A0A096N513_PAPAN Loading...

Complement C1q like 4

AlphaFold DB (A0A2K5NWD5), UniProt , Accession A0A096N513, Species PAPAN (Papio anubis, Olive baboon), Gene C1QL4, Length 238 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
1M61.5Low67.4Low199 Ų199109.1 Ų109.198%0.9860%0.597SS**  0-43.50-68.4-170.975.400113.2L3 L4 L5M1-L3 PolarHBondContact O-N 3.39Å; M1-L4 WeakPolarHBondContact O-CB 3.45Å; M1-L4 PolarHBondContact O-N 2.81Å; M1-L5 PolarHBondContact O-N 3.15Å
2V65.9Low66.7Low109 Ų109110.5 Ų110.566%0.66160%0.602SS**Hα-helixtrans-62.8-40.9179.5-178.60000113.4L4 L5 L6V2-L4 VanDerWaalsContact C-N 3.29Å; V2-L4 PolarHBondContact O-N 2.77Å; V2-L5 PolarHBondContact O-N 3.49Å; V2-L6 HydrophobicContact CG1-CD1 4.35Å; V2-L6 WeakPolarHBondContact O-CG 3.46Å; V2-L6 PolarHBondContact O-N 3.45Å; V2-L6 VanDerWaalsContact O-N 3.15Å
3L69.7Low66.1Low137 Ų137109.2 Ų109.272%0.71760%0.599SS**Hα-helixtrans-66.1-30178.2-157.277.3000113.2M1 V7M1-L3 PolarHBondContact O-N 3.39Å; L3-V7 PolarHBondContact O-N 3Å
4L72.8Confident65.4Low133 Ų133111.4 Ų111.470%0.69660%0.603SS**Hα-helixtrans-70.5-37.2178.1-120.7156.6000111M1 V2 A8M1-L4 WeakPolarHBondContact O-CB 3.45Å; M1-L4 PolarHBondContact O-N 2.81Å; V2-L4 VanDerWaalsContact C-N 3.29Å; V2-L4 PolarHBondContact O-N 2.77Å; L4-A8 WeakPolarHBondContact O-CB 3.43Å; L4-A8 PolarHBondContact O-N 2.96Å
5L69.9Low64.6Low104 Ų104111 Ų11155%0.54561%0.612SS.*Hα-helixtrans-71-37.9175.7-70167.9000112.2M1 V2 V7 A8 I9M1-L5 PolarHBondContact O-N 3.15Å; V2-L5 PolarHBondContact O-N 3.49Å; L5-V7 PolarHBondContact O-N 3.44Å; L5-A8 PolarHBondContact O-N 3.42Å; L5-I9 HydrophobicContact CB-CD1 4.34Å; L5-I9 WeakPolarHBondContact O-CB 3.4Å; L5-I9 WeakPolarHBondContact O-CD1 3.5Å; L5-I9 VanDerWaalsContact O-CG1 3.24Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.44Å; L5-I9 VanDerWaalsContact O-N 3.15Å
6L73Confident63.9Low116 Ų116109.9 Ų109.961%0.60761%0.614SS**Hα-helixtrans-64.6-25.2178.2-72.9171.9000113.6V2 P10V2-L6 HydrophobicContact CG1-CD1 4.35Å; V2-L6 WeakPolarHBondContact O-CG 3.46Å; V2-L6 PolarHBondContact O-N 3.45Å; V2-L6 VanDerWaalsContact O-N 3.15Å; L6-P10 WeakPolarHBondContact O-CD 3.43Å; L6-P10 VanDerWaalsContact O-CG 3.25Å; L6-P10 WeakPolarHBondContact O-CG 3.47Å
7V71.9Confident63.2Low88 Ų88116.3 Ų116.353%0.53363%0.626SS.*Hα-helixtrans-96.3-36.3177.7-179.80000111.8L3 L5 P10 L11L3-V7 PolarHBondContact O-N 3Å; L5-V7 PolarHBondContact O-N 3.44Å; V7-P10 WeakPolarHBondContact O-CD 3.46Å; V7-L11 HydrophobicContact CG1-CD1 3.94Å; V7-L11 WeakPolarHBondContact O-CD1 3.45Å
8A68.9Low62.7Low36 Ų36112.9 Ų112.930%0.29862%0.624SS.*Hα-helixtrans-70.7-37.3-177.900000113.4L4 L5 L11 L12L4-A8 WeakPolarHBondContact O-CB 3.43Å; L4-A8 PolarHBondContact O-N 2.96Å; L5-A8 PolarHBondContact O-N 3.42Å; A8-L11 PolarHBondContact O-N 3.11Å; A8-L12 WeakPolarHBondContact O-CB 3.16Å; A8-L12 PolarHBondContact O-N 2.81Å
9I65.6Low61.7Low99 Ų99113.7 Ų113.751%0.50864%0.635SS.*Hα-helixtrans-67.3-46.5-176.7-63.5166.2000111.8L5 L11 L12 V13L5-I9 HydrophobicContact CB-CD1 4.34Å; L5-I9 WeakPolarHBondContact O-CB 3.4Å; L5-I9 WeakPolarHBondContact O-CD1 3.5Å; L5-I9 VanDerWaalsContact O-CG1 3.24Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.44Å; L5-I9 VanDerWaalsContact O-N 3.15Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 2.7Å; I9-L12 PolarHBondContact O-N 2.74Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.31Å; I9-V13 PolarHBondContact O-N 3.36Å; I9-V13 VanDerWaalsContact O-N 3.11Å
10P60.1Low60.8Low64 Ų64112.8 Ų112.842%0.41664%0.642SS.*Hα-helixtrans-62.9-34.2175.6-24.234.9000113.9L6 V7 H14L6-P10 WeakPolarHBondContact O-CD 3.43Å; L6-P10 VanDerWaalsContact O-CG 3.25Å; L6-P10 WeakPolarHBondContact O-CG 3.47Å; V7-P10 WeakPolarHBondContact O-CD 3.46Å; P10-H14 PolarHBondContact O-N 3.14Å; P10-H14 PolarHBondContact O-ND1 3.06Å
11L61.9Low59.7Low115 Ų115114.8 Ų114.860%0.60265%0.645SS**Hα-helixtrans-69.7-41.3177.9-83.5165.7000112.1V7 A8 I9 V13 H14 S15V7-L11 HydrophobicContact CG1-CD1 3.94Å; V7-L11 WeakPolarHBondContact O-CD1 3.45Å; A8-L11 PolarHBondContact O-N 3.11Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 2.7Å; L11-V13 VanDerWaalsContact C-N 3.35Å; L11-H14 PolarHBondContact O-N 2.8Å; L11-S15 WeakPolarHBondContact O-CB 3.49Å; L11-S15 PolarHBondContact O-N 3.39Å
12L58.8Low59Low126 Ų126114.8 Ų114.866%0.6664%0.636SS**Hα-helixtrans-64.2-38.4174.3-85.1156.5000112.1A8 I9 S15A8-L12 WeakPolarHBondContact O-CB 3.16Å; A8-L12 PolarHBondContact O-N 2.81Å; I9-L12 PolarHBondContact O-N 2.74Å; L12-S15 PolarHBondContact O-N 2.81Å
13V59.5Low58Low93 Ų93116 Ų11656%0.56463%0.634SS**Hα-helixtrans-72-33.5177.9174.90000112.2I9 L11I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.31Å; I9-V13 PolarHBondContact O-N 3.36Å; I9-V13 VanDerWaalsContact O-N 3.11Å; L11-V13 VanDerWaalsContact C-N 3.35Å
14H55.7Low56.8Low141 Ų141117.7 Ų117.765%0.65364%0.641SS**Hα-helixtrans-75-27.1174.5-82.482.2000113.2P10 L11 S16P10-H14 PolarHBondContact O-N 3.14Å; P10-H14 PolarHBondContact O-ND1 3.06Å; L11-H14 PolarHBondContact O-N 2.8Å; H14-S16 VanDerWaalsContact C-N 3.29Å; H14-S16 PolarHBondContact O-N 3.25Å
15S54.1Low55.8Low105 Ų105118.5 Ų118.573%0.73465%0.645SS**THydrogen-bonded Turntrans-77.1-10.5178.3-168.40000113.9L11 L12L11-S15 WeakPolarHBondContact O-CB 3.49Å; L11-S15 PolarHBondContact O-N 3.39Å; L12-S15 PolarHBondContact O-N 2.81Å
16S52.7Low54.9Low93 Ų93116.4 Ų116.465%0.6565%0.649SS**THydrogen-bonded Turntrans-94.67.2-175.891.30000115H14 G18H14-S16 VanDerWaalsContact C-N 3.29Å; H14-S16 PolarHBondContact O-N 3.25Å; S16-G18 VanDerWaalsContact C-N 3.25Å; S16-G18 PolarHBondContact O-N 3.05Å
17R52.1Low53.7Low219 Ų219122.7 Ų122.783%0.82667%0.665SS**  trans-82.771.1172.1-78.8-176.4176.6164.2-0110.8
18G53.9Low52.5Low56 Ų56125.2 Ų125.258%0.57768%0.684SS**  trans-67.9146.9156.800000109.7S16 A20S16-G18 VanDerWaalsContact C-N 3.25Å; S16-G18 PolarHBondContact O-N 3.05Å; G18-A20 PolarHBondContact O-N 3.25Å
19P43.6Very low51.7Low128 Ų128134.3 Ų134.383%0.83171%0.711SS**  trans-66.2107.5171.827.1-29.9000107.9H21P19-H21 PolarHBondContact O-N 3.33Å
20A44.4Very low50.9Low94 Ų94137.6 Ų137.678%0.77773%0.726SS**  trans-70.386.5168.300000107.9G18 Y22G18-A20 PolarHBondContact O-N 3.25Å; A20-Y22 PolarHBondContact O-N 3.5Å
21H38.5Very low50.4Low155 Ų155140.3 Ų140.372%0.71874%0.741SS**  trans-78.498.4169.8-162.7-92.8000107.3P19 E23P19-H21 PolarHBondContact O-N 3.33Å; H21-E23 PolarHBondContact O-N 3.29Å
22Y46.7Very low49.8Very low199 Ų199139.5 Ų139.578%0.7874%0.744SS**  trans-86.1107.5169.862.8-85.9000107.7A20 M24A20-Y22 PolarHBondContact O-N 3.5Å; Y22-M24 HydrophobicContact CD2-CG 4.3Å
23E43.2Very low48.9Very low135 Ų135139.6 Ų139.663%0.63175%0.745SS**  trans-94.799.8172.3-139.8177.1-177.600107.3H21 L25H21-E23 PolarHBondContact O-N 3.29Å; E23-L25 HydrophobicContact CB-CD1 4.46Å; E23-L25 HydrophobicContact CG-CD1 4.02Å; E23-L25 HydrophobicContact CG-CG 4.09Å; E23-L25 PolarHBondContact O-N 3.14Å
24M45.8Very low48.3Very low173 Ų173140.6 Ų140.685%0.85275%0.754SS**  trans-76.371.9170.9-72.9-79.7-82.300108.8Y22 G26Y22-M24 HydrophobicContact CD2-CG 4.3Å; M24-G26 PolarHBondContact O-N 3.4Å
25L52.2Low47.9Very low149 Ų149142.8 Ų142.878%0.7876%0.764SS**  trans-78.369.2169-79.6161.7000109.4E23E23-L25 HydrophobicContact CB-CD1 4.46Å; E23-L25 HydrophobicContact CG-CD1 4.02Å; E23-L25 HydrophobicContact CG-CG 4.09Å; E23-L25 PolarHBondContact O-N 3.14Å
26G50.1Low47.3Very low61 Ų61140.4 Ų140.463%0.62976%0.756SS**  trans-132.1110174.600000110.5M24 C28M24-G26 PolarHBondContact O-N 3.4Å; G26-C28 PolarHBondContact O-N 2.76Å
27R48.1Very low47Very low248 Ų248142.4 Ų142.494%0.93677%0.766SS**  trans-75.3112.1165.2-70.9178.4175.4172.5-1.4107.7R29R27-R29 PolarHBondContact O-N 3.22Å
28C46.7Very low46.8Very low140 Ų140143.7 Ų143.795%0.94677%0.771SS**  trans-65114.2165.6-78.50000108.7G26G26-C28 PolarHBondContact O-N 2.76Å
29R51Low46.2Very low228 Ų228144.1 Ų144.186%0.8678%0.775SS**  trans-109.7123170.1-170.7175.9178.3164.3-0.3107.9R27 V31R27-R29 PolarHBondContact O-N 3.22Å; R29-V31 PolarHBondContact O-N 3.31Å
30M50.8Low46.4Very low167 Ų167144.7 Ų144.782%0.82378%0.779SS**  trans-61.3120.9166.2-80.6-159.6-74.200108.8
31V49.3Very low46.2Very low122 Ų122143.4 Ų143.474%0.73978%0.776SS**  trans-93.289.5162.2-176.50000105.9R29R29-V31 PolarHBondContact O-N 3.31Å
32C48.6Very low46.8Very low97 Ų97141.5 Ų141.566%0.65578%0.777SS**  trans-88.299.8159.9-61.40000106
33D40.5Very low46.4Very low128 Ų128139.8 Ų139.868%0.68478%0.781SS**  trans-69.8128163.9-94.7-23.4000108.5H35D33-H35 PolarHBondContact O-N 3.27Å
34P47Very low46.2Very low115 Ų115137.2 Ų137.275%0.74779%0.791SS**  trans-80.2105173.130.8-29.7000108.8G36P34-G36 VanDerWaalsContact C-N 3.29Å; P34-G36 PolarHBondContact O-N 2.85Å
35H46.1Very low46.2Very low187 Ų187133.8 Ų133.887%0.86679%0.79SS**  trans-70.493.9158.4-75.3-54.2000108.5D33D33-H35 PolarHBondContact O-N 3.27Å
36G42.4Very low45.9Very low55 Ų55133 Ų13357%0.56779%0.793SS**PPolyproline II helixtrans-62.6152170.500000111.9P34 R38P34-G36 VanDerWaalsContact C-N 3.29Å; P34-G36 PolarHBondContact O-N 2.85Å; G36-R38 PolarHBondContact O-N 2.75Å
37P47.1Very low45.4Very low134 Ų134135 Ų13587%0.8781%0.805SS**PPolyproline II helixtrans-70.6125.6-178.927.8-31.5000110.5
38R46.2Very low45.2Very low247 Ų247129 Ų12993%0.93280%0.8SS**PPolyproline II helixtrans-78.4123.6165.5-80.9-177.1178.5177.6-0.1108.9G36G36-R38 PolarHBondContact O-N 2.75Å
39G41.3Very low45Very low64 Ų64129 Ų12966%0.6680%0.796SS**PPolyproline II helixtrans-67.3163.2173.600000112.9
40P47.9Very low44.8Very low140 Ų140123.4 Ų123.491%0.90979%0.792SS**PPolyproline II helixtrans-82.8124.7178.727.5-21.8000110.9
41G41.8Very low45Very low68 Ų68121.4 Ų121.470%0.70179%0.791SS**PPolyproline II helixtrans-88.4159.8165.500000111.6
42P49.6Very low44.8Very low114 Ų114125.1 Ų125.174%0.7480%0.798SS**PPolyproline II helixtrans-92.6164.4-170.737.9-34.8000114
43D40Very low45.3Very low164 Ų164126.2 Ų126.288%0.87780%0.803SS**  trans81.1126.4154.8-54.7-27.5000121
44G38.7Very low46.3Very low81 Ų81126.2 Ų126.284%0.83581%0.811SS**  trans149.561.1159.300000115.9
45A44.9Very low46.6Very low100 Ų100124.5 Ų124.583%0.82681%0.814SS**PPolyproline II helixtrans-103.8129.3168.400000110.4
46P46.1Very low47Very low132 Ų132120.9 Ų120.986%0.85782%0.816SS**PPolyproline II helixtrans-91.3159.5174.233.8-29000113
47A38.9Very low47.9Very low105 Ų105128.3 Ų128.387%0.86883%0.833SS**PPolyproline II helixtrans-61.9151.9-165.200000117.1
48S43.9Very low48.3Very low120 Ų120125.4 Ų125.484%0.83983%0.827SS**  trans-137.5143.4157.368.60000111.2
49V42.4Very low49Very low142 Ų142123.2 Ų123.286%0.86183%0.827SS**  trans-83.9146.7-160.5179.70000113.4
50S46.5Very low50.2Low110 Ų110127 Ų12777%0.76984%0.837SS**  trans-74.9154.8175.6-45.80000114.5
51P54.9Low50.7Low124 Ų124123.7 Ų123.781%0.80583%0.829SS**  trans-127.5161.4140.77.714.9000115.1
52F46.4Very low51.7Low201 Ų201132.5 Ų132.588%0.88284%0.841SS**PPolyproline II helixtrans-67.5161.6-161.4-69.5-99.8000118.2
53P58.8Low52.7Low119 Ų119138.7 Ų138.777%0.77385%0.849SS**PPolyproline II helixtrans-91138.3174.233.8-30.2000113.8
54P60.4Low53.9Low129 Ų129134.2 Ų134.284%0.83884%0.842SS**PPolyproline II helixtrans-87.8141.4163.9-13.230.6000113.2
55G54.1Low55.1Low79 Ų79140.5 Ų140.581%0.81485%0.847SS**  trans-79.6176.7-169.600000117.8
56A54.6Low56.3Low110 Ų110140.3 Ų140.391%0.90985%0.845SS**  trans-72.2142.6-167.700000114.8
57K60.7Low57.2Low212 Ų212137.5 Ų137.592%0.92284%0.84SS**  trans-121.3131.7166.8-165.7175.3-177.5-177.80109.6
58G55.8Low58.7Low72 Ų72141 Ų14174%0.74284%0.843SS**PPolyproline II helixtrans-72.2169.4-163.500000117.4
59E60.4Low60.1Low202 Ų202146.8 Ų146.894%0.94485%0.847SS**PPolyproline II helixtrans-75.7134.5-172.2-63.2-176.1138.500113.1
60V66.7Low61.6Low142 Ų142142.6 Ų142.686%0.86183%0.832SS**PPolyproline II helixtrans-95.9133.3166.4177.10000108.8
61G58.2Low63.2Low72 Ų72143.1 Ų143.174%0.74283%0.833SS**PPolyproline II helixtrans-57.7149.6-170.800000115.9R63G61-R63 PolarHBondContact O-N 3.46Å
62R63.9Low64.5Low252 Ų252143.2 Ų143.295%0.95183%0.833SS**PPolyproline II helixtrans-70.4122.7-174-69.1-178.9176.8-179.8-0.9112.2
63R71.1Confident65.9Low244 Ų244136.5 Ų136.592%0.92182%0.821SS**PPolyproline II helixtrans-69.3136.5166.3-166.7173.2-179.6-178.9-0.1109.8G61G61-R63 PolarHBondContact O-N 3.46Å
64G64.9Low67Low71 Ų71136.7 Ų136.773%0.73282%0.822SS**PPolyproline II helixtrans-57.2146-177.900000113.6A66G64-A66 PolarHBondContact O-N 2.93Å
65K64.4Low68.2Low213 Ų213136.6 Ų136.693%0.92682%0.822SS**PPolyproline II helixtrans-65.8125.3-172.9-64.4-175.5-179.8-177.40111.1
66A68.8Low69.4Low95 Ų95135.9 Ų135.979%0.78581%0.814SS**PPolyproline II helixtrans-62.8140.3164.900000109.7G64G64-A66 PolarHBondContact O-N 2.93Å
67G65.8Low70.9Confident73 Ų73136.9 Ų136.975%0.75381%0.811SS**PPolyproline II helixtrans-56.9143.517800000111.7R69G67-R69 PolarHBondContact O-N 3.14Å; G67-R69 VanDerWaalsContact O-N 3.14Å
68L69.9Low72Confident178 Ų178138.4 Ų138.493%0.93281%0.811SS**PPolyproline II helixtrans-60.8118-177.4-67170.3000109.7G70L68-G70 PolarHBondContact O-N 2.98Å
69R74.2Confident73.2Confident243 Ų243137.3 Ų137.392%0.91780%0.8SS**PPolyproline II helixtrans-60.8129167.5-171.9175-179.2-179.1-0.1107.3G67G67-R69 PolarHBondContact O-N 3.14Å; G67-R69 VanDerWaalsContact O-N 3.14Å
70G73.8Confident74.4Confident53 Ų53133.5 Ų133.555%0.54679%0.793SS.*PPolyproline II helixtrans-53149.2179.100000111.4L68L68-G70 PolarHBondContact O-N 2.98Å
71P79.6Confident75.4Confident122 Ų122132.8 Ų132.879%0.79279%0.791SS**PPolyproline II helixtrans-56.6139.1-178.123.5-32.3000110G73P71-G73 PolarHBondContact O-N 2.92Å
72P81.1Confident76.4Confident125 Ų125132.8 Ų132.881%0.81279%0.791SS**PPolyproline II helixtrans-51.5139.6168.9-24.433.8000110
73G76.6Confident77.5Confident61 Ų61129.7 Ų129.763%0.62979%0.788SS**PPolyproline II helixtrans-56.2152.3174.700000111P71P71-G73 PolarHBondContact O-N 2.92Å
74P83Confident78.3Confident122 Ų122124 Ų12479%0.79278%0.782SS**PPolyproline II helixtrans-57.3142.2178.324.3-32.8000110.3G76P74-G76 PolarHBondContact O-N 3.09Å
75P84.6Confident79Confident128 Ų128124 Ų12483%0.83178%0.782SS**PPolyproline II helixtrans-52139.1171.9-25.534.2000110.7
76G79.1Confident80.1Confident63 Ų63125.2 Ų125.265%0.64978%0.781SS**PPolyproline II helixtrans-58.6154.6175.400000111.5P74P74-G76 PolarHBondContact O-N 3.09Å
77P85.6Confident81Confident132 Ų132126.8 Ų126.886%0.85778%0.783SS**PPolyproline II helixtrans-58.6142.5177.425.3-33.1000110.5G79P77-G79 PolarHBondContact O-N 2.77Å
78R84.9Confident81.5Confident243 Ų243126.2 Ų126.292%0.91778%0.777SS**PPolyproline II helixtrans-58.4133.2173.4-174.6178.3175-179.3-1.1108.7
79G81.1Confident82Confident49 Ų49123.5 Ų123.551%0.50577%0.77SS.*PPolyproline II helixtrans-58.6157.1174.700000112P77P77-G79 PolarHBondContact O-N 2.77Å
80P85.4Confident82.5Confident122 Ų122118 Ų11879%0.79277%0.765SS**PPolyproline II helixtrans-59.1147.8179.225.2-33.1000111.1
81P87.1Confident82.2Confident127 Ų127118.2 Ų118.283%0.82577%0.768SS**PPolyproline II helixtrans-53.1140.6171-23.933.9000111.1
82G80.6Confident81.8Confident73 Ų73118.2 Ų118.275%0.75377%0.768SS**PPolyproline II helixtrans-62.4150.8173.700000111.2
83E85.6Confident81.5Confident187 Ų187118.3 Ų118.387%0.87477%0.769SS**PPolyproline II helixtrans-61.2144.4177.5-65.9-171.5155.400111.1G85E83-G85 PolarHBondContact O-N 3.22Å
84P88Confident80.6Confident125 Ų125118 Ų11881%0.81277%0.766SS**PPolyproline II helixtrans-53.2138.3173.2-25.334.2000111.6
85G80.6Confident79.6Confident70 Ų70118 Ų11872%0.72277%0.766SS**PPolyproline II helixtrans-58.4148.717300000111.1E83E83-G85 PolarHBondContact O-N 3.22Å
86R85.9Confident78.2Confident239 Ų239114 Ų11490%0.90275%0.748SS**PPolyproline II helixtrans-59.5143.2176.2-64.3-176.9-177.2-165.20.4109.7G88R86-G88 PolarHBondContact O-N 3.39Å
87P88.6Confident77Confident128 Ų128118.5 Ų118.583%0.83177%0.766SS**PPolyproline II helixtrans-51142.2170.8-25.634.2000111
88G76.3Confident75.2Confident61 Ų61115.6 Ų115.663%0.62976%0.759SS**PPolyproline II helixtrans-60.5158.4173.100000111.4R86R86-G88 PolarHBondContact O-N 3.39Å
89P80.1Confident73.3Confident121 Ų121105.9 Ų105.979%0.78674%0.735SS**PPolyproline II helixtrans-57.4146.2173.325.8-33000110G91P89-G91 PolarHBondContact O-N 2.98Å
90P84.9Confident71.9Confident126 Ų126109.8 Ų109.882%0.81875%0.749SS**PPolyproline II helixtrans-50.6138.6171.5-25.534.1000110.6
91G68.6Low70.3Confident59 Ų59107.5 Ų107.561%0.60874%0.74SS**PPolyproline II helixtrans-57.9158.6172.600000111.2P89P89-G91 PolarHBondContact O-N 2.98Å
92P70.7Confident68.6Low121 Ų121106.4 Ų106.479%0.78673%0.733SS**PPolyproline II helixtrans-53.3144.1174.223.2-32.2000109.8G94P92-G94 PolarHBondContact O-N 3.39Å; P92-G94 VanDerWaalsContact O-N 3.15Å
93P75.1Confident67.3Low127 Ų127106.2 Ų106.283%0.82572%0.724SS**PPolyproline II helixtrans-49.7126.1175.8-2633.7000109.8
94G57Low65.6Low55 Ų55102.8 Ų102.857%0.56773%0.728SS**PPolyproline II helixtrans-56157.2169.700000109.8P92 G96P92-G94 PolarHBondContact O-N 3.39Å; P92-G94 VanDerWaalsContact O-N 3.15Å; G94-G96 PolarHBondContact O-N 3.41Å
95P61.8Low64.2Low123 Ų123100.2 Ų100.280%0.79972%0.724SS**PPolyproline II helixtrans-49.1117.8173.6-21.130.6000108.2
96G55.3Low63.6Low44 Ų44104.4 Ų104.445%0.45472%0.719SS.*  trans-61.2-178.7-175.700000111.8G94 G98 G99G94-G96 PolarHBondContact O-N 3.41Å; G96-G98 PolarHBondContact O-N 3.04Å; G96-G99 PolarHBondContact O-N 3.23Å
97P52.9Low63.1Low157 Ų15797.9 Ų97.9100%1.01971%0.706SS**THydrogen-bonded Turntrans-63.12.6178.6-18.731.4000115.3
98G49.5Very low62.7Low70 Ų7092.7 Ų92.772%0.72267%0.672SS**THydrogen-bonded Turntrans-118.211.6169.900000113.6G96 V100G96-G98 PolarHBondContact O-N 3.04Å; G98-V100 PolarHBondContact O-N 3.25Å
99G43.4Very low63.5Low40 Ų4099 Ų9941%0.41268%0.677SS.*  trans-64.4102.9163.300000106.4G96 A101G96-G99 PolarHBondContact O-N 3.23Å; G99-A101 PolarHBondContact O-N 2.88Å
100V52Low64.4Low130 Ų13093.9 Ų93.979%0.78864%0.642SS**  trans-55.897.4171-167.90000105.1G98G98-V100 PolarHBondContact O-N 3.25Å
101A51.6Low65Low74 Ų7489.4 Ų89.461%0.61262%0.616SS**PPolyproline II helixtrans-46.3134.1157.200000105G99 A103G99-A101 PolarHBondContact O-N 2.88Å; A101-A103 PolarHBondContact O-N 2.87Å
102P51.6Low66.5Low104 Ų10486.9 Ų86.968%0.67559%0.588SS**PPolyproline II helixtrans-49.2117.3175.220.7-29.3000105.4A104P102-A104 PolarHBondContact O-N 3.44Å; P102-A104 VanDerWaalsContact O-N 3.11Å
103A53.5Low67.8Low69 Ų6984.5 Ų84.557%0.5756%0.564SS**PPolyproline II helixtrans-46.6129.4-170.800000106.6A101 G105 Y106A101-A103 PolarHBondContact O-N 2.87Å; A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 CarbonylContact O-C 3.45Å; A103-G105 WeakPolarHBondContact O-CA 3.36Å; A103-G105 PolarHBondContact O-N 2.61Å; A103-Y106 PolarHBondContact O-N 2.85Å
104A51.2Low69Low116 Ų11678.5 Ų78.596%0.95953%0.525SS*.THydrogen-bonded Turntrans-49.9102177.800000107.7P102P102-A104 PolarHBondContact O-N 3.44Å; P102-A104 VanDerWaalsContact O-N 3.11Å
105G58.6Low70.9Confident70 Ų7075.9 Ų75.972%0.72250%0.498SS*.THydrogen-bonded Turntrans123.7-1.1-165.200000118.4A103 V107A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 CarbonylContact O-C 3.45Å; A103-G105 WeakPolarHBondContact O-CA 3.36Å; A103-G105 PolarHBondContact O-N 2.61Å; G105-V107 PolarHBondContact O-N 3.21Å
106Y67.7Low72.6Confident159 Ų15970 Ų7062%0.62446%0.46SS*.  trans-72101.3170.9-173-99.8000110.3A103 P108A103-Y106 PolarHBondContact O-N 2.85Å; Y106-P108 HydrophobicContact CE1-CB 4.29Å; Y106-P108 WeakPolarHBondContact O-CD 3.2Å
107V74.8Confident74.5Confident102 Ų10274.2 Ų74.262%0.61846%0.462SS*.  trans-87112.8171-176.20000107.4G105 R109G105-V107 PolarHBondContact O-N 3.21Å; V107-R109 PolarHBondContact O-N 2.83Å
108P80.8Confident76.2Confident18 Ų1874.1 Ų74.112%0.11744%0.442CS..  trans-60.6126.1178.224.3-32.1000109.7Y106 M150 P237Y106-P108 HydrophobicContact CE1-CB 4.29Å; Y106-P108 WeakPolarHBondContact O-CD 3.2Å; P108-M150 HydrophobicContact CB-CE 4Å; P108-M150 HydrophobicContact CB-SD 3.6Å; P108-M150 VanDerWaalsContact CB-SD 3.6Å; P108-M150 HydrophobicContact CG-CE 4.41Å; P108-M150 HydrophobicContact CG-SD 3.57Å; P108-M150 VanDerWaalsContact CG-SD 3.57Å; P108-P237 HydrophobicContact CG-CB 3.89Å; P108-P237 HydrophobicContact CG-CG 3.67Å
109R93.5Very high77.9Confident194 Ų19474.5 Ų74.573%0.73243%0.431SS*.  trans-111.1111.7175.9-62.4-177.6-175.3-175.70.1108.1V107 V135V107-R109 PolarHBondContact O-N 2.83Å; R109-V135 HydrophobicContact CB-CG1 4.05Å; R109-V135 WeakPolarHBondContact O-CG1 3.33Å
110I97.9Very high79.8Confident13 Ų1373.9 Ų73.97%0.06742%0.418CS..  trans-130.2120.1177.7-60.2158.1000106.9V135 A138 F146 P149 M150 Y154 F233 I234I110-V135 WeakPolarHBondContact CA-O 3.46Å; I110-A138 HydrophobicContact CG2-CB 4.07Å; I110-F146 HydrophobicContact CG2-CE2 3.73Å; I110-F146 HydrophobicContact CG2-CZ 3.93Å; I110-P149 HydrophobicContact CD1-CG 3.51Å; I110-P149 HydrophobicContact CG1-CG 4.16Å; I110-M150 HydrophobicContact CD1-CB 4.34Å; I110-Y154 HydrophobicContact CB-CE1 4.46Å; I110-Y154 HydrophobicContact CD1-CE1 4.25Å; I110-Y154 WeakPolarHBondContact CD1-OH 3.43Å; I110-Y154 HydrophobicContact CG2-CE1 4.2Å; I110-F233 CarbonylContact O-C 3.45Å; I110-F233 WeakPolarHBondContact O-CA 3.36Å; I110-F233 WeakPolarHBondContact O-CB 3.43Å; I110-I234 HydrophobicContact CB-CB 4.19Å; I110-I234 HydrophobicContact CB-CG2 3.87Å; I110-I234 HydrophobicContact CD1-CB 4.48Å; I110-I234 HydrophobicContact CD1-CD1 4.22Å; I110-I234 HydrophobicContact CD1-CG2 4.43Å; I110-I234 HydrophobicContact CG1-CG2 4.41Å; I110-I234 PolarHBondContact O-N 3.23Å
111A98.6Very high81.3Confident32 Ų3273.6 Ų73.626%0.26441%0.408SS..EExtended strand (participates in β ladder)trans-158.4139.4178.300000110.5N134 V135 G232 F233A111-N134 CarbonylContact O-C 3.52Å; A111-N134 WeakPolarHBondContact O-CA 3.43Å; A111-V135 PolarHBondContact N-O 2.85Å; A111-V135 VanDerWaalsContact N-O 3.09Å; A111-V135 PolarHBondContact O-N 2.92Å; A111-G232 CarbonylContact C-O 3.11Å; A111-G232 VanDerWaalsContact CA-O 3.31Å; A111-G232 WeakPolarHBondContact CA-O 3.48Å; A111-F233 HydrophobicContact CB-CB 3.79Å
112F98.9Very high82.5Confident6 Ų671.2 Ų71.23%0.02639%0.391CS..EExtended strand (participates in β ladder)trans-138.1154.5172.778-78.2000111.9T133 Y139 F146 F156 F230 S231 G232F112-T133 CarbonylContact C-O 3.54Å; F112-T133 WeakPolarHBondContact CA-O 3.48Å; F112-T133 WeakPolarHBondContact CB-O 3.16Å; F112-Y139 HydrophobicContact CB-CG 4.46Å; F112-Y139 HydrophobicContact CD2-CD1 4.21Å; F112-Y139 AromaticContact CD2-CD2 3.59Å; F112-Y139 HydrophobicContact CD2-CD2 3.59Å; F112-Y139 HydrophobicContact CD2-CE2 4.3Å; F112-Y139 AromaticContact CD2-CG 3.55Å; F112-Y139 HydrophobicContact CD2-CG 3.55Å; F112-Y139 AromaticContact CE2-CD2 3.52Å; F112-Y139 HydrophobicContact CE2-CD2 3.52Å; F112-Y139 AromaticContact CE2-CE2 3.96Å; F112-Y139 HydrophobicContact CE2-CE2 3.96Å; F112-Y139 AromaticContact CE2-CG 4Å; F112-Y139 HydrophobicContact CE2-CG 4Å; F112-Y139 HydrophobicContact CG-CD2 4.3Å; F112-Y139 HydrophobicContact CG-CG 4.06Å; F112-Y139 HydrophobicContact CZ-CD2 4.17Å; F112-F146 AromaticContact CD1-CD2 3.61Å; F112-F146 HydrophobicContact CD1-CD2 3.61Å; F112-F146 HydrophobicContact CD1-CE2 4.14Å; F112-F146 HydrophobicContact CE1-CB 4.09Å; F112-F146 AromaticContact CE1-CD2 3.57Å; F112-F146 HydrophobicContact CE1-CD2 3.57Å; F112-F146 HydrophobicContact CE1-CE2 4.3Å; F112-F146 HydrophobicContact CE1-CG 4.06Å; F112-F146 HydrophobicContact CZ-CB 4.28Å; F112-F156 HydrophobicContact CE1-CD1 4.01Å; F112-F156 AromaticContact CE1-CE1 3.83Å; F112-F156 HydrophobicContact CE1-CE1 3.83Å; F112-F156 HydrophobicContact CZ-CD1 4.15Å; F112-F156 HydrophobicContact CZ-CE1 4.28Å; F112-F230 HydrophobicContact CE2-CB 4.48Å; F112-F230 AromaticContact CE2-CD1 3.58Å; F112-F230 HydrophobicContact CE2-CD1 3.58Å; F112-F230 HydrophobicContact CE2-CD2 4.46Å; F112-F230 AromaticContact CE2-CE1 3.83Å; F112-F230 HydrophobicContact CE2-CE1 3.83Å; F112-F230 AromaticContact CE2-CG 3.91Å; F112-F230 HydrophobicContact CE2-CG 3.91Å; F112-F230 HydrophobicContact CE2-CZ 4.37Å; F112-F230 AromaticContact CZ-CD1 3.8Å; F112-F230 HydrophobicContact CZ-CD1 3.8Å; F112-F230 HydrophobicContact CZ-CD2 4.28Å; F112-F230 AromaticContact CZ-CE1 3.58Å; F112-F230 HydrophobicContact CZ-CE1 3.58Å; F112-F230 HydrophobicContact CZ-CE2 4.08Å; F112-F230 HydrophobicContact CZ-CG 4.13Å; F112-F230 AromaticContact CZ-CZ 3.73Å; F112-F230 HydrophobicContact CZ-CZ 3.73Å; F112-S231 VanDerWaalsContact O-CA 3.28Å; F112-S231 WeakPolarHBondContact O-CA 3.24Å; F112-S231 WeakPolarHBondContact O-CB 3.32Å; F112-G232 WeakPolarHBondContact CD1-O 3.49Å; F112-G232 VanDerWaalsContact CE1-N 3.29Å; F112-G232 PolarHBondContact N-O 3.29Å; F112-G232 PolarHBondContact O-N 2.82Å; F112-G232 VanDerWaalsContact O-N 3.09Å
113Y98.9Very high84Confident72 Ų7274 Ų7428%0.28239%0.389SS..EExtended strand (participates in β ladder)trans-148.4125.9169.9168.9-114000108.2V132 T133 K226 T229 F230Y113-V132 HydrophobicContact CD1-CB 3.6Å; Y113-V132 HydrophobicContact CD1-CG1 3.97Å; Y113-V132 HydrophobicContact CD1-CG2 3.96Å; Y113-V132 HydrophobicContact CE1-CB 4.04Å; Y113-V132 HydrophobicContact CE1-CG1 4.34Å; Y113-V132 HydrophobicContact CE1-CG2 3.88Å; Y113-V132 PolarHBondContact O-N 3.22Å; Y113-T133 PolarHBondContact N-O 3.08Å; Y113-T133 PolarHBondContact O-N 2.76Å; Y113-T133 VanDerWaalsContact O-N 3.14Å; Y113-K226 HydrophobicContact CE1-CD 4.42Å; Y113-T229 HydrophobicContact CE2-CG2 3.65Å; Y113-T229 WeakPolarHBondContact OH-CG2 3.46Å; Y113-F230 WeakPolarHBondContact CA-O 3.45Å
114A98.8Very high85.7Confident0 Ų074.6 Ų74.60%038%0.38CS..EExtended strand (participates in β ladder)trans-134.9137.7179.600000110.7F128 D130 V131 Y139 T229 F230A114-F128 HydrophobicContact CB-CB 3.6Å; A114-D130 WeakPolarHBondContact CA-O 3.18Å; A114-V131 HydrophobicContact CB-CG2 4.18Å; A114-Y139 HydrophobicContact CB-CD1 4.32Å; A114-Y139 HydrophobicContact CB-CE1 3.77Å; A114-T229 VanDerWaalsContact O-CA 3.29Å; A114-T229 WeakPolarHBondContact O-CA 3.33Å; A114-F230 PolarHBondContact N-O 3.36Å; A114-F230 PolarHBondContact O-N 3.21Å
115G98.5Very high87.8Confident0 Ų070.6 Ų70.60%034%0.343CS..EExtended strand (participates in β ladder)trans-95.2175.6168.100000111.7F128 D129 D130 N225 S228G115-F128 CarbonylContact O-C 3.56Å; G115-F128 VanDerWaalsContact O-CA 3.28Å; G115-F128 WeakPolarHBondContact O-CA 3.23Å; G115-F128 WeakPolarHBondContact O-CB 3.47Å; G115-D129 PolarHBondContact O-N 3.03Å; G115-D130 PolarHBondContact N-O 3.3Å; G115-D130 WeakPolarHBondContact O-CB 3.21Å; G115-D130 PolarHBondContact O-N 3.37Å; G115-N225 CarbonylContact C-O 3.55Å; G115-N225 VanDerWaalsContact CA-O 3.25Å; G115-N225 WeakPolarHBondContact CA-O 3.42Å; G115-S228 CarbonylContact C-O 3.47Å; G115-S228 WeakPolarHBondContact CA-O 3.49Å
116L97.7Very high89.6Confident0 Ų067.2 Ų67.20%031%0.309CS..  trans-108.6121.3178.2-173.570.9000109.9R118 L126 R127 F128 V219 G221 N225 S228L116-R118 WeakPolarHBondContact CD1-O 3.5Å; L116-R118 VanDerWaalsContact CG-O 3.29Å; L116-R118 WeakPolarHBondContact CG-O 3.23Å; L116-L126 HydrophobicContact CD1-CD1 3.84Å; L116-L126 HydrophobicContact CD2-CD1 4.09Å; L116-R127 VanDerWaalsContact CD1-O 3.23Å; L116-R127 WeakPolarHBondContact CD1-O 3.31Å; L116-F128 HydrophobicContact CB-CD1 4.14Å; L116-V219 HydrophobicContact CD2-CB 4.21Å; L116-V219 HydrophobicContact CD2-CG1 3.49Å; L116-V219 VanDerWaalsContact CD2-CG1 3.49Å; L116-G221 WeakPolarHBondContact O-CA 3.34Å; L116-N225 PolarHBondContact N-O 3.03Å; L116-N225 WeakPolarHBondContact O-CA 3.37Å; L116-N225 WeakPolarHBondContact O-CB 3.41Å; L116-S228 PolarHBondContact N-O 2.85Å; L116-S228 VanDerWaalsContact N-O 3.08Å
117R94.8Very high90.9Very high132 Ų13264.8 Ų64.850%0.49830%0.298SS..  trans-93.5-43.5175.8-170.8-179.7-60.2170.95.5111.8D129 D130R117-D129 WeakPolarHBondContact CA-OD1 3.12Å; R117-D129 WeakPolarHBondContact CB-OD1 3.46Å; R117-D129 PolarHBondContact N-OD1 3.15Å; R117-D130 HydrophobicContact CB-CB 4.39Å; R117-D130 IonicContact CZ-OD1 3.79Å; R117-D130 IonicContact NE-OD1 3.61Å; R117-D130 IonicContact NH2-OD1 2.75Å; R117-D130 PolarHBondContact NH2-OD1 3.5Å
118R88.2Confident92Very high156 Ų15659.9 Ų59.959%0.58927%0.269SS*.SBendtrans-99.4129.4-177.7-61.4-175.5-146.71168.7110.4L116 H120 D129L116-R118 WeakPolarHBondContact CD1-O 3.5Å; L116-R118 VanDerWaalsContact CG-O 3.29Å; L116-R118 WeakPolarHBondContact CG-O 3.23Å; R118-H120 PolarHBondContact O-N 3.19Å; R118-D129 IonicContact CZ-OD2 3.65Å; R118-D129 IonicContact NE-OD2 3.71Å; R118-D129 PolarHBondContact NE-OD2 2.75Å; R118-D129 IonicContact NH1-OD2 2.75Å; R118-D129 PolarHBondContact NH1-OD2 2.69Å; R118-D129 IonicContact NH2-OD2 3.5Å; R118-D129 PolarHBondContact NH2-OD2 2.91Å
119P85Confident92.8Very high78 Ų7860.2 Ų60.251%0.50627%0.269SS..  trans-54.9140.7169.6-23.333.5000110.8V219P119-V219 VanDerWaalsContact CA-O 3.29Å; P119-V219 WeakPolarHBondContact CA-O 3.21Å
120H84.3Confident93Very high27 Ų2752 Ų5213%0.12524%0.24CC..EExtended strand (participates in β ladder)trans-121.7152.1176.2-99.5-87.8000109.2R118 E124 L126 L214 V219R118-H120 PolarHBondContact O-N 3.19Å; H120-E124 IonicContact CE1-OE1 3.39Å; H120-E124 PolarHBondContact CE1-OE1 2.85Å; H120-E124 VanDerWaalsContact CE1-OE1 3.25Å; H120-E124 IonicContact ND1-OE1 3.41Å; H120-E124 PolarHBondContact ND1-OE1 3.35Å; H120-L126 HydrophobicContact CB-CD1 3.46Å; H120-L126 VanDerWaalsContact CB-CD1 3.46Å; H120-L214 HydrophobicContact CB-CD1 4.47Å; H120-V219 PolarHBondContact N-O 2.91Å; H120-V219 PolarHBondContact O-N 3.25Å
121E82.2Confident93.1Very high124 Ų12454 Ų5458%0.57925%0.253SS*.EExtended strand (participates in β ladder)trans-145.3156178.662.9-171.4-165.100111.5G217E121-G217 WeakPolarHBondContact CA-O 3.32Å
122G78.3Confident93.1Very high24 Ų2456.4 Ų56.425%0.24726%0.264CS..SBendtrans95.8-141.7173.400000114.4L214 G216 G217G122-L214 WeakPolarHBondContact O-CB 3.5Å; G122-G216 WeakPolarHBondContact O-CA 3.29Å; G122-G216 PolarHBondContact O-N 2.7Å; G122-G216 VanDerWaalsContact O-N 3.12Å; G122-G217 PolarHBondContact N-O 3.39Å
123Y82.8Confident93Very high163 Ų16358.9 Ų58.964%0.63928%0.28SS*.SBendtrans-119.327.6-164.7-63.6-89.4000113.2K213 L214 D215Y123-K213 VanDerWaalsContact O-CE 3.29Å; Y123-K213 WeakPolarHBondContact O-CE 3.47Å; Y123-L214 CarbonylContact C-O 3.55Å; Y123-L214 VanDerWaalsContact CA-O 3.31Å; Y123-L214 WeakPolarHBondContact CA-O 3.24Å; Y123-D215 WeakPolarHBondContact CD1-OD1 3.42Å; Y123-D215 WeakPolarHBondContact CE1-OD1 3.18Å
124E87.9Confident93Very high81 Ų8157.3 Ų57.338%0.37928%0.276SS..SBendtrans-106.6175.9-171.265.1172.8174.700113.5H120 L126 L214H120-E124 IonicContact CE1-OE1 3.39Å; H120-E124 PolarHBondContact CE1-OE1 2.85Å; H120-E124 VanDerWaalsContact CE1-OE1 3.25Å; H120-E124 IonicContact ND1-OE1 3.41Å; H120-E124 PolarHBondContact ND1-OE1 3.35Å; E124-L126 PolarHBondContact O-N 2.84Å; E124-L214 PolarHBondContact O-N 3.04Å
125V95.4Very high93Very high31 Ų3160.8 Ų60.819%0.18830%0.297CS..BIsolated β-bridgetrans-67.2126.5171.2-179.60000109R127 S143 F211 I212V125-R127 PolarHBondContact O-N 2.96Å; V125-S143 WeakPolarHBondContact CG1-O 3.29Å; V125-F211 HydrophobicContact CB-CD2 4.33Å; V125-F211 HydrophobicContact CG1-CB 4.09Å; V125-F211 HydrophobicContact CG1-CD2 3.84Å; V125-F211 HydrophobicContact CG1-CG 4.23Å; V125-F211 HydrophobicContact CG2-CD2 3.71Å; V125-F211 HydrophobicContact CG2-CE2 3.71Å; V125-I212 WeakPolarHBondContact CA-O 3.31Å
126L95.9Very high92.8Very high0 Ų063 Ų630%032%0.32CS..  trans-78.4116.7177.1-177.858000110.2L116 H120 E124 F128 V160 I212 L214 V219L116-L126 HydrophobicContact CD1-CD1 3.84Å; L116-L126 HydrophobicContact CD2-CD1 4.09Å; H120-L126 HydrophobicContact CB-CD1 3.46Å; H120-L126 VanDerWaalsContact CB-CD1 3.46Å; E124-L126 PolarHBondContact O-N 2.84Å; L126-F128 HydrophobicContact CB-CE2 4.14Å; L126-F128 HydrophobicContact CD2-CE1 3.9Å; L126-F128 HydrophobicContact CD2-CE2 3.75Å; L126-F128 HydrophobicContact CD2-CZ 3.31Å; L126-F128 HydrophobicContact CG-CD2 4.29Å; L126-F128 HydrophobicContact CG-CE1 4.36Å; L126-F128 HydrophobicContact CG-CE2 3.74Å; L126-F128 HydrophobicContact CG-CZ 3.8Å; L126-V160 HydrophobicContact CD2-CG1 4.03Å; L126-V160 HydrophobicContact CD2-CG2 4.06Å; L126-I212 HydrophobicContact CB-CB 4.34Å; L126-I212 HydrophobicContact CB-CG2 4.39Å; L126-I212 HydrophobicContact CD2-CG2 4.44Å; L126-I212 PolarHBondContact N-O 3.42Å; L126-L214 HydrophobicContact CB-CD2 4.48Å; L126-L214 HydrophobicContact CB-CG 4.25Å; L126-L214 HydrophobicContact CD1-CD1 4.31Å; L126-L214 HydrophobicContact CD2-CD2 4.18Å; L126-V219 HydrophobicContact CD1-CB 4.39Å; L126-V219 HydrophobicContact CD1-CG1 4.3Å; L126-V219 HydrophobicContact CD2-CG1 3.99Å; L126-V219 HydrophobicContact CD2-CG2 4.5Å
127R96.6Very high92.8Very high107 Ų10769.6 Ų69.640%0.40436%0.355SS..  trans-97.398.6-175.7-54.3179.9-166.2-158.311.9110.6L116 V125 D129 A142L116-R127 VanDerWaalsContact CD1-O 3.23Å; L116-R127 WeakPolarHBondContact CD1-O 3.31Å; V125-R127 PolarHBondContact O-N 2.96Å; R127-D129 PolarHBondContact O-N 2.62Å; R127-A142 WeakPolarHBondContact CD-O 3.44Å; R127-A142 PolarHBondContact NH1-O 3.44Å
128F97.9Very high93Very high0 Ų063.8 Ų63.80%034%0.336CS..  trans-74.793.5174.8-58.4-95.7000109.3A114 G115 L116 L126 Y139 V160 I212 T229 F230A114-F128 HydrophobicContact CB-CB 3.6Å; G115-F128 CarbonylContact O-C 3.56Å; G115-F128 VanDerWaalsContact O-CA 3.28Å; G115-F128 WeakPolarHBondContact O-CA 3.23Å; G115-F128 WeakPolarHBondContact O-CB 3.47Å; L116-F128 HydrophobicContact CB-CD1 4.14Å; L126-F128 HydrophobicContact CB-CE2 4.14Å; L126-F128 HydrophobicContact CD2-CE1 3.9Å; L126-F128 HydrophobicContact CD2-CE2 3.75Å; L126-F128 HydrophobicContact CD2-CZ 3.31Å; L126-F128 HydrophobicContact CG-CD2 4.29Å; L126-F128 HydrophobicContact CG-CE1 4.36Å; L126-F128 HydrophobicContact CG-CE2 3.74Å; L126-F128 HydrophobicContact CG-CZ 3.8Å; F128-Y139 WeakPolarHBondContact CB-OH 3.29Å; F128-Y139 PolarHBondContact N-OH 2.78Å; F128-Y139 WeakPolarHBondContact O-CE1 3.25Å; F128-Y139 PolarHBondContact O-OH 2.83Å; F128-V160 HydrophobicContact CZ-CG2 4.24Å; F128-I212 HydrophobicContact CE2-CB 4.04Å; F128-I212 HydrophobicContact CE2-CG1 3.86Å; F128-I212 HydrophobicContact CZ-CG1 4.28Å; F128-T229 VanDerWaalsContact CE1-C 3.45Å; F128-F230 HydrophobicContact CD1-CB 4.14Å; F128-F230 HydrophobicContact CD2-CB 3.54Å; F128-F230 HydrophobicContact CD2-CD1 4.17Å; F128-F230 HydrophobicContact CD2-CG 4.28Å; F128-F230 HydrophobicContact CE1-CB 4.07Å; F128-F230 HydrophobicContact CE2-CB 3.47Å; F128-F230 VanDerWaalsContact CE2-CB 3.47Å; F128-F230 HydrophobicContact CE2-CD1 4.25Å; F128-F230 HydrophobicContact CE2-CG 4.12Å; F128-F230 HydrophobicContact CG-CB 3.88Å; F128-F230 HydrophobicContact CZ-CB 3.73Å
129D97Very high93.5Very high24 Ų2456.5 Ų56.513%0.12831%0.308CS..  trans-923-169.365.3-23.8000114.6G115 R117 R118 R127G115-D129 PolarHBondContact O-N 3.03Å; R117-D129 WeakPolarHBondContact CA-OD1 3.12Å; R117-D129 WeakPolarHBondContact CB-OD1 3.46Å; R117-D129 PolarHBondContact N-OD1 3.15Å; R118-D129 IonicContact CZ-OD2 3.65Å; R118-D129 IonicContact NE-OD2 3.71Å; R118-D129 PolarHBondContact NE-OD2 2.75Å; R118-D129 IonicContact NH1-OD2 2.75Å; R118-D129 PolarHBondContact NH1-OD2 2.69Å; R118-D129 IonicContact NH2-OD2 3.5Å; R118-D129 PolarHBondContact NH2-OD2 2.91Å; R127-D129 PolarHBondContact O-N 2.62Å
130D98.1Very high94.1Very high21 Ų2157.8 Ų57.811%0.11231%0.307CS..EExtended strand (participates in β ladder)trans-107.173.1175.2-162.848.4000111.5A114 G115 R117 V132 N225 K226A114-D130 WeakPolarHBondContact CA-O 3.18Å; G115-D130 PolarHBondContact N-O 3.3Å; G115-D130 WeakPolarHBondContact O-CB 3.21Å; G115-D130 PolarHBondContact O-N 3.37Å; R117-D130 HydrophobicContact CB-CB 4.39Å; R117-D130 IonicContact CZ-OD1 3.79Å; R117-D130 IonicContact NE-OD1 3.61Å; R117-D130 IonicContact NH2-OD1 2.75Å; R117-D130 PolarHBondContact NH2-OD1 3.5Å; D130-V132 PolarHBondContact O-N 2.99Å; D130-N225 HydrophobicContact CB-CB 4Å; D130-N225 VanDerWaalsContact OD2-CB 3.31Å; D130-N225 WeakPolarHBondContact OD2-CB 3.11Å; D130-N225 PolarHBondContact OD2-ND2 3.38Å; D130-K226 IonicContact OD2-NZ 3.17Å; D130-K226 PolarHBondContact OD2-NZ 3.44Å
131V98.6Very high94.8Very high56 Ų5657.9 Ų57.934%0.33931%0.313SS..EExtended strand (participates in β ladder)trans-72.9124.4-176.7-176.40000111A114 N134 Y139 A141A114-V131 HydrophobicContact CB-CG2 4.18Å; V131-N134 HydrophobicContact CG1-CB 3.84Å; V131-Y139 HydrophobicContact CG2-CD1 4.04Å; V131-Y139 HydrophobicContact CG2-CE1 4.03Å; V131-A141 HydrophobicContact CG2-CB 3.82Å
132V98.4Very high95.4Very high83 Ų8355 Ų5550%0.50331%0.311SS..EExtended strand (participates in β ladder)trans-104.8-41.5177.7174.10000111Y113 D130Y113-V132 HydrophobicContact CD1-CB 3.6Å; Y113-V132 HydrophobicContact CD1-CG1 3.97Å; Y113-V132 HydrophobicContact CD1-CG2 3.96Å; Y113-V132 HydrophobicContact CE1-CB 4.04Å; Y113-V132 HydrophobicContact CE1-CG1 4.34Å; Y113-V132 HydrophobicContact CE1-CG2 3.88Å; Y113-V132 PolarHBondContact O-N 3.22Å; D130-V132 PolarHBondContact O-N 2.99Å
133T98.6Very high96.3Very high58 Ų5855.7 Ų55.736%0.35631%0.311SS..EExtended strand (participates in β ladder)trans-130136.7178-56.60000109F112 Y113 V135F112-T133 CarbonylContact C-O 3.54Å; F112-T133 WeakPolarHBondContact CA-O 3.48Å; F112-T133 WeakPolarHBondContact CB-O 3.16Å; Y113-T133 PolarHBondContact N-O 3.08Å; Y113-T133 PolarHBondContact O-N 2.76Å; Y113-T133 VanDerWaalsContact O-N 3.14Å; T133-V135 HydrophobicContact CG2-CG2 4Å
134N98.4Very high97Very high39 Ų3947.9 Ų47.921%0.20928%0.281CS..EExtended strand (participates in β ladder)trans-152.856.5174.1-159.96.9000111.8A111 V131 G136 N137 A138 Y139A111-N134 CarbonylContact O-C 3.52Å; A111-N134 WeakPolarHBondContact O-CA 3.43Å; V131-N134 HydrophobicContact CG1-CB 3.84Å; N134-G136 PolarHBondContact O-N 3.09Å; N134-N137 PolarHBondContact O-N 3.48Å; N134-N137 PolarHBondContact O-OD1 2.91Å; N134-N137 WeakPolarHBondContact OD1-CA 3.07Å; N134-A138 PolarHBondContact OD1-N 3.25Å; N134-Y139 PolarHBondContact ND2-O 2.85Å; N134-Y139 PolarHBondContact OD1-N 2.94Å
135V97.9Very high97.5Very high73 Ų7346.2 Ų46.244%0.44227%0.272SS..EExtended strand (participates in β ladder)trans-66.1125.7176.9-174.20000108.8R109 I110 A111 T133 N137R109-V135 HydrophobicContact CB-CG1 4.05Å; R109-V135 WeakPolarHBondContact O-CG1 3.33Å; I110-V135 WeakPolarHBondContact CA-O 3.46Å; A111-V135 PolarHBondContact N-O 2.85Å; A111-V135 VanDerWaalsContact N-O 3.09Å; A111-V135 PolarHBondContact O-N 2.92Å; T133-V135 HydrophobicContact CG2-CG2 4Å; V135-N137 VanDerWaalsContact C-N 3.31Å
136G95.4Very high97.7Very high47 Ų4744.8 Ų44.849%0.48526%0.263SS..THydrogen-bonded Turntrans86.4-3.8-174.100000114.3N134 A138N134-G136 PolarHBondContact O-N 3.09Å; G136-A138 PolarHBondContact O-N 2.99Å; G136-A138 VanDerWaalsContact O-N 3.14Å
137N97.4Very high97.8Very high137 Ų13747.5 Ų47.573%0.73328%0.28SS*.SBendtrans50.336.4176.5-61.4-46.2000114.1N134 V135N134-N137 PolarHBondContact O-N 3.48Å; N134-N137 PolarHBondContact O-OD1 2.91Å; N134-N137 WeakPolarHBondContact OD1-CA 3.07Å; V135-N137 VanDerWaalsContact C-N 3.31Å
138A98.3Very high97.9Very high10 Ų1042.4 Ų42.48%0.08326%0.261CS..  trans-88.4-14.3-177.100000113I110 N134 G136 F146 T147 P149I110-A138 HydrophobicContact CG2-CB 4.07Å; N134-A138 PolarHBondContact OD1-N 3.25Å; G136-A138 PolarHBondContact O-N 2.99Å; G136-A138 VanDerWaalsContact O-N 3.14Å; A138-F146 HydrophobicContact CB-CD2 3.78Å; A138-F146 HydrophobicContact CB-CE2 3.35Å; A138-F146 HydrophobicContact CB-CZ 3.96Å; A138-F146 CarbonylContact O-C 3.54Å; A138-F146 WeakPolarHBondContact O-CA 3.28Å; A138-T147 PolarHBondContact O-N 3.44Å; A138-P149 HydrophobicContact CB-CG 4.13Å
139Y98.8Very high97.8Very high4 Ų445.4 Ų45.42%0.01628%0.28CS..EExtended strand (participates in β ladder)trans-97.4130.6173.1-177-100.6000111.4F112 A114 F128 V131 N134 A141 G144 F146 F230F112-Y139 HydrophobicContact CB-CG 4.46Å; F112-Y139 HydrophobicContact CD2-CD1 4.21Å; F112-Y139 AromaticContact CD2-CD2 3.59Å; F112-Y139 HydrophobicContact CD2-CD2 3.59Å; F112-Y139 HydrophobicContact CD2-CE2 4.3Å; F112-Y139 AromaticContact CD2-CG 3.55Å; F112-Y139 HydrophobicContact CD2-CG 3.55Å; F112-Y139 AromaticContact CE2-CD2 3.52Å; F112-Y139 HydrophobicContact CE2-CD2 3.52Å; F112-Y139 AromaticContact CE2-CE2 3.96Å; F112-Y139 HydrophobicContact CE2-CE2 3.96Å; F112-Y139 AromaticContact CE2-CG 4Å; F112-Y139 HydrophobicContact CE2-CG 4Å; F112-Y139 HydrophobicContact CG-CD2 4.3Å; F112-Y139 HydrophobicContact CG-CG 4.06Å; F112-Y139 HydrophobicContact CZ-CD2 4.17Å; A114-Y139 HydrophobicContact CB-CD1 4.32Å; A114-Y139 HydrophobicContact CB-CE1 3.77Å; F128-Y139 WeakPolarHBondContact CB-OH 3.29Å; F128-Y139 PolarHBondContact N-OH 2.78Å; F128-Y139 WeakPolarHBondContact O-CE1 3.25Å; F128-Y139 PolarHBondContact O-OH 2.83Å; V131-Y139 HydrophobicContact CG2-CD1 4.04Å; V131-Y139 HydrophobicContact CG2-CE1 4.03Å; N134-Y139 PolarHBondContact ND2-O 2.85Å; N134-Y139 PolarHBondContact OD1-N 2.94Å; Y139-A141 HydrophobicContact CE1-CB 4.36Å; Y139-G144 WeakPolarHBondContact CE2-O 3.36Å; Y139-G144 WeakPolarHBondContact OH-CA 3.28Å; Y139-F146 HydrophobicContact CD2-CB 4.4Å; Y139-F230 AromaticContact CE2-CD1 3.94Å; Y139-F230 HydrophobicContact CE2-CD1 3.94Å; Y139-F230 HydrophobicContact CE2-CE1 4.22Å
140E98.6Very high97.8Very high105 Ų10547.3 Ų47.349%0.49129%0.289SS..EExtended strand (participates in β ladder)trans-112.7109.6178.5179.756.2-11800110.5A142 S143 G144 K145E140-A142 VanDerWaalsContact C-N 3.26Å; E140-A142 HydrophobicContact CG-CB 4.31Å; E140-A142 PolarHBondContact O-N 2.87Å; E140-A142 WeakPolarHBondContact OE1-CB 3.43Å; E140-A142 PolarHBondContact OE1-N 3.43Å; E140-S143 WeakPolarHBondContact CB-OG 3.49Å; E140-S143 PolarHBondContact O-N 3.16Å; E140-S143 PolarHBondContact O-OG 3.25Å; E140-G144 PolarHBondContact O-N 3.25Å; E140-K145 PolarHBondContact N-O 2.92Å; E140-K145 PolarHBondContact O-N 2.75Å
141A97.3Very high97.8Very high29 Ų2948.4 Ų48.424%0.2430%0.297CS..THydrogen-bonded Turntrans-63.5-32-177.500000112.7V131 Y139 S143V131-A141 HydrophobicContact CG2-CB 3.82Å; Y139-A141 HydrophobicContact CE1-CB 4.36Å; A141-S143 VanDerWaalsContact C-N 3.28Å; A141-S143 PolarHBondContact O-N 2.97Å
142A95.9Very high97.8Very high64 Ų6445.7 Ų45.753%0.52928%0.281SS..THydrogen-bonded Turntrans-66.8-30.7179.900000112.5R127 E140R127-A142 WeakPolarHBondContact CD-O 3.44Å; R127-A142 PolarHBondContact NH1-O 3.44Å; E140-A142 VanDerWaalsContact C-N 3.26Å; E140-A142 HydrophobicContact CG-CB 4.31Å; E140-A142 PolarHBondContact O-N 2.87Å; E140-A142 WeakPolarHBondContact OE1-CB 3.43Å; E140-A142 PolarHBondContact OE1-N 3.43Å
143S96.7Very high97.8Very high37 Ų3742.6 Ų42.626%0.25926%0.262SS..THydrogen-bonded Turntrans-100.9-22.4179.870.70000113.2V125 E140 A141 K145V125-S143 WeakPolarHBondContact CG1-O 3.29Å; E140-S143 WeakPolarHBondContact CB-OG 3.49Å; E140-S143 PolarHBondContact O-N 3.16Å; E140-S143 PolarHBondContact O-OG 3.25Å; A141-S143 VanDerWaalsContact C-N 3.28Å; A141-S143 PolarHBondContact O-N 2.97Å; S143-K145 VanDerWaalsContact C-N 3.3Å; S143-K145 WeakPolarHBondContact OG-CB 3.36Å; S143-K145 PolarHBondContact OG-N 3.02Å
144G97.6Very high97.8Very high0 Ų039.9 Ų39.90%025%0.245CC..THydrogen-bonded Turntrans79.810.5-17300000113.8Y139 E140Y139-G144 WeakPolarHBondContact CE2-O 3.36Å; Y139-G144 WeakPolarHBondContact OH-CA 3.28Å; E140-G144 PolarHBondContact O-N 3.25Å
145K98.7Very high97.8Very high45 Ų4540.6 Ų40.620%0.19625%0.247CC..EExtended strand (participates in β ladder)trans-112.3143.7-169.3-51.1-174-177.8179.20112.5E140 S143 E209 F211E140-K145 PolarHBondContact N-O 2.92Å; E140-K145 PolarHBondContact O-N 2.75Å; S143-K145 VanDerWaalsContact C-N 3.3Å; S143-K145 WeakPolarHBondContact OG-CB 3.36Å; S143-K145 PolarHBondContact OG-N 3.02Å; K145-E209 HydrophobicContact CD-CB 4.33Å; K145-E209 HydrophobicContact CD-CG 4.28Å; K145-E209 WeakPolarHBondContact CD-OE1 3.49Å; K145-E209 IonicContact NZ-OE1 3.25Å; K145-E209 PolarHBondContact NZ-OE1 3.28Å; K145-E209 IonicContact NZ-OE2 2.62Å; K145-E209 PolarHBondContact NZ-OE2 2.99Å; K145-F211 HydrophobicContact CB-CB 4.26Å; K145-F211 HydrophobicContact CD-CD1 4.13Å; K145-F211 HydrophobicContact CG-CB 3.88Å; K145-F211 HydrophobicContact CG-CD1 4.1Å; K145-F211 HydrophobicContact CG-CG 4.16Å
146F98.9Very high97.9Very high1 Ų137.1 Ų37.10%0.00423%0.226CC..EExtended strand (participates in β ladder)trans-90.4128.1159.1174.6-88.4000108.8I110 F112 A138 Y139 C148 Y154 F156 L204 E209 V210I110-F146 HydrophobicContact CG2-CE2 3.73Å; I110-F146 HydrophobicContact CG2-CZ 3.93Å; F112-F146 AromaticContact CD1-CD2 3.61Å; F112-F146 HydrophobicContact CD1-CD2 3.61Å; F112-F146 HydrophobicContact CD1-CE2 4.14Å; F112-F146 HydrophobicContact CE1-CB 4.09Å; F112-F146 AromaticContact CE1-CD2 3.57Å; F112-F146 HydrophobicContact CE1-CD2 3.57Å; F112-F146 HydrophobicContact CE1-CE2 4.3Å; F112-F146 HydrophobicContact CE1-CG 4.06Å; F112-F146 HydrophobicContact CZ-CB 4.28Å; A138-F146 HydrophobicContact CB-CD2 3.78Å; A138-F146 HydrophobicContact CB-CE2 3.35Å; A138-F146 HydrophobicContact CB-CZ 3.96Å; A138-F146 CarbonylContact O-C 3.54Å; A138-F146 WeakPolarHBondContact O-CA 3.28Å; Y139-F146 HydrophobicContact CD2-CB 4.4Å; F146-C148 HydrophobicContact CE1-CB 4.23Å; F146-Y154 HydrophobicContact CE1-CD1 4.29Å; F146-Y154 HydrophobicContact CE1-CE1 4.21Å; F146-Y154 AromaticContact CZ-CD1 3.92Å; F146-Y154 HydrophobicContact CZ-CD1 3.92Å; F146-Y154 AromaticContact CZ-CE1 3.65Å; F146-Y154 HydrophobicContact CZ-CE1 3.65Å; F146-F156 HydrophobicContact CB-CE1 4.27Å; F146-F156 AromaticContact CD1-CE1 3.87Å; F146-F156 HydrophobicContact CD1-CE1 3.87Å; F146-F156 AromaticContact CD1-CZ 3.78Å; F146-F156 HydrophobicContact CD1-CZ 3.78Å; F146-F156 HydrophobicContact CD2-CE1 4.41Å; F146-F156 HydrophobicContact CE1-CE1 4.3Å; F146-F156 AromaticContact CE1-CZ 3.91Å; F146-F156 HydrophobicContact CE1-CZ 3.91Å; F146-F156 AromaticContact CG-CE1 3.93Å; F146-F156 HydrophobicContact CG-CE1 3.93Å; F146-F156 HydrophobicContact CG-CZ 4.32Å; F146-L204 HydrophobicContact CD1-CD1 4.35Å; F146-L204 HydrophobicContact CE1-CD1 3.88Å; F146-E209 CarbonylContact O-C 3.58Å; F146-E209 WeakPolarHBondContact O-CA 3.29Å; F146-V210 HydrophobicContact CB-CB 4.43Å; F146-V210 HydrophobicContact CD1-CB 4.41Å; F146-V210 PolarHBondContact N-O 2.8Å; F146-V210 PolarHBondContact O-N 3.01Å
147T98.8Very high98Very high57 Ų5735.3 Ų35.335%0.3521%0.206SC..EExtended strand (participates in β ladder)trans-111.1120.2173.6-57.50000108.9A138 P149 D208A138-T147 PolarHBondContact O-N 3.44Å; T147-P149 VanDerWaalsContact O-CD 3.23Å; T147-P149 WeakPolarHBondContact O-CD 2.96Å; T147-D208 WeakPolarHBondContact CA-O 3.23Å
148C98.4Very high98.1Very high1 Ų128.8 Ų28.81%0.00717%0.171CC..  trans-61116.1-176.4-176.60000111.2F146 M150 L204 D205 V206 G207 D208F146-C148 HydrophobicContact CE1-CB 4.23Å; C148-M150 PolarHBondContact SG-O 2.85Å; C148-L204 HydrophobicContact CB-CB 4Å; C148-L204 HydrophobicContact CB-CD1 4.17Å; C148-L204 VanDerWaalsContact SG-CB 3.53Å; C148-D205 WeakPolarHBondContact CB-O 3.37Å; C148-D205 PolarHBondContact SG-O 3.08Å; C148-V206 WeakPolarHBondContact O-CA 3.43Å; C148-G207 PolarHBondContact O-N 2.8Å; C148-D208 HydrophobicContact CB-CB 4.05Å; C148-D208 WeakPolarHBondContact CB-O 3.43Å; C148-D208 PolarHBondContact N-O 2.83Å
149P97.1Very high98.1Very high63 Ų6332.3 Ų32.341%0.40919%0.186SC..SBendtrans-89.4-13-179.636.7-36000112.7I110 A138 T147I110-P149 HydrophobicContact CD1-CG 3.51Å; I110-P149 HydrophobicContact CG1-CG 4.16Å; A138-P149 HydrophobicContact CB-CG 4.13Å; T147-P149 VanDerWaalsContact O-CD 3.23Å; T147-P149 WeakPolarHBondContact O-CD 2.96Å
150M96.4Very high98Very high64 Ų6432.1 Ų32.132%0.31519%0.185SC..SBendtrans-156.8136.7-172.2-178176.8-73.300110.4P108 I110 C148 Y154 P237P108-M150 HydrophobicContact CB-CE 4Å; P108-M150 HydrophobicContact CB-SD 3.6Å; P108-M150 VanDerWaalsContact CB-SD 3.6Å; P108-M150 HydrophobicContact CG-CE 4.41Å; P108-M150 HydrophobicContact CG-SD 3.57Å; P108-M150 VanDerWaalsContact CG-SD 3.57Å; I110-M150 HydrophobicContact CD1-CB 4.34Å; C148-M150 PolarHBondContact SG-O 2.85Å; M150-Y154 WeakPolarHBondContact O-CE2 3.25Å; M150-Y154 PolarHBondContact O-OH 3.15Å; M150-P237 HydrophobicContact SD-CB 3.94Å
151P97.9Very high97.8Very high43 Ų4328.1 Ų28.128%0.27917%0.167SC..  trans-66.6143.3-179.831-33.7000111.1L204 D238P151-L204 VanDerWaalsContact CA-O 3.23Å; P151-L204 WeakPolarHBondContact CA-O 3.06Å; P151-D238 HydrophobicContact CB-CB 4.48Å; P151-D238 PolarHBondContact O-N 2.87Å
152G97.8Very high97.4Very high0 Ų026.8 Ų26.80%016%0.156CC..EExtended strand (participates in β ladder)trans163.4-175.1-176.800000113.9Y154 H203 L204 Y236 D238G152-Y154 WeakPolarHBondContact O-CD2 3.47Å; G152-H203 WeakPolarHBondContact O-CA 3.31Å; G152-L204 PolarHBondContact N-O 3.01Å; G152-L204 VanDerWaalsContact N-O 3.15Å; G152-L204 PolarHBondContact O-N 3.37Å; G152-Y236 WeakPolarHBondContact CA-O 3.48Å; G152-D238 WeakPolarHBondContact CA-OD1 3.38Å
153V98.6Very high96.9Very high18 Ų1828.1 Ų28.111%0.10915%0.147CC..EExtended strand (participates in β ladder)trans-100.4127.1176.6-179.40000110.1I201 L202 I235 Y236V153-I201 HydrophobicContact CG1-CG2 3.34Å; V153-L202 WeakPolarHBondContact CA-O 3.35Å; V153-I235 HydrophobicContact CG1-CD1 4.06Å; V153-I235 WeakPolarHBondContact O-CB 3.47Å; V153-I235 PolarHBondContact O-N 3.36Å; V153-Y236 HydrophobicContact CB-CD2 4.08Å; V153-Y236 HydrophobicContact CB-CE1 4.21Å; V153-Y236 HydrophobicContact CB-CE2 3.59Å; V153-Y236 HydrophobicContact CG1-CE1 4.44Å; V153-Y236 HydrophobicContact CG1-CE2 4.48Å; V153-Y236 HydrophobicContact CG2-CD2 4.09Å; V153-Y236 HydrophobicContact CG2-CE2 3.29Å; V153-Y236 PolarHBondContact N-O 3.01Å; V153-Y236 PolarHBondContact O-N 3Å
154Y98.8Very high95.7Very high0 Ų026.5 Ų26.50%014%0.136CC..EExtended strand (participates in β ladder)trans-122.4145.4-174.5-68.4-99.9000111.1I110 F146 M150 G152 F156 I201 L202 L204 F233 I234I110-Y154 HydrophobicContact CB-CE1 4.46Å; I110-Y154 HydrophobicContact CD1-CE1 4.25Å; I110-Y154 WeakPolarHBondContact CD1-OH 3.43Å; I110-Y154 HydrophobicContact CG2-CE1 4.2Å; F146-Y154 HydrophobicContact CE1-CD1 4.29Å; F146-Y154 HydrophobicContact CE1-CE1 4.21Å; F146-Y154 AromaticContact CZ-CD1 3.92Å; F146-Y154 HydrophobicContact CZ-CD1 3.92Å; F146-Y154 AromaticContact CZ-CE1 3.65Å; F146-Y154 HydrophobicContact CZ-CE1 3.65Å; M150-Y154 WeakPolarHBondContact O-CE2 3.25Å; M150-Y154 PolarHBondContact O-OH 3.15Å; G152-Y154 WeakPolarHBondContact O-CD2 3.47Å; Y154-F156 VanDerWaalsContact CB-CE2 3.45Å; Y154-F156 HydrophobicContact CD1-CZ 4.5Å; Y154-F156 HydrophobicContact CG-CE2 4.39Å; Y154-F156 HydrophobicContact CG-CZ 4.38Å; Y154-I201 CarbonylContact O-C 3.2Å; Y154-I201 VanDerWaalsContact O-CA 3.29Å; Y154-I201 WeakPolarHBondContact O-CA 3.38Å; Y154-L202 PolarHBondContact N-O 3.42Å; Y154-L202 PolarHBondContact O-N 3.09Å; Y154-L204 HydrophobicContact CD2-CB 3.94Å; Y154-L204 HydrophobicContact CD2-CD1 3.71Å; Y154-L204 HydrophobicContact CD2-CG 3.88Å; Y154-L204 HydrophobicContact CE2-CB 4.07Å; Y154-L204 HydrophobicContact CE2-CD1 4.23Å; Y154-L204 HydrophobicContact CE2-CG 4.46Å; Y154-L204 HydrophobicContact CG-CD1 3.89Å; Y154-L204 HydrophobicContact CG-CG 4.43Å; Y154-F233 WeakPolarHBondContact CA-O 3.45Å; Y154-I234 HydrophobicContact CD1-CB 3.87Å; Y154-I234 HydrophobicContact CD1-CG1 4.32Å; Y154-I234 HydrophobicContact CE1-CB 3.55Å; Y154-I234 HydrophobicContact CE1-CD1 4.28Å; Y154-I234 HydrophobicContact CE1-CG1 3.93Å; Y154-I234 HydrophobicContact CE2-CD1 4.43Å; Y154-I234 HydrophobicContact CE2-CG1 4.33Å
155F98.9Very high94.2Very high54 Ų5427.6 Ų27.624%0.23715%0.148CC..EExtended strand (participates in β ladder)trans-100.5140.5167.6174-95.5000109.9A157 I201 G232 F233 I235F155-A157 HydrophobicContact CE1-CB 3.64Å; F155-A157 HydrophobicContact CZ-CB 3.71Å; F155-I201 HydrophobicContact CD2-CG1 4.11Å; F155-G232 CarbonylContact O-C 3.5Å; F155-G232 WeakPolarHBondContact O-CA 3.19Å; F155-F233 HydrophobicContact CB-CD2 4.46Å; F155-F233 HydrophobicContact CB-CE1 4.1Å; F155-F233 HydrophobicContact CB-CE2 4.02Å; F155-F233 HydrophobicContact CB-CZ 3.82Å; F155-F233 HydrophobicContact CD1-CD1 4.01Å; F155-F233 AromaticContact CD1-CE1 3.32Å; F155-F233 HydrophobicContact CD1-CE1 3.32Å; F155-F233 AromaticContact CD1-CZ 3.71Å; F155-F233 HydrophobicContact CD1-CZ 3.71Å; F155-F233 HydrophobicContact CE1-CE1 4.04Å; F155-F233 HydrophobicContact CG-CE1 4.01Å; F155-F233 AromaticContact CG-CZ 3.94Å; F155-F233 HydrophobicContact CG-CZ 3.94Å; F155-F233 PolarHBondContact N-O 3.47Å; F155-F233 PolarHBondContact O-N 3.15Å; F155-I235 HydrophobicContact CB-CD1 4.13Å; F155-I235 HydrophobicContact CB-CG1 4.19Å
156F98.9Very high92.6Very high0 Ų032 Ų320%017%0.174CC..EExtended strand (participates in β ladder)trans-133.9143170.2-60.8-87000110.7F112 F146 Y154 L174 S199 V200 L204 V210 F230 S231F112-F156 HydrophobicContact CE1-CD1 4.01Å; F112-F156 AromaticContact CE1-CE1 3.83Å; F112-F156 HydrophobicContact CE1-CE1 3.83Å; F112-F156 HydrophobicContact CZ-CD1 4.15Å; F112-F156 HydrophobicContact CZ-CE1 4.28Å; F146-F156 HydrophobicContact CB-CE1 4.27Å; F146-F156 AromaticContact CD1-CE1 3.87Å; F146-F156 HydrophobicContact CD1-CE1 3.87Å; F146-F156 AromaticContact CD1-CZ 3.78Å; F146-F156 HydrophobicContact CD1-CZ 3.78Å; F146-F156 HydrophobicContact CD2-CE1 4.41Å; F146-F156 HydrophobicContact CE1-CE1 4.3Å; F146-F156 AromaticContact CE1-CZ 3.91Å; F146-F156 HydrophobicContact CE1-CZ 3.91Å; F146-F156 AromaticContact CG-CE1 3.93Å; F146-F156 HydrophobicContact CG-CE1 3.93Å; F146-F156 HydrophobicContact CG-CZ 4.32Å; Y154-F156 VanDerWaalsContact CB-CE2 3.45Å; Y154-F156 HydrophobicContact CD1-CZ 4.5Å; Y154-F156 HydrophobicContact CG-CE2 4.39Å; Y154-F156 HydrophobicContact CG-CZ 4.38Å; F156-L174 HydrophobicContact CB-CD1 3.65Å; F156-L174 HydrophobicContact CG-CD1 4.33Å; F156-S199 CarbonylContact O-C 3.51Å; F156-S199 WeakPolarHBondContact O-CA 3.35Å; F156-S199 WeakPolarHBondContact O-CB 2.82Å; F156-V200 HydrophobicContact CB-CG1 4.18Å; F156-V200 HydrophobicContact CD2-CG1 4.44Å; F156-V200 PolarHBondContact N-O 3.28Å; F156-V200 PolarHBondContact O-N 2.92Å; F156-L204 HydrophobicContact CE2-CD1 3.83Å; F156-L204 HydrophobicContact CZ-CD1 3.71Å; F156-V210 HydrophobicContact CD1-CG1 4.07Å; F156-V210 HydrophobicContact CD2-CG1 4.25Å; F156-V210 HydrophobicContact CE1-CB 4.12Å; F156-V210 HydrophobicContact CE1-CG1 4.02Å; F156-V210 HydrophobicContact CE1-CG2 4.49Å; F156-V210 HydrophobicContact CE2-CB 4.47Å; F156-V210 HydrophobicContact CE2-CG1 4.22Å; F156-V210 HydrophobicContact CE2-CG2 4.09Å; F156-V210 HydrophobicContact CG-CG1 4.19Å; F156-V210 HydrophobicContact CZ-CB 4.04Å; F156-V210 HydrophobicContact CZ-CG1 4.12Å; F156-V210 HydrophobicContact CZ-CG2 3.91Å; F156-F230 HydrophobicContact CB-CE2 4.19Å; F156-F230 HydrophobicContact CD1-CE2 4.03Å; F156-F230 AromaticContact CD1-CZ 3.95Å; F156-F230 HydrophobicContact CD1-CZ 3.95Å; F156-S231 WeakPolarHBondContact CA-O 3.49Å
157A98.9Very high90.8Very high9 Ų933.6 Ų33.67%0.07419%0.19CC..EExtended strand (participates in β ladder)trans-139.9140.417100000110.4F155 F230 S231F155-A157 HydrophobicContact CE1-CB 3.64Å; F155-A157 HydrophobicContact CZ-CB 3.71Å; A157-F230 WeakPolarHBondContact O-CD2 3.4Å; A157-S231 PolarHBondContact N-O 3.15Å; A157-S231 PolarHBondContact O-N 3.42Å; A157-S231 PolarHBondContact O-OG 3.29Å
158Y98.8Very high89.6Confident0 Ų034.7 Ų34.70%020%0.197CC..EExtended strand (participates in β ladder)trans-133.2147174.564.1-87.5000110.7V160 A172 L174 A184 S197 N198 I212 T229Y158-V160 HydrophobicContact CD2-CG2 4.02Å; Y158-A172 HydrophobicContact CD2-CB 4.33Å; Y158-A172 HydrophobicContact CE2-CB 3.86Å; Y158-A172 PolarHBondContact OH-O 2.66Å; Y158-L174 HydrophobicContact CD1-CB 4.14Å; Y158-L174 HydrophobicContact CD1-CD1 4.06Å; Y158-L174 HydrophobicContact CE1-CB 3.66Å; Y158-L174 HydrophobicContact CE1-CD1 4.23Å; Y158-A184 HydrophobicContact CE2-CB 4.15Å; Y158-A184 PolarHBondContact OH-N 2.92Å; Y158-S197 VanDerWaalsContact O-CA 3.31Å; Y158-S197 WeakPolarHBondContact O-CA 3.4Å; Y158-N198 WeakPolarHBondContact CD1-O 3.48Å; Y158-N198 HydrophobicContact CE1-CB 3.66Å; Y158-N198 HydrophobicContact CE2-CB 4.22Å; Y158-N198 VanDerWaalsContact CZ-CB 3.44Å; Y158-N198 PolarHBondContact N-O 3.41Å; Y158-N198 PolarHBondContact O-N 2.56Å; Y158-N198 WeakPolarHBondContact OH-CB 3.31Å; Y158-I212 HydrophobicContact CD1-CD1 3.52Å; Y158-I212 HydrophobicContact CD2-CD1 4.31Å; Y158-I212 HydrophobicContact CE1-CD1 4.12Å; Y158-I212 HydrophobicContact CG-CD1 3.61Å; Y158-I212 HydrophobicContact CG-CG1 4.3Å; Y158-T229 WeakPolarHBondContact CA-O 3.45Å
159H98.4Very high88.6Confident85 Ų8536 Ų3639%0.39421%0.206SC..EExtended strand (participates in β ladder)trans-135.6114.8174.1-59.2-76.6000106.6Y195 S197 S228 T229H159-Y195 HydrophobicContact CB-CD1 4.1Å; H159-Y195 HydrophobicContact CB-CE1 3.91Å; H159-S197 VanDerWaalsContact ND1-CB 3.32Å; H159-S197 WeakPolarHBondContact ND1-CB 3.42Å; H159-S197 PolarHBondContact ND1-OG 2.97Å; H159-S228 CarbonylContact O-C 3.52Å; H159-S228 VanDerWaalsContact O-CA 3.22Å; H159-S228 WeakPolarHBondContact O-CA 3.49Å; H159-T229 PolarHBondContact N-O 3.28Å; H159-T229 PolarHBondContact O-N 3.47Å
160V96.4Very high88.1Confident0 Ų033.1 Ų33.10%019%0.187CC..EExtended strand (participates in β ladder)trans-118.8113.1-174.5-1780000108.1L126 F128 Y158 M162 A172 Y195 A196 I212 L214 V219L126-V160 HydrophobicContact CD2-CG1 4.03Å; L126-V160 HydrophobicContact CD2-CG2 4.06Å; F128-V160 HydrophobicContact CZ-CG2 4.24Å; Y158-V160 HydrophobicContact CD2-CG2 4.02Å; V160-M162 HydrophobicContact CB-CG 4.29Å; V160-M162 HydrophobicContact CG1-CE 4.44Å; V160-M162 HydrophobicContact CG1-CG 3.64Å; V160-M162 HydrophobicContact CG1-SD 4.3Å; V160-M162 PolarHBondContact O-N 2.92Å; V160-A172 HydrophobicContact CB-CB 4.19Å; V160-A172 HydrophobicContact CG2-CB 4.03Å; V160-Y195 WeakPolarHBondContact O-CA 3.29Å; V160-Y195 WeakPolarHBondContact O-CD1 3.4Å; V160-A196 PolarHBondContact N-O 2.97Å; V160-A196 PolarHBondContact O-N 2.8Å; V160-I212 HydrophobicContact CG2-CG2 4.46Å; V160-L214 HydrophobicContact CG1-CD2 4.45Å; V160-V219 HydrophobicContact CG1-CB 4.17Å; V160-V219 HydrophobicContact CG1-CG1 3.39Å; V160-V219 HydrophobicContact CG1-CG2 3.6Å
161L94.3Very high87.9Confident21 Ų2134.1 Ų34.111%0.1119%0.187CC..EExtended strand (participates in β ladder)trans-77.8108.3172177.266.9000108.3Y193 Y195 V219 H220 Y227 S228L161-Y193 HydrophobicContact CD1-CD1 4Å; L161-Y193 HydrophobicContact CD1-CG 4.42Å; L161-Y193 HydrophobicContact CD2-CD1 4.2Å; L161-Y193 HydrophobicContact CG-CD1 4Å; L161-Y195 HydrophobicContact CB-CE1 4.03Å; L161-Y195 HydrophobicContact CB-CE2 4.25Å; L161-Y195 HydrophobicContact CD1-CD2 4.05Å; L161-Y195 HydrophobicContact CD1-CE2 3.74Å; L161-V219 WeakPolarHBondContact O-CA 3.34Å; L161-H220 HydrophobicContact CD2-CB 4.06Å; L161-H220 HydrophobicContact CG-CB 4.4Å; L161-H220 PolarHBondContact O-N 2.97Å; L161-Y227 HydrophobicContact CD2-CD1 3.8Å; L161-Y227 HydrophobicContact CD2-CG 4.02Å; L161-S228 PolarHBondContact N-OG 2.87Å
162M89.9Confident87.7Confident0 Ų032.1 Ų32.10%017%0.174CC..EExtended strand (participates in β ladder)trans-107.9149.7-177.5-50.6-171.591.900110.1V160 M170 A172 A186 Y193 D194 A196 L214 K218 V219V160-M162 HydrophobicContact CB-CG 4.29Å; V160-M162 HydrophobicContact CG1-CE 4.44Å; V160-M162 HydrophobicContact CG1-CG 3.64Å; V160-M162 HydrophobicContact CG1-SD 4.3Å; V160-M162 PolarHBondContact O-N 2.92Å; M162-M170 HydrophobicContact CB-CE 3.2Å; M162-M170 HydrophobicContact CB-SD 3.92Å; M162-M170 HydrophobicContact CE-CB 3.73Å; M162-M170 HydrophobicContact CE-SD 4.45Å; M162-M170 HydrophobicContact CG-CE 4.25Å; M162-M170 HydrophobicContact SD-CB 3.94Å; M162-M170 HydrophobicContact SD-CE 4.21Å; M162-A172 HydrophobicContact SD-CB 4.48Å; M162-A186 HydrophobicContact CB-CB 4.47Å; M162-A186 HydrophobicContact SD-CB 4.17Å; M162-Y193 WeakPolarHBondContact O-CA 3.29Å; M162-D194 PolarHBondContact N-O 3.05Å; M162-D194 PolarHBondContact O-N 2.95Å; M162-A196 HydrophobicContact CG-CB 4.31Å; M162-A196 HydrophobicContact SD-CB 3.5Å; M162-A196 VanDerWaalsContact SD-CB 3.5Å; M162-L214 HydrophobicContact CE-CD2 3.78Å; M162-K218 CarbonylContact C-O 3.47Å; M162-K218 WeakPolarHBondContact CA-O 3.09Å; M162-V219 HydrophobicContact CE-CG2 3.98Å; M162-V219 HydrophobicContact CG-CG2 4.3Å
163R85Confident87.7Confident93 Ų9333.1 Ų33.135%0.35118%0.18SC..EExtended strand (participates in β ladder)trans-116.1115.1168.7-177.7177.8173.6149.9-0.7108.2M170 Q191 Y193 K218R163-M170 VanDerWaalsContact C-SD 3.53Å; R163-Q191 PolarHBondContact NE-O 2.99Å; R163-Y193 HydrophobicContact CB-CD1 3.99Å; R163-Y193 HydrophobicContact CB-CE1 3.76Å; R163-Y193 HydrophobicContact CG-CE1 4.24Å; R163-Y193 PolarHBondContact NH1-OH 3.31Å; R163-K218 PolarHBondContact N-O 3.02Å; R163-K218 PolarHBondContact O-N 2.9Å
164G70.4Confident87.7Confident3 Ų332.3 Ų32.33%0.03118%0.175CC..  trans-65.7152.6177.200000112.2M170 Q191 N192G164-M170 WeakPolarHBondContact CA-SD 3.34Å; G164-Q191 PolarHBondContact O-OE1 2.78Å; G164-Q191 VanDerWaalsContact O-OE1 3.06Å; G164-N192 PolarHBondContact N-O 3.29Å
165G66.9Low87.7Confident23 Ų2332.9 Ų32.924%0.23718%0.178CC..  trans-114.5131.5165.700000110.8G167 T168 Q191G165-G167 VanDerWaalsContact C-N 3.31Å; G165-G167 PolarHBondContact O-N 2.89Å; G165-T168 WeakPolarHBondContact O-CB 3.35Å; G165-T168 PolarHBondContact O-N 2.91Å; G165-T168 PolarHBondContact O-OG1 2.84Å; G165-Q191 VanDerWaalsContact CA-NE2 3.31Å
166D64.5Low87.7Confident138 Ų13832.1 Ų32.174%0.73817%0.174SC*.THydrogen-bonded Turntrans35.251.1167.1-55.9-13.5000115.9T168 Q191D166-T168 VanDerWaalsContact C-N 3.26Å; D166-T168 PolarHBondContact O-N 2.9Å; D166-Q191 VanDerWaalsContact N-NE2 3.19Å; D166-Q191 PolarHBondContact OD1-NE2 3.22Å
167G62.5Low87.6Confident34 Ų3436.2 Ų36.235%0.35120%0.196SC..THydrogen-bonded Turntrans71.511.2177.300000116G165G165-G167 VanDerWaalsContact C-N 3.31Å; G165-G167 PolarHBondContact O-N 2.89Å
168T72.7Confident87.4Confident80 Ų8038.2 Ų38.249%0.49122%0.218SC..  trans-81.3127.9175.559.30000111.2G165 D166G165-T168 WeakPolarHBondContact O-CB 3.35Å; G165-T168 PolarHBondContact O-N 2.91Å; G165-T168 PolarHBondContact O-OG1 2.84Å; D166-T168 VanDerWaalsContact C-N 3.26Å; D166-T168 PolarHBondContact O-N 2.9Å
169S77.8Confident87.4Confident29 Ų2944.2 Ų44.220%0.20325%0.246CC..  trans-62.8143169.5-58.50000110.3W171 Q187S169-W171 VanDerWaalsContact O-CZ3 3.24Å; S169-W171 WeakPolarHBondContact O-CZ3 3.38Å; S169-Q187 PolarHBondContact OG-OE1 2.96Å
170M86.6Confident87.4Confident2 Ų243.6 Ų43.61%0.0125%0.247CC..EExtended strand (participates in β ladder)trans-125.2143.2174.2-49.1169.8-64.500109.1M162 R163 G164 I185 A186 G217M162-M170 HydrophobicContact CB-CE 3.2Å; M162-M170 HydrophobicContact CB-SD 3.92Å; M162-M170 HydrophobicContact CE-CB 3.73Å; M162-M170 HydrophobicContact CE-SD 4.45Å; M162-M170 HydrophobicContact CG-CE 4.25Å; M162-M170 HydrophobicContact SD-CB 3.94Å; M162-M170 HydrophobicContact SD-CE 4.21Å; R163-M170 VanDerWaalsContact C-SD 3.53Å; G164-M170 WeakPolarHBondContact CA-SD 3.34Å; M170-I185 WeakPolarHBondContact O-CA 3.36Å; M170-A186 HydrophobicContact CE-CB 3.98Å; M170-A186 PolarHBondContact N-O 3.32Å; M170-A186 PolarHBondContact O-N 2.85Å; M170-G217 WeakPolarHBondContact SD-CA 3.22Å
171W91.2Very high87.5Confident85 Ų8549.6 Ų49.632%0.32227%0.27SS..EExtended strand (participates in β ladder)trans-120.5144.4176.4-55.6-103000111.8S169 A184 I185 L214 D215S169-W171 VanDerWaalsContact O-CZ3 3.24Å; S169-W171 WeakPolarHBondContact O-CZ3 3.38Å; W171-A184 WeakPolarHBondContact CA-O 3.49Å; W171-I185 HydrophobicContact CG-CG1 4.5Å; W171-I185 HydrophobicContact CZ2-CD1 3.89Å; W171-I185 HydrophobicContact CZ2-CG1 4.46Å; W171-L214 WeakPolarHBondContact O-CA 3.39Å; W171-D215 HydrophobicContact CB-CB 3.97Å; W171-D215 HydrophobicContact CE3-CB 3.95Å; W171-D215 PolarHBondContact N-O 3.27Å; W171-D215 PolarHBondContact O-N 3.27Å
172A95.5Very high87.7Confident0 Ų049.1 Ų49.10%027%0.269CS..EExtended strand (participates in β ladder)trans-114.4113.2163.700000107.6Y158 V160 M162 A184 A196 I212 L214Y158-A172 HydrophobicContact CD2-CB 4.33Å; Y158-A172 HydrophobicContact CE2-CB 3.86Å; Y158-A172 PolarHBondContact OH-O 2.66Å; V160-A172 HydrophobicContact CB-CB 4.19Å; V160-A172 HydrophobicContact CG2-CB 4.03Å; M162-A172 HydrophobicContact SD-CB 4.48Å; A172-A184 PolarHBondContact N-O 3.3Å; A172-A184 PolarHBondContact O-N 3.12Å; A172-A184 VanDerWaalsContact O-N 3.07Å; A172-A196 HydrophobicContact CB-CB 3.72Å; A172-I212 HydrophobicContact CB-CG2 4.21Å; A172-L214 HydrophobicContact CB-CD2 4.41Å
173D97.6Very high88Confident22 Ų2251.5 Ų51.512%0.11829%0.286CS..EExtended strand (participates in β ladder)trans-107.8127.4-176.4-71.4-19.9000110.5M175 V180 S183 I212 K213D173-M175 HydrophobicContact CB-SD 3.82Å; D173-V180 HydrophobicContact CB-CG1 4.2Å; D173-V180 HydrophobicContact CB-CG2 4.21Å; D173-S183 WeakPolarHBondContact OD1-CB 3.16Å; D173-S183 PolarHBondContact OD1-OG 3.29Å; D173-I212 CarbonylContact O-C 3.54Å; D173-I212 VanDerWaalsContact O-CA 3.29Å; D173-I212 WeakPolarHBondContact O-CA 3.43Å; D173-K213 PolarHBondContact N-O 3.37Å; D173-K213 PolarHBondContact O-N 3.02Å
174L98.7Very high88.6Confident0 Ų047.7 Ų47.70%027%0.274CS..EExtended strand (participates in β ladder)trans-82.4117.5165.7-175.3153.2000109.3F156 Y158 R181 A182 V200 L202 V210 I212 F230F156-L174 HydrophobicContact CB-CD1 3.65Å; F156-L174 HydrophobicContact CG-CD1 4.33Å; Y158-L174 HydrophobicContact CD1-CB 4.14Å; Y158-L174 HydrophobicContact CD1-CD1 4.06Å; Y158-L174 HydrophobicContact CE1-CB 3.66Å; Y158-L174 HydrophobicContact CE1-CD1 4.23Å; L174-R181 HydrophobicContact CD2-CB 4.01Å; L174-R181 PolarHBondContact O-N 2.64Å; L174-A182 HydrophobicContact CB-CB 4.37Å; L174-A182 PolarHBondContact N-O 2.86Å; L174-V200 HydrophobicContact CD1-CG1 3.71Å; L174-V200 HydrophobicContact CD2-CG1 3.81Å; L174-V200 HydrophobicContact CG-CG1 4.38Å; L174-L202 HydrophobicContact CD2-CD1 3.95Å; L174-V210 HydrophobicContact CD1-CG1 4.19Å; L174-V210 HydrophobicContact CD2-CG1 3.74Å; L174-V210 HydrophobicContact CG-CG1 3.93Å; L174-I212 HydrophobicContact CB-CD1 3.83Å; L174-I212 HydrophobicContact CD1-CD1 4.19Å; L174-I212 HydrophobicContact CG-CD1 4.1Å; L174-F230 HydrophobicContact CD1-CE2 4.19Å
175M98.6Very high89.6Confident13 Ų1351.7 Ų51.76%0.06429%0.294CS..EExtended strand (participates in β ladder)trans-100.4139.5-176.6-53.3-59.2-74.300110.2D173 G178 Q179 V180 V210 F211 K213D173-M175 HydrophobicContact CB-SD 3.82Å; M175-G178 VanDerWaalsContact CE-C 3.48Å; M175-G178 WeakPolarHBondContact CE-O 3.34Å; M175-Q179 CarbonylContact C-O 3.56Å; M175-Q179 VanDerWaalsContact CA-O 3.31Å; M175-Q179 WeakPolarHBondContact CA-O 3.33Å; M175-V180 HydrophobicContact CE-CG2 4.06Å; M175-V180 HydrophobicContact SD-CB 4.33Å; M175-V180 HydrophobicContact SD-CG2 3.62Å; M175-V210 VanDerWaalsContact O-CA 3.25Å; M175-V210 WeakPolarHBondContact O-CA 3.4Å; M175-F211 HydrophobicContact CB-CD1 4.17Å; M175-F211 HydrophobicContact CB-CD2 3.88Å; M175-F211 HydrophobicContact CB-CE1 3.86Å; M175-F211 HydrophobicContact CB-CE2 3.55Å; M175-F211 HydrophobicContact CB-CG 4.18Å; M175-F211 HydrophobicContact CB-CZ 3.54Å; M175-F211 HydrophobicContact CG-CD2 3.92Å; M175-F211 HydrophobicContact CG-CE2 3.51Å; M175-F211 HydrophobicContact CG-CZ 3.94Å; M175-F211 PolarHBondContact N-O 3.11Å; M175-F211 PolarHBondContact O-N 2.99Å; M175-F211 VanDerWaalsContact O-N 3.16Å; M175-K213 HydrophobicContact CG-CB 3.69Å; M175-K213 HydrophobicContact SD-CB 4.25Å
176K98.6Very high90.5Very high38 Ų3850.6 Ų50.617%0.16528%0.283CS..EExtended strand (participates in β ladder)trans-118.1115.6161.1178.2-175.9177.7172.30107.8G178 Q179 R181 H203 L204 D208 E209K176-G178 PolarHBondContact O-N 3.41Å; K176-G178 VanDerWaalsContact O-N 3.08Å; K176-Q179 PolarHBondContact N-O 2.81Å; K176-Q179 PolarHBondContact O-N 2.81Å; K176-R181 HydrophobicContact CB-CG 3.49Å; K176-R181 VanDerWaalsContact CB-CG 3.49Å; K176-H203 PolarHBondContact NZ-O 2.84Å; K176-L204 HydrophobicContact CD-CD2 3.81Å; K176-L204 HydrophobicContact CG-CD2 4.23Å; K176-D208 VanDerWaalsContact CE-CG 3.45Å; K176-D208 WeakPolarHBondContact CE-OD2 3.19Å; K176-D208 IonicContact NZ-OD2 2.8Å; K176-D208 PolarHBondContact NZ-OD2 2.84Å; K176-E209 WeakPolarHBondContact CA-O 3.45Å
177N97.1Very high91.3Very high86 Ų8649.5 Ų49.546%0.4627%0.273SS..THydrogen-bonded Turntrans47.438.5179.4-59.7-19.7000114.4D208 E209N177-D208 PolarHBondContact ND2-OD1 2.92Å; N177-D208 WeakPolarHBondContact OD1-CA 3.21Å; N177-E209 PolarHBondContact N-O 2.84Å; N177-E209 PolarHBondContact OD1-N 2.79Å
178G94.1Very high91.8Very high51 Ų5150.2 Ų50.253%0.52627%0.269SS..THydrogen-bonded Turntrans85.6-0.4-178.600000115.9M175 K176M175-G178 VanDerWaalsContact CE-C 3.48Å; M175-G178 WeakPolarHBondContact CE-O 3.34Å; K176-G178 PolarHBondContact O-N 3.41Å; K176-G178 VanDerWaalsContact O-N 3.08Å
179Q97.9Very high91.4Very high126 Ų12650 Ų5059%0.58928%0.275SS*.EExtended strand (participates in β ladder)trans-101.1134.6171.6-63.8-173.2-16.200111.7M175 K176 R181M175-Q179 CarbonylContact C-O 3.56Å; M175-Q179 VanDerWaalsContact CA-O 3.31Å; M175-Q179 WeakPolarHBondContact CA-O 3.33Å; K176-Q179 PolarHBondContact N-O 2.81Å; K176-Q179 PolarHBondContact O-N 2.81Å; Q179-R181 PolarHBondContact O-N 2.97Å
180V98.2Very high90.9Very high71 Ų7154.2 Ų54.243%0.4330%0.296SS..EExtended strand (participates in β ladder)trans-67.7126.2172.3-177.70000109.3D173 M175D173-V180 HydrophobicContact CB-CG1 4.2Å; D173-V180 HydrophobicContact CB-CG2 4.21Å; M175-V180 HydrophobicContact CE-CG2 4.06Å; M175-V180 HydrophobicContact SD-CB 4.33Å; M175-V180 HydrophobicContact SD-CG2 3.62Å
181R98.6Very high90.2Very high126 Ų12658.2 Ų58.248%0.47531%0.314SS..EExtended strand (participates in β ladder)trans-111.7-27.2176.8-56.4-50.5-57.71751.3113L174 K176 Q179 L202L174-R181 HydrophobicContact CD2-CB 4.01Å; L174-R181 PolarHBondContact O-N 2.64Å; K176-R181 HydrophobicContact CB-CG 3.49Å; K176-R181 VanDerWaalsContact CB-CG 3.49Å; Q179-R181 PolarHBondContact O-N 2.97Å; R181-L202 HydrophobicContact CB-CD1 4.12Å; R181-L202 HydrophobicContact CB-CD2 4.12Å; R181-L202 HydrophobicContact CG-CD1 4.09Å; R181-L202 HydrophobicContact CG-CD2 4.23Å
182A98.5Very high89.7Confident12 Ų1258.4 Ų58.410%0.09932%0.321CS..EExtended strand (participates in β ladder)trans-150.2143.6170.200000108.6L174 N198 V200L174-A182 HydrophobicContact CB-CB 4.37Å; L174-A182 PolarHBondContact N-O 2.86Å; A182-N198 HydrophobicContact CB-CB 4.36Å; A182-V200 HydrophobicContact CB-CB 4.18Å
183S97.7Very high89.3Confident50 Ų5063.2 Ų63.235%0.3534%0.34SS..EExtended strand (participates in β ladder)trans-132.1147.7-179.4-176.80000109.3D173 N198D173-S183 WeakPolarHBondContact OD1-CB 3.16Å; D173-S183 PolarHBondContact OD1-OG 3.29Å; S183-N198 PolarHBondContact O-ND2 3.07Å
184A96.2Very high89Confident12 Ų1265.4 Ų65.410%0.09935%0.352CS..EExtended strand (participates in β ladder)trans-133.8136.8168.200000109.1Y158 W171 A172 A196 S197 N198Y158-A184 HydrophobicContact CE2-CB 4.15Å; Y158-A184 PolarHBondContact OH-N 2.92Å; W171-A184 WeakPolarHBondContact CA-O 3.49Å; A172-A184 PolarHBondContact N-O 3.3Å; A172-A184 PolarHBondContact O-N 3.12Å; A172-A184 VanDerWaalsContact O-N 3.07Å; A184-A196 HydrophobicContact CB-CB 3.85Å; A184-S197 WeakPolarHBondContact CB-O 3.49Å; A184-N198 HydrophobicContact CB-CB 4.3Å
185I91.8Very high88.7Confident88 Ų8869.7 Ų69.745%0.45137%0.369SS..EExtended strand (participates in β ladder)trans-105137.4177.1-171.6175.7000109.1M170 W171M170-I185 WeakPolarHBondContact O-CA 3.36Å; W171-I185 HydrophobicContact CG-CG1 4.5Å; W171-I185 HydrophobicContact CZ2-CD1 3.89Å; W171-I185 HydrophobicContact CZ2-CG1 4.46Å
186A86.2Confident88.6Confident0 Ų069.1 Ų69.10%037%0.366CS..EExtended strand (participates in β ladder)trans-120.9127.116600000107.6M162 M170 D194 A196M162-A186 HydrophobicContact CB-CB 4.47Å; M162-A186 HydrophobicContact SD-CB 4.17Å; M170-A186 HydrophobicContact CE-CB 3.98Å; M170-A186 PolarHBondContact N-O 3.32Å; M170-A186 PolarHBondContact O-N 2.85Å; A186-D194 HydrophobicContact CB-CB 4.13Å; A186-A196 HydrophobicContact CB-CB 4.23Å
187Q82Confident88.5Confident115 Ų11569.4 Ų69.454%0.53737%0.373SS..  trans-142.8120.8179.4-176.2176.24.100109.3S169S169-Q187 PolarHBondContact OG-OE1 2.96Å
188D72.2Confident88.6Confident48 Ų4868.3 Ų68.326%0.25737%0.367SS..  trans-128.6146170.6-154.1-30.9000108.6D190 N192D188-D190 VanDerWaalsContact C-N 3.28Å; D188-N192 HydrophobicContact CB-CB 4.28Å; D188-N192 VanDerWaalsContact OD2-CB 3.24Å; D188-N192 WeakPolarHBondContact OD2-CB 3.29Å; D188-N192 PolarHBondContact OD2-ND2 2.92Å; D188-N192 VanDerWaalsContact OD2-ND2 3.11Å
189A64.1Low88.8Confident75 Ų7568.9 Ų68.962%0.6236%0.363SS*.SBendtrans-72.9-28.1-178.900000111.4
190D68.2Low88.9Confident119 Ų11964 Ų6464%0.63634%0.341SS*.SBendtrans-106.8166.7178.7-63.1-39.1000110.5D188 N192D188-D190 VanDerWaalsContact C-N 3.28Å; D190-N192 PolarHBondContact O-N 3.4Å
191Q70.9Confident88.9Confident86 Ų8665.8 Ų65.840%0.40235%0.347SS..SBendtrans-69.644.1-179.9-69.4-88.4-18.800113.2R163 G164 G165 D166R163-Q191 PolarHBondContact NE-O 2.99Å; G164-Q191 PolarHBondContact O-OE1 2.78Å; G164-Q191 VanDerWaalsContact O-OE1 3.06Å; G165-Q191 VanDerWaalsContact CA-NE2 3.31Å; D166-Q191 VanDerWaalsContact N-NE2 3.19Å; D166-Q191 PolarHBondContact OD1-NE2 3.22Å
192N80.4Confident88.9Confident88 Ų8860.5 Ų60.547%0.47133%0.329SS..  trans-97172.7-169.7-147.838.1000110.8G164 D188 D190G164-N192 PolarHBondContact N-O 3.29Å; D188-N192 HydrophobicContact CB-CB 4.28Å; D188-N192 VanDerWaalsContact OD2-CB 3.24Å; D188-N192 WeakPolarHBondContact OD2-CB 3.29Å; D188-N192 PolarHBondContact OD2-ND2 2.92Å; D188-N192 VanDerWaalsContact OD2-ND2 3.11Å; D190-N192 PolarHBondContact O-N 3.4Å
193Y88Confident88.9Confident102 Ų10263.8 Ų63.840%0.434%0.342SS..EExtended strand (participates in β ladder)trans-102.2131.6-176.5-73.7-85000111.3L161 M162 R163 H220L161-Y193 HydrophobicContact CD1-CD1 4Å; L161-Y193 HydrophobicContact CD1-CG 4.42Å; L161-Y193 HydrophobicContact CD2-CD1 4.2Å; L161-Y193 HydrophobicContact CG-CD1 4Å; M162-Y193 WeakPolarHBondContact O-CA 3.29Å; R163-Y193 HydrophobicContact CB-CD1 3.99Å; R163-Y193 HydrophobicContact CB-CE1 3.76Å; R163-Y193 HydrophobicContact CG-CE1 4.24Å; R163-Y193 PolarHBondContact NH1-OH 3.31Å; Y193-H220 HydrophobicContact CE1-CB 4.38Å; Y193-H220 AromaticContact CE1-CD2 3.53Å; Y193-H220 AromaticContact CE1-CG 3.86Å; Y193-H220 AromaticContact CE1-NE2 3.84Å
194D90.8Very high89Confident67 Ų6761.4 Ų61.436%0.35833%0.325SS..EExtended strand (participates in β ladder)trans-143.5163175.8-167.117.1000111.1M162 A186M162-D194 PolarHBondContact N-O 3.05Å; M162-D194 PolarHBondContact O-N 2.95Å; A186-D194 HydrophobicContact CB-CB 4.13Å
195Y93.5Very high89.1Confident91 Ų9164.9 Ų64.936%0.35734%0.342SS..EExtended strand (participates in β ladder)trans-105.1123.1-177.4-95.6-84.5000112.7H159 V160 L161 Y227H159-Y195 HydrophobicContact CB-CD1 4.1Å; H159-Y195 HydrophobicContact CB-CE1 3.91Å; V160-Y195 WeakPolarHBondContact O-CA 3.29Å; V160-Y195 WeakPolarHBondContact O-CD1 3.4Å; L161-Y195 HydrophobicContact CB-CE1 4.03Å; L161-Y195 HydrophobicContact CB-CE2 4.25Å; L161-Y195 HydrophobicContact CD1-CD2 4.05Å; L161-Y195 HydrophobicContact CD1-CE2 3.74Å; Y195-Y227 WeakPolarHBondContact CE1-O 3.24Å; Y195-Y227 WeakPolarHBondContact OH-CA 3.24Å; Y195-Y227 PolarHBondContact OH-O 2.94Å
196A94.8Very high89.4Confident0 Ų065.4 Ų65.40%035%0.349CS..EExtended strand (participates in β ladder)trans-92.7105.3160.400000108.7V160 M162 A172 A184 A186V160-A196 PolarHBondContact N-O 2.97Å; V160-A196 PolarHBondContact O-N 2.8Å; M162-A196 HydrophobicContact CG-CB 4.31Å; M162-A196 HydrophobicContact SD-CB 3.5Å; M162-A196 VanDerWaalsContact SD-CB 3.5Å; A172-A196 HydrophobicContact CB-CB 3.72Å; A184-A196 HydrophobicContact CB-CB 3.85Å; A186-A196 HydrophobicContact CB-CB 4.23Å
197S97.8Very high90Very high45 Ų4567.4 Ų67.432%0.31537%0.37SS..EExtended strand (participates in β ladder)trans-129.2135.9-178.2-590000111.9Y158 H159 A184Y158-S197 VanDerWaalsContact O-CA 3.31Å; Y158-S197 WeakPolarHBondContact O-CA 3.4Å; H159-S197 VanDerWaalsContact ND1-CB 3.32Å; H159-S197 WeakPolarHBondContact ND1-CB 3.42Å; H159-S197 PolarHBondContact ND1-OG 2.97Å; A184-S197 WeakPolarHBondContact CB-O 3.49Å
198N98.8Very high90.8Very high63 Ų6362.7 Ų62.734%0.33735%0.348SS..EExtended strand (participates in β ladder)trans-152.9171.7169.6-146.8-29.8000110.7Y158 A182 S183 A184Y158-N198 WeakPolarHBondContact CD1-O 3.48Å; Y158-N198 HydrophobicContact CE1-CB 3.66Å; Y158-N198 HydrophobicContact CE2-CB 4.22Å; Y158-N198 VanDerWaalsContact CZ-CB 3.44Å; Y158-N198 PolarHBondContact N-O 3.41Å; Y158-N198 PolarHBondContact O-N 2.56Å; Y158-N198 WeakPolarHBondContact OH-CB 3.31Å; A182-N198 HydrophobicContact CB-CB 4.36Å; S183-N198 PolarHBondContact O-ND2 3.07Å; A184-N198 HydrophobicContact CB-CB 4.3Å
199S98.8Very high92Very high62 Ų6263.5 Ų63.543%0.43435%0.35SS..EExtended strand (participates in β ladder)trans-141.8157174.3640000110.5F156F156-S199 CarbonylContact O-C 3.51Å; F156-S199 WeakPolarHBondContact O-CA 3.35Å; F156-S199 WeakPolarHBondContact O-CB 2.82Å
200V98.8Very high93.7Very high23 Ų2359.9 Ų59.914%0.13932%0.321CS..EExtended strand (participates in β ladder)trans-151.8148.6-17969.90000111F156 L174 A182 L202F156-V200 HydrophobicContact CB-CG1 4.18Å; F156-V200 HydrophobicContact CD2-CG1 4.44Å; F156-V200 PolarHBondContact N-O 3.28Å; F156-V200 PolarHBondContact O-N 2.92Å; L174-V200 HydrophobicContact CD1-CG1 3.71Å; L174-V200 HydrophobicContact CD2-CG1 3.81Å; L174-V200 HydrophobicContact CG-CG1 4.38Å; A182-V200 HydrophobicContact CB-CB 4.18Å; V200-L202 HydrophobicContact CB-CG 4.49Å; V200-L202 HydrophobicContact CG1-CD1 3.88Å; V200-L202 HydrophobicContact CG1-CG 3.9Å; V200-L202 HydrophobicContact CG2-CD1 4.46Å; V200-L202 HydrophobicContact CG2-CD2 3.72Å; V200-L202 HydrophobicContact CG2-CG 3.83Å
201I98.9Very high95.1Very high109 Ų10955 Ų5556%0.55929%0.294SS*.EExtended strand (participates in β ladder)trans-107.2124.6167-61.4173.7000107.4V153 Y154 F155 I235V153-I201 HydrophobicContact CG1-CG2 3.34Å; Y154-I201 CarbonylContact O-C 3.2Å; Y154-I201 VanDerWaalsContact O-CA 3.29Å; Y154-I201 WeakPolarHBondContact O-CA 3.38Å; F155-I201 HydrophobicContact CD2-CG1 4.11Å; I201-I235 HydrophobicContact CD1-CD1 4.28Å; I201-I235 HydrophobicContact CG1-CD1 4.27Å; I201-I235 HydrophobicContact CG2-CD1 3.97Å
202L98.8Very high96.4Very high16 Ų1651 Ų518%0.08428%0.275CS..EExtended strand (participates in β ladder)trans-130139.5-177.1-65.2174.9000110.6V153 Y154 L174 R181 V200 L204V153-L202 WeakPolarHBondContact CA-O 3.35Å; Y154-L202 PolarHBondContact N-O 3.42Å; Y154-L202 PolarHBondContact O-N 3.09Å; L174-L202 HydrophobicContact CD2-CD1 3.95Å; R181-L202 HydrophobicContact CB-CD1 4.12Å; R181-L202 HydrophobicContact CB-CD2 4.12Å; R181-L202 HydrophobicContact CG-CD1 4.09Å; R181-L202 HydrophobicContact CG-CD2 4.23Å; V200-L202 HydrophobicContact CB-CG 4.49Å; V200-L202 HydrophobicContact CG1-CD1 3.88Å; V200-L202 HydrophobicContact CG1-CG 3.9Å; V200-L202 HydrophobicContact CG2-CD1 4.46Å; V200-L202 HydrophobicContact CG2-CD2 3.72Å; V200-L202 HydrophobicContact CG2-CG 3.83Å; L202-L204 HydrophobicContact CB-CD2 4.08Å; L202-L204 HydrophobicContact CB-CG 4.44Å
203H98.7Very high97.2Very high80 Ų8050.6 Ų50.637%0.3727%0.269SS..EExtended strand (participates in β ladder)trans-78.5133.8157.4-178.8-82.7000109.1G152 K176 D205 D238G152-H203 WeakPolarHBondContact O-CA 3.31Å; K176-H203 PolarHBondContact NZ-O 2.84Å; H203-D205 IonicContact CE1-OD1 2.75Å; H203-D238 IonicContact CD2-OD1 3.51Å; H203-D238 IonicContact CD2-OD2 2.69Å; H203-D238 IonicContact CE1-OD2 3.63Å; H203-D238 IonicContact NE2-OD1 3.25Å; H203-D238 PolarHBondContact NE2-OD1 3.05Å; H203-D238 IonicContact NE2-OD2 2.91Å; H203-D238 PolarHBondContact NE2-OD2 3.41Å
204L98.8Very high97.4Very high0 Ų045.8 Ų45.80%025%0.25CS..EExtended strand (participates in β ladder)trans-127.9142.9-180-59-178.3000110.1F146 C148 P151 G152 Y154 F156 K176 L202 D208 V210F146-L204 HydrophobicContact CD1-CD1 4.35Å; F146-L204 HydrophobicContact CE1-CD1 3.88Å; C148-L204 HydrophobicContact CB-CB 4Å; C148-L204 HydrophobicContact CB-CD1 4.17Å; C148-L204 VanDerWaalsContact SG-CB 3.53Å; P151-L204 VanDerWaalsContact CA-O 3.23Å; P151-L204 WeakPolarHBondContact CA-O 3.06Å; G152-L204 PolarHBondContact N-O 3.01Å; G152-L204 VanDerWaalsContact N-O 3.15Å; G152-L204 PolarHBondContact O-N 3.37Å; Y154-L204 HydrophobicContact CD2-CB 3.94Å; Y154-L204 HydrophobicContact CD2-CD1 3.71Å; Y154-L204 HydrophobicContact CD2-CG 3.88Å; Y154-L204 HydrophobicContact CE2-CB 4.07Å; Y154-L204 HydrophobicContact CE2-CD1 4.23Å; Y154-L204 HydrophobicContact CE2-CG 4.46Å; Y154-L204 HydrophobicContact CG-CD1 3.89Å; Y154-L204 HydrophobicContact CG-CG 4.43Å; F156-L204 HydrophobicContact CE2-CD1 3.83Å; F156-L204 HydrophobicContact CZ-CD1 3.71Å; K176-L204 HydrophobicContact CD-CD2 3.81Å; K176-L204 HydrophobicContact CG-CD2 4.23Å; L202-L204 HydrophobicContact CB-CD2 4.08Å; L202-L204 HydrophobicContact CB-CG 4.44Å; L204-D208 WeakPolarHBondContact CA-OD2 3.32Å; L204-D208 HydrophobicContact CB-CB 4.25Å; L204-D208 HydrophobicContact CD2-CB 4.14Å; L204-V210 HydrophobicContact CD1-CG2 3.82Å; L204-V210 HydrophobicContact CD2-CG2 3.79Å
205D98.6Very high97.3Very high86 Ų8645.5 Ų45.546%0.4625%0.249SC..  trans-97.4161.1168.1-68-54000110.5C148 H203 G207 D208C148-D205 WeakPolarHBondContact CB-O 3.37Å; C148-D205 PolarHBondContact SG-O 3.08Å; H203-D205 IonicContact CE1-OD1 2.75Å; D205-G207 PolarHBondContact O-N 3.06Å; D205-D208 PolarHBondContact N-OD2 2.7Å; D205-D208 VanDerWaalsContact O-CB 3.29Å; D205-D208 WeakPolarHBondContact O-CB 3.45Å; D205-D208 PolarHBondContact O-N 3.32Å
206V98.3Very high96.8Very high98 Ų9841.5 Ų41.559%0.59424%0.236SC*.THydrogen-bonded Turntrans-56.1129.3177.5-1780000110.3C148C148-V206 WeakPolarHBondContact O-CA 3.43Å
207G98.3Very high96.2Very high42 Ų4242.6 Ų42.643%0.43325%0.247SC..THydrogen-bonded Turntrans89.7-9-179.300000114.8C148 D205 E209C148-G207 PolarHBondContact O-N 2.8Å; D205-G207 PolarHBondContact O-N 3.06Å; G207-E209 PolarHBondContact O-N 2.64Å
208D98.9Very high95.7Very high16 Ų1644.4 Ų44.49%0.08625%0.249CC..  trans-58.3131.2172.6-78.9-16.5000110.7T147 C148 K176 N177 L204 D205T147-D208 WeakPolarHBondContact CA-O 3.23Å; C148-D208 HydrophobicContact CB-CB 4.05Å; C148-D208 WeakPolarHBondContact CB-O 3.43Å; C148-D208 PolarHBondContact N-O 2.83Å; K176-D208 VanDerWaalsContact CE-CG 3.45Å; K176-D208 WeakPolarHBondContact CE-OD2 3.19Å; K176-D208 IonicContact NZ-OD2 2.8Å; K176-D208 PolarHBondContact NZ-OD2 2.84Å; N177-D208 PolarHBondContact ND2-OD1 2.92Å; N177-D208 WeakPolarHBondContact OD1-CA 3.21Å; L204-D208 WeakPolarHBondContact CA-OD2 3.32Å; L204-D208 HydrophobicContact CB-CB 4.25Å; L204-D208 HydrophobicContact CD2-CB 4.14Å; D205-D208 PolarHBondContact N-OD2 2.7Å; D205-D208 VanDerWaalsContact O-CB 3.29Å; D205-D208 WeakPolarHBondContact O-CB 3.45Å; D205-D208 PolarHBondContact O-N 3.32Å
209E98.8Very high95.4Very high65 Ų6541.4 Ų41.430%0.30423%0.233SC..EExtended strand (participates in β ladder)trans-99.7126.1177.5-65.5-172.9133.200110.8K145 F146 K176 N177 G207 F211K145-E209 HydrophobicContact CD-CB 4.33Å; K145-E209 HydrophobicContact CD-CG 4.28Å; K145-E209 WeakPolarHBondContact CD-OE1 3.49Å; K145-E209 IonicContact NZ-OE1 3.25Å; K145-E209 PolarHBondContact NZ-OE1 3.28Å; K145-E209 IonicContact NZ-OE2 2.62Å; K145-E209 PolarHBondContact NZ-OE2 2.99Å; F146-E209 CarbonylContact O-C 3.58Å; F146-E209 WeakPolarHBondContact O-CA 3.29Å; K176-E209 WeakPolarHBondContact CA-O 3.45Å; N177-E209 PolarHBondContact N-O 2.84Å; N177-E209 PolarHBondContact OD1-N 2.79Å; G207-E209 PolarHBondContact O-N 2.64Å; E209-F211 HydrophobicContact CB-CD1 4.35Å; E209-F211 HydrophobicContact CB-CE1 4.49Å
210V98.9Very high95.1Very high0 Ų040 Ų400%022%0.22CC..EExtended strand (participates in β ladder)trans-116.2127.5172.4-174.10000110.3F146 F156 L174 M175 L204 F230F146-V210 HydrophobicContact CB-CB 4.43Å; F146-V210 HydrophobicContact CD1-CB 4.41Å; F146-V210 PolarHBondContact N-O 2.8Å; F146-V210 PolarHBondContact O-N 3.01Å; F156-V210 HydrophobicContact CD1-CG1 4.07Å; F156-V210 HydrophobicContact CD2-CG1 4.25Å; F156-V210 HydrophobicContact CE1-CB 4.12Å; F156-V210 HydrophobicContact CE1-CG1 4.02Å; F156-V210 HydrophobicContact CE1-CG2 4.49Å; F156-V210 HydrophobicContact CE2-CB 4.47Å; F156-V210 HydrophobicContact CE2-CG1 4.22Å; F156-V210 HydrophobicContact CE2-CG2 4.09Å; F156-V210 HydrophobicContact CG-CG1 4.19Å; F156-V210 HydrophobicContact CZ-CB 4.04Å; F156-V210 HydrophobicContact CZ-CG1 4.12Å; F156-V210 HydrophobicContact CZ-CG2 3.91Å; L174-V210 HydrophobicContact CD1-CG1 4.19Å; L174-V210 HydrophobicContact CD2-CG1 3.74Å; L174-V210 HydrophobicContact CG-CG1 3.93Å; M175-V210 VanDerWaalsContact O-CA 3.25Å; M175-V210 WeakPolarHBondContact O-CA 3.4Å; L204-V210 HydrophobicContact CD1-CG2 3.82Å; L204-V210 HydrophobicContact CD2-CG2 3.79Å; V210-F230 HydrophobicContact CG1-CZ 4.19Å
211F98.8Very high94.9Very high17 Ų1739.1 Ų39.18%0.07522%0.215CC..EExtended strand (participates in β ladder)trans-156.1165.1-177.558.6-88.5000112V125 K145 M175 E209 K213V125-F211 HydrophobicContact CB-CD2 4.33Å; V125-F211 HydrophobicContact CG1-CB 4.09Å; V125-F211 HydrophobicContact CG1-CD2 3.84Å; V125-F211 HydrophobicContact CG1-CG 4.23Å; V125-F211 HydrophobicContact CG2-CD2 3.71Å; V125-F211 HydrophobicContact CG2-CE2 3.71Å; K145-F211 HydrophobicContact CB-CB 4.26Å; K145-F211 HydrophobicContact CD-CD1 4.13Å; K145-F211 HydrophobicContact CG-CB 3.88Å; K145-F211 HydrophobicContact CG-CD1 4.1Å; K145-F211 HydrophobicContact CG-CG 4.16Å; M175-F211 HydrophobicContact CB-CD1 4.17Å; M175-F211 HydrophobicContact CB-CD2 3.88Å; M175-F211 HydrophobicContact CB-CE1 3.86Å; M175-F211 HydrophobicContact CB-CE2 3.55Å; M175-F211 HydrophobicContact CB-CG 4.18Å; M175-F211 HydrophobicContact CB-CZ 3.54Å; M175-F211 HydrophobicContact CG-CD2 3.92Å; M175-F211 HydrophobicContact CG-CE2 3.51Å; M175-F211 HydrophobicContact CG-CZ 3.94Å; M175-F211 PolarHBondContact N-O 3.11Å; M175-F211 PolarHBondContact O-N 2.99Å; M175-F211 VanDerWaalsContact O-N 3.16Å; E209-F211 HydrophobicContact CB-CD1 4.35Å; E209-F211 HydrophobicContact CB-CE1 4.49Å; F211-K213 HydrophobicContact CD2-CB 4.46Å; F211-K213 HydrophobicContact CE2-CB 4.23Å
212I98.2Very high94.6Very high0 Ų035.7 Ų35.70%021%0.207CC..EExtended strand (participates in β ladder)trans-96.8129.7173.6-52.5-53.7000109V125 L126 F128 Y158 V160 A172 D173 L174 F230V125-I212 WeakPolarHBondContact CA-O 3.31Å; L126-I212 HydrophobicContact CB-CB 4.34Å; L126-I212 HydrophobicContact CB-CG2 4.39Å; L126-I212 HydrophobicContact CD2-CG2 4.44Å; L126-I212 PolarHBondContact N-O 3.42Å; F128-I212 HydrophobicContact CE2-CB 4.04Å; F128-I212 HydrophobicContact CE2-CG1 3.86Å; F128-I212 HydrophobicContact CZ-CG1 4.28Å; Y158-I212 HydrophobicContact CD1-CD1 3.52Å; Y158-I212 HydrophobicContact CD2-CD1 4.31Å; Y158-I212 HydrophobicContact CE1-CD1 4.12Å; Y158-I212 HydrophobicContact CG-CD1 3.61Å; Y158-I212 HydrophobicContact CG-CG1 4.3Å; V160-I212 HydrophobicContact CG2-CG2 4.46Å; A172-I212 HydrophobicContact CB-CG2 4.21Å; D173-I212 CarbonylContact O-C 3.54Å; D173-I212 VanDerWaalsContact O-CA 3.29Å; D173-I212 WeakPolarHBondContact O-CA 3.43Å; L174-I212 HydrophobicContact CB-CD1 3.83Å; L174-I212 HydrophobicContact CD1-CD1 4.19Å; L174-I212 HydrophobicContact CG-CD1 4.1Å; I212-F230 HydrophobicContact CD1-CD2 4.1Å; I212-F230 HydrophobicContact CD1-CE2 3.95Å; I212-F230 HydrophobicContact CD1-CZ 4.31Å; I212-F230 HydrophobicContact CG1-CD1 4.26Å; I212-F230 HydrophobicContact CG1-CD2 4.06Å; I212-F230 HydrophobicContact CG1-CE1 4.45Å; I212-F230 HydrophobicContact CG1-CE2 4.26Å; I212-F230 HydrophobicContact CG1-CG 4.07Å; I212-F230 HydrophobicContact CG1-CZ 4.46Å
213K96Very high94.3Very high81 Ų8141.7 Ų41.735%0.35224%0.239SC..EExtended strand (participates in β ladder)trans-113.6136.9172-175.3-177.3167.1-168.40109.1Y123 D173 M175 F211Y123-K213 VanDerWaalsContact O-CE 3.29Å; Y123-K213 WeakPolarHBondContact O-CE 3.47Å; D173-K213 PolarHBondContact N-O 3.37Å; D173-K213 PolarHBondContact O-N 3.02Å; M175-K213 HydrophobicContact CG-CB 3.69Å; M175-K213 HydrophobicContact SD-CB 4.25Å; F211-K213 HydrophobicContact CD2-CB 4.46Å; F211-K213 HydrophobicContact CE2-CB 4.23Å
214L92.6Very high94.1Very high0 Ų041.4 Ų41.40%024%0.243CC..EExtended strand (participates in β ladder)trans-87.6145172.1-58.4-178.5000110.7H120 G122 Y123 E124 L126 V160 M162 W171 A172 V219H120-L214 HydrophobicContact CB-CD1 4.47Å; G122-L214 WeakPolarHBondContact O-CB 3.5Å; Y123-L214 CarbonylContact C-O 3.55Å; Y123-L214 VanDerWaalsContact CA-O 3.31Å; Y123-L214 WeakPolarHBondContact CA-O 3.24Å; E124-L214 PolarHBondContact O-N 3.04Å; L126-L214 HydrophobicContact CB-CD2 4.48Å; L126-L214 HydrophobicContact CB-CG 4.25Å; L126-L214 HydrophobicContact CD1-CD1 4.31Å; L126-L214 HydrophobicContact CD2-CD2 4.18Å; V160-L214 HydrophobicContact CG1-CD2 4.45Å; M162-L214 HydrophobicContact CE-CD2 3.78Å; W171-L214 WeakPolarHBondContact O-CA 3.39Å; A172-L214 HydrophobicContact CB-CD2 4.41Å; L214-V219 HydrophobicContact CD1-CB 4.37Å; L214-V219 HydrophobicContact CD1-CG2 3.44Å; L214-V219 VanDerWaalsContact CD1-CG2 3.44Å; L214-V219 HydrophobicContact CD2-CG2 3.76Å; L214-V219 HydrophobicContact CG-CG2 4.24Å
215D88.2Confident94.1Very high61 Ų6143 Ų4333%0.32625%0.251SS..EExtended strand (participates in β ladder)trans-119.376.5165.8-163.123000107.9Y123 W171Y123-D215 WeakPolarHBondContact CD1-OD1 3.42Å; Y123-D215 WeakPolarHBondContact CE1-OD1 3.18Å; W171-D215 HydrophobicContact CB-CB 3.97Å; W171-D215 HydrophobicContact CE3-CB 3.95Å; W171-D215 PolarHBondContact N-O 3.27Å; W171-D215 PolarHBondContact O-N 3.27Å
216G84.1Confident94Very high8 Ų842.7 Ų42.78%0.08225%0.246CC..SBendtrans85.1174.8-176.800000114.4G122G122-G216 WeakPolarHBondContact O-CA 3.29Å; G122-G216 PolarHBondContact O-N 2.7Å; G122-G216 VanDerWaalsContact O-N 3.12Å
217G81.6Confident93.9Very high23 Ų2343.1 Ų43.124%0.23724%0.237CC..SBendtrans86.4174.5178.300000115.9E121 G122 M170E121-G217 WeakPolarHBondContact CA-O 3.32Å; G122-G217 PolarHBondContact N-O 3.39Å; M170-G217 WeakPolarHBondContact SD-CA 3.22Å
218K87.3Confident93.9Very high83 Ų8341.1 Ų41.136%0.36122%0.217SC..EExtended strand (participates in β ladder)trans-117.1133.3171.9-173.4170.9-172.4153.80110.2M162 R163M162-K218 CarbonylContact C-O 3.47Å; M162-K218 WeakPolarHBondContact CA-O 3.09Å; R163-K218 PolarHBondContact N-O 3.02Å; R163-K218 PolarHBondContact O-N 2.9Å
219V91.8Very high93.9Very high0 Ų040.9 Ų40.90%022%0.216CC..EExtended strand (participates in β ladder)trans-109142.6-177.1-178.40000111L116 P119 H120 L126 V160 L161 M162 L214 S228L116-V219 HydrophobicContact CD2-CB 4.21Å; L116-V219 HydrophobicContact CD2-CG1 3.49Å; L116-V219 VanDerWaalsContact CD2-CG1 3.49Å; P119-V219 VanDerWaalsContact CA-O 3.29Å; P119-V219 WeakPolarHBondContact CA-O 3.21Å; H120-V219 PolarHBondContact N-O 2.91Å; H120-V219 PolarHBondContact O-N 3.25Å; L126-V219 HydrophobicContact CD1-CB 4.39Å; L126-V219 HydrophobicContact CD1-CG1 4.3Å; L126-V219 HydrophobicContact CD2-CG1 3.99Å; L126-V219 HydrophobicContact CD2-CG2 4.5Å; V160-V219 HydrophobicContact CG1-CB 4.17Å; V160-V219 HydrophobicContact CG1-CG1 3.39Å; V160-V219 HydrophobicContact CG1-CG2 3.6Å; L161-V219 WeakPolarHBondContact O-CA 3.34Å; M162-V219 HydrophobicContact CE-CG2 3.98Å; M162-V219 HydrophobicContact CG-CG2 4.3Å; L214-V219 HydrophobicContact CD1-CB 4.37Å; L214-V219 HydrophobicContact CD1-CG2 3.44Å; L214-V219 VanDerWaalsContact CD1-CG2 3.44Å; L214-V219 HydrophobicContact CD2-CG2 3.76Å; L214-V219 HydrophobicContact CG-CG2 4.24Å; V219-S228 WeakPolarHBondContact CG1-OG 3.25Å
220H92.8Very high93.9Very high33 Ų3337.8 Ų37.815%0.15320%0.202CC..  trans-124.7134.6-174.7-68.8-93.3000113.1L161 Y193 S228L161-H220 HydrophobicContact CD2-CB 4.06Å; L161-H220 HydrophobicContact CG-CB 4.4Å; L161-H220 PolarHBondContact O-N 2.97Å; Y193-H220 HydrophobicContact CE1-CB 4.38Å; Y193-H220 AromaticContact CE1-CD2 3.53Å; Y193-H220 AromaticContact CE1-CG 3.86Å; Y193-H220 AromaticContact CE1-NE2 3.84Å; H220-S228 WeakPolarHBondContact O-CB 3.14Å; H220-S228 PolarHBondContact O-OG 3.49Å
221G94.1Very high93.9Very high3 Ų339.2 Ų39.23%0.03121%0.211CC..  trans-81.6-18.2171.100000115.1L116 N225 K226 Y227L116-G221 WeakPolarHBondContact O-CA 3.34Å; G221-N225 CarbonylContact O-C 3.44Å; G221-N225 WeakPolarHBondContact O-CA 3.49Å; G221-N225 PolarHBondContact O-N 3.42Å; G221-K226 PolarHBondContact O-N 3.11Å; G221-K226 VanDerWaalsContact O-N 3.15Å; G221-Y227 PolarHBondContact O-N 3.03Å; G221-Y227 VanDerWaalsContact O-N 3.09Å
222G92.4Very high93.9Very high38 Ų3838.4 Ų38.439%0.39221%0.208SC..  trans67.3-174.2-166.100000112.6T224 N225G222-T224 VanDerWaalsContact C-N 3.31Å; G222-T224 PolarHBondContact O-N 3.19Å; G222-N225 PolarHBondContact O-N 3.38Å
223N93.6Very high93.9Very high141 Ų14142.9 Ų42.975%0.75423%0.228SC*.THydrogen-bonded Turntrans-71.4-21.9-176.661.3-11.9000114.3
224T95.1Very high94Very high75 Ų7540 Ų4046%0.4622%0.216SC..THydrogen-bonded Turntrans-1062.4-179.260.10000113.1G222 K226G222-T224 VanDerWaalsContact C-N 3.31Å; G222-T224 PolarHBondContact O-N 3.19Å; T224-K226 WeakPolarHBondContact O-CG 3.01Å; T224-K226 PolarHBondContact O-N 2.96Å; T224-K226 PolarHBondContact O-NZ 3.45Å
225N97Very high94.3Very high33 Ų3343.6 Ų43.618%0.17623%0.234CC..SBendtrans64.67.6-174.2-45.5-31000114.7G115 L116 D130 G221 G222G115-N225 CarbonylContact C-O 3.55Å; G115-N225 VanDerWaalsContact CA-O 3.25Å; G115-N225 WeakPolarHBondContact CA-O 3.42Å; L116-N225 PolarHBondContact N-O 3.03Å; L116-N225 WeakPolarHBondContact O-CA 3.37Å; L116-N225 WeakPolarHBondContact O-CB 3.41Å; D130-N225 HydrophobicContact CB-CB 4Å; D130-N225 VanDerWaalsContact OD2-CB 3.31Å; D130-N225 WeakPolarHBondContact OD2-CB 3.11Å; D130-N225 PolarHBondContact OD2-ND2 3.38Å; G221-N225 CarbonylContact O-C 3.44Å; G221-N225 WeakPolarHBondContact O-CA 3.49Å; G221-N225 PolarHBondContact O-N 3.42Å; G222-N225 PolarHBondContact O-N 3.38Å
226K97.2Very high94.6Very high79 Ų7947 Ų4734%0.34324%0.244SC..  trans-103.33-172.2-56.9-54176.5-73.60115Y113 D130 G221 T224 T229Y113-K226 HydrophobicContact CE1-CD 4.42Å; D130-K226 IonicContact OD2-NZ 3.17Å; D130-K226 PolarHBondContact OD2-NZ 3.44Å; G221-K226 PolarHBondContact O-N 3.11Å; G221-K226 VanDerWaalsContact O-N 3.15Å; T224-K226 WeakPolarHBondContact O-CG 3.01Å; T224-K226 PolarHBondContact O-N 2.96Å; T224-K226 PolarHBondContact O-NZ 3.45Å; K226-T229 WeakPolarHBondContact O-CG2 3.31Å
227Y96.8Very high95.2Very high107 Ų10749.1 Ų49.142%0.4226%0.256SS..SBendtrans-75.6-39.4177.7-76.5-102000111.8L161 Y195 G221L161-Y227 HydrophobicContact CD2-CD1 3.8Å; L161-Y227 HydrophobicContact CD2-CG 4.02Å; Y195-Y227 WeakPolarHBondContact CE1-O 3.24Å; Y195-Y227 WeakPolarHBondContact OH-CA 3.24Å; Y195-Y227 PolarHBondContact OH-O 2.94Å; G221-Y227 PolarHBondContact O-N 3.03Å; G221-Y227 VanDerWaalsContact O-N 3.09Å
228S97.7Very high95.7Very high0 Ų054.9 Ų54.90%028%0.281CS..SBendtrans-105.2125.1172.3-660000110G115 L116 H159 L161 V219 H220G115-S228 CarbonylContact C-O 3.47Å; G115-S228 WeakPolarHBondContact CA-O 3.49Å; L116-S228 PolarHBondContact N-O 2.85Å; L116-S228 VanDerWaalsContact N-O 3.08Å; H159-S228 CarbonylContact O-C 3.52Å; H159-S228 VanDerWaalsContact O-CA 3.22Å; H159-S228 WeakPolarHBondContact O-CA 3.49Å; L161-S228 PolarHBondContact N-OG 2.87Å; V219-S228 WeakPolarHBondContact CG1-OG 3.25Å; H220-S228 WeakPolarHBondContact O-CB 3.14Å; H220-S228 PolarHBondContact O-OG 3.49Å
229T98.8Very high96.1Very high12 Ų1253.5 Ų53.57%0.07428%0.277CS..EExtended strand (participates in β ladder)trans-141148.7-172.263.20000112.7Y113 A114 F128 Y158 H159 K226Y113-T229 HydrophobicContact CE2-CG2 3.65Å; Y113-T229 WeakPolarHBondContact OH-CG2 3.46Å; A114-T229 VanDerWaalsContact O-CA 3.29Å; A114-T229 WeakPolarHBondContact O-CA 3.33Å; F128-T229 VanDerWaalsContact CE1-C 3.45Å; Y158-T229 WeakPolarHBondContact CA-O 3.45Å; H159-T229 PolarHBondContact N-O 3.28Å; H159-T229 PolarHBondContact O-N 3.47Å; K226-T229 WeakPolarHBondContact O-CG2 3.31Å
230F98.9Very high96.3Very high0 Ų056.3 Ų56.30%029%0.292CS..EExtended strand (participates in β ladder)trans-133.4135.7169.2-177.7-145.3000109.9F112 Y113 A114 F128 Y139 F156 A157 L174 V210 I212F112-F230 HydrophobicContact CE2-CB 4.48Å; F112-F230 AromaticContact CE2-CD1 3.58Å; F112-F230 HydrophobicContact CE2-CD1 3.58Å; F112-F230 HydrophobicContact CE2-CD2 4.46Å; F112-F230 AromaticContact CE2-CE1 3.83Å; F112-F230 HydrophobicContact CE2-CE1 3.83Å; F112-F230 AromaticContact CE2-CG 3.91Å; F112-F230 HydrophobicContact CE2-CG 3.91Å; F112-F230 HydrophobicContact CE2-CZ 4.37Å; F112-F230 AromaticContact CZ-CD1 3.8Å; F112-F230 HydrophobicContact CZ-CD1 3.8Å; F112-F230 HydrophobicContact CZ-CD2 4.28Å; F112-F230 AromaticContact CZ-CE1 3.58Å; F112-F230 HydrophobicContact CZ-CE1 3.58Å; F112-F230 HydrophobicContact CZ-CE2 4.08Å; F112-F230 HydrophobicContact CZ-CG 4.13Å; F112-F230 AromaticContact CZ-CZ 3.73Å; F112-F230 HydrophobicContact CZ-CZ 3.73Å; Y113-F230 WeakPolarHBondContact CA-O 3.45Å; A114-F230 PolarHBondContact N-O 3.36Å; A114-F230 PolarHBondContact O-N 3.21Å; F128-F230 HydrophobicContact CD1-CB 4.14Å; F128-F230 HydrophobicContact CD2-CB 3.54Å; F128-F230 HydrophobicContact CD2-CD1 4.17Å; F128-F230 HydrophobicContact CD2-CG 4.28Å; F128-F230 HydrophobicContact CE1-CB 4.07Å; F128-F230 HydrophobicContact CE2-CB 3.47Å; F128-F230 VanDerWaalsContact CE2-CB 3.47Å; F128-F230 HydrophobicContact CE2-CD1 4.25Å; F128-F230 HydrophobicContact CE2-CG 4.12Å; F128-F230 HydrophobicContact CG-CB 3.88Å; F128-F230 HydrophobicContact CZ-CB 3.73Å; Y139-F230 AromaticContact CE2-CD1 3.94Å; Y139-F230 HydrophobicContact CE2-CD1 3.94Å; Y139-F230 HydrophobicContact CE2-CE1 4.22Å; F156-F230 HydrophobicContact CB-CE2 4.19Å; F156-F230 HydrophobicContact CD1-CE2 4.03Å; F156-F230 AromaticContact CD1-CZ 3.95Å; F156-F230 HydrophobicContact CD1-CZ 3.95Å; A157-F230 WeakPolarHBondContact O-CD2 3.4Å; L174-F230 HydrophobicContact CD1-CE2 4.19Å; V210-F230 HydrophobicContact CG1-CZ 4.19Å; I212-F230 HydrophobicContact CD1-CD2 4.1Å; I212-F230 HydrophobicContact CD1-CE2 3.95Å; I212-F230 HydrophobicContact CD1-CZ 4.31Å; I212-F230 HydrophobicContact CG1-CD1 4.26Å; I212-F230 HydrophobicContact CG1-CD2 4.06Å; I212-F230 HydrophobicContact CG1-CE1 4.45Å; I212-F230 HydrophobicContact CG1-CE2 4.26Å; I212-F230 HydrophobicContact CG1-CG 4.07Å; I212-F230 HydrophobicContact CG1-CZ 4.46Å
231S98.9Very high96.5Very high29 Ų2957.6 Ų57.620%0.20330%0.299CS..EExtended strand (participates in β ladder)trans-144.2157.6-178.958.40000111.7F112 F156 A157F112-S231 VanDerWaalsContact O-CA 3.28Å; F112-S231 WeakPolarHBondContact O-CA 3.24Å; F112-S231 WeakPolarHBondContact O-CB 3.32Å; F156-S231 WeakPolarHBondContact CA-O 3.49Å; A157-S231 PolarHBondContact N-O 3.15Å; A157-S231 PolarHBondContact O-N 3.42Å; A157-S231 PolarHBondContact O-OG 3.29Å
232G98.8Very high96.7Very high1 Ų160.8 Ų60.81%0.0132%0.315CS..EExtended strand (participates in β ladder)trans-171.3162.7170.200000112.4A111 F112 F155A111-G232 CarbonylContact C-O 3.11Å; A111-G232 VanDerWaalsContact CA-O 3.31Å; A111-G232 WeakPolarHBondContact CA-O 3.48Å; F112-G232 WeakPolarHBondContact CD1-O 3.49Å; F112-G232 VanDerWaalsContact CE1-N 3.29Å; F112-G232 PolarHBondContact N-O 3.29Å; F112-G232 PolarHBondContact O-N 2.82Å; F112-G232 VanDerWaalsContact O-N 3.09Å; F155-G232 CarbonylContact O-C 3.5Å; F155-G232 WeakPolarHBondContact O-CA 3.19Å
233F98.8Very high96.9Very high94 Ų9462.2 Ų62.241%0.41231%0.31SS..EExtended strand (participates in β ladder)trans-155.8156.3179.156.5-92000111.2I110 A111 Y154 F155 I235I110-F233 CarbonylContact O-C 3.45Å; I110-F233 WeakPolarHBondContact O-CA 3.36Å; I110-F233 WeakPolarHBondContact O-CB 3.43Å; A111-F233 HydrophobicContact CB-CB 3.79Å; Y154-F233 WeakPolarHBondContact CA-O 3.45Å; F155-F233 HydrophobicContact CB-CD2 4.46Å; F155-F233 HydrophobicContact CB-CE1 4.1Å; F155-F233 HydrophobicContact CB-CE2 4.02Å; F155-F233 HydrophobicContact CB-CZ 3.82Å; F155-F233 HydrophobicContact CD1-CD1 4.01Å; F155-F233 AromaticContact CD1-CE1 3.32Å; F155-F233 HydrophobicContact CD1-CE1 3.32Å; F155-F233 AromaticContact CD1-CZ 3.71Å; F155-F233 HydrophobicContact CD1-CZ 3.71Å; F155-F233 HydrophobicContact CE1-CE1 4.04Å; F155-F233 HydrophobicContact CG-CE1 4.01Å; F155-F233 AromaticContact CG-CZ 3.94Å; F155-F233 HydrophobicContact CG-CZ 3.94Å; F155-F233 PolarHBondContact N-O 3.47Å; F155-F233 PolarHBondContact O-N 3.15Å; F233-I235 HydrophobicContact CE2-CG1 4.32Å
234I98.3Very high97.2Very high20 Ų2056.9 Ų56.910%0.10328%0.281CS..EExtended strand (participates in β ladder)trans-72.1131.5170.5-168170.5000109.8I110 Y154 P237I110-I234 HydrophobicContact CB-CB 4.19Å; I110-I234 HydrophobicContact CB-CG2 3.87Å; I110-I234 HydrophobicContact CD1-CB 4.48Å; I110-I234 HydrophobicContact CD1-CD1 4.22Å; I110-I234 HydrophobicContact CD1-CG2 4.43Å; I110-I234 HydrophobicContact CG1-CG2 4.41Å; I110-I234 PolarHBondContact O-N 3.23Å; Y154-I234 HydrophobicContact CD1-CB 3.87Å; Y154-I234 HydrophobicContact CD1-CG1 4.32Å; Y154-I234 HydrophobicContact CE1-CB 3.55Å; Y154-I234 HydrophobicContact CE1-CD1 4.28Å; Y154-I234 HydrophobicContact CE1-CG1 3.93Å; Y154-I234 HydrophobicContact CE2-CD1 4.43Å; Y154-I234 HydrophobicContact CE2-CG1 4.33Å; I234-P237 HydrophobicContact CD1-CB 4.07Å
235I97.7Very high97.3Very high75 Ų7555.6 Ų55.639%0.38527%0.268SS..EExtended strand (participates in β ladder)trans-85-53.4172.1-48-175000108.8V153 F155 I201 F233V153-I235 HydrophobicContact CG1-CD1 4.06Å; V153-I235 WeakPolarHBondContact O-CB 3.47Å; V153-I235 PolarHBondContact O-N 3.36Å; F155-I235 HydrophobicContact CB-CD1 4.13Å; F155-I235 HydrophobicContact CB-CG1 4.19Å; I201-I235 HydrophobicContact CD1-CD1 4.28Å; I201-I235 HydrophobicContact CG1-CD1 4.27Å; I201-I235 HydrophobicContact CG2-CD1 3.97Å; F233-I235 HydrophobicContact CE2-CG1 4.32Å
236Y95.1Very high97.3Very high134 Ų13457.4 Ų57.453%0.52528%0.275SS..EExtended strand (participates in β ladder)trans-153.3142.6173.145.9-94.9000110.8G152 V153G152-Y236 WeakPolarHBondContact CA-O 3.48Å; V153-Y236 HydrophobicContact CB-CD2 4.08Å; V153-Y236 HydrophobicContact CB-CE1 4.21Å; V153-Y236 HydrophobicContact CB-CE2 3.59Å; V153-Y236 HydrophobicContact CG1-CE1 4.44Å; V153-Y236 HydrophobicContact CG1-CE2 4.48Å; V153-Y236 HydrophobicContact CG2-CD2 4.09Å; V153-Y236 HydrophobicContact CG2-CE2 3.29Å; V153-Y236 PolarHBondContact N-O 3.01Å; V153-Y236 PolarHBondContact O-N 3Å
237P95.6Very high97.3Very high51 Ų5155.6 Ų55.633%0.33127%0.269SS..EExtended strand (participates in β ladder)trans-71.6159.6168.434.4-36.6000110.6P108 M150 I234P108-P237 HydrophobicContact CG-CB 3.89Å; P108-P237 HydrophobicContact CG-CG 3.67Å; M150-P237 HydrophobicContact SD-CB 3.94Å; I234-P237 HydrophobicContact CD1-CB 4.07Å
238D92.8Very high97.4Very high144 Ų14450.9 Ų50.977%0.7726%0.256SS*.  trans-68.10169.5-70.7-8.2000113P151 G152 H203P151-D238 HydrophobicContact CB-CB 4.48Å; P151-D238 PolarHBondContact O-N 2.87Å; G152-D238 WeakPolarHBondContact CA-OD1 3.38Å; H203-D238 IonicContact CD2-OD1 3.51Å; H203-D238 IonicContact CD2-OD2 2.69Å; H203-D238 IonicContact CE1-OD2 3.63Å; H203-D238 IonicContact NE2-OD1 3.25Å; H203-D238 PolarHBondContact NE2-OD1 3.05Å; H203-D238 IonicContact NE2-OD2 2.91Å; H203-D238 PolarHBondContact NE2-OD2 3.41Å

Retrieved 238 of 238 residues in 464.9 ms (Link to these results)