG2-CG2 4.35Å; I208-V210 HydrophobicContact CG2-CG2 3.76Å; I208-S235 WeakPolarHBondContact O-CA 3.34Å; I208-I236 PolarHBondContact N-O 3.49Å; I208-I236 PolarHBondContact O-N 2.96Å; I208-T238 HydrophobicContact CD1-CG2 4.15Å; I208-T238 HydrophobicContact CG1-CG2 4.47Å; I208-V244 HydrophobicContact CD1-CG1 3.85Å; I208-V244 HydrophobicContact CG1-CG1 4.01Å; I208-F253 HydrophobicContact CG2-CE1 4.43Å; I208-L264 HydrophobicContact CD1-CD2 3.88Å
209T95Very high90.1Very high30 Ų3054.7 Ų54.718%0.18429%0.288CS..EExtended strand (participates in β ladder)trans-85.5120.9171.1-54.20000108.4H195 G196 L233 T234H195-T209 HydrophobicContact CB-CG2 4.17Å; H195-T209 WeakPolarHBondContact CB-O 3.45Å; H195-T209 PolarHBondContact N-O 2.69Å; G196-T209 PolarHBondContact N-O 3.34Å; G196-T209 PolarHBondContact O-N 2.77Å; T209-L233 HydrophobicContact CG2-CB 4.36Å; T209-L233 HydrophobicContact CG2-CD2 3.72Å; T209-T234 CarbonylContact C-O 3.54Å; T209-T234 WeakPolarHBondContact CA-O 3.39Å
210V93.7Very high89.6Confident0 Ų052 Ų520%028%0.279CS..EExtended strand (participates in β ladder)trans-118.9134-174.4178.80000109.2I190 I193 I208 L233 T234 I236 F253I190-V210 HydrophobicContact CD1-CG1 4.11Å; I193-V210 CarbonylContact O-C 3.58Å; I193-V210 WeakPolarHBondContact O-CA 3.3Å; I208-V210 HydrophobicContact CG2-CG2 3.76Å; V210-L233 CarbonylContact O-C 3.6Å; V210-L233 WeakPolarHBondContact O-CA 3.33Å; V210-T234 HydrophobicContact CB-CG2 4.05Å; V210-T234 PolarHBondContact N-O 2.88Å; V210-T234 PolarHBondContact O-N 2.77Å; V210-I236 HydrophobicContact CG2-CD1 4.12Å; V210-I236 HydrophobicContact CG2-CG1 4.46Å; V210-F253 HydrophobicContact CB-CE2 4.35Å; V210-F253 HydrophobicContact CG1-CD2 3.95Å; V210-F253 HydrophobicContact CG1-CE2 3.47Å; V210-F253 VanDerWaalsContact CG1-CE2 3.47Å; V210-F253 HydrophobicContact CG1-CZ 4.05Å; V210-F253 HydrophobicContact CG2-CD1 4.39Å; V210-F253 HydrophobicContact CG2-CD2 4.34Å; V210-F253 HydrophobicContact CG2-CE1 3.93Å; V210-F253 HydrophobicContact CG2-CE2 3.87Å; V210-F253 HydrophobicContact CG2-CZ 3.63Å
211V91.8Very high89.2Confident50 Ų5055.4 Ų55.430%0.30330%0.304SS..EExtended strand (participates in β ladder)trans-85.6109.4162.5176.70000107.2G192 I193 H195 A213 L233G192-V211 WeakPolarHBondContact CA-O 3.38Å; I193-V211 PolarHBondContact N-O 3.24Å; I193-V211 VanDerWaalsContact N-O 3.07Å; I193-V211 PolarHBondContact O-N 3.49Å; H195-V211 HydrophobicContact CB-CG2 4.14Å; V211-A213 PolarHBondContact O-N 2.89Å; V211-L233 HydrophobicContact CG2-CD2 3.52Å; V211-L233 HydrophobicContact CG2-CG 4.42Å
212A90.3Very high88.9Confident15 Ų1552.7 Ų52.712%0.12429%0.286CS..EExtended strand (participates in β ladder)trans-77.6110.1-179.700000110.1I190 G232 T234I190-A212 HydrophobicContact CD1-CB 4.47Å; A212-G232 PolarHBondContact N-O 2.87Å; A212-T234 HydrophobicContact CB-CG2 4.42Å
213A89Confident88.7Confident74 Ų7445.5 Ų45.561%0.61225%0.252SS*.EExtended strand (participates in β ladder)trans-77.9-37.2174.600000111.4H191 V211H191-A213 PolarHBondContact O-N 3.16Å; V211-A213 PolarHBondContact O-N 2.89Å
214R90Very high88Confident76 Ų7652 Ų5229%0.28728%0.282SS..EExtended strand (participates in β ladder)trans-151.5138.7176-169.4166.974.1-159.46.8111.3I190 H191 L216 A291 L292 H293I190-R214 CarbonylContact C-O 3.53Å; I190-R214 WeakPolarHBondContact CA-O 3.45Å; H191-R214 HydrophobicContact CB-CB 4.42Å; H191-R214 PolarHBondContact N-O 2.84Å; H191-R214 PolarHBondContact O-N 3.37Å; R214-L216 HydrophobicContact CB-CD1 4.43Å; R214-L216 HydrophobicContact CG-CD1 4.42Å; R214-A291 PolarHBondContact NH2-O 2.94Å; R214-L292 PolarHBondContact NH2-O 3.3Å; R214-H293 PolarHBondContact NH1-O 3.5Å; R214-H293 PolarHBondContact NH1-OXT 3.13Å
215V90.2Very high86.6Confident32 Ų3249.3 Ų49.319%0.19428%0.28CS..EExtended strand (participates in β ladder)trans-97.1110.4167.6-179.70000107.7I190 Q218 F223 A225I190-V215 HydrophobicContact CG2-CB 4.36Å; I190-V215 HydrophobicContact CG2-CG1 4.17Å; I190-V215 HydrophobicContact CG2-CG2 3.99Å; V215-Q218 HydrophobicContact CG1-CB 4.02Å; V215-Q218 HydrophobicContact CG1-CG 3.89Å; V215-F223 HydrophobicContact CG2-CB 4.12Å; V215-A225 HydrophobicContact CG2-CB 4.27Å
216L90.9Very high84.9Confident42 Ų4252.5 Ų52.522%0.2232%0.315CS..EExtended strand (participates in β ladder)trans-80.4-33.7179.1-70.377.3000110.7V189 H191 R214 L252 V290 L292V189-L216 HydrophobicContact CB-CB 4.2Å; V189-L216 HydrophobicContact CG1-CB 4.03Å; V189-L216 HydrophobicContact CG1-CD2 4.31Å; V189-L216 PolarHBondContact O-N 3.03Å; H191-L216 HydrophobicContact CB-CD1 3.74Å; R214-L216 HydrophobicContact CB-CD1 4.43Å; R214-L216 HydrophobicContact CG-CD1 4.42Å; L216-L252 HydrophobicContact CD1-CD1 3.96Å; L216-L252 HydrophobicContact CD2-CD1 4.07Å; L216-V290 HydrophobicContact CD2-CG1 3.91Å; L216-L292 HydrophobicContact CD2-CD2 4.09Å
217R90.6Very high82.4Confident96 Ų9662.9 Ų62.936%0.36235%0.354SS..EExtended strand (participates in β ladder)trans-154.4142.7177.3175.7175.1170.8167.2-7109.9C184 S186 F188 V189C184-R217 PolarHBondContact O-NH1 3.47Å; S186-R217 PolarHBondContact O-NE 3.48Å; F188-R217 CarbonylContact C-O 3.57Å; F188-R217 VanDerWaalsContact CA-O 3.25Å; F188-R217 WeakPolarHBondContact CA-O 3.31Å; V189-R217 HydrophobicContact CB-CB 4.14Å; V189-R217 HydrophobicContact CG2-CB 4.18Å; V189-R217 PolarHBondContact N-O 3.38Å; V189-R217 PolarHBondContact O-N 3.38Å; V189-R217 VanDerWaalsContact O-N 3.16Å
218Q90.1Very high79.7Confident68 Ų6867.8 Ų67.832%0.31839%0.389SS..EExtended strand (participates in β ladder)trans-151.6138.9161.362.6-176.7-36.700109.6D187 F188 V215 P220 L222 F223D187-Q218 CarbonylContact O-C 3.45Å; D187-Q218 WeakPolarHBondContact O-CA 2.97Å; F188-Q218 HydrophobicContact CB-CB 4.39Å; V215-Q218 HydrophobicContact CG1-CB 4.02Å; V215-Q218 HydrophobicContact CG1-CG 3.89Å; Q218-P220 PolarHBondContact OE1-O 2.67Å; Q218-L222 VanDerWaalsContact OE1-N 3.14Å; Q218-F223 PolarHBondContact NE2-O 2.86Å; Q218-F223 VanDerWaalsContact NE2-O 3.1Å; Q218-F223 VanDerWaalsContact OE1-N 3.14Å; Q218-F223 PolarHBondContact OE1-O 3Å
219T85.6Confident77.5Confident92 Ų9272 Ų7256%0.56443%0.434SS*.SBendtrans-94-61.6178.7-52.50000109.5D187D187-T219 PolarHBondContact O-N 3.37Å; D187-T219 PolarHBondContact O-OG1 2.8Å
220P82.5Confident75.5Confident39 Ų3977.1 Ų77.125%0.25346%0.46SS..SBendtrans-79144.1159.728.4-26.1000110.3Q218 L222Q218-P220 PolarHBondContact OE1-O 2.67Å; P220-L222 HydrophobicContact CB-CD2 4.28Å; P220-L222 HydrophobicContact CB-CG 4.28Å; P220-L222 HydrophobicContact CG-CD1 4.19Å; P220-L222 HydrophobicContact CG-CD2 4.24Å; P220-L222 HydrophobicContact CG-CG 3.95Å; P220-L222 PolarHBondContact O-N 2.98Å
221P83.4Confident73.7Confident122 Ų12283.7 Ų83.779%0.79249%0.491SS*.  trans-74.876.1177.432.3-35.2000110.6
222L80.5Confident72.9Confident43 Ų4382.1 Ų82.123%0.22549%0.485CS..  trans-82.1-24.4178.9-60.4178.9000112.5F188 Q218 P220 G260 A262F188-L222 HydrophobicContact CD1-CD1 4.09Å; Q218-L222 VanDerWaalsContact OE1-N 3.14Å; P220-L222 HydrophobicContact CB-CD2 4.28Å; P220-L222 HydrophobicContact CB-CG 4.28Å; P220-L222 HydrophobicContact CG-CD1 4.19Å; P220-L222 HydrophobicContact CG-CD2 4.24Å; P220-L222 HydrophobicContact CG-CG 3.95Å; P220-L222 PolarHBondContact O-N 2.98Å; L222-G260 WeakPolarHBondContact CD2-O 3.13Å; L222-A262 HydrophobicContact CD1-CB 4.06Å
223F79.8Confident72.6Confident9 Ų984.5 Ų84.54%0.03950%0.495CS..  trans-128.4127.8-168.7-48.8-50.3000111F188 I190 V215 Q218 T234 I236 A262F188-F223 HydrophobicContact CB-CD2 4.28Å; F188-F223 HydrophobicContact CB-CE2 3.59Å; F188-F223 HydrophobicContact CD1-CE2 4.04Å; F188-F223 HydrophobicContact CD1-CZ 4.18Å; F188-F223 AromaticContact CD2-CE2 3.51Å; F188-F223 HydrophobicContact CD2-CE2 3.51Å; F188-F223 AromaticContact CD2-CZ 3.94Å; F188-F223 HydrophobicContact CD2-CZ 3.94Å; F188-F223 HydrophobicContact CE1-CZ 4.34Å; F188-F223 HydrophobicContact CE2-CE2 4.15Å; F188-F223 HydrophobicContact CE2-CZ 4.11Å; F188-F223 AromaticContact CG-CE2 3.44Å; F188-F223 HydrophobicContact CG-CE2 3.44Å; F188-F223 VanDerWaalsContact CG-CE2 3.44Å; F188-F223 AromaticContact CG-CZ 3.98Å; F188-F223 HydrophobicContact CG-CZ 3.98Å; F188-F223 HydrophobicContact CZ-CZ 4.31Å; I190-F223 HydrophobicContact CD1-CE2 4.29Å; I190-F223 HydrophobicContact CD1-CZ 4.41Å; I190-F223 HydrophobicContact CG2-CD2 3.46Å; I190-F223 VanDerWaalsContact CG2-CD2 3.46Å; I190-F223 HydrophobicContact CG2-CE2 3.63Å; I190-F223 HydrophobicContact CG2-CG 4.36Å; V215-F223 HydrophobicContact CG2-CB 4.12Å; Q218-F223 PolarHBondContact NE2-O 2.86Å; Q218-F223 VanDerWaalsContact NE2-O 3.1Å; Q218-F223 VanDerWaalsContact OE1-N 3.14Å; Q218-F223 PolarHBondContact OE1-O 3Å; F223-T234 HydrophobicContact CD1-CG2 3.81Å; F223-T234 WeakPolarHBondContact CD1-OG1 3.44Å; F223-T234 HydrophobicContact CE1-CG2 3.97Å; F223-T234 WeakPolarHBondContact CE1-OG1 3.45Å; F223-I236 HydrophobicContact CZ-CG1 4.45Å; F223-A262 HydrophobicContact CE1-CB 3.81Å; F223-A262 HydrophobicContact CZ-CB 3.54Å
224Q67.6Low72.6Confident158 Ų15881.8 Ų81.874%0.73847%0.471SS*.  trans-92.6112.6171.1-62-173.115.300108.9G226Q224-G226 PolarHBondContact O-N 2.82Å
225A58Low72.8Confident60 Ų6081.1 Ų81.150%0.49648%0.478SS..  trans-78.9108.7168.500000109.1V215 R227V215-A225 HydrophobicContact CG2-CB 4.27Å; A225-R227 PolarHBondContact O-N 2.75Å; A225-R227 VanDerWaalsContact O-N 3.13Å
226G52Low72.9Confident75 Ų7579.6 Ų79.677%0.77347%0.469SS*.SBendtrans57.933.7153.600000118.7Q224Q224-G226 PolarHBondContact O-N 2.82Å
227R40.3Very low73Confident218 Ų21880.3 Ų80.382%0.82347%0.468SS*.  trans-109.197.5168.4-74.9-178.172.2151.60111.1A225A225-R227 PolarHBondContact O-N 2.75Å; A225-R227 VanDerWaalsContact O-N 3.13Å
228S37.8Very low73Confident121 Ų12176 Ų7685%0.84645%0.453SS*.SBendtrans60.3115.2162.4-63.80000119D230S228-D230 VanDerWaalsContact C-N 3.34Å; S228-D230 PolarHBondContact O-N 3.19Å; S228-D230 VanDerWaalsContact O-N 3.13Å
229G48Very low72.9Confident93 Ų9374.1 Ų74.196%0.95945%0.446SS*.SBendtrans88.1-35.6151.500000117
230D53Low73Confident137 Ų13771.5 Ų71.573%0.73343%0.429SS*.SBendtrans-103.3136.6175.2-143.5-6.7000108.9S228 G232S228-D230 VanDerWaalsContact C-N 3.34Å; S228-D230 PolarHBondContact O-N 3.19Å; S228-D230 VanDerWaalsContact O-N 3.13Å; D230-G232 PolarHBondContact O-N 2.94Å
231Q56.6Low73.3Confident138 Ų13876.3 Ų76.365%0.64544%0.442SS*.  trans-68.126.2-163.5-70.1-179.214.300115.9L233Q231-L233 HydrophobicContact CB-CD1 3.92Å; Q231-L233 HydrophobicContact CB-CG 3.92Å; Q231-L233 PolarHBondContact O-N 2.81Å; Q231-L233 VanDerWaalsContact O-N 3.1Å
232G73.8Confident73.6Confident17 Ų1772 Ų7218%0.17541%0.414CS..SBendtrans5923.7-174.500000111.9A212 D230A212-G232 PolarHBondContact N-O 2.87Å; D230-G232 PolarHBondContact O-N 2.94Å
233L85.1Confident74.1Confident64 Ų6471.7 Ų71.734%0.33542%0.422SS..EExtended strand (participates in β ladder)trans-72.8131.2178.9-71.8164000108.4H195 T209 V210 V211 Q231H195-L233 HydrophobicContact CB-CD2 3.89Å; T209-L233 HydrophobicContact CG2-CB 4.36Å; T209-L233 HydrophobicContact CG2-CD2 3.72Å; V210-L233 CarbonylContact O-C 3.6Å; V210-L233 WeakPolarHBondContact O-CA 3.33Å; V211-L233 HydrophobicContact CG2-CD2 3.52Å; V211-L233 HydrophobicContact CG2-CG 4.42Å; Q231-L233 HydrophobicContact CB-CD1 3.92Å; Q231-L233 HydrophobicContact CB-CG 3.92Å; Q231-L233 PolarHBondContact O-N 2.81Å; Q231-L233 VanDerWaalsContact O-N 3.1Å
234T89.4Confident74.6Confident17 Ų1772.7 Ų72.710%0.10443%0.429CS..EExtended strand (participates in β ladder)trans-134.9155.9175.5-174.80000111.4I190 T209 V210 A212 F223I190-T234 HydrophobicContact CD1-CG2 3.99Å; T209-T234 CarbonylContact C-O 3.54Å; T209-T234 WeakPolarHBondContact CA-O 3.39Å; V210-T234 HydrophobicContact CB-CG2 4.05Å; V210-T234 PolarHBondContact N-O 2.88Å; V210-T234 PolarHBondContact O-N 2.77Å; A212-T234 HydrophobicContact CB-CG2 4.42Å; F223-T234 HydrophobicContact CD1-CG2 3.81Å; F223-T234 WeakPolarHBondContact CD1-OG1 3.44Å; F223-T234 HydrophobicContact CE1-CG2 3.97Å; F223-T234 WeakPolarHBondContact CE1-OG1 3.45Å
235S93.3Very high75.6Confident63 Ų6371.7 Ų71.744%0.44142%0.424SS..EExtended strand (participates in β ladder)trans-111.3127.2-177.9-59.40000110.8I208I208-S235 WeakPolarHBondContact O-CA 3.34Å
236I93.7Very high77.1Confident0 Ų072.8 Ų72.80%043%0.426CS..EExtended strand (participates in β ladder)trans-117.2129.4172.8-53.9179.8000108.8F188 I190 I208 V210 F223 F253 A262 L264F188-I236 HydrophobicContact CE2-CD1 4.05Å; F188-I236 HydrophobicContact CZ-CD1 4.41Å; F188-I236 HydrophobicContact CZ-CG2 4.23Å; I190-I236 HydrophobicContact CD1-CD1 3.86Å; I190-I236 HydrophobicContact CG1-CD1 4.44Å; I208-I236 PolarHBondContact N-O 3.49Å; I208-I236 PolarHBondContact O-N 2.96Å; V210-I236 HydrophobicContact CG2-CD1 4.12Å; V210-I236 HydrophobicContact CG2-CG1 4.46Å; F223-I236 HydrophobicContact CZ-CG1 4.45Å; I236-F253 HydrophobicContact CD1-CB 3.61Å; I236-F253 HydrophobicContact CD1-CD1 4.01Å; I236-F253 HydrophobicContact CD1-CG 3.82Å; I236-A262 HydrophobicContact CG1-CB 4.24Å; I236-A262 HydrophobicContact CG2-CB 4.46Å; I236-L264 HydrophobicContact CG2-CB 3.73Å; I236-L264 HydrophobicContact CG2-CD1 4.07Å; I236-L264 HydrophobicContact CG2-CG 4.49Å
237R91.6Very high78.6Confident56 Ų5670.5 Ų70.521%0.21140%0.403CS..EExtended strand (participates in β ladder)trans-96.7142.9-178.8-67.2172.8174.5-92.2-2.9111.5E205 S206 V207 E261 A262 R263 L264E205-R237 WeakPolarHBondContact OE2-CD 3.39Å; E205-R237 IonicContact OE2-CZ 3.61Å; E205-R237 IonicContact OE2-NH1 2.72Å; E205-R237 PolarHBondContact OE2-NH1 2.88Å; S206-R237 WeakPolarHBondContact O-CA 3.36Å; V207-R237 HydrophobicContact CG2-CG 4.37Å; R237-E261 IonicContact NE-OE2 2.58Å; R237-A262 PolarHBondContact N-O 2.83Å; R237-R263 CarbonylContact O-C 3.49Å; R237-R263 WeakPolarHBondContact O-CA 3.4Å; R237-L264 PolarHBondContact O-N 2.91Å
238T90.3Very high81Confident6 Ų665.5 Ų65.54%0.03740%0.398CS..EExtended strand (participates in β ladder)trans-146.4156.2174.8-169.90000110E205 S206 I208 L240 V244E205-T238 CarbonylContact C-O 3.25Å; E205-T238 WeakPolarHBondContact CA-O 3.15Å; S206-T238 PolarHBondContact N-O 3.25Å; S206-T238 PolarHBondContact O-N 3.02Å; I208-T238 HydrophobicContact CD1-CG2 4.15Å; I208-T238 HydrophobicContact CG1-CG2 4.47Å; T238-L240 PolarHBondContact O-N 2.86Å; T238-V244 HydrophobicContact CG2-CB 4.42Å; T238-V244 HydrophobicContact CG2-CG2 3.64Å
239P88.1Confident83.6Confident28 Ų2861.6 Ų61.618%0.18238%0.377CS..EExtended strand (participates in β ladder)trans-58.8138.5178.2-25.135.4000113.3A170 R241 C242A170-P239 HydrophobicContact CB-CG 4.12Å; P239-R241 VanDerWaalsContact C-N 3.26Å; P239-R241 HydrophobicContact CB-CG 4.07Å; P239-R241 PolarHBondContact O-N 2.77Å; P239-C242 WeakPolarHBondContact O-CB 3.43Å; P239-C242 PolarHBondContact O-N 3.01Å
240L89.1Confident85.9Confident38 Ų3859.6 Ų59.620%0.19935%0.346CS..G310 helixtrans-57.7-37.9-179-178.661000112.9H199 V201 Q204 S206 T238 C242 G243H199-L240 HydrophobicContact CB-CD1 3.76Å; H199-L240 WeakPolarHBondContact ND1-CD1 3.39Å; V201-L240 HydrophobicContact CG1-CD2 4.3Å; Q204-L240 WeakPolarHBondContact O-CB 3.41Å; Q204-L240 PolarHBondContact O-N 3.05Å; S206-L240 WeakPolarHBondContact OG-CD1 3.45Å; T238-L240 PolarHBondContact O-N 2.86Å; L240-C242 PolarHBondContact O-N 2.8Å; L240-G243 PolarHBondContact O-N 2.82Å
241R88.7Confident87.9Confident139 Ų13954.3 Ų54.353%0.52532%0.317SS..G310 helixtrans-59.1-16.2176.867.2174.7176.5-74.3-11.8114.7V167 P239 G243V167-R241 VanDerWaalsContact CG1-NH2 3.31Å; V167-R241 PolarHBondContact O-NH2 3.13Å; P239-R241 VanDerWaalsContact C-N 3.26Å; P239-R241 HydrophobicContact CB-CG 4.07Å; P239-R241 PolarHBondContact O-N 2.77Å; R241-G243 PolarHBondContact O-N 3.3Å
242C89.8Confident89.7Confident31 Ų3147.7 Ų47.721%0.20929%0.286CS..G310 helixtrans-72.9-12176.6-60.10000112.7C171 P239 L240 V244C171-C242 VanDerWaalsContact CA-SG 3.5Å; C171-C242 HydrophobicContact CB-CB 3.67Å; C171-C242 WeakPolarHBondContact CB-SG 3.39Å; C171-C242 WeakPolarHBondContact SG-CA 3.45Å; C171-C242 WeakPolarHBondContact SG-CB 2.88Å; C171-C242 PolarHBondContact SG-N 3.1Å; C171-C242 CovalentContact SG-SG 2.04Å; C171-C242 PolarHBondContact SG-SG 2.91Å; P239-C242 WeakPolarHBondContact O-CB 3.43Å; P239-C242 PolarHBondContact O-N 3.01Å; L240-C242 PolarHBondContact O-N 2.8Å; C242-V244 HydrophobicContact CB-CG2 4.24Å; C242-V244 PolarHBondContact O-N 2.8Å
243G90.1Very high90.7Very high38 Ų3847 Ų4739%0.39228%0.278SS..  trans59.146.3173.300000112.4L240 R241 H245L240-G243 PolarHBondContact O-N 2.82Å; R241-G243 PolarHBondContact O-N 3.3Å; G243-H245 PolarHBondContact O-CE1 3.07Å; G243-H245 PolarHBondContact O-N 2.89Å; G243-H245 PolarHBondContact O-ND1 3.27Å
244V91.4Very high91.2Very high30 Ų3044 Ų4418%0.18226%0.262CS..  trans-72.8130.9179.8-178.60000109.7V197 I208 T238 C242V197-V244 HydrophobicContact CG1-CG1 4.49Å; V197-V244 HydrophobicContact CG2-CG1 4.19Å; I208-V244 HydrophobicContact CD1-CG1 3.85Å; I208-V244 HydrophobicContact CG1-CG1 4.01Å; T238-V244 HydrophobicContact CG2-CB 4.42Å; T238-V244 HydrophobicContact CG2-CG2 3.64Å; C242-V244 HydrophobicContact CB-CG2 4.24Å; C242-V244 PolarHBondContact O-N 2.8Å
245H88.6Confident91.3Very high136 Ų13643.1 Ų43.163%0.6326%0.257SS*.  trans-123.2149.7177.3-61.485.9000109.8G243G243-H245 PolarHBondContact O-CE1 3.07Å; G243-H245 PolarHBondContact O-N 2.89Å; G243-H245 PolarHBondContact O-ND1 3.27Å
246P87.7Confident91Very high83 Ų8341.2 Ų41.254%0.53924%0.24SC..  trans-57140.2169.6-19.631000110.5V197V197-P246 HydrophobicContact CB-CG 4.1Å; V197-P246 HydrophobicContact CG2-CG 3.95Å
247G84.2Confident90.7Very high28 Ų2842 Ų4229%0.28925%0.246SC..  trans-150.5150.117800000111.4
248P90.5Very high90.5Very high112 Ų11240.6 Ų40.673%0.72724%0.241SC*.SBendtrans-71153.7178.931-35.5000111.3
249G93.1Very high90.3Very high39 Ų3941 Ų4140%0.40224%0.242SC..SBendtrans115.8178.3174.800000113.4
250T95Very high90.3Very high51 Ų5142.3 Ų42.331%0.31326%0.261SS..  trans-106.7141.1175.664.60000110.2H191 G192 I193 F270H191-T250 VanDerWaalsContact NE2-CB 3.34Å; H191-T250 WeakPolarHBondContact NE2-CB 3.33Å; H191-T250 PolarHBondContact NE2-OG1 2.84Å; G192-T250 WeakPolarHBondContact O-CA 3.38Å; I193-T250 HydrophobicContact CD1-CG2 4.29Å; I193-T250 HydrophobicContact CG1-CG2 3.88Å; T250-F270 PolarHBondContact O-N 3.35Å; T250-F270 WeakPolarHBondContact OG1-CB 3.09Å
251F95.7Very high90.3Very high26 Ų2643 Ų4311%0.11426%0.262CS..EExtended strand (participates in β ladder)trans-126.2153-174.5-60.4-93.3000110H191 G192 I194 F253 P268 R269H191-F251 WeakPolarHBondContact CA-O 3.25Å; G192-F251 PolarHBondContact N-O 2.85Å; G192-F251 PolarHBondContact O-N 2.71Å; I194-F251 HydrophobicContact CD1-CD2 4.15Å; I194-F251 HydrophobicContact CD1-CE2 3.87Å; I194-F251 HydrophobicContact CD1-CZ 4.24Å; I194-F251 HydrophobicContact CG1-CD2 4.07Å; I194-F251 HydrophobicContact CG1-CE2 4.12Å; F251-F253 HydrophobicContact CB-CD2 4.21Å; F251-F253 HydrophobicContact CB-CE1 4.13Å; F251-F253 HydrophobicContact CB-CE2 3.66Å; F251-F253 HydrophobicContact CB-CZ 3.61Å; F251-F253 HydrophobicContact CD2-CZ 4.27Å; F251-F253 HydrophobicContact CG-CZ 4.18Å; F251-P268 WeakPolarHBondContact CA-O 3.1Å; F251-R269 HydrophobicContact CD1-CG 4.21Å; F251-R269 HydrophobicContact CE1-CG 3.88Å
252L95.5Very high90.4Very high0 Ų036.6 Ų36.60%024%0.24CC..EExtended strand (participates in β ladder)trans-102.9105.5167.4-166.774.6000108.1V189 I190 H191 L216 M254 A267 P268 F270 F273V189-L252 HydrophobicContact CG1-CD1 3.78Å; V189-L252 HydrophobicContact CG1-CD2 4.01Å; V189-L252 HydrophobicContact CG1-CG 3.88Å; I190-L252 CarbonylContact O-C 3.52Å; I190-L252 WeakPolarHBondContact O-CA 3.21Å; H191-L252 HydrophobicContact CB-CD1 4.15Å; L216-L252 HydrophobicContact CD1-CD1 3.96Å; L216-L252 HydrophobicContact CD2-CD1 4.07Å; L252-M254 HydrophobicContact CD2-CE 4.24Å; L252-M254 HydrophobicContact CD2-CG 4.4Å; L252-M254 HydrophobicContact CD2-SD 3.98Å; L252-M254 HydrophobicContact CG-CG 4.36Å; L252-A267 WeakPolarHBondContact O-CA 3.1Å; L252-P268 HydrophobicContact CB-CG 4.3Å; L252-P268 PolarHBondContact N-O 2.78Å; L252-P268 VanDerWaalsContact O-CD 3.3Å; L252-P268 WeakPolarHBondContact O-CD 3.3Å; L252-F270 HydrophobicContact CD1-CD2 4.38Å; L252-F273 HydrophobicContact CD2-CB 4.2Å; L252-F273 HydrophobicContact CD2-CD1 3.55Å; L252-F273 HydrophobicContact CD2-CD2 3.73Å; L252-F273 HydrophobicContact CD2-CE1 3.8Å; L252-F273 HydrophobicContact CD2-CE2 3.97Å; L252-F273 HydrophobicContact CD2-CG 3.52Å; L252-F273 HydrophobicContact CD2-CZ 4Å
253F94.6Very high90.4Very high2 Ų236.7 Ų36.71%0.00924%0.236CC..EExtended strand (participates in β ladder)trans-89.9122.7178.9-52.1-93.7000109.8F188 V189 I190 I194 I208 V210 I236 F251 L264 A267F188-F253 HydrophobicContact CE2-CB 4.46Å; V189-F253 CarbonylContact C-O 3.52Å; V189-F253 WeakPolarHBondContact CA-O 3.26Å; I190-F253 HydrophobicContact CD1-CB 4.35Å; I190-F253 HydrophobicContact CD1-CD2 4.27Å; I190-F253 HydrophobicContact CG1-CB 3.71Å; I190-F253 HydrophobicContact CG1-CD2 3.95Å; I190-F253 HydrophobicContact CG1-CG 4.25Å; I190-F253 PolarHBondContact N-O 3Å; I190-F253 PolarHBondContact O-N 2.84Å; I194-F253 HydrophobicContact CD1-CZ 4.5Å; I194-F253 HydrophobicContact CG1-CE1 4.18Å; I194-F253 HydrophobicContact CG1-CZ 3.73Å; I208-F253 HydrophobicContact CG2-CE1 4.43Å; V210-F253 HydrophobicContact CB-CE2 4.35Å; V210-F253 HydrophobicContact CG1-CD2 3.95Å; V210-F253 HydrophobicContact CG1-CE2 3.47Å; V210-F253 VanDerWaalsContact CG1-CE2 3.47Å; V210-F253 HydrophobicContact CG1-CZ 4.05Å; V210-F253 HydrophobicContact CG2-CD1 4.39Å; V210-F253 HydrophobicContact CG2-CD2 4.34Å; V210-F253 HydrophobicContact CG2-CE1 3.93Å; V210-F253 HydrophobicContact CG2-CE2 3.87Å; V210-F253 HydrophobicContact CG2-CZ 3.63Å; I236-F253 HydrophobicContact CD1-CB 3.61Å; I236-F253 HydrophobicContact CD1-CD1 4.01Å; I236-F253 HydrophobicContact CD1-CG 3.82Å; F251-F253 HydrophobicContact CB-CD2 4.21Å; F251-F253 HydrophobicContact CB-CE1 4.13Å; F251-F253 HydrophobicContact CB-CE2 3.66Å; F251-F253 HydrophobicContact CB-CZ 3.61Å; F251-F253 HydrophobicContact CD2-CZ 4.27Å; F251-F253 HydrophobicContact CG-CZ 4.18Å; F253-L264 HydrophobicContact CB-CD1 4.28Å; F253-L264 HydrophobicContact CD1-CD1 4.05Å; F253-A267 HydrophobicContact CD1-CB 4Å; F253-A267 HydrophobicContact CE1-CB 4.38Å
254M94.1Very high90.5Very high0 Ų036.4 Ų36.40%023%0.225CC..EExtended strand (participates in β ladder)trans-123.4134.8-179.4-62.5177-7800108.6L179 A182 A183 F188 V189 L252 G265 C266 P268 F273L179-M254 HydrophobicContact CD2-CE 3.81Å; A182-M254 HydrophobicContact CB-CB 4.29Å; A182-M254 HydrophobicContact CB-CE 4.44Å; A182-M254 HydrophobicContact CB-SD 4.07Å; A183-M254 VanDerWaalsContact CA-SD 3.55Å; A183-M254 HydrophobicContact CB-SD 3.74Å; A183-M254 PolarHBondContact N-SD 2.96Å; A183-M254 VanDerWaalsContact N-SD 3.38Å; F188-M254 WeakPolarHBondContact O-CA 3.44Å; V189-M254 HydrophobicContact CB-CG 4.39Å; V189-M254 HydrophobicContact CG1-CG 3.94Å; V189-M254 HydrophobicContact CG2-CG 4.08Å; L252-M254 HydrophobicContact CD2-CE 4.24Å; L252-M254 HydrophobicContact CD2-CG 4.4Å; L252-M254 HydrophobicContact CD2-SD 3.98Å; L252-M254 HydrophobicContact CG-CG 4.36Å; M254-G265 WeakPolarHBondContact O-CA 3.43Å; M254-G265 PolarHBondContact O-N 3.08Å; M254-C266 HydrophobicContact CB-CB 4.43Å; M254-C266 HydrophobicContact CE-CB 3.76Å; M254-C266 PolarHBondContact N-O 2.58Å; M254-C266 PolarHBondContact O-N 3.22Å; M254-P268 HydrophobicContact CE-CG 3.85Å; M254-F273 HydrophobicContact CE-CD2 4.21Å; M254-F273 HydrophobicContact CE-CE2 4.38Å; M254-F273 HydrophobicContact SD-CE2 4.31Å
255G91.5Very high90.4Very high0 Ų036 Ų360%023%0.226CC..EExtended strand (participates in β ladder)trans-175.1-165.7-17600000114.9S186 D187 F188 R263S186-G255 CarbonylContact C-O 3.56Å; S186-G255 WeakPolarHBondContact CA-O 3.35Å; S186-G255 WeakPolarHBondContact CB-O 3.4Å; S186-G255 PolarHBondContact OG-N 2.78Å; D187-G255 PolarHBondContact N-O 3.36Å; F188-G255 VanDerWaalsContact CZ-CA 3.49Å; F188-G255 PolarHBondContact N-O 2.92Å; F188-G255 PolarHBondContact O-N 2.81Å; G255-R263 CarbonylContact C-O 3.59Å; G255-R263 WeakPolarHBondContact CA-O 3.42Å
256W88.6Confident90.6Very high22 Ų2230 Ų308%0.08320%0.2CC..EExtended strand (participates in β ladder)trans-123.7150.4-173.6-51.5-89.6000111.1Q161 A162 G164 D187 R263 G265Q161-W256 WeakPolarHBondContact O-CH2 3.26Å; Q161-W256 VanDerWaalsContact O-CZ2 3.31Å; Q161-W256 WeakPolarHBondContact O-CZ2 3.27Å; A162-W256 VanDerWaalsContact O-CE2 3.27Å; A162-W256 WeakPolarHBondContact O-CZ2 3.32Å; A162-W256 PolarHBondContact O-NE1 3.07Å; G164-W256 VanDerWaalsContact CA-CZ3 3.46Å; D187-W256 VanDerWaalsContact OD2-CA 3.31Å; D187-W256 WeakPolarHBondContact OD2-CA 3.5Å; D187-W256 WeakPolarHBondContact OD2-CB 3.45Å; W256-R263 PolarHBondContact N-O 3.25Å; W256-R263 PolarHBondContact O-N 3.48Å; W256-G265 VanDerWaalsContact CH2-CA 3.46Å
257S87.2Confident90.9Very high17 Ų1728 Ų2812%0.11919%0.19CC..EExtended strand (participates in β ladder)trans-83.4134.7166-165.10000109.5D187 E261D187-S257 PolarHBondContact OD2-N 3.26Å; S257-E261 CarbonylContact C-O 3.53Å; S257-E261 WeakPolarHBondContact CA-O 3.49Å
258R86.5Confident91.4Very high27 Ų2727.1 Ų27.110%0.10218%0.18CC..EExtended strand (participates in β ladder)trans-141.7115.2171-166.8-175.1-67.4171.20.6109.6C82 R84 C118 E149 G164 G260 E261 R263C82-R258 HydrophobicContact CB-CG 4.26Å; C82-R258 PolarHBondContact SG-NE 2.97Å; C82-R258 VanDerWaalsContact SG-NE 3.43Å; R84-R258 PolarHBondContact NH2-O 3.08Å; C118-R258 PolarHBondContact SG-NE 3.23Å; C118-R258 PolarHBondContact SG-NH1 2.63Å; C118-R258 PolarHBondContact SG-NH2 3.35Å; E149-R258 WeakPolarHBondContact OE2-CA 2.9Å; G164-R258 PolarHBondContact O-NH2 3.2Å; R258-G260 VanDerWaalsContact C-N 3.29Å; R258-G260 PolarHBondContact O-N 2.83Å; R258-E261 PolarHBondContact N-O 3.37Å; R258-E261 WeakPolarHBondContact O-CB 3.41Å; R258-E261 PolarHBondContact O-N 3.38Å; R258-E261 VanDerWaalsContact O-N 3.11Å; R258-R263 HydrophobicContact CB-CG 3.92Å
259F87.3Confident91.6Very high14 Ų1429 Ų296%0.06117%0.172CC..THydrogen-bonded Turntrans52.447-174.8-54.3-74.6000112C82 R84 R147 E149 E261C82-F259 HydrophobicContact CB-CE2 4.08Å; C82-F259 HydrophobicContact CB-CZ 4.22Å; C82-F259 WeakPolarHBondContact O-CZ 3.21Å; R84-F259 HydrophobicContact CB-CD1 4.46Å; R84-F259 HydrophobicContact CB-CD2 3.81Å; R84-F259 HydrophobicContact CB-CE1 4.12Å; R84-F259 HydrophobicContact CB-CE2 3.46Å; R84-F259 VanDerWaalsContact CB-CE2 3.46Å; R84-F259 HydrophobicContact CB-CG 4.32Å; R84-F259 HydrophobicContact CB-CZ 3.61Å; R84-F259 VanDerWaalsContact CZ-CD2 3.5Å; R84-F259 VanDerWaalsContact NE-CD2 3.3Å; R147-F259 HydrophobicContact CB-CD1 4.26Å; R147-F259 HydrophobicContact CB-CE1 3.85Å; E149-F259 HydrophobicContact CB-CE1 4.08Å; E149-F259 HydrophobicContact CB-CZ 4.37Å; E149-F259 HydrophobicContact CG-CD1 3.64Å; E149-F259 HydrophobicContact CG-CE1 3.61Å; E149-F259 HydrophobicContact CG-CG 4.39Å; E149-F259 HydrophobicContact CG-CZ 4.32Å; E149-F259 WeakPolarHBondContact OE1-CA 3.39Å; E149-F259 PolarHBondContact OE1-N 2.91Å; E149-F259 PolarHBondContact OE2-N 3.14Å; F259-E261 PolarHBondContact O-N 3.35Å
260G87.2Confident91.7Very high56 Ų5628.3 Ų28.358%0.57716%0.158SC*.THydrogen-bonded Turntrans71.36.4-178.900000115.4L222 R258L222-G260 WeakPolarHBondContact CD2-O 3.13Å; R258-G260 VanDerWaalsContact C-N 3.29Å; R258-G260 PolarHBondContact O-N 2.83Å
261E88Confident91.7Very high51 Ų5130.3 Ų30.324%0.23816%0.164CC..EExtended strand (participates in β ladder)trans-107.5140.9178.6-66.3162.5-160.800111.3R84 R237 S257 R258 F259 R263R84-E261 IonicContact CZ-OE1 3.65Å; R84-E261 VanDerWaalsContact CZ-OE1 3.28Å; R84-E261 IonicContact CZ-OE2 3.66Å; R84-E261 IonicContact NH1-OE1 2.94Å; R84-E261 PolarHBondContact NH1-OE1 2.79Å; R84-E261 IonicContact NH1-OE2 3.86Å; R84-E261 IonicContact NH2-OE1 3.97Å; R84-E261 PolarHBondContact NH2-OE1 2.88Å; R84-E261 IonicContact NH2-OE2 2.81Å; R84-E261 PolarHBondContact NH2-OE2 3.47Å; R237-E261 IonicContact NE-OE2 2.58Å; S257-E261 CarbonylContact C-O 3.53Å; S257-E261 WeakPolarHBondContact CA-O 3.49Å; R258-E261 PolarHBondContact N-O 3.37Å; R258-E261 WeakPolarHBondContact O-CB 3.41Å; R258-E261 PolarHBondContact O-N 3.38Å; R258-E261 VanDerWaalsContact O-N 3.11Å; F259-E261 PolarHBondContact O-N 3.35Å; E261-R263 IonicContact OE2-NH1 3.89Å
262A91.5Very high91.7Very high6 Ų632.8 Ų32.85%0.0518%0.176CC..EExtended strand (participates in β ladder)trans-77124.8171.900000111.1F188 L222 F223 I236 R237F188-A262 HydrophobicContact CD1-CB 4.42Å; F188-A262 HydrophobicContact CE1-CB 3.69Å; F188-A262 HydrophobicContact CZ-CB 3.93Å; L222-A262 HydrophobicContact CD1-CB 4.06Å; F223-A262 HydrophobicContact CE1-CB 3.81Å; F223-A262 HydrophobicContact CZ-CB 3.54Å; I236-A262 HydrophobicContact CG1-CB 4.24Å; I236-A262 HydrophobicContact CG2-CB 4.46Å; R237-A262 PolarHBondContact N-O 2.83Å
263R90.3Very high91.8Very high32 Ų3232.8 Ų32.812%0.12118%0.176CC..EExtended strand (participates in β ladder)trans-113.5128.3176.6-51.9-66.6-85.6-161.22.7109.2E205 R237 G255 W256 R258 E261E205-R263 IonicContact OE1-CZ 3.28Å; E205-R263 IonicContact OE1-NH1 3.84Å; E205-R263 PolarHBondContact OE1-NH1 3.39Å; E205-R263 IonicContact OE1-NH2 3.79Å; E205-R263 PolarHBondContact OE1-NH2 3.3Å; E205-R263 IonicContact OE2-NH1 3.17Å; E205-R263 PolarHBondContact OE2-NH1 3.44Å; R237-R263 CarbonylContact O-C 3.49Å; R237-R263 WeakPolarHBondContact O-CA 3.4Å; G255-R263 CarbonylContact C-O 3.59Å; G255-R263 WeakPolarHBondContact CA-O 3.42Å; W256-R263 PolarHBondContact N-O 3.25Å; W256-R263 PolarHBondContact O-N 3.48Å; R258-R263 HydrophobicContact CB-CG 3.92Å; E261-R263 IonicContact OE2-NH1 3.89Å
264L91.4Very high91.8Very high33 Ų3336.9 Ų36.917%0.17319%0.191CC..EExtended strand (participates in β ladder)trans-70.2136.2-178.2-169.665.4000111.6I208 I236 R237 F253 A267I208-L264 HydrophobicContact CD1-CD2 3.88Å; I236-L264 HydrophobicContact CG2-CB 3.73Å; I236-L264 HydrophobicContact CG2-CD1 4.07Å; I236-L264 HydrophobicContact CG2-CG 4.49Å; R237-L264 PolarHBondContact O-N 2.91Å; F253-L264 HydrophobicContact CB-CD1 4.28Å; F253-L264 HydrophobicContact CD1-CD1 4.05Å; L264-A267 HydrophobicContact CD1-CB 4.03Å; L264-A267 HydrophobicContact CD2-CB 4.18Å
265G89.7Confident92Very high20 Ų2044.9 Ų44.921%0.20622%0.222CC..EExtended strand (participates in β ladder)trans-109.3-67166.300000112.1M254 W256M254-G265 WeakPolarHBondContact O-CA 3.43Å; M254-G265 PolarHBondContact O-N 3.08Å; W256-G265 VanDerWaalsContact CH2-CA 3.46Å
266C92.3Very high92.2Very high10 Ų1045.3 Ų45.37%0.06823%0.225CC..EExtended strand (participates in β ladder)trans-126.6144.2178.7-61.50000110.2C174 L179 A182 M254C174-C266 HydrophobicContact CB-CB 3.97Å; C174-C266 WeakPolarHBondContact CB-SG 3.09Å; C174-C266 WeakPolarHBondContact SG-CB 3.25Å; C174-C266 CovalentContact SG-SG 2.05Å; C174-C266 PolarHBondContact SG-SG 3.13Å; L179-C266 HydrophobicContact CD2-CB 3.82Å; A182-C266 HydrophobicContact CB-CB 4.48Å; M254-C266 HydrophobicContact CB-CB 4.43Å; M254-C266 HydrophobicContact CE-CB 3.76Å; M254-C266 PolarHBondContact N-O 2.58Å; M254-C266 PolarHBondContact O-N 3.22Å
267A94.4Very high92.5Very high42 Ų4244.4 Ų44.435%0.34722%0.222SC..  trans-140.662.8176.300000112.2L252 F253 L264L252-A267 WeakPolarHBondContact O-CA 3.1Å; F253-A267 HydrophobicContact CD1-CB 4Å; F253-A267 HydrophobicContact CE1-CB 4.38Å; L264-A267 HydrophobicContact CD1-CB 4.03Å; L264-A267 HydrophobicContact CD2-CB 4.18Å
268P95Very high93Very high10 Ų1047.1 Ų47.17%0.06523%0.232CC..  trans-63.9160.3173.332.9-40.7000110.8L179 F251 L252 M254 E272 F273L179-P268 HydrophobicContact CD1-CB 3.81Å; L179-P268 HydrophobicContact CD1-CG 4.12Å; L179-P268 HydrophobicContact CD2-CB 3.92Å; L179-P268 HydrophobicContact CD2-CG 3.62Å; L179-P268 HydrophobicContact CG-CG 4.45Å; F251-P268 WeakPolarHBondContact CA-O 3.1Å; L252-P268 HydrophobicContact CB-CG 4.3Å; L252-P268 PolarHBondContact N-O 2.78Å; L252-P268 VanDerWaalsContact O-CD 3.3Å; L252-P268 WeakPolarHBondContact O-CD 3.3Å; M254-P268 HydrophobicContact CE-CG 3.85Å; P268-E272 HydrophobicContact CB-CB 4.48Å; P268-F273 HydrophobicContact CB-CB 4.44Å; P268-F273 HydrophobicContact CG-CB 3.94Å; P268-F273 HydrophobicContact CG-CD2 4.41Å
269R95.5Very high93.4Very high151 Ų15148.9 Ų48.957%0.5725%0.252SS*.BIsolated β-bridgetrans-63144163.1-71.4-174.9174-169-0.7109F251 Q271 E272 F273F251-R269 HydrophobicContact CD1-CG 4.21Å; F251-R269 HydrophobicContact CE1-CG 3.88Å; R269-Q271 PolarHBondContact O-N 3.49Å; R269-Q271 VanDerWaalsContact O-N 3.14Å; R269-E272 HydrophobicContact CB-CB 4.3Å; R269-E272 PolarHBondContact N-OE2 2.73Å; R269-E272 WeakPolarHBondContact O-CB 3.48Å; R269-E272 PolarHBondContact O-N 3.23Å; R269-F273 PolarHBondContact O-N 2.84Å; R269-F273 VanDerWaalsContact O-N 3.14Å
270F95.3Very high93.8Very high24 Ų2448.8 Ų48.811%0.10525%0.254CS..Hα-helixtrans-56.5-37.9-177.1-175.7-106.8000112.6H191 T250 L252 E272 R274 L292H191-F270 AromaticContact CD2-CD2 3.48Å; H191-F270 VanDerWaalsContact CD2-CD2 3.48Å; H191-F270 WeakPolarHBondContact CD2-CD2 3.11Å; H191-F270 AromaticContact CD2-CG 3.74Å; H191-F270 AromaticContact NE2-CD2 3.89Å; H191-F270 AromaticContact NE2-CG 3.71Å; T250-F270 PolarHBondContact O-N 3.35Å; T250-F270 WeakPolarHBondContact OG1-CB 3.09Å; L252-F270 HydrophobicContact CD1-CD2 4.38Å; F270-E272 VanDerWaalsContact C-N 3.35Å; F270-E272 PolarHBondContact O-N 2.85Å; F270-R274 WeakPolarHBondContact O-CB 3.44Å; F270-R274 PolarHBondContact O-N 2.05Å; F270-L292 HydrophobicContact CE2-CD2 3.96Å; F270-L292 HydrophobicContact CZ-CD2 4.24Å
271Q95.1Very high94.2Very high94 Ų9451 Ų5144%0.43925%0.245SC..Hα-helixtrans-68.3-29.1177.1-65.8-61.8-1800114.2R269 R274 R275R269-Q271 PolarHBondContact O-N 3.49Å; R269-Q271 VanDerWaalsContact O-N 3.14Å; Q271-R274 VanDerWaalsContact OE1-CZ 3.28Å; Q271-R275 WeakPolarHBondContact O-CG 3.27Å; Q271-R275 PolarHBondContact O-N 3.18Å; Q271-R275 PolarHBondContact O-NE 3.01Å
272E95.3Very high94.5Very high78 Ų7852.3 Ų52.336%0.36427%0.265SS..Hα-helixtrans-72.1-50175.7-179.4-179.2-168.900110.2P268 R269 F270 R274 R275 A276P268-E272 HydrophobicContact CB-CB 4.48Å; R269-E272 HydrophobicContact CB-CB 4.3Å; R269-E272 PolarHBondContact N-OE2 2.73Å; R269-E272 WeakPolarHBondContact O-CB 3.48Å; R269-E272 PolarHBondContact O-N 3.23Å; F270-E272 VanDerWaalsContact C-N 3.35Å; F270-E272 PolarHBondContact O-N 2.85Å; E272-R274 VanDerWaalsContact C-N 3.33Å; E272-R274 PolarHBondContact O-N 3.44Å; E272-R275 PolarHBondContact O-N 2.04Å; E272-A276 PolarHBondContact O-N 3.05Å
273F96.4Very high94.7Very high0 Ų054.8 Ų54.80%029%0.285CS..Hα-helixtrans-57.5-45.7175-178-92.5000112L179 A183 L252 M254 P268 R269 R275 A276 Y277 V290 L292L179-F273 HydrophobicContact CB-CD2 4.11Å; L179-F273 HydrophobicContact CB-CE2 4.38Å; A183-F273 HydrophobicContact CB-CE2 3.8Å; A183-F273 HydrophobicContact CB-CZ 3.63Å; L252-F273 HydrophobicContact CD2-CB 4.2Å; L252-F273 HydrophobicContact CD2-CD1 3.55Å; L252-F273 HydrophobicContact CD2-CD2 3.73Å; L252-F273 HydrophobicContact CD2-CE1 3.8Å; L252-F273 HydrophobicContact CD2-CE2 3.97Å; L252-F273 HydrophobicContact CD2-CG 3.52Å; L252-F273 HydrophobicContact CD2-CZ 4Å; M254-F273 HydrophobicContact CE-CD2 4.21Å; M254-F273 HydrophobicContact CE-CE2 4.38Å; M254-F273 HydrophobicContact SD-CE2 4.31Å; P268-F273 HydrophobicContact CB-CB 4.44Å; P268-F273 HydrophobicContact CG-CB 3.94Å; P268-F273 HydrophobicContact CG-CD2 4.41Å; R269-F273 PolarHBondContact O-N 2.84Å; R269-F273 VanDerWaalsContact O-N 3.14Å; F273-R275 VanDerWaalsContact C-N 3.33Å; F273-R275 PolarHBondContact O-N 3.48Å; F273-A276 PolarHBondContact O-N 3.36Å; F273-Y277 HydrophobicContact CE1-CD2 4.28Å; F273-Y277 HydrophobicContact CE1-CG 4.2Å; F273-Y277 HydrophobicContact CZ-CD2 4.17Å; F273-Y277 HydrophobicContact CZ-CG 4.49Å; F273-Y277 WeakPolarHBondContact O-CB 3.42Å; F273-Y277 PolarHBondContact O-N 3.04Å; F273-V290 HydrophobicContact CE1-CG1 4.2Å; F273-V290 HydrophobicContact CZ-CG1 4.45Å; F273-V290 HydrophobicContact CZ-CG2 4.49Å; F273-L292 HydrophobicContact CD1-CD1 4.21Å; F273-L292 HydrophobicContact CD1-CD2 3.96Å; F273-L292 HydrophobicContact CE1-CD1 4.08Å; F273-L292 HydrophobicContact CE1-CD2 3.82Å; F273-L292 HydrophobicContact CE1-CG 4.39Å
274R96Very high94.8Very high88 Ų8861 Ų6133%0.33232%0.315SS..Hα-helixtrans-57.9-44.7180-175.1172.567.71414.9111.9F270 Q271 E272 Y277 E278 L292F270-R274 WeakPolarHBondContact O-CB 3.44Å; F270-R274 PolarHBondContact O-N 2.05Å; Q271-R274 VanDerWaalsContact OE1-CZ 3.28Å; E272-R274 VanDerWaalsContact C-N 3.33Å; E272-R274 PolarHBondContact O-N 3.44Å; R274-Y277 PolarHBondContact O-N 3.39Å; R274-E278 HydrophobicContact CG-CG 4.4Å; R274-E278 VanDerWaalsContact CG-OE1 3.28Å; R274-E278 WeakPolarHBondContact CG-OE1 3.44Å; R274-E278 WeakPolarHBondContact O-CB 3.4Å; R274-E278 VanDerWaalsContact O-CG 3.29Å; R274-E278 WeakPolarHBondContact O-CG 3.34Å; R274-E278 PolarHBondContact O-N 3.41Å; R274-L292 HydrophobicContact CB-CD1 4.42Å; R274-L292 HydrophobicContact CG-CD1 4.24Å
275R96.5Very high94.9Very high168 Ų16865.8 Ų65.863%0.63434%0.34SS*.Hα-helixtrans-62.3-47.1176.4-74.7-177-66.8167.54.2112Q271 E272 F273 Y277 A279Q271-R275 WeakPolarHBondContact O-CG 3.27Å; Q271-R275 PolarHBondContact O-N 3.18Å; Q271-R275 PolarHBondContact O-NE 3.01Å; E272-R275 PolarHBondContact O-N 2.04Å; F273-R275 VanDerWaalsContact C-N 3.33Å; F273-R275 PolarHBondContact O-N 3.48Å; R275-Y277 PolarHBondContact O-N 3.03Å; R275-A279 WeakPolarHBondContact O-CB 3.43Å; R275-A279 PolarHBondContact O-N 3.25Å
276A96Very high94.8Very high8 Ų867.3 Ų67.37%0.06634%0.342CS..Hα-helixtrans-61.9-42.9177.900000112D176 E272 F273 A280D176-A276 HydrophobicContact CB-CB 4.12Å; E272-A276 PolarHBondContact O-N 3.05Å; F273-A276 PolarHBondContact O-N 3.36Å; A276-A280 WeakPolarHBondContact O-CB 3.44Å; A276-A280 PolarHBondContact O-N 3.02Å
277Y96.7Very high94.7Very high4 Ų470 Ų702%0.01636%0.359CS..Hα-helixtrans-66.9-44.9178.6-174.3-96.2000112.7L180 F273 R274 R275 A279 A280 R281 H286 C288 E289 V290 L292L180-Y277 HydrophobicContact CD2-CD2 3.84Å; L180-Y277 HydrophobicContact CD2-CG 4.42Å; F273-Y277 HydrophobicContact CE1-CD2 4.28Å; F273-Y277 HydrophobicContact CE1-CG 4.2Å; F273-Y277 HydrophobicContact CZ-CD2 4.17Å; F273-Y277 HydrophobicContact CZ-CG 4.49Å; F273-Y277 WeakPolarHBondContact O-CB 3.42Å; F273-Y277 PolarHBondContact O-N 3.04Å; R274-Y277 PolarHBondContact O-N 3.39Å; R275-Y277 PolarHBondContact O-N 3.03Å; Y277-A279 PolarHBondContact O-N 2.91Å; Y277-A280 PolarHBondContact O-N 2.94Å; Y277-R281 VanDerWaalsContact O-CB 3.27Å; Y277-R281 WeakPolarHBondContact O-CB 3.47Å; Y277-R281 PolarHBondContact O-N 2.98Å; Y277-H286 HydrophobicContact CE2-CB 4.34Å; Y277-C288 PolarHBondContact OH-O 2.95Å; Y277-E289 VanDerWaalsContact OH-CA 3.31Å; Y277-E289 WeakPolarHBondContact OH-CA 3.35Å; Y277-E289 PolarHBondContact OH-OE2 3.48Å; Y277-V290 HydrophobicContact CD2-CB 4.29Å; Y277-V290 HydrophobicContact CD2-CG2 4.21Å; Y277-V290 HydrophobicContact CE2-CB 3.74Å; Y277-V290 HydrophobicContact CE2-CG2 3.65Å; Y277-V290 PolarHBondContact OH-N 3.14Å; Y277-L292 HydrophobicContact CD1-CD1 3.63Å; Y277-L292 HydrophobicContact CD1-CG 4.49Å; Y277-L292 HydrophobicContact CE1-CD1 4.36Å; Y277-L292 HydrophobicContact CG-CD1 4.04Å
278E95.8Very high94.6Very high74 Ų7470 Ų7035%0.34636%0.356SS..Hα-helixtrans-63.1-40.8176.5-74.5170.5-177.800111.9R274 R281 A282R274-E278 HydrophobicContact CG-CG 4.4Å; R274-E278 VanDerWaalsContact CG-OE1 3.28Å; R274-E278 WeakPolarHBondContact CG-OE1 3.44Å; R274-E278 WeakPolarHBondContact O-CB 3.4Å; R274-E278 VanDerWaalsContact O-CG 3.29Å; R274-E278 WeakPolarHBondContact O-CG 3.34Å; R274-E278 PolarHBondContact O-N 3.41Å; E278-R281 PolarHBondContact O-N 3.37Å; E278-A282 WeakPolarHBondContact O-CB 3.36Å; E278-A282 PolarHBondContact O-N 3.49Å
279A96.2Very high94.5Very high63 Ų6376.4 Ų76.452%0.52139%0.385SS..Hα-helixtrans-63.1-46.617500000112.1R275 Y277 R281 A282 A283R275-A279 WeakPolarHBondContact O-CB 3.43Å; R275-A279 PolarHBondContact O-N 3.25Å; Y277-A279 PolarHBondContact O-N 2.91Å; A279-R281 VanDerWaalsContact C-N 3.33Å; A279-R281 PolarHBondContact O-N 3.02Å; A279-A282 PolarHBondContact O-N 3.43Å; A279-A283 WeakPolarHBondContact O-CB 3.37Å; A279-A283 PolarHBondContact O-N 2.83Å
280A95.6Very high94.3Very high12 Ų1270.1 Ų70.110%0.09936%0.363CS..Hα-helixtrans-66.1-35.1176.700000112.6L180 A276 Y277 A283 H284 L285 H286L180-A280 HydrophobicContact CD1-CB 3.46Å; L180-A280 VanDerWaalsContact CD1-CB 3.46Å; L180-A280 HydrophobicContact CD2-CB 4.1Å; L180-A280 HydrophobicContact CG-CB 4.44Å; A276-A280 WeakPolarHBondContact O-CB 3.44Å; A276-A280 PolarHBondContact O-N 3.02Å; Y277-A280 PolarHBondContact O-N 2.94Å; A280-A283 PolarHBondContact O-N 3.4Å; A280-H284 PolarHBondContact O-N 3.24Å; A280-H284 VanDerWaalsContact O-N 3.08Å; A280-L285 PolarHBondContact O-N 3.29Å; A280-H286 HydrophobicContact CB-CB 4.21Å; A280-H286 PolarHBondContact O-N 2.97Å
281R95Very high93.9Very high103 Ų10372.5 Ų72.539%0.38939%0.388SS..Hα-helixtrans-65.4-46.8174.9-170.9176.163.7-175.1-3111.4Y277 E278 A279 A283 H284Y277-R281 VanDerWaalsContact O-CB 3.27Å; Y277-R281 WeakPolarHBondContact O-CB 3.47Å; Y277-R281 PolarHBondContact O-N 2.98Å; E278-R281 PolarHBondContact O-N 3.37Å; A279-R281 VanDerWaalsContact C-N 3.33Å; A279-R281 PolarHBondContact O-N 3.02Å; R281-A283 VanDerWaalsContact C-N 3.28Å; R281-A283 PolarHBondContact O-N 2.9Å; R281-H284 PolarHBondContact O-N 3.06Å
282A95.6Very high93.4Very high79 Ų7968.8 Ų68.865%0.65337%0.371SS*.Hα-helixtrans-61.3-36.417600000112.5E278 A279 H284E278-A282 WeakPolarHBondContact O-CB 3.36Å; E278-A282 PolarHBondContact O-N 3.49Å; A279-A282 PolarHBondContact O-N 3.43Å; A282-H284 VanDerWaalsContact C-N 3.3Å; A282-H284 PolarHBondContact O-N 3.38Å; A282-H284 PolarHBondContact O-ND1 3.25Å
283A95.7Very high92.2Very high57 Ų5774.1 Ų74.147%0.47140%0.395SS..THydrogen-bonded Turntrans-80.1-3.717600000114.3A279 A280 R281 L285A279-A283 WeakPolarHBondContact O-CB 3.37Å; A279-A283 PolarHBondContact O-N 2.83Å; A280-A283 PolarHBondContact O-N 3.4Å; R281-A283 VanDerWaalsContact C-N 3.28Å; R281-A283 PolarHBondContact O-N 2.9Å; A283-L285 HydrophobicContact CB-CB 4.43Å; A283-L285 HydrophobicContact CB-CD1 4.01Å; A283-L285 HydrophobicContact CB-CG 4.04Å; A283-L285 PolarHBondContact O-N 3.38Å
284H92.4Very high92Very high163 Ų16377.9 Ų77.976%0.75542%0.415SS*.THydrogen-bonded Turntrans57.632.1-172.8-53.576.6000113.8A280 R281 A282A280-H284 PolarHBondContact O-N 3.24Å; A280-H284 VanDerWaalsContact O-N 3.08Å; R281-H284 PolarHBondContact O-N 3.06Å; A282-H284 VanDerWaalsContact C-N 3.3Å; A282-H284 PolarHBondContact O-N 3.38Å; A282-H284 PolarHBondContact O-ND1 3.25Å
285L91.9Very high91.7Very high134 Ų13477.3 Ų77.370%0.70242%0.42SS*.  trans-11210.9-179.6-63.2177.7000113.2A280 A283A280-L285 PolarHBondContact O-N 3.29Å; A283-L285 HydrophobicContact CB-CB 4.43Å; A283-L285 HydrophobicContact CB-CD1 4.01Å; A283-L285 HydrophobicContact CB-CG 4.04Å; A283-L285 PolarHBondContact O-N 3.38Å
286H88.8Confident91.5Very high52 Ų5272.3 Ų72.324%0.24141%0.408CS..  trans-77131.717963.6-74.1000110.6Y277 A280 C288Y277-H286 HydrophobicContact CE2-CB 4.34Å; A280-H286 HydrophobicContact CB-CB 4.21Å; A280-H286 PolarHBondContact O-N 2.97Å; H286-C288 PolarHBondContact CD2-O 3.14Å
287P88.8Confident91.2Very high66 Ų6676.1 Ų76.143%0.42943%0.428SS..SBendtrans-78.4-18.1-173.825.5-29.5000114.5L180L180-P287 HydrophobicContact CB-CG 3.98Å; L180-P287 WeakPolarHBondContact O-CG 3.28Å
288C93.2Very high90.9Very high41 Ų4180.6 Ų80.628%0.27745%0.454SS..SBendtrans-162.2164.2172.472.90000111C184 Y277 H286C184-C288 WeakPolarHBondContact CA-SG 3.39Å; C184-C288 HydrophobicContact CB-CB 3.83Å; C184-C288 WeakPolarHBondContact CB-SG 3.35Å; C184-C288 WeakPolarHBondContact SG-CB 3.29Å; C184-C288 PolarHBondContact SG-N 3.47Å; C184-C288 CovalentContact SG-SG 2.01Å; C184-C288 PolarHBondContact SG-SG 3.27Å; Y277-C288 PolarHBondContact OH-O 2.95Å; H286-C288 PolarHBondContact CD2-O 3.14Å
289E92.6Very high90.5Very high145 Ų14581 Ų8168%0.67846%0.461SS*.  trans-74.1131.1171.8-77.3-79.7-170.200111.5Y277Y277-E289 VanDerWaalsContact OH-CA 3.31Å; Y277-E289 WeakPolarHBondContact OH-CA 3.35Å; Y277-E289 PolarHBondContact OH-OE2 3.48Å
290V90.7Very high90.1Very high19 Ų1982.3 Ų82.312%0.11546%0.456CS..  trans-124.5119.5177.8-177.50000109.7A183 L216 F273 Y277 L292A183-V290 HydrophobicContact CB-CG2 4.04Å; L216-V290 HydrophobicContact CD2-CG1 3.91Å; F273-V290 HydrophobicContact CE1-CG1 4.2Å; F273-V290 HydrophobicContact CZ-CG1 4.45Å; F273-V290 HydrophobicContact CZ-CG2 4.49Å; Y277-V290 HydrophobicContact CD2-CB 4.29Å; Y277-V290 HydrophobicContact CD2-CG2 4.21Å; Y277-V290 HydrophobicContact CE2-CB 3.74Å; Y277-V290 HydrophobicContact CE2-CG2 3.65Å; Y277-V290 PolarHBondContact OH-N 3.14Å; V290-L292 HydrophobicContact CG1-CD2 3.93Å; V290-L292 HydrophobicContact CG1-CG 4.19Å; V290-L292 PolarHBondContact O-N 2.73Å
291A87.8Confident89.7Confident75 Ų7587.7 Ų87.762%0.6248%0.484SS*.  trans-74.889.217900000111.7R214R214-A291 PolarHBondContact NH2-O 2.94Å
292L84.4Confident89.3Confident15 Ų1586.4 Ų86.48%0.07949%0.492CS..  trans-84.4-11.9179.2-67.7-177.9000114.4R214 L216 F270 F273 R274 Y277 V290R214-L292 PolarHBondContact NH2-O 3.3Å; L216-L292 HydrophobicContact CD2-CD2 4.09Å; F270-L292 HydrophobicContact CE2-CD2 3.96Å; F270-L292 HydrophobicContact CZ-CD2 4.24Å; F273-L292 HydrophobicContact CD1-CD1 4.21Å; F273-L292 HydrophobicContact CD1-CD2 3.96Å; F273-L292 HydrophobicContact CE1-CD1 4.08Å; F273-L292 HydrophobicContact CE1-CD2 3.82Å; F273-L292 HydrophobicContact CE1-CG 4.39Å; R274-L292 HydrophobicContact CB-CD1 4.42Å; R274-L292 HydrophobicContact CG-CD1 4.24Å; Y277-L292 HydrophobicContact CD1-CD1 3.63Å; Y277-L292 HydrophobicContact CD1-CG 4.49Å; Y277-L292 HydrophobicContact CE1-CD1 4.36Å; Y277-L292 HydrophobicContact CG-CD1 4.04Å; V290-L292 HydrophobicContact CG1-CD2 3.93Å; V290-L292 HydrophobicContact CG1-CG 4.19Å; V290-L292 PolarHBondContact O-N 2.73Å
293H69.4Low88.7Confident191 Ų19187.1 Ų87.188%0.88448%0.477SS*.  trans-96.40179.5-60.1-66.4000112.2R214R214-H293 PolarHBondContact NH1-O 3.5Å; R214-H293 PolarHBondContact NH1-OXT 3.13Å

Retrieved 293 of 293 residues in 80.7 ms (Link to these results)