A0A087YKN5_POEFO Loading...

F-box only protein 32

Substrate recognition component of a SCF (SKP1-CUL1-F-box protein) E3 ubiquitin-protein ligase complex which mediates the ubiquitination and subsequent proteasomal degradation of target proteins. Probably recognizes and binds to phosphorylated target proteins during skeletal muscle atrophy. Recognizes TERF1.

AlphaFold DB , UniProt , Accession A0A087YKN5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 357 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
1M29.6Very low37.8Very low240 Ų240109.9 Ų109.9100%1.18257%0.574SS**  0109.30-74.2175.3163.500107.9
2P37.7Very low38.7Very low127 Ų127105 Ų10583%0.82557%0.57SS**  trans-83.2135.6171.423.6-11.3000109.6L4P2-L4 PolarHBondContact O-N 3.19Å
3F29Very low39.8Very low203 Ų203100.2 Ų100.289%0.8954%0.542SS*.  trans-57.3120.8-175-150.3-105.2000111.3G5F3-G5 VanDerWaalsContact C-N 3.32Å; F3-G5 PolarHBondContact O-N 2.94Å; F3-G5 VanDerWaalsContact O-N 3.11Å
4L35Very low40.2Very low163 Ų16398.7 Ų98.785%0.85353%0.533SS*.  trans-77.485165.5-85.1157.1000107.9P2 Q6P2-L4 PolarHBondContact O-N 3.19Å; L4-Q6 PolarHBondContact O-N 2.94Å
5G32.6Very low41Very low49 Ų49101.2 Ų101.251%0.50553%0.532SS..  trans-65.1124.7167.200000109.8F3 D7F3-G5 VanDerWaalsContact C-N 3.32Å; F3-G5 PolarHBondContact O-N 2.94Å; F3-G5 VanDerWaalsContact O-N 3.11Å; G5-D7 PolarHBondContact O-N 2.86Å
6Q39.3Very low41.7Very low174 Ų17499.1 Ų99.181%0.81352%0.524SS*.  trans-69.554.9166-71.1177.9-26.700110.5L4 W8L4-Q6 PolarHBondContact O-N 2.94Å; Q6-W8 PolarHBondContact O-NE1 2.77Å
7D42Very low41.7Very low54 Ų54102.5 Ų102.529%0.28953%0.534SS..  trans-103.3101.3-166.4-171.78.2000112G5 R9 S250G5-D7 PolarHBondContact O-N 2.86Å; D7-R9 VanDerWaalsContact C-N 3.29Å; D7-R9 PolarHBondContact O-N 2.76Å; D7-R9 VanDerWaalsContact OD1-CD 3.23Å; D7-R9 WeakPolarHBondContact OD1-CD 3.48Å; D7-R9 WeakPolarHBondContact OD1-CG 3.47Å; D7-R9 IonicContact OD1-CZ 3.15Å; D7-R9 VanDerWaalsContact OD1-CZ 3.28Å; D7-R9 IonicContact OD1-NE 3.48Å; D7-R9 PolarHBondContact OD1-NE 2.86Å; D7-R9 IonicContact OD1-NH2 2.76Å; D7-R9 PolarHBondContact OD1-NH2 3.07Å; D7-R9 VanDerWaalsContact OD1-NH2 3.14Å; D7-R9 IonicContact OD2-CZ 3.32Å; D7-R9 IonicContact OD2-NE 2.77Å; D7-R9 PolarHBondContact OD2-NE 3.06Å; D7-R9 IonicContact OD2-NH2 3.67Å; D7-R9 PolarHBondContact OD2-NH2 3.49Å; D7-S250 WeakPolarHBondContact OD2-CB 3.31Å
8W51.5Low42.9Very low79 Ų79100 Ų10030%0.29952%0.523SS..  trans-81.854.4-168.4-59.6112.5000115.3Q6 K169 D213 I215Q6-W8 PolarHBondContact O-NE1 2.77Å; W8-K169 VanDerWaalsContact CG-NZ 3.34Å; W8-D213 WeakPolarHBondContact CH2-O 3.45Å; W8-D213 WeakPolarHBondContact CZ2-O 3.47Å; W8-I215 WeakPolarHBondContact CH2-O 3.44Å; W8-I215 HydrophobicContact CZ3-CB 4.16Å; W8-I215 WeakPolarHBondContact CZ3-O 3.47Å
9R44.4Very low43.4Very low50 Ų50104.1 Ų104.119%0.18955%0.546CS..PPolyproline II helixtrans-102.9125.3-172.8-65.1-176-154.7171.848111.3D7 P11 R246 S250D7-R9 VanDerWaalsContact C-N 3.29Å; D7-R9 PolarHBondContact O-N 2.76Å; D7-R9 VanDerWaalsContact OD1-CD 3.23Å; D7-R9 WeakPolarHBondContact OD1-CD 3.48Å; D7-R9 WeakPolarHBondContact OD1-CG 3.47Å; D7-R9 IonicContact OD1-CZ 3.15Å; D7-R9 VanDerWaalsContact OD1-CZ 3.28Å; D7-R9 IonicContact OD1-NE 3.48Å; D7-R9 PolarHBondContact OD1-NE 2.86Å; D7-R9 IonicContact OD1-NH2 2.76Å; D7-R9 PolarHBondContact OD1-NH2 3.07Å; D7-R9 VanDerWaalsContact OD1-NH2 3.14Å; D7-R9 IonicContact OD2-CZ 3.32Å; D7-R9 IonicContact OD2-NE 2.77Å; D7-R9 PolarHBondContact OD2-NE 3.06Å; D7-R9 IonicContact OD2-NH2 3.67Å; D7-R9 PolarHBondContact OD2-NH2 3.49Å; R9-P11 WeakPolarHBondContact O-CD 3.49Å; R9-R246 PolarHBondContact NH1-O 3.35Å; R9-S250 WeakPolarHBondContact CD-OG 3.49Å; R9-S250 VanDerWaalsContact NE-CB 3.31Å; R9-S250 PolarHBondContact NE-OG 3.41Å; R9-S250 PolarHBondContact NH1-OG 3.47Å
10S34.9Very low43.7Very low27 Ų27107.4 Ų107.419%0.18956%0.564CS.*PPolyproline II helixtrans-47.8117.9-174.1-54.90000111.2G12 N164 V165S10-G12 PolarHBondContact O-N 2.79Å; S10-N164 VanDerWaalsContact OG-CA 3.23Å; S10-N164 WeakPolarHBondContact OG-CA 3.41Å; S10-V165 PolarHBondContact OG-N 3Å
11P39.5Very low44.7Very low43 Ų43103.7 Ų103.728%0.27955%0.552SS.*PPolyproline II helixtrans-57.9125.4157.924.1-28000106.3R9 Q162 Q163R9-P11 WeakPolarHBondContact O-CD 3.49Å; P11-Q162 WeakPolarHBondContact CD-O 3.49Å; P11-Q162 WeakPolarHBondContact CG-O 3.48Å; P11-Q163 HydrophobicContact CG-CG 4.31Å
12G49.4Very low45.7Very low51 Ų51100.4 Ų100.453%0.52653%0.526SS..  trans-60.1179.9-177.800000112.6S10 Q163S10-G12 PolarHBondContact O-N 2.79Å; G12-Q163 VanDerWaalsContact O-CD 3.23Å; G12-Q163 PolarHBondContact O-NE2 3.35Å
13Q52.3Low46.1Very low43 Ų43100 Ų10020%0.20151%0.512CS..  trans-56.4140.3179.1-63.2178.3-19.700111.6W15Q13-W15 PolarHBondContact O-N 3.04Å
14N45.5Very low47.3Very low79 Ų7992.9 Ų92.942%0.42248%0.48SS..  trans-73.3124.1177.5-75.6-31.9000111.2R25 Q163N14-R25 HydrophobicContact CB-CB 4.14Å; N14-R25 PolarHBondContact O-N 2.96Å; N14-Q163 PolarHBondContact ND2-NE2 3.26Å; N14-Q163 VanDerWaalsContact ND2-NE2 3.11Å; N14-Q163 PolarHBondContact OD1-NE2 3.16Å
15W52.6Low47.9Very low136 Ų13690.8 Ų90.852%0.51546%0.461SS..EExtended strand (participates in β ladder)trans-109.8136.7175.2-64.185.2000110.2Q13 W22 K24Q13-W15 PolarHBondContact O-N 3.04Å; W15-W22 HydrophobicContact CB-CE3 3.96Å; W15-W22 HydrophobicContact CE3-CB 4.09Å; W15-K24 HydrophobicContact CD2-CG 3.95Å; W15-K24 HydrophobicContact CE3-CG 3.74Å; W15-K24 HydrophobicContact CH2-CD 4.1Å; W15-K24 HydrophobicContact CH2-CG 3.62Å; W15-K24 HydrophobicContact CZ2-CD 4.14Å; W15-K24 HydrophobicContact CZ2-CG 3.8Å; W15-K24 HydrophobicContact CZ3-CG 3.57Å
16V51.4Low48.8Very low68 Ų6889.9 Ų89.941%0.41245%0.446SS..EExtended strand (participates in β ladder)trans-116133.7176-177.90000107.9T18 K23 R25V16-T18 PolarHBondContact O-N 3.14Å; V16-K23 PolarHBondContact N-O 2.75Å; V16-K23 PolarHBondContact O-N 2.66Å; V16-R25 HydrophobicContact CG2-CB 4.11Å; V16-R25 HydrophobicContact CG2-CG 4.25Å
17K41.5Very low49.1Very low157 Ų15784.6 Ų84.668%0.68343%0.432SS*.EExtended strand (participates in β ladder)trans-77.3120.7173.4-168.5179.6178.4-173.50108.5W22K17-W22 HydrophobicContact CB-CD2 4.29Å; K17-W22 HydrophobicContact CB-CE3 4.02Å; K17-W22 HydrophobicContact CB-CH2 4.1Å; K17-W22 HydrophobicContact CB-CZ2 4.33Å; K17-W22 HydrophobicContact CB-CZ3 3.93Å; K17-W22 HydrophobicContact CD-CZ2 4.29Å; K17-W22 HydrophobicContact CG-CZ2 4.45Å
18T64.9Low49.1Very low57 Ų5788.9 Ų88.935%0.3546%0.455SS..EExtended strand (participates in β ladder)trans-112.6166.9173.153.80000109.5V16 D20 G21 K23V16-T18 PolarHBondContact O-N 3.14Å; T18-D20 PolarHBondContact O-N 3.41Å; T18-G21 CarbonylContact C-O 3.5Å; T18-G21 WeakPolarHBondContact CA-O 3.37Å; T18-G21 PolarHBondContact N-O 3.42Å; T18-G21 PolarHBondContact O-N 3.3Å; T18-G21 PolarHBondContact OG1-O 3.31Å; T18-K23 HydrophobicContact CG2-CB 4.16Å
19D50.8Low48.5Very low177 Ų17791.1 Ų91.195%0.94747%0.473SS*.THydrogen-bonded Turntrans-60.1-27.9-179.6-59.8-35.9000112.5
20D50.5Low48.1Very low170 Ų17096.6 Ų96.691%0.90950%0.498SS*.THydrogen-bonded Turntrans-89.48.9175.2-62.6-39.6000114.2T18T18-D20 PolarHBondContact O-N 3.41Å
21G63.8Low48Very low30 Ų30102.5 Ų102.531%0.30953%0.527SS..EExtended strand (participates in β ladder)trans114-156.218000000114.4T18T18-G21 CarbonylContact C-O 3.5Å; T18-G21 WeakPolarHBondContact CA-O 3.37Å; T18-G21 PolarHBondContact N-O 3.42Å; T18-G21 PolarHBondContact O-N 3.3Å; T18-G21 PolarHBondContact OG1-O 3.31Å
22W50.4Low47.5Very low171 Ų171107.3 Ų107.365%0.64855%0.551SS**EExtended strand (participates in β ladder)trans-88.3119.3-176.7-68.993.7000111.7W15 K17W15-W22 HydrophobicContact CB-CE3 3.96Å; W15-W22 HydrophobicContact CE3-CB 4.09Å; K17-W22 HydrophobicContact CB-CD2 4.29Å; K17-W22 HydrophobicContact CB-CE3 4.02Å; K17-W22 HydrophobicContact CB-CH2 4.1Å; K17-W22 HydrophobicContact CB-CZ2 4.33Å; K17-W22 HydrophobicContact CB-CZ3 3.93Å; K17-W22 HydrophobicContact CD-CZ2 4.29Å; K17-W22 HydrophobicContact CG-CZ2 4.45Å
23K47.1Very low46.6Very low120 Ų120111.8 Ų111.852%0.52256%0.563SS.*EExtended strand (participates in β ladder)trans-113.9139.6178.7-165.9176179.2-177.50110.7V16 T18V16-K23 PolarHBondContact N-O 2.75Å; V16-K23 PolarHBondContact O-N 2.66Å; T18-K23 HydrophobicContact CG2-CB 4.16Å
24K54.2Low45.3Very low52 Ų52116.9 Ų116.923%0.22660%0.596CS.*EExtended strand (participates in β ladder)trans-68.6134173.9-65.4-174.7-175.6-173.20109.9W15 T26W15-K24 HydrophobicContact CD2-CG 3.95Å; W15-K24 HydrophobicContact CE3-CG 3.74Å; W15-K24 HydrophobicContact CH2-CD 4.1Å; W15-K24 HydrophobicContact CH2-CG 3.62Å; W15-K24 HydrophobicContact CZ2-CD 4.14Å; W15-K24 HydrophobicContact CZ2-CG 3.8Å; W15-K24 HydrophobicContact CZ3-CG 3.57Å; K24-T26 PolarHBondContact O-N 3.33Å; K24-T26 VanDerWaalsContact O-N 3.15Å
25R48.5Very low44.3Very low120 Ų120118 Ų11845%0.45361%0.61SS.*  trans-67.1111.3177.3-162.8-179.6-171.1-173.46.3109.8N14 V16N14-R25 HydrophobicContact CB-CB 4.14Å; N14-R25 PolarHBondContact O-N 2.96Å; V16-R25 HydrophobicContact CG2-CB 4.11Å; V16-R25 HydrophobicContact CG2-CG 4.25Å
26T49.5Very low43.1Very low29 Ų29118.4 Ų118.418%0.17863%0.628CS.*  trans-90150.4168.442.10000109.4K24 D28K24-T26 PolarHBondContact O-N 3.33Å; K24-T26 VanDerWaalsContact O-N 3.15Å; T26-D28 PolarHBondContact O-N 2.72Å
27A46.7Very low41.7Very low64 Ų64119 Ų11953%0.52965%0.647SS.*G310 helixtrans-66.1-4.9-173.900000114.7D29A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 2.94Å
28D41Very low41Very low144 Ų144116 Ų11677%0.7765%0.646SS**G310 helixtrans-75.2-9.3-174.8-78-21.8000115.2T26 K30T26-D28 PolarHBondContact O-N 2.72Å; D28-K30 VanDerWaalsContact C-N 3.31Å; D28-K30 PolarHBondContact O-N 3.18Å
29D39.4Very low39Very low125 Ų125123.3 Ų123.367%0.66867%0.673SS**G310 helixtrans-86.612.6-177-66.2-26.2000114.6A27A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 2.94Å
30K36Very low37.8Very low165 Ų165120.1 Ų120.172%0.71766%0.664SS**G310 helixtrans-106.85.7-177.9-85-168.3-179.9-178.60115.9D28 N32D28-K30 VanDerWaalsContact C-N 3.31Å; D28-K30 PolarHBondContact O-N 3.18Å; K30-N32 PolarHBondContact O-N 3.48Å
31N33.9Very low36.6Very low152 Ų152121 Ų12181%0.81366%0.659SS**  trans-97.788172.9-90.1-0.2000111
32N28.2Very low34.6Very low143 Ų143125.3 Ų125.377%0.76568%0.676SS**  trans-145.8101.3150.1-95.3-23.4000109.8K30K30-N32 PolarHBondContact O-N 3.48Å
33N29.6Very low33.2Very low146 Ų146123.3 Ų123.378%0.78168%0.677SS**  trans48.6123.6145.9-52.8-19.6000119.9
34V26Very low32.1Very low149 Ų149126.7 Ų126.790%0.90369%0.692SS**  -161.1140.5104.51730000109.7
35S25.5Very low31Very low102 Ų102129.5 Ų129.571%0.71372%0.716SS**  trans-84146.3-168.541.30000117
36V26.7Very low29.9Very low146 Ų146132.2 Ų132.289%0.88573%0.734SS**  trans20.3129.8142-171.30000120.3
37G22.3Very low28.8Very low80 Ų80137 Ų13783%0.82577%0.767SS**  trans-155.2108.6156.100000112.3
38S26.8Very low27.8Very low94 Ų94141.7 Ų141.766%0.65778%0.776SS**  trans-77.1149.3174.7166.10000111.8
39F23.3Very low27.3Very low210 Ų210142.7 Ų142.792%0.92178%0.781SS**  trans-163.3135.1142.8-109.9-77.8000112.7
40C24.6Very low27.1Very low110 Ų110145 Ų14574%0.74379%0.785SS**  trans-98.2166.2173.3-63.60000112.2
41K24.8Very low26.9Very low188 Ų188145.9 Ų145.982%0.81779%0.792SS**  trans144.1148.6149.2-82.9178.3177-171.80110.8
42D22.7Very low26.9Very low122 Ų122144 Ų14465%0.65278%0.782SS**  cis-167.3146.40.8-110-39.4000110.9
43N21.7Very low27.4Very low128 Ų128144 Ų14468%0.68478%0.781SS**  trans30.8120.9141-66.4-49.4000128.4
44K22.4Very low27.6Very low191 Ų191144.3 Ų144.383%0.8378%0.782SS**  57168.4125-77.1-173.4-179.5-176.10123.6
45P31Very low28.1Very low112 Ų112143.1 Ų143.173%0.72777%0.77SS**  cis-141.1170.9-16.631.8-7.8000118.9
46E25.8Very low28.6Very low177 Ų177140.4 Ų140.483%0.82775%0.751SS**  trans34.2136.5145.2-64.8178.2179.300127.2
47C25.7Very low28.9Very low130 Ų130139.6 Ų139.688%0.87874%0.741SS**  -160.2137.3125.5-163.40000112.8
48F26.6Very low29.6Very low162 Ų162139.8 Ų139.871%0.71173%0.73SS**  trans-88.7140.7-179.9-100.3-99.2000111.9
49N31.1Very low30Very low165 Ų165143.4 Ų143.488%0.88273%0.73SS**  trans-141.8123.6154.9-116.2-18.2000111.2
50K34.8Very low30.4Very low172 Ų172137.5 Ų137.575%0.74871%0.705SS**  trans-9879-169.6-76.5176.1173173.20110.9
51E31.8Very low30.9Very low185 Ų185140 Ų14086%0.86471%0.708SS**SBendtrans-137.23.8166.4-67-170.2167.100113.8
52N34.6Very low31.5Very low113 Ų113134.2 Ų134.260%0.60469%0.691SS**  trans-106.615.5-178.4-80-47.5000115.1L54 L55 S56N52-L54 PolarHBondContact O-N 3.15Å; N52-L55 PolarHBondContact O-N 3.43Å; N52-S56 PolarHBondContact O-N 3.2Å
53L36.9Very low32.2Very low141 Ų141129.8 Ų129.874%0.73867%0.672SS**THydrogen-bonded Turntrans-67.3-19.8-170.7-145.981.5000114.1
54L34.3Very low32.9Very low154 Ų154130.3 Ų130.381%0.80667%0.668SS**THydrogen-bonded Turntrans-97.2-18.2179.8-94.1158.5000114.5N52N52-L54 PolarHBondContact O-N 3.15Å
55L37.7Very low33.5Very low123 Ų123129.1 Ų129.164%0.64466%0.663SS**THydrogen-bonded Turntrans-86.5-19170.7-75.4160.5000112.2N52N52-L55 PolarHBondContact O-N 3.43Å
56S35.2Very low34.1Very low45 Ų45133.2 Ų133.232%0.31566%0.664SS.*Hα-helixtrans-69.5-31.9178.2154.70000113.6N52 E60N52-S56 PolarHBondContact O-N 3.2Å; S56-E60 VanDerWaalsContact O-CB 3.28Å; S56-E60 WeakPolarHBondContact O-CB 3.34Å; S56-E60 WeakPolarHBondContact O-CG 3.45Å; S56-E60 PolarHBondContact O-N 3.43Å
57L33.9Very low34.5Very low130 Ų130132.7 Ų132.768%0.68166%0.658SS**Hα-helixtrans-73.7-33.2-175.8-85.1149.7000113.9
58S35Very low34.9Very low84 Ų84134.4 Ų134.459%0.58765%0.651SS**Hα-helixtrans-84.5-25.5177.360.60000112.9S62S58-S62 PolarHBondContact O-OG 2.9Å
59Y35.3Very low35.4Very low169 Ų169131.5 Ų131.566%0.66364%0.643SS**Hα-helixtrans-81.7-29.5175-163.7-102.3000112.9M61 S62 A63Y59-M61 PolarHBondContact O-N 3.41Å; Y59-S62 PolarHBondContact O-N 2.94Å; Y59-A63 HydrophobicContact CD1-CB 4.08Å; Y59-A63 HydrophobicContact CE1-CB 3.98Å; Y59-A63 VanDerWaalsContact O-CB 3.28Å; Y59-A63 WeakPolarHBondContact O-CB 3.49Å; Y59-A63 PolarHBondContact O-N 2.93Å
60E31.8Very low36Very low87 Ų87130.1 Ų130.141%0.40764%0.635SS.*Hα-helixtrans-69.4-31.9-177.6-90.3-163.8-163.300114.9S56 S62 K64S56-E60 VanDerWaalsContact O-CB 3.28Å; S56-E60 WeakPolarHBondContact O-CB 3.34Å; S56-E60 WeakPolarHBondContact O-CG 3.45Å; S56-E60 PolarHBondContact O-N 3.43Å; E60-S62 VanDerWaalsContact C-N 3.28Å; E60-S62 PolarHBondContact O-N 3.3Å; E60-K64 WeakPolarHBondContact O-CB 3.37Å; E60-K64 VanDerWaalsContact O-CG 3.27Å; E60-K64 WeakPolarHBondContact O-CG 3.28Å; E60-K64 PolarHBondContact O-N 3.43Å; E60-K64 VanDerWaalsContact O-N 3.1Å; E60-K64 IonicContact OE2-NZ 3.51Å; E60-K64 PolarHBondContact OE2-NZ 3.3Å
61M35.8Very low36Very low162 Ų162129.3 Ų129.380%0.79864%0.635SS**Hα-helixtrans-69.7-31.4175.5-135.675.3176.200111.4Y59Y59-M61 PolarHBondContact O-N 3.41Å
62S37.6Very low36.1Very low67 Ų67125 Ų12547%0.46962%0.619SS.*Hα-helixtrans-83.2-35.8-178.6-48.90000112.4S58 Y59 E60 R66S58-S62 PolarHBondContact O-OG 2.9Å; Y59-S62 PolarHBondContact O-N 2.94Å; E60-S62 VanDerWaalsContact C-N 3.28Å; E60-S62 PolarHBondContact O-N 3.3Å; S62-R66 PolarHBondContact O-N 2.94Å
63A37.5Very low36.1Very low29 Ų29126.2 Ų126.224%0.2463%0.625CS.*Hα-helixtrans-79.3-30.3179.100000112.8Y59 K65 R66 K67Y59-A63 HydrophobicContact CD1-CB 4.08Å; Y59-A63 HydrophobicContact CE1-CB 3.98Å; Y59-A63 VanDerWaalsContact O-CB 3.28Å; Y59-A63 WeakPolarHBondContact O-CB 3.49Å; Y59-A63 PolarHBondContact O-N 2.93Å; A63-K65 VanDerWaalsContact C-N 3.26Å; A63-K65 PolarHBondContact O-N 3.15Å; A63-R66 PolarHBondContact O-N 2.81Å; A63-K67 WeakPolarHBondContact O-CB 3.5Å; A63-K67 PolarHBondContact O-N 3.47Å
64K35.1Very low35.9Very low139 Ų139126.8 Ų126.860%0.60463%0.629SS**Hα-helixtrans-67.7-25.1173.8-74.4173.1-172161.40112.7E60E60-K64 WeakPolarHBondContact O-CB 3.37Å; E60-K64 VanDerWaalsContact O-CG 3.27Å; E60-K64 WeakPolarHBondContact O-CG 3.28Å; E60-K64 PolarHBondContact O-N 3.43Å; E60-K64 VanDerWaalsContact O-N 3.1Å; E60-K64 IonicContact OE2-NZ 3.51Å; E60-K64 PolarHBondContact OE2-NZ 3.3Å
65K36.5Very low35.8Very low166 Ų166122.4 Ų122.472%0.72261%0.611SS**Hα-helixtrans-75-38.2170.6-155.9169.7-176.2175.80112A63A63-K65 VanDerWaalsContact C-N 3.26Å; A63-K65 PolarHBondContact O-N 3.15Å
66R43.2Very low35.8Very low198 Ų198124.8 Ų124.875%0.74762%0.616SS**Hα-helixtrans-85.1-23.8-179.1-68.9-176-172.7166.63.1115.3S62 A63 L70S62-R66 PolarHBondContact O-N 2.94Å; A63-R66 PolarHBondContact O-N 2.81Å; R66-L70 PolarHBondContact O-N 3.27Å
67K34.8Very low36.1Very low165 Ų165128.1 Ų128.172%0.71763%0.629SS**Hα-helixtrans-80.8-23.1174.8-112.2177.7178.4176.50113.7A63 D69 M71A63-K67 WeakPolarHBondContact O-CB 3.5Å; A63-K67 PolarHBondContact O-N 3.47Å; K67-D69 VanDerWaalsContact C-N 3.28Å; K67-M71 PolarHBondContact O-N 3.33Å
68K34.1Very low36.5Very low167 Ų167125.1 Ų125.173%0.72662%0.618SS**Hα-helixtrans-67.8-32.4168.8-170.6171-179.3176.60111.3N72K68-N72 WeakPolarHBondContact O-CB 3.48Å; K68-N72 PolarHBondContact O-N 3.45Å
69D37.2Very low37Very low101 Ų101130.4 Ų130.454%0.5463%0.626SS.*Hα-helixtrans-80.2-32.5178.9-64-25.3000112.7K67 N72K67-D69 VanDerWaalsContact C-N 3.28Å; D69-N72 PolarHBondContact O-N 3.36Å
70L43Very low37.8Very low136 Ų136124 Ų12471%0.71260%0.602SS**Hα-helixtrans-76.4-28.6179.7-140.678.5000113.8R66 N72R66-L70 PolarHBondContact O-N 3.27Å; L70-N72 VanDerWaalsContact C-N 3.34Å
71M34.4Very low38.8Very low154 Ų154126.1 Ų126.176%0.75961%0.611SS**SBendtrans-86.6-3172-90.7-66.1-177.200113.7K67K67-M71 PolarHBondContact O-N 3.33Å
72N34.9Very low40.3Very low96 Ų96125.9 Ų125.951%0.51360%0.601SS.*SBendtrans-86.8-10.2175-159.449.4000113.3K68 D69 L70 N74 S75K68-N72 WeakPolarHBondContact O-CB 3.48Å; K68-N72 PolarHBondContact O-N 3.45Å; D69-N72 PolarHBondContact O-N 3.36Å; L70-N72 VanDerWaalsContact C-N 3.34Å; N72-N74 PolarHBondContact O-N 3.3Å; N72-S75 WeakPolarHBondContact O-CB 3.34Å; N72-S75 PolarHBondContact O-N 3.46Å; N72-S75 VanDerWaalsContact O-N 3.13Å; N72-S75 PolarHBondContact O-OG 3.48Å; N72-S75 VanDerWaalsContact OD1-CB 3.26Å; N72-S75 WeakPolarHBondContact OD1-CB 3.29Å; N72-S75 PolarHBondContact OD1-OG 2.83Å
73N34.6Very low42.1Very low137 Ų137125 Ų12573%0.73359%0.59SS**THydrogen-bonded Turntrans-73.1-17.2174.5-75.6-10.1000113.3
74N32.6Very low44.2Very low154 Ų154130.8 Ų130.882%0.82461%0.61SS**THydrogen-bonded Turntrans-102.711.6168.6-85.8-9.1000113.1N72 K76N72-N74 PolarHBondContact O-N 3.3Å; N74-K76 PolarHBondContact O-N 3.38Å; N74-K76 VanDerWaalsContact O-N 3.12Å
75S31.1Very low46.6Very low61 Ų61127.6 Ų127.643%0.42759%0.594SS.*SBendtrans-72.4108.3164.871.10000107.8N72 I77N72-S75 WeakPolarHBondContact O-CB 3.34Å; N72-S75 PolarHBondContact O-N 3.46Å; N72-S75 VanDerWaalsContact O-N 3.13Å; N72-S75 PolarHBondContact O-OG 3.48Å; N72-S75 VanDerWaalsContact OD1-CB 3.26Å; N72-S75 WeakPolarHBondContact OD1-CB 3.29Å; N72-S75 PolarHBondContact OD1-OG 2.83Å; S75-I77 PolarHBondContact O-N 3.38Å
76K38.4Very low49.1Very low174 Ų174119.7 Ų119.776%0.75756%0.56SS**  trans0113.1163.2-65.6172.4179.1177.60112.8N74N74-K76 PolarHBondContact O-N 3.38Å; N74-K76 VanDerWaalsContact O-N 3.12Å
77I41Very low51.1Low115 Ų115113.7 Ų113.759%0.5954%0.537SS*.  trans-26.7116.1162.3-60.4160.6000107S75 Y79S75-I77 PolarHBondContact O-N 3.38Å; I77-Y79 PolarHBondContact O-N 2.94Å
78P43.1Very low53.4Low67 Ų67106.1 Ų106.144%0.43551%0.505SS..  trans-53.8116.617522-30000104.3F80P78-F80 HydrophobicContact CG-CE2 4.3Å; P78-F80 HydrophobicContact CG-CZ 4.31Å; P78-F80 WeakPolarHBondContact O-CD2 3.33Å; P78-F80 PolarHBondContact O-N 3.35Å
79Y44.4Very low55.4Low195 Ų195100.6 Ų100.677%0.76548%0.481SS*.  trans-59.192.8-176.5-84.3-101.7000105.8I77 H81I77-Y79 PolarHBondContact O-N 2.94Å; Y79-H81 VanDerWaalsContact C-N 3.28Å; Y79-H81 PolarHBondContact O-N 3.29Å
80F52.8Low56.8Low34 Ų34102.8 Ų102.815%0.14949%0.486CS..  trans-58107.6161-66.2-69.7000102.8P78 R82 N107 V142 N146P78-F80 HydrophobicContact CG-CE2 4.3Å; P78-F80 HydrophobicContact CG-CZ 4.31Å; P78-F80 WeakPolarHBondContact O-CD2 3.33Å; P78-F80 PolarHBondContact O-N 3.35Å; F80-R82 WeakPolarHBondContact O-CG 3.4Å; F80-R82 PolarHBondContact O-N 3.05Å; F80-N107 HydrophobicContact CD1-CB 4.46Å; F80-V142 HydrophobicContact CE1-CG1 4.32Å; F80-N146 HydrophobicContact CD1-CB 4.13Å; F80-N146 HydrophobicContact CE1-CB 3.41Å; F80-N146 VanDerWaalsContact CE1-CB 3.41Å; F80-N146 HydrophobicContact CE2-CB 4.49Å; F80-N146 WeakPolarHBondContact CE2-OD1 3.25Å; F80-N146 HydrophobicContact CZ-CB 3.61Å; F80-N146 WeakPolarHBondContact CZ-OD1 3.44Å
81H52.1Low57.5Low131 Ų13198.4 Ų98.461%0.60647%0.473SS*.  trans-51.3117.7178.5-88.9-84.5000106.2Y79 E83 R108Y79-H81 VanDerWaalsContact C-N 3.28Å; Y79-H81 PolarHBondContact O-N 3.29Å; H81-E83 HydrophobicContact CB-CG 4.14Å; H81-E83 PolarHBondContact O-N 3.15Å; H81-E83 VanDerWaalsContact O-N 3.14Å; H81-R108 CarbonylContact O-C 3.49Å; H81-R108 VanDerWaalsContact O-C 3.31Å; H81-R108 WeakPolarHBondContact O-CA 3.38Å
82R67Low58.4Low157 Ų15794.7 Ų94.759%0.59246%0.463SS*.  trans-89.469.7178.3-65.5-175.6-171.8-1795.7107.2F80 D110F80-R82 WeakPolarHBondContact O-CG 3.4Å; F80-R82 PolarHBondContact O-N 3.05Å; R82-D110 HydrophobicContact CB-CB 4.14Å; R82-D110 WeakPolarHBondContact CD-OD2 3.49Å; R82-D110 HydrophobicContact CG-CB 4.34Å
83E76.8Confident59.5Low48 Ų4894.1 Ų94.122%0.22446%0.463CS..BIsolated β-bridgetrans-74.8132.8176.4-60.9-180-157.600108.1H81 W85 I86 R108H81-E83 HydrophobicContact CB-CG 4.14Å; H81-E83 PolarHBondContact O-N 3.15Å; H81-E83 VanDerWaalsContact O-N 3.14Å; E83-W85 VanDerWaalsContact CB-O 3.3Å; E83-W85 WeakPolarHBondContact CB-O 3.38Å; E83-W85 PolarHBondContact O-N 3.29Å; E83-I86 HydrophobicContact CB-CG2 4.16Å; E83-R108 VanDerWaalsContact CD-NE 3.34Å; E83-R108 PolarHBondContact N-O 2.98Å; E83-R108 IonicContact OE1-CZ 2.58Å; E83-R108 VanDerWaalsContact OE1-CZ 3.3Å; E83-R108 IonicContact OE1-NE 2.74Å; E83-R108 PolarHBondContact OE1-NE 3.29Å; E83-R108 IonicContact OE1-NH2 3.14Å; E83-R108 PolarHBondContact OE1-NH2 3.25Å; E83-R108 IonicContact OE2-CZ 3.25Å; E83-R108 VanDerWaalsContact OE2-CZ 3.32Å; E83-R108 IonicContact OE2-NE 3.48Å; E83-R108 PolarHBondContact OE2-NE 3.06Å; E83-R108 IonicContact OE2-NH2 2.67Å; E83-R108 PolarHBondContact OE2-NH2 2.7Å
84K80.7Confident60.3Low152 Ų15298.2 Ų98.266%0.66147%0.474SS*.SBendtrans-66.2-20.5174.9-68-174.3178-176.90111.9T330K84-T330 HydrophobicContact CB-CG2 4.3Å; K84-T330 PolarHBondContact O-OG1 3.34Å
85W87Confident61.4Low72 Ų7299.8 Ų99.827%0.27348%0.477SS..EExtended strand (participates in β ladder)trans-160.2154.5-177.152.2-105000109.7E83 Y87 I324 L325 F326 H332 P333E83-W85 VanDerWaalsContact CB-O 3.3Å; E83-W85 WeakPolarHBondContact CB-O 3.38Å; E83-W85 PolarHBondContact O-N 3.29Å; W85-Y87 HydrophobicContact CE3-CE2 4.33Å; W85-Y87 AromaticContact CH2-CE2 3.99Å; W85-Y87 HydrophobicContact CH2-CE2 3.99Å; W85-Y87 AromaticContact CZ3-CD2 3.87Å; W85-Y87 HydrophobicContact CZ3-CD2 3.87Å; W85-Y87 AromaticContact CZ3-CE2 3.36Å; W85-Y87 HydrophobicContact CZ3-CE2 3.36Å; W85-Y87 AromaticContact CZ3-CZ 3.9Å; W85-I324 HydrophobicContact CB-CG2 3.53Å; W85-I324 HydrophobicContact CD2-CG2 4.2Å; W85-I324 HydrophobicContact CE3-CD1 4.27Å; W85-I324 HydrophobicContact CE3-CG2 4.03Å; W85-I324 HydrophobicContact CG-CG2 4.04Å; W85-L325 CarbonylContact C-O 3.55Å; W85-L325 WeakPolarHBondContact CA-O 3.48Å; W85-F326 HydrophobicContact CB-CB 3.61Å; W85-H332 HydrophobicContact CB-CB 4.49Å; W85-H332 HydrophobicContact CG-CB 4.35Å; W85-P333 VanDerWaalsContact CE2-CD 3.47Å; W85-P333 HydrophobicContact CH2-CG 3.99Å; W85-P333 HydrophobicContact CZ2-CG 3.58Å
86I87Confident62.4Low0 Ų0103 Ų1030%048%0.479CS..EExtended strand (participates in β ladder)trans-131.9152.9177.867.4171.7000110.6E83 V88 A105 R108 L109 I324 L325E83-I86 HydrophobicContact CB-CG2 4.16Å; I86-V88 HydrophobicContact CG1-CG2 4.37Å; I86-A105 VanDerWaalsContact CD1-CA 3.46Å; I86-A105 HydrophobicContact CD1-CB 3.4Å; I86-A105 VanDerWaalsContact CD1-CB 3.4Å; I86-R108 HydrophobicContact CG2-CB 3.67Å; I86-L109 HydrophobicContact CD1-CD1 4.1Å; I86-L109 HydrophobicContact CD1-CD2 4.42Å; I86-L109 HydrophobicContact CD1-CG 4.02Å; I86-L109 HydrophobicContact CG1-CD2 4.12Å; I86-L109 HydrophobicContact CG1-CG 4.27Å; I86-L109 HydrophobicContact CG2-CD2 3.93Å; I86-L109 HydrophobicContact CG2-CG 4.14Å; I86-I324 CarbonylContact O-C 3.31Å; I86-I324 WeakPolarHBondContact O-CA 3.43Å; I86-L325 HydrophobicContact CD1-CD2 4.07Å; I86-L325 HydrophobicContact CG1-CB 3.9Å; I86-L325 HydrophobicContact CG1-CD2 4.22Å; I86-L325 PolarHBondContact N-O 3.3Å; I86-L325 PolarHBondContact O-N 3.12Å
87Y85.5Confident62.6Low72 Ų72104 Ų10428%0.28249%0.486SS..EExtended strand (participates in β ladder)trans-82.5131.7169.2-70.6-79.6000110.8W85 I324W85-Y87 HydrophobicContact CE3-CE2 4.33Å; W85-Y87 AromaticContact CH2-CE2 3.99Å; W85-Y87 HydrophobicContact CH2-CE2 3.99Å; W85-Y87 AromaticContact CZ3-CD2 3.87Å; W85-Y87 HydrophobicContact CZ3-CD2 3.87Å; W85-Y87 AromaticContact CZ3-CE2 3.36Å; W85-Y87 HydrophobicContact CZ3-CE2 3.36Å; W85-Y87 AromaticContact CZ3-CZ 3.9Å; Y87-I324 HydrophobicContact CD1-CD1 4.21Å; Y87-I324 HydrophobicContact CD1-CG1 3.54Å; Y87-I324 HydrophobicContact CE1-CD1 3.53Å; Y87-I324 HydrophobicContact CE1-CG1 3.39Å; Y87-I324 HydrophobicContact CG-CG1 4.35Å
88V84.5Confident63.3Low5 Ų5100 Ų1003%0.0347%0.474CS..  trans-106.5100.1175.5-178.40000108.7I86 L318 H323 L325 F355I86-V88 HydrophobicContact CG1-CG2 4.37Å; V88-L318 HydrophobicContact CB-CD1 4.38Å; V88-L318 HydrophobicContact CG2-CD1 4.43Å; V88-H323 PolarHBondContact N-O 3.44Å; V88-H323 WeakPolarHBondContact O-CB 3.48Å; V88-L325 HydrophobicContact CG2-CB 3.55Å; V88-L325 HydrophobicContact CG2-CD2 4.17Å; V88-L325 HydrophobicContact CG2-CG 4.45Å; V88-F355 HydrophobicContact CG1-CE1 4.01Å; V88-F355 HydrophobicContact CG1-CZ 4.41Å; V88-F355 HydrophobicContact CG2-CZ 4.35Å
89H75.4Confident64.4Low51 Ų51104.3 Ų104.324%0.23648%0.483CS..  trans-99125.9177.1-64.2-53.1000110.6G91 R96H89-G91 VanDerWaalsContact C-N 3.32Å; H89-R96 PolarHBondContact CE1-NH1 3.23Å; H89-R96 VanDerWaalsContact CE1-NH1 3.31Å; H89-R96 PolarHBondContact NE2-NH1 2.89Å
90K65.9Low66.2Low148 Ų14895.3 Ų95.364%0.64345%0.448SS*.SBendtrans-83.4-3.9177.8-61.4-167.5171-175.40113.8F357K90-F357 HydrophobicContact CB-CE1 3.7Å; K90-F357 HydrophobicContact CB-CZ 4.03Å; K90-F357 HydrophobicContact CD-CE1 4.04Å; K90-F357 HydrophobicContact CG-CE1 3.64Å; K90-F357 HydrophobicContact CG-CZ 3.82Å
91G57.8Low67.9Low43 Ų4396.3 Ų96.344%0.44346%0.457SS..SBendtrans-164.7157.5-179.300000112.5H89H89-G91 VanDerWaalsContact C-N 3.32Å
92S53.7Low69.7Low76 Ų7690.7 Ų90.753%0.53143%0.432SS..  trans-80.4133.9175.1-165.40000109.7
93T57.3Low70.8Confident84 Ų8483.5 Ų83.552%0.51541%0.406SS..BIsolated β-bridgetrans-115.7161.1174.558.70000109.8E95 R96T93-E95 PolarHBondContact O-N 3.48Å; T93-E95 VanDerWaalsContact O-N 3.12Å; T93-R96 PolarHBondContact N-O 3.02Å; T93-R96 CarbonylContact O-C 3.43Å; T93-R96 PolarHBondContact O-N 3.32Å; T93-R96 PolarHBondContact OG1-N 3.09Å
94K51.5Low71.3Confident224 Ų22484.4 Ų84.497%0.97441%0.41SS*.THydrogen-bonded Turntrans-59-24.4178.8-72-173.8177.9-179.20113.3
95E56Low71.8Confident187 Ų18777.2 Ų77.287%0.87438%0.379SS*.THydrogen-bonded Turntrans-95.8-16.9-178.8-62.5-179.4179.200113.8T93T93-E95 PolarHBondContact O-N 3.48Å; T93-E95 VanDerWaalsContact O-N 3.12Å
96R52.8Low71.9Confident128 Ų12873.8 Ų73.848%0.48337%0.366SS..BIsolated β-bridgetrans-139.5115.7-179.8-64.5-173.4-175-171.52.2111H89 T93H89-R96 PolarHBondContact CE1-NH1 3.23Å; H89-R96 VanDerWaalsContact CE1-NH1 3.31Å; H89-R96 PolarHBondContact NE2-NH1 2.89Å; T93-R96 PolarHBondContact N-O 3.02Å; T93-R96 CarbonylContact O-C 3.43Å; T93-R96 PolarHBondContact O-N 3.32Å; T93-R96 PolarHBondContact OG1-N 3.09Å
97H41.6Very low72.1Confident194 Ų19474.8 Ų74.890%0.89837%0.371SS*.  trans-86.2121.5178.2-141.784.3000110.4
98G56Low72.3Confident33 Ų3374.4 Ų74.434%0.3437%0.369SS..  trans127.213916800000114.8
99Y67.5Low72.5Confident157 Ų15774.5 Ų74.562%0.61637%0.369SS*.PPolyproline II helixtrans-94.6134.4165.850.8-84.1000108.1T101Y99-T101 HydrophobicContact CD2-CG2 3.47Å; Y99-T101 VanDerWaalsContact CD2-CG2 3.47Å; Y99-T101 HydrophobicContact CE2-CG2 3.32Å; Y99-T101 PolarHBondContact O-N 3.35Å
100C81.4Confident73Confident5 Ų573.5 Ų73.53%0.03437%0.366CS..PPolyproline II helixtrans-76.1119.1174.8-171.50000108F355C100-F355 HydrophobicContact CB-CE1 4.27Å; C100-F355 VanDerWaalsContact O-CD1 3.22Å; C100-F355 WeakPolarHBondContact O-CD1 3.41Å
101T88.3Confident74.2Confident55 Ų5566.5 Ų66.534%0.33734%0.336SS..PPolyproline II helixtrans-91.1160.8175.761.30000111.3Y99 G103 E104 A105Y99-T101 HydrophobicContact CD2-CG2 3.47Å; Y99-T101 VanDerWaalsContact CD2-CG2 3.47Å; Y99-T101 HydrophobicContact CE2-CG2 3.32Å; Y99-T101 PolarHBondContact O-N 3.35Å; T101-G103 PolarHBondContact O-N 3.22Å; T101-E104 PolarHBondContact O-N 3.47Å; T101-E104 VanDerWaalsContact O-N 3.08Å; T101-E104 WeakPolarHBondContact OG1-CB 3.33Å; T101-E104 PolarHBondContact OG1-N 2.94Å; T101-E104 VanDerWaalsContact OG1-N 3.14Å; T101-A105 PolarHBondContact O-N 3.26Å
102L90.4Very high75.6Confident14 Ų1465.2 Ų65.27%0.07332%0.32CS..Hα-helixtrans-51.9-44.4171.1177.562.7000111.7E104 A105 F106 Q135 L139 F351 I352 F355L102-E104 VanDerWaalsContact C-N 3.35Å; L102-E104 PolarHBondContact O-N 3.32Å; L102-A105 PolarHBondContact O-N 3.48Å; L102-F106 WeakPolarHBondContact O-CB 3.2Å; L102-F106 PolarHBondContact O-N 2.86Å; L102-Q135 HydrophobicContact CD2-CB 4.05Å; L102-Q135 HydrophobicContact CD2-CG 4.18Å; L102-L139 HydrophobicContact CB-CD2 4.42Å; L102-L139 HydrophobicContact CD2-CD2 4.01Å; L102-L139 HydrophobicContact CG-CD2 3.98Å; L102-F351 HydrophobicContact CD1-CD1 4.24Å; L102-F351 HydrophobicContact CD1-CE1 3.52Å; L102-F351 HydrophobicContact CD1-CZ 3.96Å; L102-I352 HydrophobicContact CD1-CG1 4.37Å; L102-I352 HydrophobicContact CD2-CG2 4.33Å; L102-F355 HydrophobicContact CB-CB 3.87Å; L102-F355 HydrophobicContact CB-CD2 4.06Å; L102-F355 HydrophobicContact CB-CG 4.03Å; L102-F355 HydrophobicContact CD1-CD2 3.79Å; L102-F355 HydrophobicContact CD1-CE2 4.25Å
103G88.8Confident77.1Confident5 Ų563.8 Ų63.85%0.05231%0.31CS..Hα-helixtrans-66-34.8179.300000113.5T101 N107T101-G103 PolarHBondContact O-N 3.22Å; G103-N107 WeakPolarHBondContact O-CB 3.25Å; G103-N107 PolarHBondContact O-N 2.85Å; G103-N107 VanDerWaalsContact O-N 3.13Å; G103-N107 PolarHBondContact O-ND2 2.94Å
104E88.8Confident78.6Confident68 Ų6859.8 Ų59.832%0.31829%0.285SS..Hα-helixtrans-69.4-48.7174.6-168.1-169.5158.800111.3T101 L102 F106 N107 R108T101-E104 PolarHBondContact O-N 3.47Å; T101-E104 VanDerWaalsContact O-N 3.08Å; T101-E104 WeakPolarHBondContact OG1-CB 3.33Å; T101-E104 PolarHBondContact OG1-N 2.94Å; T101-E104 VanDerWaalsContact OG1-N 3.14Å; L102-E104 VanDerWaalsContact C-N 3.35Å; L102-E104 PolarHBondContact O-N 3.32Å; E104-F106 VanDerWaalsContact C-N 3.27Å; E104-F106 PolarHBondContact O-N 3Å; E104-N107 PolarHBondContact O-N 3.31Å; E104-N107 VanDerWaalsContact O-N 3.09Å; E104-R108 HydrophobicContact CG-CG 4.37Å; E104-R108 WeakPolarHBondContact O-CG 3.37Å; E104-R108 PolarHBondContact O-N 3.4Å; E104-R108 WeakPolarHBondContact OE1-CD 3.46Å; E104-R108 IonicContact OE1-CZ 3.33Å; E104-R108 IonicContact OE1-NH1 2.71Å; E104-R108 PolarHBondContact OE1-NH1 3.18Å
105A90.1Very high80.5Confident0 Ų049.3 Ų49.30%024%0.24CC..Hα-helixtrans-57.9-42.6176.400000111.7I86 T101 L102 N107 R108 L109 F351 F355I86-A105 VanDerWaalsContact CD1-CA 3.46Å; I86-A105 HydrophobicContact CD1-CB 3.4Å; I86-A105 VanDerWaalsContact CD1-CB 3.4Å; T101-A105 PolarHBondContact O-N 3.26Å; L102-A105 PolarHBondContact O-N 3.48Å; A105-N107 VanDerWaalsContact C-N 3.29Å; A105-N107 PolarHBondContact O-N 3.45Å; A105-R108 PolarHBondContact O-N 3.43Å; A105-L109 WeakPolarHBondContact O-CB 3.43Å; A105-L109 WeakPolarHBondContact O-CG 3.06Å; A105-L109 PolarHBondContact O-N 3.45Å; A105-F351 HydrophobicContact CB-CE2 4.31Å; A105-F351 HydrophobicContact CB-CZ 4.21Å; A105-F355 HydrophobicContact CB-CE1 3.94Å; A105-F355 HydrophobicContact CB-CE2 3.95Å; A105-F355 HydrophobicContact CB-CZ 3.38Å
106F90.6Very high82Confident0 Ų047 Ų470%023%0.227CC..Hα-helixtrans-64.5-31.2177.3-169.5-101.5000113.5L102 E104 F111 L127 L128 I131 N146 Y147 I150L102-F106 WeakPolarHBondContact O-CB 3.2Å; L102-F106 PolarHBondContact O-N 2.86Å; E104-F106 VanDerWaalsContact C-N 3.27Å; E104-F106 PolarHBondContact O-N 3Å; F106-F111 AromaticContact CD2-CD2 3.92Å; F106-F111 HydrophobicContact CD2-CD2 3.92Å; F106-F111 AromaticContact CD2-CE2 3.75Å; F106-F111 HydrophobicContact CD2-CE2 3.75Å; F106-F111 HydrophobicContact CD2-CZ 4.36Å; F106-F111 HydrophobicContact CE2-CD2 4.1Å; F106-F111 HydrophobicContact CE2-CE2 4.28Å; F106-F111 HydrophobicContact CE2-CG 4.44Å; F106-F111 HydrophobicContact CG-CE2 4.44Å; F106-L127 HydrophobicContact CD2-CD2 4.46Å; F106-L127 HydrophobicContact CE2-CD2 4.39Å; F106-L128 HydrophobicContact CE2-CD2 4.18Å; F106-L128 HydrophobicContact CZ-CD2 3.77Å; F106-I131 HydrophobicContact CD2-CD1 4.01Å; F106-I131 HydrophobicContact CE2-CD1 3.86Å; F106-I131 HydrophobicContact CZ-CD1 4.43Å; F106-N146 HydrophobicContact CE1-CB 4.38Å; F106-N146 PolarHBondContact O-ND2 3.11Å; F106-Y147 HydrophobicContact CZ-CD2 4.3Å; F106-I150 HydrophobicContact CE1-CD1 3.62Å; F106-I150 HydrophobicContact CE2-CD1 4.26Å; F106-I150 HydrophobicContact CZ-CD1 3.47Å; F106-I150 VanDerWaalsContact CZ-CD1 3.47Å
107N90.5Very high83.5Confident22 Ų2242.2 Ų42.212%0.11821%0.211CC..Hα-helixtrans-82.1-30.1177.7-74.6-27000114.2F80 G103 E104 A105 A143 N146F80-N107 HydrophobicContact CD1-CB 4.46Å; G103-N107 WeakPolarHBondContact O-CB 3.25Å; G103-N107 PolarHBondContact O-N 2.85Å; G103-N107 VanDerWaalsContact O-N 3.13Å; G103-N107 PolarHBondContact O-ND2 2.94Å; E104-N107 PolarHBondContact O-N 3.31Å; E104-N107 VanDerWaalsContact O-N 3.09Å; A105-N107 VanDerWaalsContact C-N 3.29Å; A105-N107 PolarHBondContact O-N 3.45Å; N107-A143 PolarHBondContact ND2-N 3.25Å; N107-A143 WeakPolarHBondContact OD1-CA 3.36Å; N107-N146 WeakPolarHBondContact OD1-CB 3.47Å; N107-N146 PolarHBondContact OD1-ND2 3.48Å
108R88.7Confident85.6Confident64 Ų6434.2 Ų34.224%0.24218%0.176CC..Hα-helixtrans-92.7-26.2-174.4-68.4176.468.8-173.5-3.4113.7H81 E83 I86 E104 A105H81-R108 CarbonylContact O-C 3.49Å; H81-R108 VanDerWaalsContact O-C 3.31Å; H81-R108 WeakPolarHBondContact O-CA 3.38Å; E83-R108 VanDerWaalsContact CD-NE 3.34Å; E83-R108 PolarHBondContact N-O 2.98Å; E83-R108 IonicContact OE1-CZ 2.58Å; E83-R108 VanDerWaalsContact OE1-CZ 3.3Å; E83-R108 IonicContact OE1-NE 2.74Å; E83-R108 PolarHBondContact OE1-NE 3.29Å; E83-R108 IonicContact OE1-NH2 3.14Å; E83-R108 PolarHBondContact OE1-NH2 3.25Å; E83-R108 IonicContact OE2-CZ 3.25Å; E83-R108 VanDerWaalsContact OE2-CZ 3.32Å; E83-R108 IonicContact OE2-NE 3.48Å; E83-R108 PolarHBondContact OE2-NE 3.06Å; E83-R108 IonicContact OE2-NH2 2.67Å; E83-R108 PolarHBondContact OE2-NH2 2.7Å; I86-R108 HydrophobicContact CG2-CB 3.67Å; E104-R108 HydrophobicContact CG-CG 4.37Å; E104-R108 WeakPolarHBondContact O-CG 3.37Å; E104-R108 PolarHBondContact O-N 3.4Å; E104-R108 WeakPolarHBondContact OE1-CD 3.46Å; E104-R108 IonicContact OE1-CZ 3.33Å; E104-R108 IonicContact OE1-NH1 2.71Å; E104-R108 PolarHBondContact OE1-NH1 3.18Å; A105-R108 PolarHBondContact O-N 3.43Å
109L89.1Confident87Confident6 Ų637.7 Ų37.73%0.03118%0.179CC..BIsolated β-bridgetrans-79.7140.5174-69.2168.5000110.8I86 A105 F111 L316 L325 F351I86-L109 HydrophobicContact CD1-CD1 4.1Å; I86-L109 HydrophobicContact CD1-CD2 4.42Å; I86-L109 HydrophobicContact CD1-CG 4.02Å; I86-L109 HydrophobicContact CG1-CD2 4.12Å; I86-L109 HydrophobicContact CG1-CG 4.27Å; I86-L109 HydrophobicContact CG2-CD2 3.93Å; I86-L109 HydrophobicContact CG2-CG 4.14Å; A105-L109 WeakPolarHBondContact O-CB 3.43Å; A105-L109 WeakPolarHBondContact O-CG 3.06Å; A105-L109 PolarHBondContact O-N 3.45Å; L109-F111 HydrophobicContact CB-CD2 3.96Å; L109-F111 HydrophobicContact CB-CE2 3.58Å; L109-F111 HydrophobicContact CB-CZ 4.2Å; L109-F111 HydrophobicContact CD1-CE2 4.02Å; L109-F111 HydrophobicContact CD1-CZ 4.03Å; L109-F111 HydrophobicContact CG-CE2 4.44Å; L109-F111 PolarHBondContact O-N 3.31Å; L109-L316 HydrophobicContact CD1-CD1 4.12Å; L109-L316 HydrophobicContact CD1-CD2 4.27Å; L109-L325 HydrophobicContact CD1-CD2 3.61Å; L109-L325 HydrophobicContact CD1-CG 4.28Å; L109-F351 HydrophobicContact CD1-CE2 4.11Å; L109-F351 HydrophobicContact CD1-CZ 4.5Å
110D87.1Confident88Confident31 Ų3131.4 Ų31.417%0.16615%0.154CC..  trans-79.668.1-179.3-167.13.3000113.1R82 S112 S113 A114R82-D110 HydrophobicContact CB-CB 4.14Å; R82-D110 WeakPolarHBondContact CD-OD2 3.49Å; R82-D110 HydrophobicContact CG-CB 4.34Å; D110-S112 PolarHBondContact O-N 3.31Å; D110-S112 PolarHBondContact OD1-N 3.17Å; D110-S113 PolarHBondContact OD1-N 2.82Å; D110-S113 PolarHBondContact OD1-OG 3.17Å; D110-S113 WeakPolarHBondContact OD2-CB 3.32Å; D110-S113 PolarHBondContact OD2-OG 3.3Å; D110-A114 PolarHBondContact O-N 3.39Å
111F90.6Very high88.5Confident1 Ų131.3 Ų31.30%0.00415%0.153CC..Hα-helixtrans-63.9-26.1171.2-71.1-72.5000112.2F106 L109 A114 I115 V124 L127 I150 L316 W327 F351F106-F111 AromaticContact CD2-CD2 3.92Å; F106-F111 HydrophobicContact CD2-CD2 3.92Å; F106-F111 AromaticContact CD2-CE2 3.75Å; F106-F111 HydrophobicContact CD2-CE2 3.75Å; F106-F111 HydrophobicContact CD2-CZ 4.36Å; F106-F111 HydrophobicContact CE2-CD2 4.1Å; F106-F111 HydrophobicContact CE2-CE2 4.28Å; F106-F111 HydrophobicContact CE2-CG 4.44Å; F106-F111 HydrophobicContact CG-CE2 4.44Å; L109-F111 HydrophobicContact CB-CD2 3.96Å; L109-F111 HydrophobicContact CB-CE2 3.58Å; L109-F111 HydrophobicContact CB-CZ 4.2Å; L109-F111 HydrophobicContact CD1-CE2 4.02Å; L109-F111 HydrophobicContact CD1-CZ 4.03Å; L109-F111 HydrophobicContact CG-CE2 4.44Å; L109-F111 PolarHBondContact O-N 3.31Å; F111-A114 WeakPolarHBondContact O-CB 3.45Å; F111-A114 PolarHBondContact O-N 2.86Å; F111-I115 WeakPolarHBondContact O-CD1 3.43Å; F111-I115 WeakPolarHBondContact O-CG1 3.33Å; F111-I115 PolarHBondContact O-N 3.33Å; F111-V124 HydrophobicContact CD1-CG1 4.29Å; F111-V124 HydrophobicContact CD1-CG2 4.02Å; F111-L127 HydrophobicContact CD1-CD2 4.31Å; F111-L127 HydrophobicContact CE1-CD2 3.49Å; F111-L127 VanDerWaalsContact CE1-CD2 3.49Å; F111-L127 HydrophobicContact CZ-CD2 3.62Å; F111-I150 HydrophobicContact CB-CD1 3.84Å; F111-L316 HydrophobicContact CE1-CD1 4.18Å; F111-L316 HydrophobicContact CZ-CD1 3.99Å; F111-W327 HydrophobicContact CD1-CH2 4.31Å; F111-W327 AromaticContact CD1-CZ2 3.75Å; F111-W327 HydrophobicContact CD1-CZ2 3.75Å; F111-W327 HydrophobicContact CE1-CH2 4.09Å; F111-W327 AromaticContact CE1-CZ2 3.7Å; F111-W327 HydrophobicContact CE1-CZ2 3.7Å; F111-F351 HydrophobicContact CZ-CE1 4.48Å; F111-F351 HydrophobicContact CZ-CZ 4.23Å
112S86.7Confident88.6Confident15 Ų1531.1 Ų31.111%0.10515%0.15CC..Hα-helixtrans-67.6-42-178.6-71.40000113D110 R153D110-S112 PolarHBondContact O-N 3.31Å; D110-S112 PolarHBondContact OD1-N 3.17Å; S112-R153 PolarHBondContact OG-NH1 3.18Å
113S86.1Confident88.7Confident46 Ų4630.4 Ų30.432%0.32215%0.146SC..Hα-helixtrans-73.5-34.2171.2-57.20000111.2D110 I115 K116D110-S113 PolarHBondContact OD1-N 2.82Å; D110-S113 PolarHBondContact OD1-OG 3.17Å; D110-S113 WeakPolarHBondContact OD2-CB 3.32Å; D110-S113 PolarHBondContact OD2-OG 3.3Å; S113-I115 VanDerWaalsContact C-N 3.26Å; S113-I115 PolarHBondContact O-N 2.89Å; S113-K116 WeakPolarHBondContact O-CB 3.35Å; S113-K116 PolarHBondContact O-N 2.96Å
114A88.3Confident89Confident1 Ų130.2 Ų30.21%0.00814%0.144CC..Hα-helixtrans-60.4-32.7176.800000113.2D110 F111 K116 D117 R120 V124 W327D110-A114 PolarHBondContact O-N 3.39Å; F111-A114 WeakPolarHBondContact O-CB 3.45Å; F111-A114 PolarHBondContact O-N 2.86Å; A114-K116 PolarHBondContact O-N 3.3Å; A114-D117 PolarHBondContact O-N 2.67Å; A114-R120 HydrophobicContact CB-CB 4.07Å; A114-R120 WeakPolarHBondContact O-CB 3.45Å; A114-V124 HydrophobicContact CB-CG2 3.98Å; A114-W327 HydrophobicContact CB-CH2 4.08Å; A114-W327 HydrophobicContact CB-CZ2 3.54Å
115I90.4Very high89.2Confident4 Ų427.2 Ų27.22%0.02113%0.13CC..Hα-helixtrans-61.1-34.2173.4-64.8152.8000111.4F111 S113 D117 F121 V124 I150 R153 V154 K157F111-I115 WeakPolarHBondContact O-CD1 3.43Å; F111-I115 WeakPolarHBondContact O-CG1 3.33Å; F111-I115 PolarHBondContact O-N 3.33Å; S113-I115 VanDerWaalsContact C-N 3.26Å; S113-I115 PolarHBondContact O-N 2.89Å; I115-D117 VanDerWaalsContact C-N 3.28Å; I115-D117 PolarHBondContact O-N 2.77Å; I115-F121 HydrophobicContact CG2-CD2 4.1Å; I115-F121 HydrophobicContact CG2-CE2 4.16Å; I115-F121 WeakPolarHBondContact O-CD2 3.41Å; I115-V124 HydrophobicContact CG1-CG1 3.99Å; I115-I150 HydrophobicContact CD1-CB 4.38Å; I115-I150 HydrophobicContact CD1-CG2 3.55Å; I115-I150 HydrophobicContact CG1-CG2 4.45Å; I115-R153 HydrophobicContact CD1-CB 4.13Å; I115-V154 HydrophobicContact CD1-CG2 3.88Å; I115-V154 HydrophobicContact CG1-CG2 3.8Å; I115-V154 HydrophobicContact CG2-CG2 3.96Å; I115-K157 HydrophobicContact CG2-CB 4.37Å; I115-K157 HydrophobicContact CG2-CD 3.72Å; I115-K157 WeakPolarHBondContact O-CD 3.44Å; I115-K157 WeakPolarHBondContact O-CE 3.45Å
116K87.5Confident89.4Confident137 Ų13729.8 Ų29.860%0.59614%0.14SC*.Hα-helixtrans-69-30.7-179.5-60.8-176.2177.4-174.80111.8S113 A114 K157S113-K116 WeakPolarHBondContact O-CB 3.35Å; S113-K116 PolarHBondContact O-N 2.96Å; A114-K116 PolarHBondContact O-N 3.3Å; K116-K157 PolarHBondContact O-NZ 3.44Å
117D86.1Confident89.6Confident29 Ų2929.8 Ų29.816%0.15514%0.14CC..SBendtrans-79.3118175.8-175.41.2000111.6A114 I115 R119 R120 F121A114-D117 PolarHBondContact O-N 2.67Å; I115-D117 VanDerWaalsContact C-N 3.28Å; I115-D117 PolarHBondContact O-N 2.77Å; D117-R119 PolarHBondContact O-N 3.32Å; D117-R119 VanDerWaalsContact O-N 3.13Å; D117-R119 WeakPolarHBondContact OD1-CB 3.27Å; D117-R119 WeakPolarHBondContact OD1-CG 3.48Å; D117-R119 PolarHBondContact OD1-N 2.76Å; D117-R120 HydrophobicContact CB-CB 4.45Å; D117-R120 PolarHBondContact O-N 2.83Å; D117-R120 IonicContact OD2-NH2 2.67Å; D117-F121 WeakPolarHBondContact O-CB 3.5Å; D117-F121 PolarHBondContact O-N 2.91Å
118T84.9Confident89.8Confident26 Ų2628.7 Ų28.716%0.1613%0.134CC..Hα-helixtrans-56.9-25.8175.860.60000113.8
119R85.4Confident90.1Very high106 Ų10627 Ų2740%0.413%0.129SC..Hα-helixtrans-74.5-35-179.6-59.5174.5-175.7177.53.2112.4D117 D314D117-R119 PolarHBondContact O-N 3.32Å; D117-R119 VanDerWaalsContact O-N 3.13Å; D117-R119 WeakPolarHBondContact OD1-CB 3.27Å; D117-R119 WeakPolarHBondContact OD1-CG 3.48Å; D117-R119 PolarHBondContact OD1-N 2.76Å; R119-D314 HydrophobicContact CB-CB 4Å; R119-D314 PolarHBondContact O-N 2.8Å
120R89.1Confident90.3Very high24 Ų2427.5 Ų27.59%0.09113%0.132CC..Hα-helixtrans-93.5-22.1-179.9-65.8-179-178.5129.453.1113.1A114 D117 N122 Y123 V124 D314 W327 D329A114-R120 HydrophobicContact CB-CB 4.07Å; A114-R120 WeakPolarHBondContact O-CB 3.45Å; D117-R120 HydrophobicContact CB-CB 4.45Å; D117-R120 PolarHBondContact O-N 2.83Å; D117-R120 IonicContact OD2-NH2 2.67Å; R120-N122 PolarHBondContact O-N 3.33Å; R120-Y123 WeakPolarHBondContact O-CA 3.43Å; R120-Y123 VanDerWaalsContact O-CB 3.25Å; R120-Y123 WeakPolarHBondContact O-CB 3.43Å; R120-Y123 PolarHBondContact O-N 3.4Å; R120-V124 PolarHBondContact O-N 3Å; R120-D314 HydrophobicContact CG-CB 3.84Å; R120-D314 IonicContact CZ-OD2 3.28Å; R120-D314 VanDerWaalsContact CZ-OD2 3.25Å; R120-D314 IonicContact NE-OD2 3.07Å; R120-D314 PolarHBondContact NE-OD2 2.97Å; R120-D314 IonicContact NH2-OD2 3.51Å; R120-D314 PolarHBondContact NH2-OD2 3.49Å; R120-W327 HydrophobicContact CB-CH2 4.41Å; R120-W327 HydrophobicContact CB-CZ3 4.21Å; R120-W327 VanDerWaalsContact CD-CE3 3.48Å; R120-W327 HydrophobicContact CG-CE3 3.95Å; R120-W327 HydrophobicContact CG-CH2 4.45Å; R120-W327 HydrophobicContact CG-CZ3 3.86Å; R120-D329 IonicContact CZ-OD1 3.06Å; R120-D329 IonicContact CZ-OD2 2.89Å; R120-D329 IonicContact NH1-OD1 2.61Å; R120-D329 PolarHBondContact NH1-OD1 2.89Å; R120-D329 IonicContact NH1-OD2 3.2Å; R120-D329 IonicContact NH2-OD1 2.73Å; R120-D329 PolarHBondContact NH2-OD1 3.47Å; R120-D329 IonicContact NH2-OD2 3.15Å; R120-D329 PolarHBondContact NH2-OD2 3.17Å
121F90.8Very high90.6Very high4 Ų426 Ų262%0.01812%0.124CC..Hα-helixtrans-47.6-53.7-174.7-178.1-94.9000113.6I115 D117 Y123 V124 V125 V154 K157 V158 N164 I168I115-F121 HydrophobicContact CG2-CD2 4.1Å; I115-F121 HydrophobicContact CG2-CE2 4.16Å; I115-F121 WeakPolarHBondContact O-CD2 3.41Å; D117-F121 WeakPolarHBondContact O-CB 3.5Å; D117-F121 PolarHBondContact O-N 2.91Å; F121-Y123 VanDerWaalsContact C-N 3.26Å; F121-Y123 PolarHBondContact O-N 3.06Å; F121-V124 PolarHBondContact O-N 3.17Å; F121-V124 VanDerWaalsContact O-N 3.14Å; F121-V125 HydrophobicContact CD1-CG2 4.06Å; F121-V125 HydrophobicContact CE1-CG2 3.6Å; F121-V125 HydrophobicContact CE2-CG2 4.2Å; F121-V125 HydrophobicContact CZ-CG2 3.69Å; F121-V125 WeakPolarHBondContact O-CG2 3.34Å; F121-V125 PolarHBondContact O-N 3.46Å; F121-V154 HydrophobicContact CE2-CG1 4.01Å; F121-V154 HydrophobicContact CZ-CG1 3.96Å; F121-K157 HydrophobicContact CD2-CD 3.87Å; F121-K157 HydrophobicContact CE2-CD 3.89Å; F121-V158 HydrophobicContact CE1-CG2 4.41Å; F121-V158 HydrophobicContact CE2-CG2 4.28Å; F121-V158 HydrophobicContact CZ-CG2 3.56Å; F121-N164 HydrophobicContact CD1-CB 4.41Å; F121-N164 HydrophobicContact CE1-CB 3.68Å; F121-I168 HydrophobicContact CZ-CD1 4.14Å
122N90.1Very high90.6Very high50 Ų5026 Ų2627%0.26712%0.123SC..Hα-helixtrans-64-30.3-178.8-72.2-19.9000113.1R120 R126 Y312R120-N122 PolarHBondContact O-N 3.33Å; N122-R126 WeakPolarHBondContact O-CB 2.91Å; N122-R126 PolarHBondContact O-N 2.72Å; N122-R126 VanDerWaalsContact O-N 3.1Å; N122-Y312 HydrophobicContact CB-CD1 4.19Å; N122-Y312 HydrophobicContact CB-CE1 4.31Å; N122-Y312 WeakPolarHBondContact O-CE1 3.28Å
123Y93.1Very high90.8Very high0 Ų030.1 Ų30.10%014%0.14CC..Hα-helixtrans-65.9-48.2174.3-178.8-81.1000110.5R120 F121 R126 L127 Y312 T315 L316 W327 L346 P348R120-Y123 WeakPolarHBondContact O-CA 3.43Å; R120-Y123 VanDerWaalsContact O-CB 3.25Å; R120-Y123 WeakPolarHBondContact O-CB 3.43Å; R120-Y123 PolarHBondContact O-N 3.4Å; F121-Y123 VanDerWaalsContact C-N 3.26Å; F121-Y123 PolarHBondContact O-N 3.06Å; Y123-R126 PolarHBondContact O-N 3.45Å; Y123-L127 HydrophobicContact CE1-CD2 4.46Å; Y123-L127 WeakPolarHBondContact O-CB 3.34Å; Y123-L127 PolarHBondContact O-N 3.49Å; Y123-Y312 VanDerWaalsContact CA-CD1 3.5Å; Y123-Y312 HydrophobicContact CD2-CD1 4.35Å; Y123-Y312 AromaticContact CD2-CD2 3.91Å; Y123-Y312 HydrophobicContact CD2-CD2 3.91Å; Y123-Y312 HydrophobicContact CD2-CE2 4.38Å; Y123-Y312 AromaticContact CD2-CG 3.9Å; Y123-Y312 HydrophobicContact CD2-CG 3.9Å; Y123-Y312 HydrophobicContact CG-CG 4.49Å; Y123-T315 HydrophobicContact CD2-CG2 3.95Å; Y123-T315 HydrophobicContact CE2-CG2 4.1Å; Y123-L316 HydrophobicContact CE1-CD1 3.99Å; Y123-L316 HydrophobicContact CE1-CG 4.16Å; Y123-W327 AromaticContact CD1-CH2 3.72Å; Y123-W327 HydrophobicContact CD1-CH2 3.72Å; Y123-W327 AromaticContact CD1-CZ3 3.97Å; Y123-W327 HydrophobicContact CD1-CZ3 3.97Å; Y123-W327 HydrophobicContact CE1-CH2 4.05Å; Y123-W327 HydrophobicContact CE1-CZ3 4.29Å; Y123-W327 HydrophobicContact CG-CZ3 4.44Å; Y123-L346 VanDerWaalsContact CE2-O 3.31Å; Y123-L346 WeakPolarHBondContact CE2-O 3.27Å; Y123-P348 HydrophobicContact CD2-CG 3.67Å; Y123-P348 HydrophobicContact CE1-CG 4.47Å; Y123-P348 HydrophobicContact CE2-CB 4.45Å; Y123-P348 VanDerWaalsContact CE2-CD 3.47Å; Y123-P348 HydrophobicContact CE2-CG 3.61Å; Y123-P348 HydrophobicContact CG-CG 4.14Å
124V94.4Very high90.8Very high0 Ų031.5 Ų31.50%015%0.149CC..Hα-helixtrans-63.8-44.3179.8-177.10000111F111 A114 I115 R120 F121 R126 L127 L128 I150 W327F111-V124 HydrophobicContact CD1-CG1 4.29Å; F111-V124 HydrophobicContact CD1-CG2 4.02Å; A114-V124 HydrophobicContact CB-CG2 3.98Å; I115-V124 HydrophobicContact CG1-CG1 3.99Å; R120-V124 PolarHBondContact O-N 3Å; F121-V124 PolarHBondContact O-N 3.17Å; F121-V124 VanDerWaalsContact O-N 3.14Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 3.24Å; V124-L127 WeakPolarHBondContact O-CB 2.97Å; V124-L127 PolarHBondContact O-N 2.88Å; V124-L128 HydrophobicContact CG1-CD1 4.37Å; V124-L128 HydrophobicContact CG1-CG 4.45Å; V124-L128 WeakPolarHBondContact O-CG 3.47Å; V124-L128 PolarHBondContact O-N 3.13Å; V124-I150 HydrophobicContact CG1-CG2 4.3Å; V124-W327 HydrophobicContact CG2-CH2 4.15Å
125V93.8Very high90.7Very high6 Ų633.2 Ų33.24%0.03616%0.157CC..Hα-helixtrans-58.8-46.2177.11720000111.1F121 L127 L128 E129 V154 P167 I168 L171F121-V125 HydrophobicContact CD1-CG2 4.06Å; F121-V125 HydrophobicContact CE1-CG2 3.6Å; F121-V125 HydrophobicContact CE2-CG2 4.2Å; F121-V125 HydrophobicContact CZ-CG2 3.69Å; F121-V125 WeakPolarHBondContact O-CG2 3.34Å; F121-V125 PolarHBondContact O-N 3.46Å; V125-L127 VanDerWaalsContact C-N 3.34Å; V125-L127 PolarHBondContact O-N 2.62Å; V125-L128 PolarHBondContact O-N 3.1Å; V125-E129 PolarHBondContact O-N 3.16Å; V125-V154 HydrophobicContact CG2-CG1 4.02Å; V125-P167 HydrophobicContact CG1-CB 4.04Å; V125-I168 HydrophobicContact CB-CD1 4.31Å; V125-I168 HydrophobicContact CG1-CD1 3.69Å; V125-I168 HydrophobicContact CG2-CD1 3.55Å; V125-L171 HydrophobicContact CG1-CD2 4.39Å
126R93.6Very high90.6Very high53 Ų5333 Ų3320%0.216%0.156CC..Hα-helixtrans-62.6-42.6176.8-177.960.5164168.1-3.2111.9N122 Y123 V124 L128 E129 L130 E310 Y312 P348N122-R126 WeakPolarHBondContact O-CB 2.91Å; N122-R126 PolarHBondContact O-N 2.72Å; N122-R126 VanDerWaalsContact O-N 3.1Å; Y123-R126 PolarHBondContact O-N 3.45Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 3.24Å; R126-L128 VanDerWaalsContact C-N 3.33Å; R126-L128 PolarHBondContact O-N 3.49Å; R126-E129 WeakPolarHBondContact CD-OE2 3.36Å; R126-E129 IonicContact CZ-OE2 2.73Å; R126-E129 IonicContact NE-OE2 3.15Å; R126-E129 IonicContact NH1-OE1 2.66Å; R126-E129 PolarHBondContact NH1-OE1 2.58Å; R126-E129 VanDerWaalsContact NH1-OE1 3.15Å; R126-E129 IonicContact NH1-OE2 4Å; R126-E129 PolarHBondContact NH1-OE2 2.67Å; R126-E129 WeakPolarHBondContact O-CB 2.7Å; R126-E129 PolarHBondContact O-N 3.41Å; R126-L130 HydrophobicContact CG-CD1 4.31Å; R126-L130 HydrophobicContact CG-CG 4.45Å; R126-L130 WeakPolarHBondContact O-CG 3.12Å; R126-L130 PolarHBondContact O-N 3.13Å; R126-E310 IonicContact CZ-OE1 2.64Å; R126-E310 IonicContact NE-OE1 2.88Å; R126-E310 PolarHBondContact NE-OE1 3.32Å; R126-E310 IonicContact NE-OE2 3.3Å; R126-E310 IonicContact NH2-OE1 3.84Å; R126-E310 PolarHBondContact NH2-OE1 3.11Å; R126-Y312 HydrophobicContact CB-CE1 4.27Å; R126-Y312 WeakPolarHBondContact CB-OH 3.48Å; R126-Y312 VanDerWaalsContact CG-OH 3.23Å; R126-Y312 WeakPolarHBondContact CG-OH 3.39Å; R126-P348 HydrophobicContact CB-CB 4.38Å; R126-P348 HydrophobicContact CB-CG 4.02Å; R126-P348 HydrophobicContact CG-CB 4.02Å; R126-P348 HydrophobicContact CG-CG 3.91Å
127L94.7Very high90.6Very high0 Ų028 Ų280%014%0.138CC..Hα-helixtrans-58.9-45.5177.3177.559000111.5F106 F111 Y123 V124 V125 E129 L130 I131 P348 F351 I352F106-L127 HydrophobicContact CD2-CD2 4.46Å; F106-L127 HydrophobicContact CE2-CD2 4.39Å; F111-L127 HydrophobicContact CD1-CD2 4.31Å; F111-L127 HydrophobicContact CE1-CD2 3.49Å; F111-L127 VanDerWaalsContact CE1-CD2 3.49Å; F111-L127 HydrophobicContact CZ-CD2 3.62Å; Y123-L127 HydrophobicContact CE1-CD2 4.46Å; Y123-L127 WeakPolarHBondContact O-CB 3.34Å; Y123-L127 PolarHBondContact O-N 3.49Å; V124-L127 WeakPolarHBondContact O-CB 2.97Å; V124-L127 PolarHBondContact O-N 2.88Å; V125-L127 VanDerWaalsContact C-N 3.34Å; V125-L127 PolarHBondContact O-N 2.62Å; L127-E129 VanDerWaalsContact C-N 3.29Å; L127-E129 PolarHBondContact O-N 3.2Å; L127-L130 PolarHBondContact O-N 3.17Å; L127-I131 HydrophobicContact CD1-CD1 4.11Å; L127-I131 HydrophobicContact CD1-CG1 4.39Å; L127-I131 HydrophobicContact CG-CD1 4.03Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.49Å; L127-P348 HydrophobicContact CB-CB 4.2Å; L127-F351 HydrophobicContact CD1-CD1 3.52Å; L127-F351 HydrophobicContact CD1-CE1 3.84Å; L127-F351 HydrophobicContact CD2-CD1 3.95Å; L127-F351 HydrophobicContact CD2-CE1 3.79Å; L127-F351 HydrophobicContact CG-CD1 4.41Å; L127-F351 HydrophobicContact CG-CE1 4.45Å; L127-I352 HydrophobicContact CD1-CD1 3.93Å; L127-I352 HydrophobicContact CD1-CG1 3.8Å
128L96.1Very high90.6Very high0 Ų030.4 Ų30.40%016%0.156CC..Hα-helixtrans-60.7-40.5176.1-66.9175000111.6F106 V124 V125 R126 L130 I131 A132 Y147 I150 V154 L171F106-L128 HydrophobicContact CE2-CD2 4.18Å; F106-L128 HydrophobicContact CZ-CD2 3.77Å; V124-L128 HydrophobicContact CG1-CD1 4.37Å; V124-L128 HydrophobicContact CG1-CG 4.45Å; V124-L128 WeakPolarHBondContact O-CG 3.47Å; V124-L128 PolarHBondContact O-N 3.13Å; V125-L128 PolarHBondContact O-N 3.1Å; R126-L128 VanDerWaalsContact C-N 3.33Å; R126-L128 PolarHBondContact O-N 3.49Å; L128-L130 PolarHBondContact O-N 3.21Å; L128-I131 PolarHBondContact O-N 3.2Å; L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.15Å; L128-Y147 HydrophobicContact CB-CE2 3.9Å; L128-Y147 HydrophobicContact CD2-CD2 3.44Å; L128-Y147 VanDerWaalsContact CD2-CD2 3.44Å; L128-Y147 HydrophobicContact CD2-CE2 3.36Å; L128-Y147 HydrophobicContact CD2-CG 4.36Å; L128-Y147 HydrophobicContact CG-CE2 4.22Å; L128-Y147 PolarHBondContact O-OH 3.21Å; L128-I150 HydrophobicContact CD1-CG2 3.98Å; L128-I150 HydrophobicContact CD2-CG2 4.07Å; L128-V154 HydrophobicContact CD1-CG2 3.98Å; L128-L171 HydrophobicContact CB-CD1 4.06Å; L128-L171 HydrophobicContact CB-CD2 3.97Å; L128-L171 HydrophobicContact CD1-CD2 4.3Å
129E94.4Very high90.8Very high29 Ų2929.4 Ų29.414%0.13615%0.15CC..Hα-helixtrans-62.6-43.4178-162.3-160.3154.600112.3V125 R126 L127 I131 A132 K133 L171V125-E129 PolarHBondContact O-N 3.16Å; R126-E129 WeakPolarHBondContact CD-OE2 3.36Å; R126-E129 IonicContact CZ-OE2 2.73Å; R126-E129 IonicContact NE-OE2 3.15Å; R126-E129 IonicContact NH1-OE1 2.66Å; R126-E129 PolarHBondContact NH1-OE1 2.58Å; R126-E129 VanDerWaalsContact NH1-OE1 3.15Å; R126-E129 IonicContact NH1-OE2 4Å; R126-E129 PolarHBondContact NH1-OE2 2.67Å; R126-E129 WeakPolarHBondContact O-CB 2.7Å; R126-E129 PolarHBondContact O-N 3.41Å; L127-E129 VanDerWaalsContact C-N 3.29Å; L127-E129 PolarHBondContact O-N 3.2Å; E129-I131 VanDerWaalsContact C-N 3.34Å; E129-A132 PolarHBondContact O-N 3.28Å; E129-K133 WeakPolarHBondContact O-CG 3.38Å; E129-K133 PolarHBondContact O-N 2.85Å; E129-K133 VanDerWaalsContact O-N 3.11Å; E129-K133 VanDerWaalsContact OE1-CE 3.28Å; E129-K133 WeakPolarHBondContact OE1-CE 3.35Å; E129-K133 IonicContact OE1-NZ 2.81Å; E129-K133 PolarHBondContact OE1-NZ 3.33Å; E129-L171 HydrophobicContact CB-CD1 3.79Å; E129-L171 HydrophobicContact CG-CD1 4.21Å; E129-L171 VanDerWaalsContact N-CD1 3.34Å
130L92.9Very high91Very high15 Ų1527.2 Ų27.28%0.07915%0.151CC..Hα-helixtrans-65.2-39.3176.5-66174.9000111.7R126 L127 L128 K133 S134 P348 Q349 I352R126-L130 HydrophobicContact CG-CD1 4.31Å; R126-L130 HydrophobicContact CG-CG 4.45Å; R126-L130 WeakPolarHBondContact O-CG 3.12Å; R126-L130 PolarHBondContact O-N 3.13Å; L127-L130 PolarHBondContact O-N 3.17Å; L128-L130 PolarHBondContact O-N 3.21Å; L130-K133 PolarHBondContact O-N 3.46Å; L130-S134 PolarHBondContact O-N 2.76Å; L130-S134 PolarHBondContact O-OG 3.11Å; L130-P348 HydrophobicContact CD1-CB 3.8Å; L130-Q349 HydrophobicContact CD1-CB 4.09Å; L130-I352 HydrophobicContact CB-CD1 3.46Å; L130-I352 VanDerWaalsContact CB-CD1 3.46Å; L130-I352 HydrophobicContact CD1-CD1 4.1Å; L130-I352 HydrophobicContact CG-CD1 4.43Å
131I93.1Very high90.9Very high0 Ų027.4 Ų27.40%016%0.161CC..Iπ-helixtrans-63.5-46.5174.9-68.1168.3000110.5F106 L127 L128 E129 K133 S134 Q135 L136 L139 Y147 I352F106-I131 HydrophobicContact CD2-CD1 4.01Å; F106-I131 HydrophobicContact CE2-CD1 3.86Å; F106-I131 HydrophobicContact CZ-CD1 4.43Å; L127-I131 HydrophobicContact CD1-CD1 4.11Å; L127-I131 HydrophobicContact CD1-CG1 4.39Å; L127-I131 HydrophobicContact CG-CD1 4.03Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.49Å; L128-I131 PolarHBondContact O-N 3.2Å; E129-I131 VanDerWaalsContact C-N 3.34Å; I131-K133 VanDerWaalsContact C-N 3.26Å; I131-K133 PolarHBondContact O-N 2.86Å; I131-S134 PolarHBondContact O-N 3.18Å; I131-Q135 HydrophobicContact CG2-CB 4.38Å; I131-Q135 CarbonylContact O-C 3.55Å; I131-Q135 PolarHBondContact O-N 2.82Å; I131-L136 HydrophobicContact CG2-CB 4.49Å; I131-L136 HydrophobicContact CG2-CD1 4.36Å; I131-L136 PolarHBondContact O-N 3.33Å; I131-L139 HydrophobicContact CG2-CD1 3.69Å; I131-Y147 HydrophobicContact CB-CD2 4.25Å; I131-Y147 HydrophobicContact CB-CE2 3.93Å; I131-Y147 HydrophobicContact CD1-CD2 4.47Å; I131-Y147 HydrophobicContact CG2-CD2 3.68Å; I131-Y147 HydrophobicContact CG2-CE2 3.71Å; I131-I352 HydrophobicContact CG1-CD1 4.3Å
132A92.3Very high90.8Very high0 Ų031.4 Ų31.40%019%0.185CC..Iπ-helixtrans-57.5-37.9178.400000112.9L128 E129 L171 L175 S178L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.15Å; E129-A132 PolarHBondContact O-N 3.28Å; A132-L171 HydrophobicContact CB-CD1 4.41Å; A132-L175 HydrophobicContact CB-CB 4.08Å; A132-L175 HydrophobicContact CB-CD1 3.95Å; A132-S178 WeakPolarHBondContact O-CB 3.31Å; A132-S178 PolarHBondContact O-OG 2.86Å
133K90.6Very high90.9Very high103 Ų10329 Ų2945%0.44817%0.172SC..Iπ-helixtrans-70.7-34-177.8-76.5177.7-175.5171.60114.4E129 L130 I131 T174E129-K133 WeakPolarHBondContact O-CG 3.38Å; E129-K133 PolarHBondContact O-N 2.85Å; E129-K133 VanDerWaalsContact O-N 3.11Å; E129-K133 VanDerWaalsContact OE1-CE 3.28Å; E129-K133 WeakPolarHBondContact OE1-CE 3.35Å; E129-K133 IonicContact OE1-NZ 2.81Å; E129-K133 PolarHBondContact OE1-NZ 3.33Å; L130-K133 PolarHBondContact O-N 3.46Å; I131-K133 VanDerWaalsContact C-N 3.26Å; I131-K133 PolarHBondContact O-N 2.86Å; K133-T174 HydrophobicContact CD-CG2 4.25Å; K133-T174 HydrophobicContact CG-CG2 3.43Å; K133-T174 VanDerWaalsContact CG-CG2 3.43Å
134S84.9Confident90.8Very high74 Ų7429.1 Ų29.152%0.51717%0.173SC..Iπ-helixtrans-149.8-22-167.162.60000116.6L130 I131L130-S134 PolarHBondContact O-N 2.76Å; L130-S134 PolarHBondContact O-OG 3.11Å; I131-S134 PolarHBondContact O-N 3.18Å
135Q87.2Confident90.6Very high37 Ų3733.7 Ų33.717%0.17319%0.193CC..Iπ-helixtrans-109.5-13.1-170.7-56.4-59-33.300113.8L102 I131 P137 S138 L139 I352L102-Q135 HydrophobicContact CD2-CB 4.05Å; L102-Q135 HydrophobicContact CD2-CG 4.18Å; I131-Q135 HydrophobicContact CG2-CB 4.38Å; I131-Q135 CarbonylContact O-C 3.55Å; I131-Q135 PolarHBondContact O-N 2.82Å; Q135-P137 VanDerWaalsContact C-N 3.29Å; Q135-P137 VanDerWaalsContact O-N 3.16Å; Q135-S138 PolarHBondContact O-N 3.45Å; Q135-S138 PolarHBondContact O-OG 3.2Å; Q135-S138 PolarHBondContact OE1-OG 3.36Å; Q135-L139 WeakPolarHBondContact O-CG 3.39Å; Q135-L139 PolarHBondContact O-N 3.08Å; Q135-I352 HydrophobicContact CG-CG2 3.96Å
136L88.3Confident90.6Very high0 Ų033.5 Ų33.50%019%0.192CC..G310 helixtrans-51.5-42.3-178.1-168.769.3000113.5I131 L139 Q144 Y147 L175 L179 W198I131-L136 HydrophobicContact CG2-CB 4.49Å; I131-L136 HydrophobicContact CG2-CD1 4.36Å; I131-L136 PolarHBondContact O-N 3.33Å; L136-L139 PolarHBondContact O-N 2.84Å; L136-Q144 HydrophobicContact CD1-CG 4.41Å; L136-Q144 WeakPolarHBondContact O-CG 3.19Å; L136-Q144 PolarHBondContact O-NE2 3.35Å; L136-Y147 HydrophobicContact CD1-CD1 3.8Å; L136-Y147 HydrophobicContact CD1-CD2 4.43Å; L136-Y147 HydrophobicContact CD1-CE1 4.17Å; L136-Y147 HydrophobicContact CD1-CG 3.98Å; L136-L175 HydrophobicContact CD2-CD1 3.74Å; L136-L179 HydrophobicContact CD2-CD2 3.81Å; L136-W198 HydrophobicContact CD2-CH2 4.33Å; L136-W198 HydrophobicContact CD2-CZ3 4.3Å
137P86.9Confident90.6Very high33 Ų3331 Ų3121%0.21418%0.182CC..G310 helixtrans-74.5-22.2178.5-12.429.2000114.2Q135 L139 L182 V190Q135-P137 VanDerWaalsContact C-N 3.29Å; Q135-P137 VanDerWaalsContact O-N 3.16Å; P137-L139 VanDerWaalsContact C-N 3.31Å; P137-L182 HydrophobicContact CG-CD1 3.75Å; P137-L182 HydrophobicContact CG-CD2 3.86Å; P137-L182 HydrophobicContact CG-CG 4.49Å; P137-V190 HydrophobicContact CB-CB 3.92Å; P137-V190 HydrophobicContact CB-CG1 3.26Å; P137-V190 HydrophobicContact CG-CG1 4.45Å
138S86.9Confident90.6Very high78 Ų7831.5 Ų31.555%0.54519%0.185SC..G310 helixtrans-79.9-14.6177.368.80000112.8Q135Q135-S138 PolarHBondContact O-N 3.45Å; Q135-S138 PolarHBondContact O-OG 3.2Å; Q135-S138 PolarHBondContact OE1-OG 3.36Å
139L89.2Confident90.5Very high6 Ų633.7 Ų33.73%0.03120%0.196CC..SBendtrans-74.4146.7176.9-65.6-176.5000112.5L102 I131 Q135 L136 P137 A143 Q144L102-L139 HydrophobicContact CB-CD2 4.42Å; L102-L139 HydrophobicContact CD2-CD2 4.01Å; L102-L139 HydrophobicContact CG-CD2 3.98Å; I131-L139 HydrophobicContact CG2-CD1 3.69Å; Q135-L139 WeakPolarHBondContact O-CG 3.39Å; Q135-L139 PolarHBondContact O-N 3.08Å; L136-L139 PolarHBondContact O-N 2.84Å; P137-L139 VanDerWaalsContact C-N 3.31Å; L139-A143 HydrophobicContact CB-CB 3.97Å; L139-A143 HydrophobicContact CD1-CB 4.38Å; L139-A143 HydrophobicContact CD2-CB 4.33Å; L139-A143 HydrophobicContact CG-CB 4.46Å; L139-Q144 HydrophobicContact CB-CG 3.82Å; L139-Q144 PolarHBondContact O-NE2 2.89Å; L139-Q144 VanDerWaalsContact O-NE2 3.11Å
140S88.8Confident90.4Very high60 Ų6032.4 Ų32.442%0.4219%0.19SC..  trans-63.2156.7169.972.20000111.6V142 A143 Q144S140-V142 PolarHBondContact O-N 2.95Å; S140-V142 VanDerWaalsContact O-N 3.14Å; S140-A143 CarbonylContact O-C 3.57Å; S140-A143 WeakPolarHBondContact O-CA 3.43Å; S140-A143 WeakPolarHBondContact O-CB 3.38Å; S140-A143 PolarHBondContact O-N 2.77Å; S140-A143 PolarHBondContact OG-N 3.41Å; S140-Q144 PolarHBondContact O-N 2.87Å
141G87.9Confident90.6Very high28 Ų2831.7 Ų31.729%0.28919%0.187SC..Hα-helixtrans-57.4-32.4179.400000114K145G141-K145 WeakPolarHBondContact O-CB 3.39Å; G141-K145 PolarHBondContact O-N 2.97Å
142V88.4Confident90.6Very high88 Ų8836.4 Ų36.453%0.53321%0.208SC..Hα-helixtrans-67.8-43173.9-179.20000110.9F80 S140 K145 N146F80-V142 HydrophobicContact CE1-CG1 4.32Å; S140-V142 PolarHBondContact O-N 2.95Å; S140-V142 VanDerWaalsContact O-N 3.14Å; V142-K145 PolarHBondContact O-N 2.92Å; V142-N146 PolarHBondContact O-N 2.82Å
143A91.4Very high90.7Very high0 Ų041.1 Ų41.10%023%0.226CC..Hα-helixtrans-67.6-39.517600000112.6N107 L139 S140 K145 N146 Y147N107-A143 PolarHBondContact ND2-N 3.25Å; N107-A143 WeakPolarHBondContact OD1-CA 3.36Å; L139-A143 HydrophobicContact CB-CB 3.97Å; L139-A143 HydrophobicContact CD1-CB 4.38Å; L139-A143 HydrophobicContact CD2-CB 4.33Å; L139-A143 HydrophobicContact CG-CB 4.46Å; S140-A143 CarbonylContact O-C 3.57Å; S140-A143 WeakPolarHBondContact O-CA 3.43Å; S140-A143 WeakPolarHBondContact O-CB 3.38Å; S140-A143 PolarHBondContact O-N 2.77Å; S140-A143 PolarHBondContact OG-N 3.41Å; A143-K145 VanDerWaalsContact C-N 3.32Å; A143-K145 PolarHBondContact O-N 3.36Å; A143-N146 PolarHBondContact O-N 3.33Å; A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.3Å
144Q91.6Very high90.9Very high1 Ų136.2 Ų36.21%0.00521%0.205CC..Hα-helixtrans-61.7-39.6172.6-68.7176-3.400111.6L136 L139 S140 M148 V192 W198L136-Q144 HydrophobicContact CD1-CG 4.41Å; L136-Q144 WeakPolarHBondContact O-CG 3.19Å; L136-Q144 PolarHBondContact O-NE2 3.35Å; L139-Q144 HydrophobicContact CB-CG 3.82Å; L139-Q144 PolarHBondContact O-NE2 2.89Å; L139-Q144 VanDerWaalsContact O-NE2 3.11Å; S140-Q144 PolarHBondContact O-N 2.87Å; Q144-M148 PolarHBondContact O-N 3.27Å; Q144-V192 VanDerWaalsContact OE1-N 3.12Å; Q144-W198 HydrophobicContact CB-CH2 4.32Å; Q144-W198 HydrophobicContact CB-CZ2 4.32Å
145K90.6Very high91.3Very high96 Ų9632.8 Ų32.842%0.41718%0.181SC..Hα-helixtrans-64.4-45.6173-177.5179.7178178.50111.4G141 V142 A143 Y147 M148 N149G141-K145 WeakPolarHBondContact O-CB 3.39Å; G141-K145 PolarHBondContact O-N 2.97Å; V142-K145 PolarHBondContact O-N 2.92Å; A143-K145 VanDerWaalsContact C-N 3.32Å; A143-K145 PolarHBondContact O-N 3.36Å; K145-Y147 VanDerWaalsContact C-N 3.31Å; K145-Y147 PolarHBondContact O-N 3.46Å; K145-M148 PolarHBondContact O-N 3.25Å; K145-N149 VanDerWaalsContact O-CG 3.28Å; K145-N149 PolarHBondContact O-N 3.45Å; K145-N149 VanDerWaalsContact O-N 3.07Å; K145-N149 PolarHBondContact O-ND2 3.08Å; K145-N149 PolarHBondContact O-OD1 3.38Å
146N92.6Very high91.6Very high3 Ų335.7 Ų35.72%0.01620%0.195CC..Hα-helixtrans-62.4-40.1177.6-165.724.8000112F80 F106 N107 V142 A143 M148 N149 I150F80-N146 HydrophobicContact CD1-CB 4.13Å; F80-N146 HydrophobicContact CE1-CB 3.41Å; F80-N146 VanDerWaalsContact CE1-CB 3.41Å; F80-N146 HydrophobicContact CE2-CB 4.49Å; F80-N146 WeakPolarHBondContact CE2-OD1 3.25Å; F80-N146 HydrophobicContact CZ-CB 3.61Å; F80-N146 WeakPolarHBondContact CZ-OD1 3.44Å; F106-N146 HydrophobicContact CE1-CB 4.38Å; F106-N146 PolarHBondContact O-ND2 3.11Å; N107-N146 WeakPolarHBondContact OD1-CB 3.47Å; N107-N146 PolarHBondContact OD1-ND2 3.48Å; V142-N146 PolarHBondContact O-N 2.82Å; A143-N146 PolarHBondContact O-N 3.33Å; N146-M148 VanDerWaalsContact C-N 3.33Å; N146-M148 PolarHBondContact O-N 3.37Å; N146-N149 WeakPolarHBondContact O-CB 3.36Å; N146-N149 PolarHBondContact O-N 2.89Å; N146-N149 VanDerWaalsContact O-N 3.16Å; N146-I150 WeakPolarHBondContact O-CB 3.49Å; N146-I150 VanDerWaalsContact O-CG1 3.31Å; N146-I150 WeakPolarHBondContact O-CG1 3.4Å; N146-I150 PolarHBondContact O-N 2.82Å
147Y94.6Very high91.7Very high0 Ų037.5 Ų37.50%020%0.202CC..Hα-helixtrans-55-49.4175.3173.6-84.3000111F106 L128 I131 L136 A143 K145 N149 I150 L151 L175F106-Y147 HydrophobicContact CZ-CD2 4.3Å; L128-Y147 HydrophobicContact CB-CE2 3.9Å; L128-Y147 HydrophobicContact CD2-CD2 3.44Å; L128-Y147 VanDerWaalsContact CD2-CD2 3.44Å; L128-Y147 HydrophobicContact CD2-CE2 3.36Å; L128-Y147 HydrophobicContact CD2-CG 4.36Å; L128-Y147 HydrophobicContact CG-CE2 4.22Å; L128-Y147 PolarHBondContact O-OH 3.21Å; I131-Y147 HydrophobicContact CB-CD2 4.25Å; I131-Y147 HydrophobicContact CB-CE2 3.93Å; I131-Y147 HydrophobicContact CD1-CD2 4.47Å; I131-Y147 HydrophobicContact CG2-CD2 3.68Å; I131-Y147 HydrophobicContact CG2-CE2 3.71Å; L136-Y147 HydrophobicContact CD1-CD1 3.8Å; L136-Y147 HydrophobicContact CD1-CD2 4.43Å; L136-Y147 HydrophobicContact CD1-CE1 4.17Å; L136-Y147 HydrophobicContact CD1-CG 3.98Å; A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.3Å; K145-Y147 VanDerWaalsContact C-N 3.31Å; K145-Y147 PolarHBondContact O-N 3.46Å; Y147-N149 PolarHBondContact O-N 2.95Å; Y147-I150 PolarHBondContact O-N 3.12Å; Y147-L151 HydrophobicContact CE1-CD2 4.1Å; Y147-L151 WeakPolarHBondContact O-CB 3.45Å; Y147-L151 PolarHBondContact O-N 3.14Å; Y147-L175 HydrophobicContact CE1-CD1 4.04Å; Y147-L175 HydrophobicContact CE1-CD2 3.91Å
148M93.9Very high91.9Very high11 Ų1136 Ų365%0.05419%0.193CC..Hα-helixtrans-64.1-38.7177.9-69.4-61.6-17700112.6Q144 K145 N146 L151 E152 L175 L179 W198 R201 I205Q144-M148 PolarHBondContact O-N 3.27Å; K145-M148 PolarHBondContact O-N 3.25Å; N146-M148 VanDerWaalsContact C-N 3.33Å; N146-M148 PolarHBondContact O-N 3.37Å; M148-L151 PolarHBondContact O-N 2.85Å; M148-L151 HydrophobicContact SD-CD2 4.25Å; M148-E152 WeakPolarHBondContact O-CB 3Å; M148-E152 PolarHBondContact O-N 3.41Å; M148-L175 HydrophobicContact CE-CD1 4.47Å; M148-L175 HydrophobicContact CE-CD2 4.14Å; M148-L175 HydrophobicContact SD-CD2 4.38Å; M148-L179 HydrophobicContact CE-CD1 4.23Å; M148-W198 HydrophobicContact CE-CE3 4.29Å; M148-W198 HydrophobicContact CE-CH2 4.21Å; M148-W198 HydrophobicContact CE-CZ3 3.46Å; M148-W198 VanDerWaalsContact CE-CZ3 3.46Å; M148-R201 HydrophobicContact CE-CB 4.47Å; M148-I205 HydrophobicContact CE-CD1 4.48Å
149N93.1Very high92Very high46 Ų4634 Ų3425%0.24618%0.176CC..Hα-helixtrans-66-40.5176.3-65.7-17.2000112.6K145 N146 Y147 R153K145-N149 VanDerWaalsContact O-CG 3.28Å; K145-N149 PolarHBondContact O-N 3.45Å; K145-N149 VanDerWaalsContact O-N 3.07Å; K145-N149 PolarHBondContact O-ND2 3.08Å; K145-N149 PolarHBondContact O-OD1 3.38Å; N146-N149 WeakPolarHBondContact O-CB 3.36Å; N146-N149 PolarHBondContact O-N 2.89Å; N146-N149 VanDerWaalsContact O-N 3.16Å; Y147-N149 PolarHBondContact O-N 2.95Å; N149-R153 WeakPolarHBondContact O-CG 3.44Å; N149-R153 PolarHBondContact O-N 3.15Å; N149-R153 VanDerWaalsContact O-N 3.16Å
150I93.9Very high92Very high2 Ų238.8 Ų38.81%0.0120%0.201CC..Hα-helixtrans-66.6-44.1176.5-70.7169.1000108.9F106 F111 I115 V124 L128 N146 Y147 E152 R153 V154F106-I150 HydrophobicContact CE1-CD1 3.62Å; F106-I150 HydrophobicContact CE2-CD1 4.26Å; F106-I150 HydrophobicContact CZ-CD1 3.47Å; F106-I150 VanDerWaalsContact CZ-CD1 3.47Å; F111-I150 HydrophobicContact CB-CD1 3.84Å; I115-I150 HydrophobicContact CD1-CB 4.38Å; I115-I150 HydrophobicContact CD1-CG2 3.55Å; I115-I150 HydrophobicContact CG1-CG2 4.45Å; V124-I150 HydrophobicContact CG1-CG2 4.3Å; L128-I150 HydrophobicContact CD1-CG2 3.98Å; L128-I150 HydrophobicContact CD2-CG2 4.07Å; N146-I150 WeakPolarHBondContact O-CB 3.49Å; N146-I150 VanDerWaalsContact O-CG1 3.31Å; N146-I150 WeakPolarHBondContact O-CG1 3.4Å; N146-I150 PolarHBondContact O-N 2.82Å; Y147-I150 PolarHBondContact O-N 3.12Å; I150-E152 PolarHBondContact O-N 3.29Å; I150-R153 WeakPolarHBondContact O-CB 3.36Å; I150-R153 PolarHBondContact O-N 2.92Å; I150-V154 WeakPolarHBondContact O-CG2 3.37Å; I150-V154 PolarHBondContact O-N 3.29Å
151L95.9Very high91.8Very high0 Ų039.2 Ų39.20%020%0.199CC..Hα-helixtrans-59-46.7176.3179.460.4000112.2Y147 M148 R153 V154 V155 L171 L172 L175 W208Y147-L151 HydrophobicContact CE1-CD2 4.1Å; Y147-L151 WeakPolarHBondContact O-CB 3.45Å; Y147-L151 PolarHBondContact O-N 3.14Å; M148-L151 PolarHBondContact O-N 2.85Å; M148-L151 HydrophobicContact SD-CD2 4.25Å; L151-R153 VanDerWaalsContact C-N 3.29Å; L151-R153 PolarHBondContact O-N 3.08Å; L151-V154 WeakPolarHBondContact O-CB 3.46Å; L151-V154 PolarHBondContact O-N 2.78Å; L151-V154 VanDerWaalsContact O-N 3.08Å; L151-V155 HydrophobicContact CD1-CG2 4.48Å; L151-V155 WeakPolarHBondContact O-CG2 3.24Å; L151-V155 PolarHBondContact O-N 3.07Å; L151-L171 HydrophobicContact CD1-CD2 3.63Å; L151-L171 HydrophobicContact CD1-CG 4.18Å; L151-L172 HydrophobicContact CD1-CD2 3.94Å; L151-L172 HydrophobicContact CD2-CD2 3.97Å; L151-L172 HydrophobicContact CG-CD2 4.17Å; L151-L175 HydrophobicContact CD2-CD2 3.31Å; L151-W208 HydrophobicContact CD2-CZ3 3.95Å; L151-W208 HydrophobicContact CG-CZ3 3.97Å
152E94.5Very high91.6Very high98 Ų9839.3 Ų39.346%0.45819%0.192SC..Hα-helixtrans-56-43.7174.7-179.6174.7-159.100111.6M148 I150 V154 V155 Q156 W208M148-E152 WeakPolarHBondContact O-CB 3Å; M148-E152 PolarHBondContact O-N 3.41Å; I150-E152 PolarHBondContact O-N 3.29Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 3.42Å; E152-V155 PolarHBondContact O-N 2.95Å; E152-Q156 PolarHBondContact O-N 3.24Å; E152-W208 HydrophobicContact CB-CH2 3.76Å; E152-W208 HydrophobicContact CB-CZ2 3.63Å; E152-W208 HydrophobicContact CG-CH2 4.35Å; E152-W208 HydrophobicContact CG-CZ2 3.7Å
153R93.3Very high91.3Very high100 Ų10035.7 Ų35.738%0.37717%0.169SC..Hα-helixtrans-64.6-36.3175.8-73177.8174163.83.2113.1S112 I115 N149 I150 L151 K157S112-R153 PolarHBondContact OG-NH1 3.18Å; I115-R153 HydrophobicContact CD1-CB 4.13Å; N149-R153 WeakPolarHBondContact O-CG 3.44Å; N149-R153 PolarHBondContact O-N 3.15Å; N149-R153 VanDerWaalsContact O-N 3.16Å; I150-R153 WeakPolarHBondContact O-CB 3.36Å; I150-R153 PolarHBondContact O-N 2.92Å; L151-R153 VanDerWaalsContact C-N 3.29Å; L151-R153 PolarHBondContact O-N 3.08Å; R153-K157 WeakPolarHBondContact O-CB 3.45Å; R153-K157 PolarHBondContact O-N 3.4Å
154V94.6Very high90.9Very high0 Ų037 Ų370%018%0.176CC..Hα-helixtrans-63.4-47.7173.7170.60000110.2I115 F121 V125 L128 I150 L151 E152 K157 V158 I168I115-V154 HydrophobicContact CD1-CG2 3.88Å; I115-V154 HydrophobicContact CG1-CG2 3.8Å; I115-V154 HydrophobicContact CG2-CG2 3.96Å; F121-V154 HydrophobicContact CE2-CG1 4.01Å; F121-V154 HydrophobicContact CZ-CG1 3.96Å; V125-V154 HydrophobicContact CG2-CG1 4.02Å; L128-V154 HydrophobicContact CD1-CG2 3.98Å; I150-V154 WeakPolarHBondContact O-CG2 3.37Å; I150-V154 PolarHBondContact O-N 3.29Å; L151-V154 WeakPolarHBondContact O-CB 3.46Å; L151-V154 PolarHBondContact O-N 2.78Å; L151-V154 VanDerWaalsContact O-N 3.08Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 3.42Å; V154-K157 PolarHBondContact O-N 3.06Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 2.93Å; V154-I168 HydrophobicContact CG1-CD1 3.29Å; V154-I168 HydrophobicContact CG1-CG1 3.98Å
155V94.3Very high90.7Very high1 Ų137.1 Ų37.11%0.00618%0.177CC..Hα-helixtrans-60-49.6178.7174.70000110.3L151 E152 K157 V158 L159 I168 L172 W208L151-V155 HydrophobicContact CD1-CG2 4.48Å; L151-V155 WeakPolarHBondContact O-CG2 3.24Å; L151-V155 PolarHBondContact O-N 3.07Å; E152-V155 PolarHBondContact O-N 2.95Å; V155-K157 VanDerWaalsContact C-N 3.35Å; V155-K157 PolarHBondContact O-N 2.89Å; V155-V158 PolarHBondContact O-N 2.92Å; V155-V158 VanDerWaalsContact O-N 3.11Å; V155-L159 HydrophobicContact CG1-CD1 3.9Å; V155-L159 HydrophobicContact CG1-CG 4.32Å; V155-L159 WeakPolarHBondContact O-CG 3.42Å; V155-L159 PolarHBondContact O-N 3.22Å; V155-I168 HydrophobicContact CG2-CG2 3.99Å; V155-L172 HydrophobicContact CG2-CD1 4.24Å; V155-L172 HydrophobicContact CG2-CD2 4.3Å; V155-W208 HydrophobicContact CB-CD2 4.46Å; V155-W208 HydrophobicContact CB-CG 4.41Å; V155-W208 HydrophobicContact CG1-CB 3.93Å; V155-W208 HydrophobicContact CG1-CD2 4.32Å; V155-W208 HydrophobicContact CG1-CG 3.78Å; V155-W208 HydrophobicContact CG2-CB 4.38Å; V155-W208 HydrophobicContact CG2-CD2 4.1Å; V155-W208 HydrophobicContact CG2-CE3 4.07Å; V155-W208 HydrophobicContact CG2-CG 4.25Å
156Q92.3Very high90.5Very high99 Ų9934.1 Ų34.146%0.46316%0.163SC..Hα-helixtrans-59-45.2179.3-172.160.447.800111.9E152 V158 L159 D160E152-Q156 PolarHBondContact O-N 3.24Å; Q156-V158 VanDerWaalsContact C-N 3.28Å; Q156-V158 PolarHBondContact O-N 3.27Å; Q156-L159 PolarHBondContact O-N 3.06Å; Q156-D160 PolarHBondContact NE2-OD1 3.43Å; Q156-D160 PolarHBondContact O-N 3.14Å
157K91.1Very high90.3Very high37 Ų3735.9 Ų35.916%0.16118%0.175CC..Hα-helixtrans-58.4-40.9176.5177.7177.217264.30111.9I115 K116 F121 R153 V154 V155 D160 D161I115-K157 HydrophobicContact CG2-CB 4.37Å; I115-K157 HydrophobicContact CG2-CD 3.72Å; I115-K157 WeakPolarHBondContact O-CD 3.44Å; I115-K157 WeakPolarHBondContact O-CE 3.45Å; K116-K157 PolarHBondContact O-NZ 3.44Å; F121-K157 HydrophobicContact CD2-CD 3.87Å; F121-K157 HydrophobicContact CE2-CD 3.89Å; R153-K157 WeakPolarHBondContact O-CB 3.45Å; R153-K157 PolarHBondContact O-N 3.4Å; V154-K157 PolarHBondContact O-N 3.06Å; V155-K157 VanDerWaalsContact C-N 3.35Å; V155-K157 PolarHBondContact O-N 2.89Å; K157-D160 PolarHBondContact O-N 3.47Å; K157-D161 WeakPolarHBondContact CE-OD2 3.25Å; K157-D161 WeakPolarHBondContact CG-OD2 3.45Å; K157-D161 IonicContact NZ-OD2 3.99Å; K157-D161 PolarHBondContact NZ-OD2 2.58Å; K157-D161 WeakPolarHBondContact O-CB 3.48Å; K157-D161 PolarHBondContact O-N 2.71Å
158V90.6Very high90.2Very high3 Ų335.9 Ų35.92%0.01818%0.175CC..Hα-helixtrans-71.8-34.4179.1168.10000112.1F121 V154 V155 Q156 D160 Q162 Q163 V165 I168 L212F121-V158 HydrophobicContact CE1-CG2 4.41Å; F121-V158 HydrophobicContact CE2-CG2 4.28Å; F121-V158 HydrophobicContact CZ-CG2 3.56Å; V154-V158 WeakPolarHBondContact O-CG2 3.48Å; V154-V158 PolarHBondContact O-N 2.93Å; V155-V158 PolarHBondContact O-N 2.92Å; V155-V158 VanDerWaalsContact O-N 3.11Å; Q156-V158 VanDerWaalsContact C-N 3.28Å; Q156-V158 PolarHBondContact O-N 3.27Å; V158-D160 VanDerWaalsContact C-N 3.31Å; V158-Q162 WeakPolarHBondContact O-CA 3.44Å; V158-Q162 PolarHBondContact O-N 3.22Å; V158-Q163 WeakPolarHBondContact CG1-O 3.48Å; V158-Q163 WeakPolarHBondContact CG2-O 3.36Å; V158-V165 HydrophobicContact CG1-CB 4.46Å; V158-V165 HydrophobicContact CG1-CG2 3.96Å; V158-I168 HydrophobicContact CB-CG1 4.35Å; V158-I168 HydrophobicContact CG1-CG1 4.41Å; V158-I168 HydrophobicContact CG2-CD1 4.5Å; V158-I168 HydrophobicContact CG2-CG1 3.68Å; V158-L212 HydrophobicContact CG1-CD2 3.79Å
159L89.9Confident90.1Very high35 Ų3537 Ų3718%0.18318%0.179CC..Hα-helixtrans-63.3-39.5171.8-68.8169.5000111.3V155 Q156 Q211 L212 I215V155-L159 HydrophobicContact CG1-CD1 3.9Å; V155-L159 HydrophobicContact CG1-CG 4.32Å; V155-L159 WeakPolarHBondContact O-CG 3.42Å; V155-L159 PolarHBondContact O-N 3.22Å; Q156-L159 PolarHBondContact O-N 3.06Å; L159-Q211 HydrophobicContact CD1-CB 4.33Å; L159-Q211 HydrophobicContact CD2-CB 3.94Å; L159-L212 HydrophobicContact CD2-CD2 3.91Å; L159-L212 HydrophobicContact CG-CD2 4.27Å; L159-I215 HydrophobicContact CD2-CD1 4.05Å; L159-I215 HydrophobicContact CD2-CG1 4.03Å
160D87.9Confident90Very high107 Ų10738.1 Ų38.157%0.57218%0.183SC*.Hα-helixtrans-74.7-50.5-179.8-62.9-19.3000112.7Q156 K157 V158Q156-D160 PolarHBondContact NE2-OD1 3.43Å; Q156-D160 PolarHBondContact O-N 3.14Å; K157-D160 PolarHBondContact O-N 3.47Å; V158-D160 VanDerWaalsContact C-N 3.31Å
161D84.8Confident90Very high69 Ų6938 Ų3837%0.36918%0.182SC..Hα-helixtrans-83.8-17.8-174.8-69.6-24.5000112.5K157 Q163K157-D161 WeakPolarHBondContact CE-OD2 3.25Å; K157-D161 WeakPolarHBondContact CG-OD2 3.45Å; K157-D161 IonicContact NZ-OD2 3.99Å; K157-D161 PolarHBondContact NZ-OD2 2.58Å; K157-D161 WeakPolarHBondContact O-CB 3.48Å; K157-D161 PolarHBondContact O-N 2.71Å; D161-Q163 HydrophobicContact CB-CG 4.33Å; D161-Q163 WeakPolarHBondContact O-CG 3.34Å; D161-Q163 PolarHBondContact O-N 2.97Å; D161-Q163 VanDerWaalsContact O-N 3.13Å
162Q84.8Confident90Very high30 Ų3038 Ų3814%0.1418%0.182CC..  trans58.915.6-175.6-55.3-176.2-26.700114.5P11 V158 I215 Q216 N218P11-Q162 WeakPolarHBondContact CD-O 3.49Å; P11-Q162 WeakPolarHBondContact CG-O 3.48Å; V158-Q162 WeakPolarHBondContact O-CA 3.44Å; V158-Q162 PolarHBondContact O-N 3.22Å; Q162-I215 HydrophobicContact CB-CG2 4.41Å; Q162-I215 HydrophobicContact CG-CG2 4.13Å; Q162-Q216 PolarHBondContact NE2-O 3.18Å; Q162-Q216 PolarHBondContact OE1-O 3.16Å; Q162-N218 PolarHBondContact NE2-ND2 3.05Å; Q162-N218 PolarHBondContact OE1-ND2 3.37Å
163Q82.6Confident90Very high11 Ų1137.7 Ų37.75%0.05118%0.181CC..  trans-101.1155.6-178.7-54.4-163.3-2100112.5P11 G12 N14 V158 D161 V165P11-Q163 HydrophobicContact CG-CG 4.31Å; G12-Q163 VanDerWaalsContact O-CD 3.23Å; G12-Q163 PolarHBondContact O-NE2 3.35Å; N14-Q163 PolarHBondContact ND2-NE2 3.26Å; N14-Q163 VanDerWaalsContact ND2-NE2 3.11Å; N14-Q163 PolarHBondContact OD1-NE2 3.16Å; V158-Q163 WeakPolarHBondContact CG1-O 3.48Å; V158-Q163 WeakPolarHBondContact CG2-O 3.36Å; D161-Q163 HydrophobicContact CB-CG 4.33Å; D161-Q163 WeakPolarHBondContact O-CG 3.34Å; D161-Q163 PolarHBondContact O-N 2.97Å; D161-Q163 VanDerWaalsContact O-N 3.13Å; Q163-V165 VanDerWaalsContact C-N 3.28Å; Q163-V165 PolarHBondContact O-N 3.27Å
164N81.6Confident90Very high28 Ų2834.7 Ų34.715%0.1517%0.174CC..SBendtrans56.635.5174.7-54-61.7000114.5S10 F121 R166 P167S10-N164 VanDerWaalsContact OG-CA 3.23Å; S10-N164 WeakPolarHBondContact OG-CA 3.41Å; F121-N164 HydrophobicContact CD1-CB 4.41Å; F121-N164 HydrophobicContact CE1-CB 3.68Å; N164-R166 PolarHBondContact O-N 3.29Å; N164-P167 WeakPolarHBondContact O-CD 3.24Å
165V87.3Confident90Very high4 Ų434.7 Ų34.72%0.02417%0.174CC..Hα-helixtrans-61.1-45.6-176.4-179.40000112.3S10 V158 Q163 I168 K169 L212 I215S10-V165 PolarHBondContact OG-N 3Å; V158-V165 HydrophobicContact CG1-CB 4.46Å; V158-V165 HydrophobicContact CG1-CG2 3.96Å; Q163-V165 VanDerWaalsContact C-N 3.28Å; Q163-V165 PolarHBondContact O-N 3.27Å; V165-I168 PolarHBondContact O-N 2.74Å; V165-K169 HydrophobicContact CG1-CD 4.27Å; V165-K169 HydrophobicContact CG1-CG 4.39Å; V165-K169 PolarHBondContact O-N 2.9Å; V165-L212 HydrophobicContact CG1-CB 4.48Å; V165-I215 HydrophobicContact CG1-CD1 4.28Å; V165-I215 HydrophobicContact CG2-CD1 3.94Å
166R87Confident90Very high32 Ų3237.7 Ų37.712%0.12119%0.185CC..Hα-helixtrans-60.1-51.2-176.3179.9-166.3-67.5150-3.5112.9N164 I168 K169 E170 D244 D247N164-R166 PolarHBondContact O-N 3.29Å; R166-I168 PolarHBondContact O-N 3.43Å; R166-K169 PolarHBondContact O-N 2.64Å; R166-K169 VanDerWaalsContact O-N 3.14Å; R166-E170 HydrophobicContact CG-CG 4.39Å; R166-E170 WeakPolarHBondContact O-CG 3.46Å; R166-E170 PolarHBondContact O-N 2.92Å; R166-D244 IonicContact NH1-OD2 3.54Å; R166-D244 PolarHBondContact NH1-OD2 2.95Å; R166-D244 VanDerWaalsContact NH1-OD2 3.15Å; R166-D247 IonicContact CZ-OD1 2.75Å; R166-D247 IonicContact NH1-OD1 2.95Å; R166-D247 PolarHBondContact NH1-OD1 3.09Å; R166-D247 IonicContact NH2-OD1 3.67Å
167P88.3Confident89.9Confident41 Ų4137 Ų3727%0.26619%0.188SC..Hα-helixtrans-51.6-37.7175-29.933.2000114.2V125 N164 L171V125-P167 HydrophobicContact CG1-CB 4.04Å; N164-P167 WeakPolarHBondContact O-CD 3.24Å; P167-L171 VanDerWaalsContact O-CB 3.31Å; P167-L171 WeakPolarHBondContact O-CB 3.36Å; P167-L171 PolarHBondContact O-N 2.95Å
168I92.8Very high89.9Confident0 Ų036.6 Ų36.60%019%0.19CC..Hα-helixtrans-73.8-41179.7-54.7-42.2000111.4F121 V125 V154 V155 V158 V165 R166 E170 L171 L172 L212F121-I168 HydrophobicContact CZ-CD1 4.14Å; V125-I168 HydrophobicContact CB-CD1 4.31Å; V125-I168 HydrophobicContact CG1-CD1 3.69Å; V125-I168 HydrophobicContact CG2-CD1 3.55Å; V154-I168 HydrophobicContact CG1-CD1 3.29Å; V154-I168 HydrophobicContact CG1-CG1 3.98Å; V155-I168 HydrophobicContact CG2-CG2 3.99Å; V158-I168 HydrophobicContact CB-CG1 4.35Å; V158-I168 HydrophobicContact CG1-CG1 4.41Å; V158-I168 HydrophobicContact CG2-CD1 4.5Å; V158-I168 HydrophobicContact CG2-CG1 3.68Å; V165-I168 PolarHBondContact O-N 2.74Å; R166-I168 PolarHBondContact O-N 3.43Å; I168-E170 VanDerWaalsContact C-N 3.31Å; I168-E170 PolarHBondContact O-N 3.15Å; I168-L171 WeakPolarHBondContact O-CB 3.01Å; I168-L171 PolarHBondContact O-N 3.26Å; I168-L172 HydrophobicContact CG2-CD1 4.14Å; I168-L172 HydrophobicContact CG2-CG 4.2Å; I168-L172 WeakPolarHBondContact O-CB 3.47Å; I168-L172 VanDerWaalsContact O-CG 3.29Å; I168-L172 WeakPolarHBondContact O-CG 3.33Å; I168-L172 PolarHBondContact O-N 3.06Å; I168-L212 HydrophobicContact CB-CD1 4.23Å; I168-L212 HydrophobicContact CG2-CD1 3.72Å
169K91Very high89.8Confident33 Ų3336.5 Ų36.514%0.14319%0.189CC..Hα-helixtrans-59-43.8173.6-71.6-172180-178.60111.7W8 V165 R166 L172 Q173 L212 D213W8-K169 VanDerWaalsContact CG-NZ 3.34Å; V165-K169 HydrophobicContact CG1-CD 4.27Å; V165-K169 HydrophobicContact CG1-CG 4.39Å; V165-K169 PolarHBondContact O-N 2.9Å; R166-K169 PolarHBondContact O-N 2.64Å; R166-K169 VanDerWaalsContact O-N 3.14Å; K169-L172 PolarHBondContact O-N 2.68Å; K169-Q173 WeakPolarHBondContact O-CB 3.33Å; K169-Q173 PolarHBondContact O-N 3.48Å; K169-L212 HydrophobicContact CD-CB 4.47Å; K169-L212 VanDerWaalsContact CE-CB 3.5Å; K169-L212 WeakPolarHBondContact CE-O 3.41Å; K169-L212 HydrophobicContact CG-CB 4.11Å; K169-L212 HydrophobicContact CG-CD1 4.05Å; K169-L212 PolarHBondContact NZ-O 2.92Å; K169-D213 WeakPolarHBondContact CE-OD1 3.43Å; K169-D213 IonicContact NZ-OD1 3.74Å; K169-D213 PolarHBondContact NZ-OD1 3.45Å
170E91.6Very high89.6Confident70 Ų7036.3 Ų36.333%0.32719%0.19SC..Hα-helixtrans-63.9-41.9176.7-70.6176.5174.800112.1R166 I168 T174 R246R166-E170 HydrophobicContact CG-CG 4.39Å; R166-E170 WeakPolarHBondContact O-CG 3.46Å; R166-E170 PolarHBondContact O-N 2.92Å; I168-E170 VanDerWaalsContact C-N 3.31Å; I168-E170 PolarHBondContact O-N 3.15Å; E170-T174 VanDerWaalsContact O-CB 3.28Å; E170-T174 WeakPolarHBondContact O-CB 3.14Å; E170-T174 PolarHBondContact O-N 2.89Å; E170-T174 PolarHBondContact O-OG1 2.73Å; E170-R246 IonicContact OE1-CZ 3.28Å; E170-R246 IonicContact OE1-NH1 2.86Å; E170-R246 PolarHBondContact OE1-NH1 3.29Å; E170-R246 IonicContact OE1-NH2 2.83Å
171L94.6Very high89.4Confident0 Ų032.5 Ų32.50%018%0.177CC..Hα-helixtrans-60-50.9173.8170.661.9000111.8V125 L128 E129 A132 L151 P167 I168 Q173 T174 L175V125-L171 HydrophobicContact CG1-CD2 4.39Å; L128-L171 HydrophobicContact CB-CD1 4.06Å; L128-L171 HydrophobicContact CB-CD2 3.97Å; L128-L171 HydrophobicContact CD1-CD2 4.3Å; E129-L171 HydrophobicContact CB-CD1 3.79Å; E129-L171 HydrophobicContact CG-CD1 4.21Å; E129-L171 VanDerWaalsContact N-CD1 3.34Å; A132-L171 HydrophobicContact CB-CD1 4.41Å; L151-L171 HydrophobicContact CD1-CD2 3.63Å; L151-L171 HydrophobicContact CD1-CG 4.18Å; P167-L171 VanDerWaalsContact O-CB 3.31Å; P167-L171 WeakPolarHBondContact O-CB 3.36Å; P167-L171 PolarHBondContact O-N 2.95Å; I168-L171 WeakPolarHBondContact O-CB 3.01Å; I168-L171 PolarHBondContact O-N 3.26Å; L171-Q173 PolarHBondContact O-N 3.47Å; L171-T174 PolarHBondContact O-N 2.99Å; L171-L175 WeakPolarHBondContact O-CB 3.01Å; L171-L175 PolarHBondContact O-N 2.61Å
172L95.7Very high89.3Confident0 Ų031.9 Ų31.90%017%0.173CC..Hα-helixtrans-62.7-42.3180-69.7179.7000111.4L151 V155 I168 K169 L175 Y176 I205 W208 Q209 L212L151-L172 HydrophobicContact CD1-CD2 3.94Å; L151-L172 HydrophobicContact CD2-CD2 3.97Å; L151-L172 HydrophobicContact CG-CD2 4.17Å; V155-L172 HydrophobicContact CG2-CD1 4.24Å; V155-L172 HydrophobicContact CG2-CD2 4.3Å; I168-L172 HydrophobicContact CG2-CD1 4.14Å; I168-L172 HydrophobicContact CG2-CG 4.2Å; I168-L172 WeakPolarHBondContact O-CB 3.47Å; I168-L172 VanDerWaalsContact O-CG 3.29Å; I168-L172 WeakPolarHBondContact O-CG 3.33Å; I168-L172 PolarHBondContact O-N 3.06Å; K169-L172 PolarHBondContact O-N 2.68Å; L172-L175 PolarHBondContact O-N 2.96Å; L172-Y176 WeakPolarHBondContact O-CB 3.38Å; L172-Y176 PolarHBondContact O-N 3.32Å; L172-I205 HydrophobicContact CB-CG2 4.16Å; L172-I205 HydrophobicContact CD2-CG2 4.23Å; L172-W208 HydrophobicContact CD1-CB 3.84Å; L172-W208 HydrophobicContact CD2-CE3 3.91Å; L172-Q209 HydrophobicContact CB-CG 3.9Å; L172-Q209 HydrophobicContact CD1-CG 4Å; L172-L212 HydrophobicContact CD1-CD1 3.62Å
173Q94.1Very high88.8Confident92 Ų9232 Ų3243%0.4318%0.176SC..Hα-helixtrans-63.1-45176.1-175.360.73200111.6K169 L171 L175 Y176 V177K169-Q173 WeakPolarHBondContact O-CB 3.33Å; K169-Q173 PolarHBondContact O-N 3.48Å; L171-Q173 PolarHBondContact O-N 3.47Å; Q173-L175 VanDerWaalsContact C-N 3.33Å; Q173-L175 PolarHBondContact O-N 3.19Å; Q173-Y176 PolarHBondContact O-N 3.39Å; Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 3.14Å
174T93.7Very high88.4Confident37 Ų3738.6 Ų38.623%0.22721%0.207CC..Hα-helixtrans-60.8-45.2177.7-61.40000111K133 E170 L171 S178K133-T174 HydrophobicContact CD-CG2 4.25Å; K133-T174 HydrophobicContact CG-CG2 3.43Å; K133-T174 VanDerWaalsContact CG-CG2 3.43Å; E170-T174 VanDerWaalsContact O-CB 3.28Å; E170-T174 WeakPolarHBondContact O-CB 3.14Å; E170-T174 PolarHBondContact O-N 2.89Å; E170-T174 PolarHBondContact O-OG1 2.73Å; L171-T174 PolarHBondContact O-N 2.99Å; T174-S178 VanDerWaalsContact O-CB 3.25Å; T174-S178 WeakPolarHBondContact O-CB 3.38Å; T174-S178 PolarHBondContact O-N 3.39Å
175L94.3Very high87.6Confident0 Ų043.8 Ų43.80%023%0.234CC..Hα-helixtrans-63.1-45.6177.3178.463.6000111.6A132 L136 Y147 M148 L151 L171 L172 Q173 S178 L179 I205A132-L175 HydrophobicContact CB-CB 4.08Å; A132-L175 HydrophobicContact CB-CD1 3.95Å; L136-L175 HydrophobicContact CD2-CD1 3.74Å; Y147-L175 HydrophobicContact CE1-CD1 4.04Å; Y147-L175 HydrophobicContact CE1-CD2 3.91Å; M148-L175 HydrophobicContact CE-CD1 4.47Å; M148-L175 HydrophobicContact CE-CD2 4.14Å; M148-L175 HydrophobicContact SD-CD2 4.38Å; L151-L175 HydrophobicContact CD2-CD2 3.31Å; L171-L175 WeakPolarHBondContact O-CB 3.01Å; L171-L175 PolarHBondContact O-N 2.61Å; L172-L175 PolarHBondContact O-N 2.96Å; Q173-L175 VanDerWaalsContact C-N 3.33Å; Q173-L175 PolarHBondContact O-N 3.19Å; L175-S178 WeakPolarHBondContact O-CB 3.48Å; L175-S178 PolarHBondContact O-N 2.88Å; L175-L179 HydrophobicContact CD1-CD1 4.11Å; L175-L179 HydrophobicContact CD1-CG 4.17Å; L175-L179 HydrophobicContact CG-CD1 4.02Å; L175-L179 HydrophobicContact CG-CG 4.46Å; L175-L179 WeakPolarHBondContact O-CB 3.37Å; L175-L179 VanDerWaalsContact O-CG 3.28Å; L175-L179 WeakPolarHBondContact O-CG 3.23Å; L175-L179 PolarHBondContact O-N 3.42Å; L175-I205 HydrophobicContact CD2-CD1 3.54Å; L175-I205 HydrophobicContact CD2-CG1 4.26Å; L175-I205 HydrophobicContact CG-CD1 3.89Å
176Y93.4Very high85.9Confident63 Ų6350.7 Ų50.725%0.24727%0.268CS..Hα-helixtrans-59.9-49179.3-175-94.3000111.6L172 Q173 S178 L179 C180 M202 I205 L206L172-Y176 WeakPolarHBondContact O-CB 3.38Å; L172-Y176 PolarHBondContact O-N 3.32Å; Q173-Y176 PolarHBondContact O-N 3.39Å; Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.42Å; Y176-L179 PolarHBondContact O-N 3.4Å; Y176-C180 WeakPolarHBondContact CE1-SG 3.19Å; Y176-C180 PolarHBondContact O-N 2.91Å; Y176-C180 PolarHBondContact O-SG 3.11Å; Y176-C180 VanDerWaalsContact O-SG 3.36Å; Y176-M202 HydrophobicContact CD2-CE 4.2Å; Y176-M202 HydrophobicContact CE2-CB 4.21Å; Y176-M202 HydrophobicContact CE2-CE 3.76Å; Y176-I205 HydrophobicContact CD2-CG2 4.29Å; Y176-L206 HydrophobicContact CD2-CD2 4.06Å; Y176-L206 HydrophobicContact CD2-CG 4.22Å; Y176-L206 HydrophobicContact CE2-CD1 3.92Å; Y176-L206 HydrophobicContact CE2-CD2 3.68Å; Y176-L206 HydrophobicContact CE2-CG 3.71Å
177V91.6Very high84.1Confident85 Ų8552.6 Ų52.652%0.51530%0.298SS..Hα-helixtrans-61.4-43.4177.8172.80000111.5Q173 L179 C180 G181Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 3.14Å; V177-L179 PolarHBondContact O-N 3.43Å; V177-C180 PolarHBondContact O-N 2.82Å; V177-G181 PolarHBondContact O-N 3.4Å; V177-G181 VanDerWaalsContact O-N 3.12Å
178S89.7Confident82.4Confident29 Ų2959.4 Ų59.420%0.20332%0.323CS..Hα-helixtrans-58.9-45.5175.8-178.40000111.6A132 T174 L175 Y176 G181 L182A132-S178 WeakPolarHBondContact O-CB 3.31Å; A132-S178 PolarHBondContact O-OG 2.86Å; T174-S178 VanDerWaalsContact O-CB 3.25Å; T174-S178 WeakPolarHBondContact O-CB 3.38Å; T174-S178 PolarHBondContact O-N 3.39Å; L175-S178 WeakPolarHBondContact O-CB 3.48Å; L175-S178 PolarHBondContact O-N 2.88Å; Y176-S178 VanDerWaalsContact C-N 3.35Å; Y176-S178 PolarHBondContact O-N 3.42Å; S178-G181 PolarHBondContact O-N 3.36Å; S178-L182 VanDerWaalsContact O-CG 3.26Å; S178-L182 WeakPolarHBondContact O-CG 2.86Å; S178-L182 PolarHBondContact O-N 3.39Å; S178-L182 VanDerWaalsContact O-N 3.11Å
179L88.8Confident80.5Confident1 Ų165 Ų651%0.00536%0.362CS..Hα-helixtrans-66-40.1176.4-70.3174.3000112.6L136 M148 L175 Y176 V177 G181 L182 V183 L191 W198 M202 I205L136-L179 HydrophobicContact CD2-CD2 3.81Å; M148-L179 HydrophobicContact CE-CD1 4.23Å; L175-L179 HydrophobicContact CD1-CD1 4.11Å; L175-L179 HydrophobicContact CD1-CG 4.17Å; L175-L179 HydrophobicContact CG-CD1 4.02Å; L175-L179 HydrophobicContact CG-CG 4.46Å; L175-L179 WeakPolarHBondContact O-CB 3.37Å; L175-L179 VanDerWaalsContact O-CG 3.28Å; L175-L179 WeakPolarHBondContact O-CG 3.23Å; L175-L179 PolarHBondContact O-N 3.42Å; Y176-L179 PolarHBondContact O-N 3.4Å; V177-L179 PolarHBondContact O-N 3.43Å; L179-G181 VanDerWaalsContact C-N 3.34Å; L179-G181 PolarHBondContact O-N 3.26Å; L179-L182 PolarHBondContact O-N 2.91Å; L179-V183 WeakPolarHBondContact O-CB 2.97Å; L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.46Å; L179-V183 PolarHBondContact O-N 2.96Å; L179-L191 HydrophobicContact CD2-CD1 3.85Å; L179-L191 HydrophobicContact CD2-CD2 4.42Å; L179-W198 HydrophobicContact CD1-CE3 4.45Å; L179-W198 HydrophobicContact CD1-CZ3 4.45Å; L179-W198 HydrophobicContact CD2-CE3 3.78Å; L179-W198 HydrophobicContact CD2-CZ3 3.67Å; L179-M202 HydrophobicContact CB-CE 4.33Å; L179-M202 HydrophobicContact CB-CG 4.19Å; L179-M202 HydrophobicContact CB-SD 4.09Å; L179-M202 HydrophobicContact CD1-CG 3.94Å; L179-I205 HydrophobicContact CD1-CD1 3.79Å
180C87.1Confident79.2Confident30 Ų3067.3 Ų67.320%0.20338%0.379CS..Hα-helixtrans-56.8-47.5174.9-73.30000111.6Y176 V177 V183 Q184 M202Y176-C180 WeakPolarHBondContact CE1-SG 3.19Å; Y176-C180 PolarHBondContact O-N 2.91Å; Y176-C180 PolarHBondContact O-SG 3.11Å; Y176-C180 VanDerWaalsContact O-SG 3.36Å; V177-C180 PolarHBondContact O-N 2.82Å; C180-V183 PolarHBondContact O-N 2.95Å; C180-Q184 WeakPolarHBondContact O-CB 3.38Å; C180-Q184 VanDerWaalsContact O-CG 3.25Å; C180-Q184 WeakPolarHBondContact O-CG 3.23Å; C180-Q184 PolarHBondContact O-N 2.96Å; C180-M202 WeakPolarHBondContact SG-CE 3.49Å
181G83.8Confident78.4Confident28 Ų2864.8 Ų64.829%0.28937%0.368SS..Hα-helixtrans-60.5-47.2176.900000112.1V177 S178 L179 V183 Q184 D185V177-G181 PolarHBondContact O-N 3.4Å; V177-G181 VanDerWaalsContact O-N 3.12Å; S178-G181 PolarHBondContact O-N 3.36Å; L179-G181 VanDerWaalsContact C-N 3.34Å; L179-G181 PolarHBondContact O-N 3.26Å; G181-V183 VanDerWaalsContact C-N 3.28Å; G181-V183 PolarHBondContact O-N 3.31Å; G181-Q184 PolarHBondContact O-N 3.49Å; G181-D185 PolarHBondContact O-N 2.93Å
182L81.3Confident77.5Confident55 Ų5568.5 Ų68.529%0.28839%0.39SS..Hα-helixtrans-63.9-29.6179.6-67.7168.8000113.9P137 S178 L179 L191P137-L182 HydrophobicContact CG-CD1 3.75Å; P137-L182 HydrophobicContact CG-CD2 3.86Å; P137-L182 HydrophobicContact CG-CG 4.49Å; S178-L182 VanDerWaalsContact O-CG 3.26Å; S178-L182 WeakPolarHBondContact O-CG 2.86Å; S178-L182 PolarHBondContact O-N 3.39Å; S178-L182 VanDerWaalsContact O-N 3.11Å; L179-L182 PolarHBondContact O-N 2.91Å; L182-L191 HydrophobicContact CB-CD1 4.26Å; L182-L191 HydrophobicContact CD1-CD2 4.06Å; L182-L191 HydrophobicContact CD1-CG 4.43Å
183V75.7Confident76.4Confident33 Ų3371.2 Ų71.220%0.242%0.418CS..Hα-helixtrans-82.6-32177.1172.30000111.6L179 C180 G181 M186 I195 M202L179-V183 WeakPolarHBondContact O-CB 2.97Å; L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.46Å; L179-V183 PolarHBondContact O-N 2.96Å; C180-V183 PolarHBondContact O-N 2.95Å; G181-V183 VanDerWaalsContact C-N 3.28Å; G181-V183 PolarHBondContact O-N 3.31Å; V183-M186 HydrophobicContact CG1-CE 4.27Å; V183-M186 WeakPolarHBondContact O-CE 3.18Å; V183-M186 WeakPolarHBondContact O-CG 2.83Å; V183-I195 HydrophobicContact CG1-CD1 4.21Å; V183-I195 HydrophobicContact CG2-CD1 4.2Å; V183-M202 HydrophobicContact CG2-SD 4.32Å
184Q72.6Confident75.8Confident150 Ų15070.9 Ų70.970%0.70142%0.419SS*.Hα-helixtrans-78-32.6-179.4-74.6174.8-4.900113.4C180 G181 M186C180-Q184 WeakPolarHBondContact O-CB 3.38Å; C180-Q184 VanDerWaalsContact O-CG 3.25Å; C180-Q184 WeakPolarHBondContact O-CG 3.23Å; C180-Q184 PolarHBondContact O-N 2.96Å; G181-Q184 PolarHBondContact O-N 3.49Å; Q184-M186 PolarHBondContact O-N 3.01Å
185D65.3Low75.2Confident136 Ų13672.8 Ų72.873%0.72743%0.427SS*.SBendtrans-76.548.4179.6-69.1-25000113G181 G187G181-D185 PolarHBondContact O-N 2.93Å; D185-G187 PolarHBondContact O-N 3.08Å; D185-G187 VanDerWaalsContact O-N 3.08Å
186M50.8Low74.7Confident150 Ų15078.1 Ų78.174%0.73946%0.456SS*.THydrogen-bonded Turntrans-61.9107.8-171.8-69.8-152.9159.300113.5V183 Q184V183-M186 HydrophobicContact CG1-CE 4.27Å; V183-M186 WeakPolarHBondContact O-CE 3.18Å; V183-M186 WeakPolarHBondContact O-CG 2.83Å; Q184-M186 PolarHBondContact O-N 3.01Å
187G50.8Low74.3Confident72 Ų7279.2 Ų79.274%0.74247%0.465SS*.THydrogen-bonded Turntrans-174-22.8166.900000114.1D185D185-G187 PolarHBondContact O-N 3.08Å; D185-G187 VanDerWaalsContact O-N 3.08Å
188K51.7Low74.1Confident183 Ų18375.3 Ų75.380%0.79644%0.441SS*.SBendtrans-141.2108.9172.2-63.8178.5-177175.30107.7V190K188-V190 VanDerWaalsContact C-N 3.35Å; K188-V190 VanDerWaalsContact O-CG2 3.3Å; K188-V190 WeakPolarHBondContact O-CG2 3.33Å; K188-V190 PolarHBondContact O-N 2.91Å
189S52.9Low73.9Confident118 Ų11877.8 Ų77.883%0.82546%0.455SS*.  trans-62.393.6176.157.50000109.9L191S189-L191 VanDerWaalsContact C-N 3.3Å
190V63.5Low73.9Confident82 Ų8283.1 Ų83.150%0.49748%0.479SS..  trans-78.1-23.5178.2-157.70000110.7P137 K188P137-V190 HydrophobicContact CB-CB 3.92Å; P137-V190 HydrophobicContact CB-CG1 3.26Å; P137-V190 HydrophobicContact CG-CG1 4.45Å; K188-V190 VanDerWaalsContact C-N 3.35Å; K188-V190 VanDerWaalsContact O-CG2 3.3Å; K188-V190 WeakPolarHBondContact O-CG2 3.33Å; K188-V190 PolarHBondContact O-N 2.91Å
191L75.1Confident74Confident17 Ų1783.9 Ų83.99%0.08948%0.478CS..SBendtrans-80.3132.9173.4-64.1178.2000110.7L179 L182 S189 W198L179-L191 HydrophobicContact CD2-CD1 3.85Å; L179-L191 HydrophobicContact CD2-CD2 4.42Å; L182-L191 HydrophobicContact CB-CD1 4.26Å; L182-L191 HydrophobicContact CD1-CD2 4.06Å; L182-L191 HydrophobicContact CD1-CG 4.43Å; S189-L191 VanDerWaalsContact C-N 3.3Å; L191-W198 HydrophobicContact CB-CD2 4.35Å; L191-W198 HydrophobicContact CB-CZ2 4.12Å; L191-W198 HydrophobicContact CD1-CD2 3.86Å; L191-W198 HydrophobicContact CD1-CE3 4.09Å; L191-W198 HydrophobicContact CD1-CG 4.12Å; L191-W198 HydrophobicContact CD2-CH2 4.06Å; L191-W198 HydrophobicContact CD2-CZ2 4.02Å; L191-W198 HydrophobicContact CD2-CZ3 4.46Å; L191-W198 HydrophobicContact CG-CZ2 4.46Å
192V75.1Confident74.4Confident77 Ų7783.6 Ų83.647%0.46747%0.47SS..  trans-80.9128.3-178-176.10000109.3Q144 W198Q144-V192 VanDerWaalsContact OE1-N 3.12Å; V192-W198 PolarHBondContact O-NE1 2.98Å
193G73.6Confident74.9Confident57 Ų5784.8 Ų84.859%0.58848%0.476SS*.SBendtrans110-173.1172.600000115
194N82Confident75.8Confident86 Ų8685.1 Ų85.146%0.4648%0.477SS..  trans-71.5133.2-177.8-175.2-32.5000110.9N196 I197N194-N196 PolarHBondContact O-N 2.87Å; N194-N196 WeakPolarHBondContact OD1-CB 3.15Å; N194-N196 PolarHBondContact OD1-N 2.81Å; N194-I197 HydrophobicContact CB-CD1 3.9Å; N194-I197 HydrophobicContact CB-CG1 4.1Å; N194-I197 VanDerWaalsContact O-CB 3.31Å; N194-I197 WeakPolarHBondContact O-CB 3.33Å; N194-I197 PolarHBondContact O-N 2.82Å
195I80.4Confident76.8Confident76 Ų7678 Ų7839%0.3944%0.443SS..Hα-helixtrans-53.6-36.8177.8-171.761.7000112.9V183 I197 W198 V199V183-I195 HydrophobicContact CG1-CD1 4.21Å; V183-I195 HydrophobicContact CG2-CD1 4.2Å; I195-I197 PolarHBondContact O-N 2.61Å; I195-W198 WeakPolarHBondContact O-CA 3.47Å; I195-W198 WeakPolarHBondContact O-CB 3.27Å; I195-W198 PolarHBondContact O-N 3.06Å; I195-V199 HydrophobicContact CG1-CG2 4.46Å; I195-V199 WeakPolarHBondContact O-CG2 3.35Å; I195-V199 PolarHBondContact O-N 2.89Å
196N83.3Confident78.2Confident112 Ų11274.3 Ų74.360%0.59942%0.423SS*.Hα-helixtrans-62.9-30.9178.8-65.8-23.4000112.3N194 W198 H200N194-N196 PolarHBondContact O-N 2.87Å; N194-N196 WeakPolarHBondContact OD1-CB 3.15Å; N194-N196 PolarHBondContact OD1-N 2.81Å; N196-W198 VanDerWaalsContact C-N 3.32Å; N196-H200 WeakPolarHBondContact O-CB 3.45Å; N196-H200 PolarHBondContact O-N 3.44Å
197I85.9Confident80.3Confident87 Ų8771.2 Ų71.245%0.44641%0.407SS..Hα-helixtrans-67.2-39.1174.7-62.2170.7000109.8N194 I195 H200 R201N194-I197 HydrophobicContact CB-CD1 3.9Å; N194-I197 HydrophobicContact CB-CG1 4.1Å; N194-I197 VanDerWaalsContact O-CB 3.31Å; N194-I197 WeakPolarHBondContact O-CB 3.33Å; N194-I197 PolarHBondContact O-N 2.82Å; I195-I197 PolarHBondContact O-N 2.61Å; I197-H200 PolarHBondContact O-N 3.13Å; I197-R201 VanDerWaalsContact O-CG 3.29Å; I197-R201 WeakPolarHBondContact O-CG 3.2Å; I197-R201 PolarHBondContact O-N 2.95Å
198W86.6Confident82.5Confident3 Ų369.2 Ų69.21%0.01138%0.377CS..Hα-helixtrans-71.8-38.8178.3-74.5104000112.3L136 Q144 M148 L179 L191 V192 I195 N196 H200 R201 M202L136-W198 HydrophobicContact CD2-CH2 4.33Å; L136-W198 HydrophobicContact CD2-CZ3 4.3Å; Q144-W198 HydrophobicContact CB-CH2 4.32Å; Q144-W198 HydrophobicContact CB-CZ2 4.32Å; M148-W198 HydrophobicContact CE-CE3 4.29Å; M148-W198 HydrophobicContact CE-CH2 4.21Å; M148-W198 HydrophobicContact CE-CZ3 3.46Å; M148-W198 VanDerWaalsContact CE-CZ3 3.46Å; L179-W198 HydrophobicContact CD1-CE3 4.45Å; L179-W198 HydrophobicContact CD1-CZ3 4.45Å; L179-W198 HydrophobicContact CD2-CE3 3.78Å; L179-W198 HydrophobicContact CD2-CZ3 3.67Å; L191-W198 HydrophobicContact CB-CD2 4.35Å; L191-W198 HydrophobicContact CB-CZ2 4.12Å; L191-W198 HydrophobicContact CD1-CD2 3.86Å; L191-W198 HydrophobicContact CD1-CE3 4.09Å; L191-W198 HydrophobicContact CD1-CG 4.12Å; L191-W198 HydrophobicContact CD2-CH2 4.06Å; L191-W198 HydrophobicContact CD2-CZ2 4.02Å; L191-W198 HydrophobicContact CD2-CZ3 4.46Å; L191-W198 HydrophobicContact CG-CZ2 4.46Å; V192-W198 PolarHBondContact O-NE1 2.98Å; I195-W198 WeakPolarHBondContact O-CA 3.47Å; I195-W198 WeakPolarHBondContact O-CB 3.27Å; I195-W198 PolarHBondContact O-N 3.06Å; N196-W198 VanDerWaalsContact C-N 3.32Å; W198-H200 VanDerWaalsContact C-N 3.35Å; W198-H200 PolarHBondContact O-N 3.09Å; W198-R201 VanDerWaalsContact CH2-NH1 3.27Å; W198-R201 PolarHBondContact O-N 3.29Å; W198-M202 WeakPolarHBondContact O-CG 3.34Å; W198-M202 PolarHBondContact O-N 3.21Å
199V86.3Confident84.5Confident80 Ų8061.8 Ų61.849%0.48535%0.345SS..Hα-helixtrans-58.6-47.2170.8174.90000110.7I195 R201 M202 D203I195-V199 HydrophobicContact CG1-CG2 4.46Å; I195-V199 WeakPolarHBondContact O-CG2 3.35Å; I195-V199 PolarHBondContact O-N 2.89Å; V199-R201 VanDerWaalsContact C-N 3.33Å; V199-R201 PolarHBondContact O-N 3.06Å; V199-M202 WeakPolarHBondContact O-CB 3.35Å; V199-M202 PolarHBondContact O-N 2.75Å; V199-D203 PolarHBondContact O-N 2.85Å
200H88.5Confident86.4Confident114 Ų11461.8 Ų61.853%0.52833%0.332SS..Hα-helixtrans-61.3-39175.4-176.8-60.8000112.5N196 I197 W198 M202 D203 N204N196-H200 WeakPolarHBondContact O-CB 3.45Å; N196-H200 PolarHBondContact O-N 3.44Å; I197-H200 PolarHBondContact O-N 3.13Å; W198-H200 VanDerWaalsContact C-N 3.35Å; W198-H200 PolarHBondContact O-N 3.09Å; H200-M202 VanDerWaalsContact C-N 3.33Å; H200-D203 PolarHBondContact O-N 3.06Å; H200-N204 PolarHBondContact CE1-ND2 3.25Å; H200-N204 PolarHBondContact CE1-OD1 3.23Å; H200-N204 PolarHBondContact ND1-ND2 3Å; H200-N204 PolarHBondContact ND1-OD1 3.38Å; H200-N204 PolarHBondContact O-N 3.13Å; H200-N204 PolarHBondContact O-OD1 3.46Å
201R90Very high87.7Confident45 Ų4562.3 Ų62.317%0.1733%0.329CS..Hα-helixtrans-65.4-37.3175.7-75.2168.9175-175.20.8112M148 I197 W198 V199 N204 I205M148-R201 HydrophobicContact CE-CB 4.47Å; I197-R201 VanDerWaalsContact O-CG 3.29Å; I197-R201 WeakPolarHBondContact O-CG 3.2Å; I197-R201 PolarHBondContact O-N 2.95Å; W198-R201 VanDerWaalsContact CH2-NH1 3.27Å; W198-R201 PolarHBondContact O-N 3.29Å; V199-R201 VanDerWaalsContact C-N 3.33Å; V199-R201 PolarHBondContact O-N 3.06Å; R201-N204 PolarHBondContact O-N 2.72Å; R201-I205 VanDerWaalsContact O-CG1 3.28Å; R201-I205 WeakPolarHBondContact O-CG1 3.4Å; R201-I205 PolarHBondContact O-N 3.49Å
202M91.2Very high88.4Confident23 Ų2361.5 Ų61.511%0.11333%0.325CS..Hα-helixtrans-64.7-41.1174.4-70.817772.900111.3Y176 L179 C180 V183 W198 V199 H200 I205 L206Y176-M202 HydrophobicContact CD2-CE 4.2Å; Y176-M202 HydrophobicContact CE2-CB 4.21Å; Y176-M202 HydrophobicContact CE2-CE 3.76Å; L179-M202 HydrophobicContact CB-CE 4.33Å; L179-M202 HydrophobicContact CB-CG 4.19Å; L179-M202 HydrophobicContact CB-SD 4.09Å; L179-M202 HydrophobicContact CD1-CG 3.94Å; C180-M202 WeakPolarHBondContact SG-CE 3.49Å; V183-M202 HydrophobicContact CG2-SD 4.32Å; W198-M202 WeakPolarHBondContact O-CG 3.34Å; W198-M202 PolarHBondContact O-N 3.21Å; V199-M202 WeakPolarHBondContact O-CB 3.35Å; V199-M202 PolarHBondContact O-N 2.75Å; H200-M202 VanDerWaalsContact C-N 3.33Å; M202-I205 WeakPolarHBondContact O-CB 3.25Å; M202-I205 PolarHBondContact O-N 2.95Å; M202-L206 PolarHBondContact O-N 3.15Å; M202-L206 VanDerWaalsContact O-N 3.08Å
203D92.4Very high88.9Confident79 Ų7961.3 Ų61.342%0.42232%0.321SS..Hα-helixtrans-61.3-45.7173.8-169.359.2000111.7V199 H200 I205 L206 Q207V199-D203 PolarHBondContact O-N 2.85Å; H200-D203 PolarHBondContact O-N 3.06Å; D203-I205 VanDerWaalsContact C-N 3.28Å; D203-I205 PolarHBondContact O-N 3.14Å; D203-L206 WeakPolarHBondContact O-CB 3.31Å; D203-L206 PolarHBondContact O-N 2.98Å; D203-L206 VanDerWaalsContact O-N 3.1Å; D203-Q207 WeakPolarHBondContact O-CG 3.28Å; D203-Q207 PolarHBondContact O-N 2.87Å; D203-Q207 PolarHBondContact OD2-NE2 3.21Å
204N93.8Very high89.6Confident41 Ų4164.4 Ų64.422%0.21932%0.324CS..Hα-helixtrans-57.8-39.6173.9-73.30.3000112.6H200 R201 L206 Q207 W208H200-N204 PolarHBondContact CE1-ND2 3.25Å; H200-N204 PolarHBondContact CE1-OD1 3.23Å; H200-N204 PolarHBondContact ND1-ND2 3Å; H200-N204 PolarHBondContact ND1-OD1 3.38Å; H200-N204 PolarHBondContact O-N 3.13Å; H200-N204 PolarHBondContact O-OD1 3.46Å; R201-N204 PolarHBondContact O-N 2.72Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-Q207 PolarHBondContact O-N 2.83Å; N204-W208 HydrophobicContact CB-CZ2 4.47Å; N204-W208 PolarHBondContact O-N 3.14Å
205I94.8Very high89.7Confident0 Ų060.8 Ų60.80%031%0.305CS..Hα-helixtrans-62.5-43176.9-71.2161.4000110.6M148 L172 L175 Y176 L179 R201 M202 D203 W208 Q209M148-I205 HydrophobicContact CE-CD1 4.48Å; L172-I205 HydrophobicContact CB-CG2 4.16Å; L172-I205 HydrophobicContact CD2-CG2 4.23Å; L175-I205 HydrophobicContact CD2-CD1 3.54Å; L175-I205 HydrophobicContact CD2-CG1 4.26Å; L175-I205 HydrophobicContact CG-CD1 3.89Å; Y176-I205 HydrophobicContact CD2-CG2 4.29Å; L179-I205 HydrophobicContact CD1-CD1 3.79Å; R201-I205 VanDerWaalsContact O-CG1 3.28Å; R201-I205 WeakPolarHBondContact O-CG1 3.4Å; R201-I205 PolarHBondContact O-N 3.49Å; M202-I205 WeakPolarHBondContact O-CB 3.25Å; M202-I205 PolarHBondContact O-N 2.95Å; D203-I205 VanDerWaalsContact C-N 3.28Å; D203-I205 PolarHBondContact O-N 3.14Å; I205-W208 HydrophobicContact CG1-CE3 4.15Å; I205-W208 HydrophobicContact CG1-CZ3 4.16Å; I205-W208 PolarHBondContact O-N 3.02Å; I205-Q209 WeakPolarHBondContact O-CG 3.23Å; I205-Q209 PolarHBondContact O-N 3.34Å
206L94.3Very high89.6Confident58 Ų5865 Ų6530%0.30432%0.323SS..Hα-helixtrans-63.6-42.7175.6-67173.4000111.4Y176 M202 D203 N204 W208 Q209 Q210Y176-L206 HydrophobicContact CD2-CD2 4.06Å; Y176-L206 HydrophobicContact CD2-CG 4.22Å; Y176-L206 HydrophobicContact CE2-CD1 3.92Å; Y176-L206 HydrophobicContact CE2-CD2 3.68Å; Y176-L206 HydrophobicContact CE2-CG 3.71Å; M202-L206 PolarHBondContact O-N 3.15Å; M202-L206 VanDerWaalsContact O-N 3.08Å; D203-L206 WeakPolarHBondContact O-CB 3.31Å; D203-L206 PolarHBondContact O-N 2.98Å; D203-L206 VanDerWaalsContact O-N 3.1Å; N204-L206 VanDerWaalsContact C-N 3.34Å; L206-W208 VanDerWaalsContact C-N 3.34Å; L206-W208 PolarHBondContact O-N 3.43Å; L206-Q209 WeakPolarHBondContact O-CB 3.39Å; L206-Q209 PolarHBondContact O-N 3.1Å; L206-Q210 WeakPolarHBondContact O-CG 3.37Å; L206-Q210 PolarHBondContact O-N 2.92Å
207Q95.3Very high89.1Confident85 Ų8563.4 Ų63.440%0.39731%0.314SS..Hα-helixtrans-60.2-43.6174.7-67.7177.515.100111.4D203 N204 Q210 Q211D203-Q207 WeakPolarHBondContact O-CG 3.28Å; D203-Q207 PolarHBondContact O-N 2.87Å; D203-Q207 PolarHBondContact OD2-NE2 3.21Å; N204-Q207 PolarHBondContact O-N 2.83Å; Q207-Q210 WeakPolarHBondContact O-CB 3.3Å; Q207-Q210 PolarHBondContact O-N 3.35Å; Q207-Q211 WeakPolarHBondContact O-CG 3.38Å; Q207-Q211 PolarHBondContact O-N 3.49Å
208W95.8Very high88.2Confident30 Ų3065 Ų6511%0.11432%0.323CS..Hα-helixtrans-63.2-40.9175.2-67.6-25.3000112.4L151 E152 V155 L172 N204 I205 L206 Q210 Q211 L212L151-W208 HydrophobicContact CD2-CZ3 3.95Å; L151-W208 HydrophobicContact CG-CZ3 3.97Å; E152-W208 HydrophobicContact CB-CH2 3.76Å; E152-W208 HydrophobicContact CB-CZ2 3.63Å; E152-W208 HydrophobicContact CG-CH2 4.35Å; E152-W208 HydrophobicContact CG-CZ2 3.7Å; V155-W208 HydrophobicContact CB-CD2 4.46Å; V155-W208 HydrophobicContact CB-CG 4.41Å; V155-W208 HydrophobicContact CG1-CB 3.93Å; V155-W208 HydrophobicContact CG1-CD2 4.32Å; V155-W208 HydrophobicContact CG1-CG 3.78Å; V155-W208 HydrophobicContact CG2-CB 4.38Å; V155-W208 HydrophobicContact CG2-CD2 4.1Å; V155-W208 HydrophobicContact CG2-CE3 4.07Å; V155-W208 HydrophobicContact CG2-CG 4.25Å; L172-W208 HydrophobicContact CD1-CB 3.84Å; L172-W208 HydrophobicContact CD2-CE3 3.91Å; N204-W208 HydrophobicContact CB-CZ2 4.47Å; N204-W208 PolarHBondContact O-N 3.14Å; I205-W208 HydrophobicContact CG1-CE3 4.15Å; I205-W208 HydrophobicContact CG1-CZ3 4.16Å; I205-W208 PolarHBondContact O-N 3.02Å; L206-W208 VanDerWaalsContact C-N 3.34Å; L206-W208 PolarHBondContact O-N 3.43Å; W208-Q210 VanDerWaalsContact C-N 3.34Å; W208-Q210 PolarHBondContact O-N 3.19Å; W208-Q211 PolarHBondContact O-N 3.44Å; W208-L212 VanDerWaalsContact O-CG 3.25Å; W208-L212 WeakPolarHBondContact O-CG 3.3Å; W208-L212 PolarHBondContact O-N 2.74Å
209Q93.4Very high87.2Confident27 Ų2775.5 Ų75.513%0.12636%0.363CS..Hα-helixtrans-58.7-46.8173.8-73.8-179.7-39.600111.1L172 I205 L206 Q211 L212 D213L172-Q209 HydrophobicContact CB-CG 3.9Å; L172-Q209 HydrophobicContact CD1-CG 4Å; I205-Q209 WeakPolarHBondContact O-CG 3.23Å; I205-Q209 PolarHBondContact O-N 3.34Å; L206-Q209 WeakPolarHBondContact O-CB 3.39Å; L206-Q209 PolarHBondContact O-N 3.1Å; Q209-Q211 PolarHBondContact O-N 3.07Å; Q209-L212 PolarHBondContact O-N 2.95Å; Q209-D213 VanDerWaalsContact O-CG 3.25Å; Q209-D213 PolarHBondContact O-N 3.27Å
210Q92.8Very high86.1Confident119 Ų11977.3 Ų77.356%0.55638%0.376SS*.Hα-helixtrans-61.3-41.6176.1-70.1175.9200112.5L206 Q207 W208 L212 D213 N214L206-Q210 WeakPolarHBondContact O-CG 3.37Å; L206-Q210 PolarHBondContact O-N 2.92Å; Q207-Q210 WeakPolarHBondContact O-CB 3.3Å; Q207-Q210 PolarHBondContact O-N 3.35Å; W208-Q210 VanDerWaalsContact C-N 3.34Å; W208-Q210 PolarHBondContact O-N 3.19Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 2.64Å; Q210-D213 PolarHBondContact O-N 3.08Å; Q210-N214 PolarHBondContact O-N 2.94Å; Q210-N214 VanDerWaalsContact O-N 3.11Å; Q210-N214 PolarHBondContact O-ND2 2.79Å
211Q92.1Very high84.8Confident92 Ų9276 Ų7643%0.4339%0.385SS..Hα-helixtrans-61.6-43.6175.6-73.4176.4-18.700111.5L159 Q207 W208 Q209 D213 N214 I215L159-Q211 HydrophobicContact CD1-CB 4.33Å; L159-Q211 HydrophobicContact CD2-CB 3.94Å; Q207-Q211 WeakPolarHBondContact O-CG 3.38Å; Q207-Q211 PolarHBondContact O-N 3.49Å; W208-Q211 PolarHBondContact O-N 3.44Å; Q209-Q211 PolarHBondContact O-N 3.07Å; Q211-D213 VanDerWaalsContact C-N 3.29Å; Q211-D213 PolarHBondContact O-N 2.93Å; Q211-N214 PolarHBondContact O-N 3.37Å; Q211-N214 VanDerWaalsContact O-N 3.16Å; Q211-I215 PolarHBondContact O-N 3.02Å
212L88.7Confident83.3Confident0 Ų078.8 Ų78.80%042%0.418CS..Hα-helixtrans-68.2-27.8176.4-65.7172.9000112.7V158 L159 V165 I168 K169 L172 W208 Q209 Q210 N214 I215V158-L212 HydrophobicContact CG1-CD2 3.79Å; L159-L212 HydrophobicContact CD2-CD2 3.91Å; L159-L212 HydrophobicContact CG-CD2 4.27Å; V165-L212 HydrophobicContact CG1-CB 4.48Å; I168-L212 HydrophobicContact CB-CD1 4.23Å; I168-L212 HydrophobicContact CG2-CD1 3.72Å; K169-L212 HydrophobicContact CD-CB 4.47Å; K169-L212 VanDerWaalsContact CE-CB 3.5Å; K169-L212 WeakPolarHBondContact CE-O 3.41Å; K169-L212 HydrophobicContact CG-CB 4.11Å; K169-L212 HydrophobicContact CG-CD1 4.05Å; K169-L212 PolarHBondContact NZ-O 2.92Å; L172-L212 HydrophobicContact CD1-CD1 3.62Å; W208-L212 VanDerWaalsContact O-CG 3.25Å; W208-L212 WeakPolarHBondContact O-CG 3.3Å; W208-L212 PolarHBondContact O-N 2.74Å; Q209-L212 PolarHBondContact O-N 2.95Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 2.64Å; L212-N214 VanDerWaalsContact C-N 3.3Å; L212-I215 HydrophobicContact CD2-CD1 3.81Å
213D85.9Confident81.8Confident73 Ų7386.3 Ų86.339%0.3946%0.455SS..Hα-helixtrans-73.7-20.1172.7-71.6-26.8000113.1W8 K169 Q209 Q210 Q211W8-D213 WeakPolarHBondContact CH2-O 3.45Å; W8-D213 WeakPolarHBondContact CZ2-O 3.47Å; K169-D213 WeakPolarHBondContact CE-OD1 3.43Å; K169-D213 IonicContact NZ-OD1 3.74Å; K169-D213 PolarHBondContact NZ-OD1 3.45Å; Q209-D213 VanDerWaalsContact O-CG 3.25Å; Q209-D213 PolarHBondContact O-N 3.27Å; Q210-D213 PolarHBondContact O-N 3.08Å; Q211-D213 VanDerWaalsContact C-N 3.29Å; Q211-D213 PolarHBondContact O-N 2.93Å
214N87.5Confident80.9Confident122 Ų12285.8 Ų85.865%0.65247%0.468SS*.SBendtrans-104.65.6-177.9-69.4-44.1000113.8Q210 Q211 L212 Q216Q210-N214 PolarHBondContact O-N 2.94Å; Q210-N214 VanDerWaalsContact O-N 3.11Å; Q210-N214 PolarHBondContact O-ND2 2.79Å; Q211-N214 PolarHBondContact O-N 3.37Å; Q211-N214 VanDerWaalsContact O-N 3.16Å; L212-N214 VanDerWaalsContact C-N 3.3Å; N214-Q216 PolarHBondContact O-N 3.35Å
215I84.5Confident80.2Confident11 Ų1191.6 Ų91.66%0.05650%0.496CS..  trans-55.6139.2176.4-70174.9000108.9W8 L159 Q162 V165 Q211 L212W8-I215 WeakPolarHBondContact CH2-O 3.44Å; W8-I215 HydrophobicContact CZ3-CB 4.16Å; W8-I215 WeakPolarHBondContact CZ3-O 3.47Å; L159-I215 HydrophobicContact CD2-CD1 4.05Å; L159-I215 HydrophobicContact CD2-CG1 4.03Å; Q162-I215 HydrophobicContact CB-CG2 4.41Å; Q162-I215 HydrophobicContact CG-CG2 4.13Å; V165-I215 HydrophobicContact CG1-CD1 4.28Å; V165-I215 HydrophobicContact CG2-CD1 3.94Å; Q211-I215 PolarHBondContact O-N 3.02Å; L212-I215 HydrophobicContact CD2-CD1 3.81Å
216Q77.9Confident79.7Confident163 Ų16394 Ų9476%0.76251%0.512SS*.  trans-114.6115.3165.1-66.6-171.3-0.200107.1Q162 N214 N218Q162-Q216 PolarHBondContact NE2-O 3.18Å; Q162-Q216 PolarHBondContact OE1-O 3.16Å; N214-Q216 PolarHBondContact O-N 3.35Å; Q216-N218 PolarHBondContact O-N 3.49Å
217I74.7Confident79.3Confident80 Ų8094 Ų9441%0.4151%0.513SS..  trans-64.8114.2-179.7-60.9175.3000107.4R219I217-R219 PolarHBondContact O-N 3.06Å
218N66.6Low79Confident119 Ų11993 Ų9364%0.63651%0.512SS*.PPolyproline II helixtrans-64.1119.5-179.9-68.9-41.5000108.8Q162 Q216Q162-N218 PolarHBondContact NE2-ND2 3.05Å; Q162-N218 PolarHBondContact OE1-ND2 3.37Å; Q216-N218 PolarHBondContact O-N 3.49Å
219R64.2Low78.7Confident224 Ų22496.3 Ų96.385%0.84553%0.532SS*.PPolyproline II helixtrans-66.5130.3172.7-75.2-174.5-179.2177.30.9108.7I217 A221I217-R219 PolarHBondContact O-N 3.06Å; R219-A221 PolarHBondContact O-N 3.14Å
220P63.9Low78.6Confident119 Ų11997.4 Ų97.477%0.77354%0.539SS*.PPolyproline II helixtrans-55.8140.6166.3-1930.2000109.1A222P220-A222 PolarHBondContact O-N 3.19Å
221A61.7Low78.7Confident85 Ų8595.4 Ų95.470%0.70254%0.536SS*.PPolyproline II helixtrans-52.8126.5170.900000108.5R219 M223R219-A221 PolarHBondContact O-N 3.14Å; A221-M223 HydrophobicContact CB-CG 4.34Å; A221-M223 PolarHBondContact O-N 3.2Å
222A58.4Low78.7Confident105 Ų10593.8 Ų93.887%0.86854%0.538SS*.SBendtrans-69.269.5-169.300000112.5P220P220-A222 PolarHBondContact O-N 3.19Å
223M60.2Low78.8Confident181 Ų18197.3 Ų97.389%0.89256%0.563SS**  trans-11122.8-173-67.6-76.3-80.200112.3A221A221-M223 HydrophobicContact CB-CG 4.34Å; A221-M223 PolarHBondContact O-N 3.2Å
224G72.1Confident79.1Confident68 Ų6897.8 Ų97.870%0.70157%0.565SS**SBendtrans-169.8-179.3-177.700000116
225M79.4Confident79.4Confident163 Ų16392.5 Ų92.580%0.80354%0.536SS*.  trans-60.6139.1175.8-69.7-174.8-69.400111.6
226S84.1Confident79.8Confident49 Ų4993.7 Ų93.734%0.34354%0.543SS..  trans-94.9166.6176.272.90000111.8T228 D229S226-T228 PolarHBondContact O-N 2.98Å; S226-T228 PolarHBondContact OG-OG1 3.04Å; S226-D229 WeakPolarHBondContact CA-OD2 3.46Å; S226-D229 WeakPolarHBondContact CB-OD2 3.46Å; S226-D229 PolarHBondContact N-OD2 3.23Å; S226-D229 WeakPolarHBondContact O-CB 3.37Å; S226-D229 PolarHBondContact O-N 2.9Å; S226-D229 VanDerWaalsContact O-N 3.14Å; S226-D229 PolarHBondContact OG-OD1 2.62Å; S226-D229 PolarHBondContact OG-OD2 2.87Å
227L87.1Confident80.5Confident60 Ų6089.9 Ų89.931%0.31453%0.528SS..G310 helixtrans-59-36.6177.9178.863.5000112.1D229 L230 Q235 I238 L251 L258L227-D229 VanDerWaalsContact C-N 3.26Å; L227-D229 PolarHBondContact O-N 3.45Å; L227-L230 HydrophobicContact CD1-CD1 4.2Å; L227-L230 WeakPolarHBondContact O-CB 3.27Å; L227-L230 PolarHBondContact O-N 3.49Å; L227-Q235 HydrophobicContact CD1-CG 4.43Å; L227-Q235 WeakPolarHBondContact O-CG 3.31Å; L227-Q235 PolarHBondContact O-NE2 3.31Å; L227-Q235 VanDerWaalsContact O-NE2 3.16Å; L227-I238 HydrophobicContact CD1-CD1 3.82Å; L227-L251 HydrophobicContact CD2-CD1 3.87Å; L227-L258 HydrophobicContact CD2-CD1 4.31Å; L227-L258 HydrophobicContact CD2-CD2 4.31Å
228T88.5Confident81.3Confident62 Ų6289.9 Ų89.938%0.3853%0.528SS..G310 helixtrans-70.2-22.2179.942.60000112.8S226 L230 Q235 L258S226-T228 PolarHBondContact O-N 2.98Å; S226-T228 PolarHBondContact OG-OG1 3.04Å; T228-L230 PolarHBondContact O-N 3.22Å; T228-Q235 PolarHBondContact O-NE2 2.79Å; T228-L258 HydrophobicContact CG2-CD1 4.5Å
229D89.6Confident82.6Confident101 Ų10184.3 Ų84.354%0.5450%0.498SS..G310 helixtrans-76.4-14.4177.3-55-36000112.4S226 L227S226-D229 WeakPolarHBondContact CA-OD2 3.46Å; S226-D229 WeakPolarHBondContact CB-OD2 3.46Å; S226-D229 PolarHBondContact N-OD2 3.23Å; S226-D229 WeakPolarHBondContact O-CB 3.37Å; S226-D229 PolarHBondContact O-N 2.9Å; S226-D229 VanDerWaalsContact O-N 3.14Å; S226-D229 PolarHBondContact OG-OD1 2.62Å; S226-D229 PolarHBondContact OG-OD2 2.87Å; L227-D229 VanDerWaalsContact C-N 3.26Å; L227-D229 PolarHBondContact O-N 3.45Å
230L91.5Very high83.9Confident49 Ų4976.2 Ų76.226%0.25747%0.469SS..SBendtrans-77.7145.9177.6-60.8178.9000111.2L227 T228 L234 Q235 I238L227-L230 HydrophobicContact CD1-CD1 4.2Å; L227-L230 WeakPolarHBondContact O-CB 3.27Å; L227-L230 PolarHBondContact O-N 3.49Å; T228-L230 PolarHBondContact O-N 3.22Å; L230-L234 HydrophobicContact CB-CB 4.35Å; L230-Q235 HydrophobicContact CB-CG 4.05Å; L230-Q235 PolarHBondContact O-NE2 3.35Å; L230-I238 HydrophobicContact CD1-CD1 3.63Å
231P93.7Very high85.1Confident78 Ų7880.7 Ų80.751%0.50647%0.471SS..  trans-53.3144.4169.8-25.932.9000112.8S233 L234 Q235P231-S233 PolarHBondContact O-N 3.45Å; P231-S233 VanDerWaalsContact O-N 3.07Å; P231-L234 HydrophobicContact CG-CD1 4.49Å; P231-L234 WeakPolarHBondContact O-CA 3.49Å; P231-L234 WeakPolarHBondContact O-CB 3.4Å; P231-L234 PolarHBondContact O-N 2.89Å; P231-Q235 PolarHBondContact O-N 2.95Å
232A92.2Very high86.5Confident57 Ų5779.5 Ų79.547%0.47145%0.452SS..Hα-helixtrans-53.1-34.5-177.800000113.9Q235 L236 L261A232-Q235 PolarHBondContact O-N 3.16Å; A232-L236 WeakPolarHBondContact O-CB 3.39Å; A232-L236 PolarHBondContact O-N 3.21Å; A232-L261 HydrophobicContact CB-CD1 4.36Å; A232-L261 HydrophobicContact CB-CD2 4.25Å
233S91.6Very high87.9Confident74 Ų7478.1 Ų78.152%0.51743%0.434SS..Hα-helixtrans-65-37.2175.658.20000112.8P231 N237P231-S233 PolarHBondContact O-N 3.45Å; P231-S233 VanDerWaalsContact O-N 3.07Å; S233-N237 WeakPolarHBondContact O-CB 3.44Å; S233-N237 PolarHBondContact O-N 3.29Å; S233-N237 PolarHBondContact O-ND2 2.96Å
234L92.3Very high89.2Confident84 Ų8470.6 Ų70.644%0.4440%0.397SS..Hα-helixtrans-73.8-41.2175.1-67.1-172.1000111.3L230 P231 L236 N237 I238L230-L234 HydrophobicContact CB-CB 4.35Å; P231-L234 HydrophobicContact CG-CD1 4.49Å; P231-L234 WeakPolarHBondContact O-CA 3.49Å; P231-L234 WeakPolarHBondContact O-CB 3.4Å; P231-L234 PolarHBondContact O-N 2.89Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 2.91Å; L234-N237 PolarHBondContact O-N 3.11Å; L234-I238 WeakPolarHBondContact O-CG1 3.39Å; L234-I238 PolarHBondContact O-N 2.68Å
235Q93.8Very high90.1Very high10 Ų1067.3 Ų67.35%0.04736%0.363CS..Hα-helixtrans-56.4-48.4173.3-62.8179.7600110.6L227 T228 L230 P231 A232 N237 I238 M239 L261L227-Q235 HydrophobicContact CD1-CG 4.43Å; L227-Q235 WeakPolarHBondContact O-CG 3.31Å; L227-Q235 PolarHBondContact O-NE2 3.31Å; L227-Q235 VanDerWaalsContact O-NE2 3.16Å; T228-Q235 PolarHBondContact O-NE2 2.79Å; L230-Q235 HydrophobicContact CB-CG 4.05Å; L230-Q235 PolarHBondContact O-NE2 3.35Å; P231-Q235 PolarHBondContact O-N 2.95Å; A232-Q235 PolarHBondContact O-N 3.16Å; Q235-N237 VanDerWaalsContact C-N 3.34Å; Q235-N237 PolarHBondContact O-N 3.43Å; Q235-I238 WeakPolarHBondContact O-CB 3.42Å; Q235-I238 PolarHBondContact O-N 3.09Å; Q235-I238 VanDerWaalsContact O-N 3.15Å; Q235-M239 HydrophobicContact CB-CE 4.4Å; Q235-M239 VanDerWaalsContact O-CG 3.28Å; Q235-M239 WeakPolarHBondContact O-CG 3.21Å; Q235-M239 PolarHBondContact O-N 3.2Å; Q235-L261 HydrophobicContact CB-CD1 3.85Å
236L92.8Very high90.6Very high36 Ų3663.7 Ų63.719%0.18834%0.341CS..Hα-helixtrans-63-38.6177.8-170.168.8000112.4A232 L234 I238 M239 Q240 D264 L267A232-L236 WeakPolarHBondContact O-CB 3.39Å; A232-L236 PolarHBondContact O-N 3.21Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 2.91Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 3.41Å; L236-M239 WeakPolarHBondContact O-CB 3.45Å; L236-M239 PolarHBondContact O-N 3.34Å; L236-Q240 VanDerWaalsContact O-CG 3.29Å; L236-Q240 WeakPolarHBondContact O-CG 3.39Å; L236-Q240 PolarHBondContact O-N 3.32Å; L236-D264 HydrophobicContact CD1-CB 4.07Å; L236-L267 HydrophobicContact CD1-CD2 4.39Å
237N91.9Very high90.9Very high84 Ų8463.2 Ų63.245%0.44933%0.334SS..Hα-helixtrans-62.9-38.8174.4-85.3-50.3000112.4S233 L234 Q235 Q240S233-N237 WeakPolarHBondContact O-CB 3.44Å; S233-N237 PolarHBondContact O-N 3.29Å; S233-N237 PolarHBondContact O-ND2 2.96Å; L234-N237 PolarHBondContact O-N 3.11Å; Q235-N237 VanDerWaalsContact C-N 3.34Å; Q235-N237 PolarHBondContact O-N 3.43Å; N237-Q240 PolarHBondContact O-N 3.49Å
238I92.1Very high91.1Very high79 Ų7960.4 Ų60.441%0.40532%0.319SS..Hα-helixtrans-64.6-46.6174-66.6164.2000109.8L227 L230 L234 Q235 L236 Q240 R241L227-I238 HydrophobicContact CD1-CD1 3.82Å; L230-I238 HydrophobicContact CD1-CD1 3.63Å; L234-I238 WeakPolarHBondContact O-CG1 3.39Å; L234-I238 PolarHBondContact O-N 2.68Å; Q235-I238 WeakPolarHBondContact O-CB 3.42Å; Q235-I238 PolarHBondContact O-N 3.09Å; Q235-I238 VanDerWaalsContact O-N 3.15Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 3.41Å; I238-Q240 VanDerWaalsContact C-N 3.26Å; I238-Q240 PolarHBondContact O-N 2.91Å; I238-R241 WeakPolarHBondContact O-CB 3.25Å; I238-R241 PolarHBondContact O-N 3.27Å
239M93.6Very high91.3Very high2 Ų259.2 Ų59.21%0.0131%0.312CS..Hα-helixtrans-57.4-39177.1-66.8179.5-168.100112.3Q235 L236 R241 L242 L248 L251 L258 L261 T262 L267Q235-M239 HydrophobicContact CB-CE 4.4Å; Q235-M239 VanDerWaalsContact O-CG 3.28Å; Q235-M239 WeakPolarHBondContact O-CG 3.21Å; Q235-M239 PolarHBondContact O-N 3.2Å; L236-M239 WeakPolarHBondContact O-CB 3.45Å; L236-M239 PolarHBondContact O-N 3.34Å; M239-R241 PolarHBondContact O-N 2.64Å; M239-R241 VanDerWaalsContact O-N 3.15Å; M239-L242 WeakPolarHBondContact O-CB 3.42Å; M239-L242 PolarHBondContact O-N 2.88Å; M239-L248 HydrophobicContact CB-CD2 3.93Å; M239-L248 HydrophobicContact CG-CD2 4.4Å; M239-L251 HydrophobicContact CE-CD2 3.65Å; M239-L251 HydrophobicContact CE-CG 4.27Å; M239-L251 HydrophobicContact CG-CD2 3.51Å; M239-L251 HydrophobicContact SD-CD2 4.02Å; M239-L258 HydrophobicContact CE-CB 4.3Å; M239-L258 HydrophobicContact CE-CD2 3.46Å; M239-L258 VanDerWaalsContact CE-CD2 3.46Å; M239-L258 HydrophobicContact CE-CG 4.46Å; M239-L261 HydrophobicContact CE-CB 3.78Å; M239-L261 HydrophobicContact CE-CD1 3.96Å; M239-L261 HydrophobicContact SD-CB 3.9Å; M239-T262 HydrophobicContact CE-CG2 4.21Å; M239-T262 HydrophobicContact SD-CG2 3.81Å; M239-L267 HydrophobicContact CB-CD1 3.94Å; M239-L267 HydrophobicContact CB-CD2 4.2Å; M239-L267 HydrophobicContact SD-CD2 4.47Å
240Q91.6Very high91.3Very high54 Ų5454.9 Ų54.925%0.25229%0.29SS..THydrogen-bonded Turntrans-65-14.3177.1-74.2175.521.300114.1L236 N237 I238 L267 K270L236-Q240 VanDerWaalsContact O-CG 3.29Å; L236-Q240 WeakPolarHBondContact O-CG 3.39Å; L236-Q240 PolarHBondContact O-N 3.32Å; N237-Q240 PolarHBondContact O-N 3.49Å; I238-Q240 VanDerWaalsContact C-N 3.26Å; I238-Q240 PolarHBondContact O-N 2.91Å; Q240-L267 HydrophobicContact CB-CD1 4.21Å; Q240-L267 HydrophobicContact CG-CD1 3.54Å; Q240-K270 HydrophobicContact CG-CD 4.34Å
241R89.8Confident91.2Very high214 Ų21454 Ų5481%0.80829%0.285SS*.THydrogen-bonded Turntrans-88.6-9.1174.6-59.6-58.6-177.3159.60.4113.2I238 M239I238-R241 WeakPolarHBondContact O-CB 3.25Å; I238-R241 PolarHBondContact O-N 3.27Å; M239-R241 PolarHBondContact O-N 2.64Å; M239-R241 VanDerWaalsContact O-N 3.15Å
242L89.4Confident91.1Very high59 Ų5951 Ų5131%0.30927%0.269SS..  trans-74.2135.2175-63.6173.8000110.1M239 D247 L248 L251M239-L242 WeakPolarHBondContact O-CB 3.42Å; M239-L242 PolarHBondContact O-N 2.88Å; L242-D247 HydrophobicContact CD1-CB 4.47Å; L242-L248 HydrophobicContact CB-CD2 4.2Å; L242-L248 HydrophobicContact CD1-CD2 3.64Å; L242-L248 HydrophobicContact CD1-CG 4.46Å; L242-L248 HydrophobicContact CG-CD2 4.48Å; L242-L251 HydrophobicContact CD1-CD2 4.35Å
243T88.1Confident91Very high77 Ų7754.4 Ų54.447%0.47228%0.275SS..  trans-103.63.7-175.458.10000113Y274 H275T243-Y274 HydrophobicContact CG2-CE1 3.88Å; T243-H275 PolarHBondContact O-CE1 2.86Å; T243-H275 PolarHBondContact O-NE2 3.48Å
244D88.2Confident90.9Very high22 Ų2256 Ų5612%0.11828%0.281CS..  trans-130.9121.6176.1-171-14.9000109.2R166 R246 D247 L248R166-D244 IonicContact NH1-OD2 3.54Å; R166-D244 PolarHBondContact NH1-OD2 2.95Å; R166-D244 VanDerWaalsContact NH1-OD2 3.15Å; D244-R246 PolarHBondContact O-N 2.88Å; D244-R246 WeakPolarHBondContact OD1-CB 3.15Å; D244-R246 WeakPolarHBondContact OD1-CG 3.35Å; D244-R246 PolarHBondContact OD1-N 3.23Å; D244-R246 IonicContact OD1-NE 2.72Å; D244-R246 PolarHBondContact OD1-NE 2.86Å; D244-R246 VanDerWaalsContact OD1-NE 3.14Å; D244-R246 IonicContact OD2-CZ 2.64Å; D244-R246 IonicContact OD2-NE 2.62Å; D244-R246 PolarHBondContact OD2-NE 3.4Å; D244-R246 IonicContact OD2-NH2 3.32Å; D244-R246 PolarHBondContact OD2-NH2 3.17Å; D244-D247 WeakPolarHBondContact O-CB 3.17Å; D244-D247 PolarHBondContact O-N 3.28Å; D244-L248 PolarHBondContact O-N 2.86Å
245G90.4Very high90.7Very high0 Ų053.4 Ų53.40%027%0.27CS..Hα-helixtrans-62.7-24177.700000113D247 L248 V249 W268 L271 Y299G245-D247 VanDerWaalsContact C-N 3.25Å; G245-D247 PolarHBondContact O-N 3.05Å; G245-L248 WeakPolarHBondContact O-CB 3.4Å; G245-L248 PolarHBondContact O-N 3.13Å; G245-V249 WeakPolarHBondContact O-CG2 3.44Å; G245-V249 PolarHBondContact O-N 3Å; G245-V249 VanDerWaalsContact O-N 3.1Å; G245-W268 WeakPolarHBondContact O-CH2 3.44Å; G245-L271 VanDerWaalsContact CA-CD2 3.49Å; G245-Y299 PolarHBondContact N-OH 3.45Å
246R90Very high90.6Very high87 Ų8758.5 Ų58.533%0.32830%0.303SS..Hα-helixtrans-65.8-31.1171.5-63.9173.8-67.8-177.45.6111.2R9 E170 D244 L248 V249 S250 F300R9-R246 PolarHBondContact NH1-O 3.35Å; E170-R246 IonicContact OE1-CZ 3.28Å; E170-R246 IonicContact OE1-NH1 2.86Å; E170-R246 PolarHBondContact OE1-NH1 3.29Å; E170-R246 IonicContact OE1-NH2 2.83Å; D244-R246 PolarHBondContact O-N 2.88Å; D244-R246 WeakPolarHBondContact OD1-CB 3.15Å; D244-R246 WeakPolarHBondContact OD1-CG 3.35Å; D244-R246 PolarHBondContact OD1-N 3.23Å; D244-R246 IonicContact OD1-NE 2.72Å; D244-R246 PolarHBondContact OD1-NE 2.86Å; D244-R246 VanDerWaalsContact OD1-NE 3.14Å; D244-R246 IonicContact OD2-CZ 2.64Å; D244-R246 IonicContact OD2-NE 2.62Å; D244-R246 PolarHBondContact OD2-NE 3.4Å; D244-R246 IonicContact OD2-NH2 3.32Å; D244-R246 PolarHBondContact OD2-NH2 3.17Å; R246-L248 VanDerWaalsContact C-N 3.32Å; R246-V249 PolarHBondContact O-N 3.5Å; R246-S250 PolarHBondContact O-N 3.35Å; R246-S250 PolarHBondContact O-OG 3.42Å; R246-F300 HydrophobicContact CG-CE1 3.95Å
247D89.8Confident90.5Very high38 Ų3862.9 Ų62.920%0.20332%0.323CS..Hα-helixtrans-72.7-31.2177.2-61.6-17.2000111.3R166 L242 D244 G245 S250 L251R166-D247 IonicContact CZ-OD1 2.75Å; R166-D247 IonicContact NH1-OD1 2.95Å; R166-D247 PolarHBondContact NH1-OD1 3.09Å; R166-D247 IonicContact NH2-OD1 3.67Å; L242-D247 HydrophobicContact CD1-CB 4.47Å; D244-D247 WeakPolarHBondContact O-CB 3.17Å; D244-D247 PolarHBondContact O-N 3.28Å; G245-D247 VanDerWaalsContact C-N 3.25Å; G245-D247 PolarHBondContact O-N 3.05Å; D247-S250 VanDerWaalsContact CA-OG 3.27Å; D247-S250 WeakPolarHBondContact CA-OG 3.43Å; D247-S250 PolarHBondContact O-N 3.4Å; D247-S250 PolarHBondContact O-OG 2.99Å; D247-L251 PolarHBondContact O-N 3.39Å
248L92.6Very high90.6Very high1 Ų159 Ų591%0.00530%0.302CS..Hα-helixtrans-66.7-44.6172.2-66178.1000112.8M239 L242 D244 G245 R246 S250 L251 G252 T262 L267 W268 L271M239-L248 HydrophobicContact CB-CD2 3.93Å; M239-L248 HydrophobicContact CG-CD2 4.4Å; L242-L248 HydrophobicContact CB-CD2 4.2Å; L242-L248 HydrophobicContact CD1-CD2 3.64Å; L242-L248 HydrophobicContact CD1-CG 4.46Å; L242-L248 HydrophobicContact CG-CD2 4.48Å; D244-L248 PolarHBondContact O-N 2.86Å; G245-L248 WeakPolarHBondContact O-CB 3.4Å; G245-L248 PolarHBondContact O-N 3.13Å; R246-L248 VanDerWaalsContact C-N 3.32Å; L248-S250 PolarHBondContact O-N 3.21Å; L248-S250 VanDerWaalsContact O-N 3.16Å; L248-L251 PolarHBondContact O-N 3.35Å; L248-G252 PolarHBondContact O-N 3.32Å; L248-G252 VanDerWaalsContact O-N 3.15Å; L248-T262 WeakPolarHBondContact O-CG2 3.43Å; L248-L267 HydrophobicContact CD1-CD1 4.3Å; L248-L267 HydrophobicContact CD1-CD2 3.94Å; L248-L267 HydrophobicContact CD1-CG 3.9Å; L248-L267 HydrophobicContact CD2-CD1 4.5Å; L248-L267 HydrophobicContact CD2-CD2 4.04Å; L248-W268 HydrophobicContact CB-CH2 4.16Å; L248-W268 HydrophobicContact CB-CZ2 4.05Å; L248-W268 HydrophobicContact CD1-CH2 4.4Å; L248-W268 HydrophobicContact CD1-CZ2 4.35Å; L248-L271 HydrophobicContact CD1-CD2 3.92Å
249V92.9Very high90.6Very high37 Ų3756.1 Ų56.122%0.22429%0.291CS..Hα-helixtrans-57.3-34.5179.3172.40000111.5G245 R246 Q253 W268 F300G245-V249 WeakPolarHBondContact O-CG2 3.44Å; G245-V249 PolarHBondContact O-N 3Å; G245-V249 VanDerWaalsContact O-N 3.1Å; R246-V249 PolarHBondContact O-N 3.5Å; V249-Q253 WeakPolarHBondContact O-CG 3.46Å; V249-Q253 PolarHBondContact O-N 3.45Å; V249-W268 HydrophobicContact CG2-CH2 3.99Å; V249-W268 HydrophobicContact CG2-CZ2 4.29Å; V249-F300 HydrophobicContact CG2-CE2 4.16Å; V249-F300 HydrophobicContact CG2-CZ 3.81Å
250S88.3Confident90.6Very high10 Ų1059.5 Ų59.57%0.0732%0.32CS..Hα-helixtrans-73.1-46.3-178.82.20000111.6D7 R9 R246 D247 L248 G252 Q253 V254D7-S250 WeakPolarHBondContact OD2-CB 3.31Å; R9-S250 WeakPolarHBondContact CD-OG 3.49Å; R9-S250 VanDerWaalsContact NE-CB 3.31Å; R9-S250 PolarHBondContact NE-OG 3.41Å; R9-S250 PolarHBondContact NH1-OG 3.47Å; R246-S250 PolarHBondContact O-N 3.35Å; R246-S250 PolarHBondContact O-OG 3.42Å; D247-S250 VanDerWaalsContact CA-OG 3.27Å; D247-S250 WeakPolarHBondContact CA-OG 3.43Å; D247-S250 PolarHBondContact O-N 3.4Å; D247-S250 PolarHBondContact O-OG 2.99Å; L248-S250 PolarHBondContact O-N 3.21Å; L248-S250 VanDerWaalsContact O-N 3.16Å; S250-G252 PolarHBondContact O-N 3.15Å; S250-Q253 WeakPolarHBondContact O-CA 3.16Å; S250-Q253 WeakPolarHBondContact O-CB 3.33Å; S250-Q253 PolarHBondContact O-N 3.31Å; S250-V254 WeakPolarHBondContact O-CG2 3.47Å; S250-V254 PolarHBondContact O-N 3.01Å
251L90.4Very high90.7Very high32 Ų3258.6 Ų58.617%0.16832%0.317CS..Hα-helixtrans-56.9-37.8-178.7-170.664.6000108.8L227 M239 L242 D247 L248 Q253 V254 L258 T262L227-L251 HydrophobicContact CD2-CD1 3.87Å; M239-L251 HydrophobicContact CE-CD2 3.65Å; M239-L251 HydrophobicContact CE-CG 4.27Å; M239-L251 HydrophobicContact CG-CD2 3.51Å; M239-L251 HydrophobicContact SD-CD2 4.02Å; L242-L251 HydrophobicContact CD1-CD2 4.35Å; D247-L251 PolarHBondContact O-N 3.39Å; L248-L251 PolarHBondContact O-N 3.35Å; L251-Q253 VanDerWaalsContact C-N 3.32Å; L251-Q253 PolarHBondContact O-N 3.17Å; L251-V254 WeakPolarHBondContact O-CB 3.4Å; L251-V254 PolarHBondContact O-N 2.73Å; L251-L258 HydrophobicContact CD1-CD1 3.93Å; L251-L258 HydrophobicContact CG-CB 4.48Å; L251-L258 HydrophobicContact CG-CD1 4.24Å; L251-L258 WeakPolarHBondContact O-CB 3.5Å; L251-T262 HydrophobicContact CB-CG2 4.17Å; L251-T262 HydrophobicContact CD2-CG2 4.41Å; L251-T262 HydrophobicContact CG-CG2 4.45Å
252G91.3Very high90.9Very high15 Ų1548.5 Ų48.516%0.15528%0.279CS..Hα-helixtrans-70.2-21.6173.900000115.5L248 S250 G259 T262L248-G252 PolarHBondContact O-N 3.32Å; L248-G252 VanDerWaalsContact O-N 3.15Å; S250-G252 PolarHBondContact O-N 3.15Å; G252-G259 VanDerWaalsContact CA-CA 3.49Å; G252-G259 WeakPolarHBondContact O-CA 3.32Å; G252-T262 WeakPolarHBondContact CA-OG1 3.37Å
253Q90.9Very high91.1Very high128 Ų12850.9 Ų50.960%0.59829%0.288SS*.Hα-helixtrans-83.4-13.8174.9-71.2170.2-30.800112.9V249 S250 L251V249-Q253 WeakPolarHBondContact O-CG 3.46Å; V249-Q253 PolarHBondContact O-N 3.45Å; S250-Q253 WeakPolarHBondContact O-CA 3.16Å; S250-Q253 WeakPolarHBondContact O-CB 3.33Å; S250-Q253 PolarHBondContact O-N 3.31Å; L251-Q253 VanDerWaalsContact C-N 3.32Å; L251-Q253 PolarHBondContact O-N 3.17Å
254V88.6Confident91.3Very high106 Ų10649.7 Ų49.764%0.64228%0.279SS*.Hα-helixtrans-69.5-47179.9177.30000111.4S250 L251 L258S250-V254 WeakPolarHBondContact O-CG2 3.47Å; S250-V254 PolarHBondContact O-N 3.01Å; L251-V254 WeakPolarHBondContact O-CB 3.4Å; L251-V254 PolarHBondContact O-N 2.73Å; V254-L258 HydrophobicContact CB-CD1 4.4Å
255C89Confident91.5Very high31 Ų3155.2 Ų55.221%0.20930%0.298CS..  trans-154.4159.5176.471.80000112E257 L258 G259C255-E257 VanDerWaalsContact C-N 3.31Å; C255-E257 PolarHBondContact O-N 2.66Å; C255-L258 PolarHBondContact O-N 3.02Å; C255-L258 WeakPolarHBondContact SG-CG 3.4Å; C255-G259 PolarHBondContact O-N 2.85Å
256P91.9Very high91.6Very high116 Ų11659.2 Ų59.275%0.75332%0.319SS*.Hα-helixtrans-60.2-35.4-177-25.235.3000114.4G259 A260P256-G259 WeakPolarHBondContact O-CA 3.41Å; P256-G259 PolarHBondContact O-N 3.26Å; P256-A260 PolarHBondContact O-N 2.84Å
257E90.6Very high91.8Very high128 Ų12855.2 Ų55.260%0.59830%0.304SS*.Hα-helixtrans-64.4-49.4-179.5-64.9171.7-18000111.6C255 G259 A260 L261C255-E257 VanDerWaalsContact C-N 3.31Å; C255-E257 PolarHBondContact O-N 2.66Å; E257-G259 VanDerWaalsContact C-N 3.27Å; E257-G259 PolarHBondContact O-N 2.91Å; E257-A260 PolarHBondContact O-N 2.65Å; E257-L261 PolarHBondContact O-N 3.06Å
258L92.4Very high92.1Very high4 Ų453.6 Ų53.62%0.02130%0.295CS..Hα-helixtrans-65.5-35.1173.7-63.8174.7000110.8L227 T228 M239 L251 V254 C255 A260 L261 T262L227-L258 HydrophobicContact CD2-CD1 4.31Å; L227-L258 HydrophobicContact CD2-CD2 4.31Å; T228-L258 HydrophobicContact CG2-CD1 4.5Å; M239-L258 HydrophobicContact CE-CB 4.3Å; M239-L258 HydrophobicContact CE-CD2 3.46Å; M239-L258 VanDerWaalsContact CE-CD2 3.46Å; M239-L258 HydrophobicContact CE-CG 4.46Å; L251-L258 HydrophobicContact CD1-CD1 3.93Å; L251-L258 HydrophobicContact CG-CB 4.48Å; L251-L258 HydrophobicContact CG-CD1 4.24Å; L251-L258 WeakPolarHBondContact O-CB 3.5Å; V254-L258 HydrophobicContact CB-CD1 4.4Å; C255-L258 PolarHBondContact O-N 3.02Å; C255-L258 WeakPolarHBondContact SG-CG 3.4Å; L258-A260 PolarHBondContact O-N 3.49Å; L258-L261 PolarHBondContact O-N 3.33Å; L258-T262 VanDerWaalsContact O-CG2 3.25Å; L258-T262 WeakPolarHBondContact O-CG2 3.28Å; L258-T262 PolarHBondContact O-N 3.07Å; L258-T262 PolarHBondContact O-OG1 3.24Å
259G93.3Very high92.1Very high17 Ų1757.1 Ų57.118%0.17531%0.311CS..Hα-helixtrans-52-53.517200000112G252 C255 P256 E257 L261 T262 E263G252-G259 VanDerWaalsContact CA-CA 3.49Å; G252-G259 WeakPolarHBondContact O-CA 3.32Å; C255-G259 PolarHBondContact O-N 2.85Å; P256-G259 WeakPolarHBondContact O-CA 3.41Å; P256-G259 PolarHBondContact O-N 3.26Å; E257-G259 VanDerWaalsContact C-N 3.27Å; E257-G259 PolarHBondContact O-N 2.91Å; G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.47Å; G259-T262 PolarHBondContact O-N 3.46Å; G259-T262 PolarHBondContact O-OG1 2.73Å; G259-E263 PolarHBondContact O-N 2.91Å
260A93.6Very high92.2Very high73 Ų7360.4 Ų60.460%0.60332%0.322SS*.Hα-helixtrans-58.9-41178.400000112.7P256 E257 L258 E263P256-A260 PolarHBondContact O-N 2.84Å; E257-A260 PolarHBondContact O-N 2.65Å; L258-A260 PolarHBondContact O-N 3.49Å; A260-E263 PolarHBondContact O-N 2.84Å
261L93.7Very high92.4Very high36 Ų3660.4 Ų60.419%0.18832%0.321CS..Hα-helixtrans-69.2-37.4178.3-67.3179000113.1A232 Q235 M239 E257 L258 G259 E263 D264A232-L261 HydrophobicContact CB-CD1 4.36Å; A232-L261 HydrophobicContact CB-CD2 4.25Å; Q235-L261 HydrophobicContact CB-CD1 3.85Å; M239-L261 HydrophobicContact CE-CB 3.78Å; M239-L261 HydrophobicContact CE-CD1 3.96Å; M239-L261 HydrophobicContact SD-CB 3.9Å; E257-L261 PolarHBondContact O-N 3.06Å; L258-L261 PolarHBondContact O-N 3.33Å; G259-L261 VanDerWaalsContact C-N 3.32Å; G259-L261 PolarHBondContact O-N 3.47Å; L261-E263 PolarHBondContact O-N 3.16Å; L261-D264 WeakPolarHBondContact O-CB 3.43Å; L261-D264 PolarHBondContact O-N 3.4Å; L261-D264 VanDerWaalsContact O-N 3.09Å
262T94.1Very high92.6Very high2 Ų258.9 Ų58.91%0.01231%0.313CS..Hα-helixtrans-70.7-17.6-179.959.70000113.3M239 L248 L251 G252 L258 G259 D264 W268M239-T262 HydrophobicContact CE-CG2 4.21Å; M239-T262 HydrophobicContact SD-CG2 3.81Å; L248-T262 WeakPolarHBondContact O-CG2 3.43Å; L251-T262 HydrophobicContact CB-CG2 4.17Å; L251-T262 HydrophobicContact CD2-CG2 4.41Å; L251-T262 HydrophobicContact CG-CG2 4.45Å; G252-T262 WeakPolarHBondContact CA-OG1 3.37Å; L258-T262 VanDerWaalsContact O-CG2 3.25Å; L258-T262 WeakPolarHBondContact O-CG2 3.28Å; L258-T262 PolarHBondContact O-N 3.07Å; L258-T262 PolarHBondContact O-OG1 3.24Å; G259-T262 PolarHBondContact O-N 3.46Å; G259-T262 PolarHBondContact O-OG1 2.73Å; T262-D264 PolarHBondContact O-N 2.87Å; T262-W268 PolarHBondContact O-NE1 3.24Å
263E92.9Very high92.7Very high109 Ų10962.6 Ų62.651%0.50933%0.326SS..THydrogen-bonded Turntrans-81.81.5171.7-63.5-56150.200113.2G259 A260 L261 R265 K296G259-E263 PolarHBondContact O-N 2.91Å; A260-E263 PolarHBondContact O-N 2.84Å; L261-E263 PolarHBondContact O-N 3.16Å; E263-R265 PolarHBondContact O-N 3.42Å; E263-K296 IonicContact OE1-NZ 2.68Å; E263-K296 PolarHBondContact OE1-NZ 3.41Å; E263-K296 IonicContact OE2-NZ 3.14Å; E263-K296 PolarHBondContact OE2-NZ 2.92Å
264D92.9Very high92.7Very high51 Ų5159.7 Ų59.727%0.27331%0.31SS..  trans-57.8127.8178.1177.7-101.5000112.2L236 L261 T262 L266 L267 W268L236-D264 HydrophobicContact CD1-CB 4.07Å; L261-D264 WeakPolarHBondContact O-CB 3.43Å; L261-D264 PolarHBondContact O-N 3.4Å; L261-D264 VanDerWaalsContact O-N 3.09Å; T262-D264 PolarHBondContact O-N 2.87Å; D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 2.85Å; D264-L266 WeakPolarHBondContact OD1-CA 3.5Å; D264-L266 WeakPolarHBondContact OD1-CB 3.31Å; D264-L266 PolarHBondContact OD1-N 2.89Å; D264-L267 HydrophobicContact CB-CB 4.09Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.49Å; D264-L267 PolarHBondContact OD1-N 3.42Å; D264-W268 VanDerWaalsContact O-CD1 3.29Å; D264-W268 PolarHBondContact O-N 3.12Å
265R92.1Very high92.8Very high138 Ų13855.6 Ų55.652%0.52128%0.284SS..Hα-helixtrans-63.8-37.9-176-169.3-176.468.8159.5-2.7112.3E263 K269 W295E263-R265 PolarHBondContact O-N 3.42Å; R265-K269 WeakPolarHBondContact O-CB 3.47Å; R265-K269 PolarHBondContact O-N 3.32Å; R265-W295 VanDerWaalsContact CG-CD1 3.43Å; R265-W295 HydrophobicContact CG-CG 4.49Å
266L92.2Very high93Very high85 Ų8554.4 Ų54.445%0.44528%0.275SS..Hα-helixtrans-74-32.7-175.4-61.6177.7000111.3D264 K269 K270D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 2.85Å; D264-L266 WeakPolarHBondContact OD1-CA 3.5Å; D264-L266 WeakPolarHBondContact OD1-CB 3.31Å; D264-L266 PolarHBondContact OD1-N 2.89Å; L266-K269 PolarHBondContact O-N 3.31Å; L266-K270 WeakPolarHBondContact O-CB 3.28Å; L266-K270 WeakPolarHBondContact O-CG 3.5Å; L266-K270 PolarHBondContact O-N 3.28Å
267L94.6Very high93.1Very high3 Ų352.7 Ų52.72%0.01626%0.263CS..Hα-helixtrans-55.5-55.2172.3-178.665.5000111.2L236 M239 Q240 L248 D264 K269 K270 L271L236-L267 HydrophobicContact CD1-CD2 4.39Å; M239-L267 HydrophobicContact CB-CD1 3.94Å; M239-L267 HydrophobicContact CB-CD2 4.2Å; M239-L267 HydrophobicContact SD-CD2 4.47Å; Q240-L267 HydrophobicContact CB-CD1 4.21Å; Q240-L267 HydrophobicContact CG-CD1 3.54Å; L248-L267 HydrophobicContact CD1-CD1 4.3Å; L248-L267 HydrophobicContact CD1-CD2 3.94Å; L248-L267 HydrophobicContact CD1-CG 3.9Å; L248-L267 HydrophobicContact CD2-CD1 4.5Å; L248-L267 HydrophobicContact CD2-CD2 4.04Å; D264-L267 HydrophobicContact CB-CB 4.09Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.49Å; D264-L267 PolarHBondContact OD1-N 3.42Å; L267-K269 PolarHBondContact O-N 2.9Å; L267-K270 PolarHBondContact O-N 3.31Å; L267-L271 PolarHBondContact O-N 3.11Å
268W95.4Very high93.1Very high4 Ų451 Ų512%0.01526%0.258CS..Hα-helixtrans-67.3-34.7178.6-6999.6000113.2G245 L248 V249 T262 D264 L271 C272 W295 K296 Y299 F300G245-W268 WeakPolarHBondContact O-CH2 3.44Å; L248-W268 HydrophobicContact CB-CH2 4.16Å; L248-W268 HydrophobicContact CB-CZ2 4.05Å; L248-W268 HydrophobicContact CD1-CH2 4.4Å; L248-W268 HydrophobicContact CD1-CZ2 4.35Å; V249-W268 HydrophobicContact CG2-CH2 3.99Å; V249-W268 HydrophobicContact CG2-CZ2 4.29Å; T262-W268 PolarHBondContact O-NE1 3.24Å; D264-W268 VanDerWaalsContact O-CD1 3.29Å; D264-W268 PolarHBondContact O-N 3.12Å; W268-L271 HydrophobicContact CE3-CD2 4.04Å; W268-L271 HydrophobicContact CZ3-CD2 4.03Å; W268-L271 PolarHBondContact O-N 3.1Å; W268-C272 WeakPolarHBondContact O-CB 3.46Å; W268-C272 PolarHBondContact O-N 3.35Å; W268-C272 PolarHBondContact O-SG 2.92Å; W268-W295 HydrophobicContact CB-CB 3.54Å; W268-K296 HydrophobicContact CD2-CB 3.69Å; W268-K296 HydrophobicContact CD2-CD 4.48Å; W268-K296 HydrophobicContact CD2-CG 3.83Å; W268-K296 HydrophobicContact CE3-CB 4.15Å; W268-K296 HydrophobicContact CE3-CG 4.1Å; W268-K296 HydrophobicContact CG-CB 3.85Å; W268-K296 HydrophobicContact CG-CG 4.47Å; W268-K296 HydrophobicContact CH2-CD 4.41Å; W268-K296 HydrophobicContact CH2-CG 3.93Å; W268-K296 HydrophobicContact CZ2-CB 4.42Å; W268-K296 HydrophobicContact CZ2-CD 3.75Å; W268-K296 HydrophobicContact CZ2-CG 3.67Å; W268-K296 HydrophobicContact CZ3-CG 4.14Å; W268-Y299 HydrophobicContact CE3-CD1 4.29Å; W268-Y299 HydrophobicContact CE3-CG 4.1Å; W268-Y299 AromaticContact CZ3-CD1 3.73Å; W268-Y299 HydrophobicContact CZ3-CD1 3.73Å; W268-Y299 HydrophobicContact CZ3-CE1 4.37Å; W268-Y299 HydrophobicContact CZ3-CG 4.02Å; W268-F300 AromaticContact CH2-CE2 3.97Å; W268-F300 HydrophobicContact CH2-CE2 3.97Å; W268-F300 HydrophobicContact CH2-CZ 4.13Å; W268-F300 HydrophobicContact CZ3-CE2 4.06Å; W268-F300 HydrophobicContact CZ3-CZ 4.31Å
269K93.8Very high93.1Very high75 Ų7559 Ų5933%0.32629%0.288SS..Hα-helixtrans-60.2-50.3173.5179.4179.9176.5-172.40111.1R265 L266 L267 L271 C272 Q273 W295R265-K269 WeakPolarHBondContact O-CB 3.47Å; R265-K269 PolarHBondContact O-N 3.32Å; L266-K269 PolarHBondContact O-N 3.31Å; L267-K269 PolarHBondContact O-N 2.9Å; K269-L271 VanDerWaalsContact C-N 3.3Å; K269-L271 PolarHBondContact O-N 3.41Å; K269-C272 PolarHBondContact O-N 2.87Å; K269-Q273 VanDerWaalsContact O-CG 3.32Å; K269-Q273 WeakPolarHBondContact O-CG 3.46Å; K269-Q273 PolarHBondContact O-N 3.46Å; K269-W295 HydrophobicContact CB-CD2 3.68Å; K269-W295 HydrophobicContact CB-CE3 4.09Å; K269-W295 HydrophobicContact CB-CG 3.98Å; K269-W295 HydrophobicContact CB-CZ2 4.26Å; K269-W295 HydrophobicContact CD-CH2 4.34Å; K269-W295 HydrophobicContact CD-CZ2 3.8Å; K269-W295 HydrophobicContact CG-CD2 3.98Å; K269-W295 HydrophobicContact CG-CE3 4.15Å; K269-W295 HydrophobicContact CG-CH2 3.86Å; K269-W295 HydrophobicContact CG-CZ2 3.67Å; K269-W295 HydrophobicContact CG-CZ3 4.09Å
270K93.6Very high93Very high106 Ų10660.6 Ų60.646%0.46129%0.291SS..Hα-helixtrans-59.9-42.4177.7-75.3-177.8-177.6-173.20111.1Q240 L266 L267 Q273 Y274Q240-K270 HydrophobicContact CG-CD 4.34Å; L266-K270 WeakPolarHBondContact O-CB 3.28Å; L266-K270 WeakPolarHBondContact O-CG 3.5Å; L266-K270 PolarHBondContact O-N 3.28Å; L267-K270 PolarHBondContact O-N 3.31Å; K270-Q273 PolarHBondContact O-N 3.48Å; K270-Y274 WeakPolarHBondContact O-CB 3.29Å; K270-Y274 PolarHBondContact O-N 2.96Å
271L93.6Very high92.9Very high9 Ų957.5 Ų57.55%0.04726%0.264CS..Hα-helixtrans-63.2-44.6177.8-173.865000112.2G245 L248 L267 W268 K269 Q273 Y274 H275 Y299G245-L271 VanDerWaalsContact CA-CD2 3.49Å; L248-L271 HydrophobicContact CD1-CD2 3.92Å; L267-L271 PolarHBondContact O-N 3.11Å; W268-L271 HydrophobicContact CE3-CD2 4.04Å; W268-L271 HydrophobicContact CZ3-CD2 4.03Å; W268-L271 PolarHBondContact O-N 3.1Å; K269-L271 VanDerWaalsContact C-N 3.3Å; K269-L271 PolarHBondContact O-N 3.41Å; L271-Q273 PolarHBondContact O-N 3.2Å; L271-Y274 WeakPolarHBondContact O-CB 3.45Å; L271-Y274 PolarHBondContact O-N 3.21Å; L271-H275 PolarHBondContact O-CD2 3.26Å; L271-H275 VanDerWaalsContact O-CD2 3.29Å; L271-H275 PolarHBondContact O-N 3.44Å; L271-Y299 HydrophobicContact CD1-CE2 4.31Å; L271-Y299 HydrophobicContact CD2-CD2 3.8Å; L271-Y299 HydrophobicContact CD2-CE1 4.31Å; L271-Y299 HydrophobicContact CD2-CE2 3.54Å; L271-Y299 HydrophobicContact CD2-CG 4.29Å; L271-Y299 HydrophobicContact CG-CD2 3.83Å; L271-Y299 HydrophobicContact CG-CE2 3.53Å
272C93.6Very high92.7Very high0 Ų063.8 Ų63.80%029%0.285CS..Hα-helixtrans-58.6-47.4173-80.50000112W268 K269 Y274 H275 F276 I281 W295 Y299W268-C272 WeakPolarHBondContact O-CB 3.46Å; W268-C272 PolarHBondContact O-N 3.35Å; W268-C272 PolarHBondContact O-SG 2.92Å; K269-C272 PolarHBondContact O-N 2.87Å; C272-Y274 PolarHBondContact O-N 2.92Å; C272-H275 PolarHBondContact O-N 3.08Å; C272-F276 WeakPolarHBondContact O-CB 3.5Å; C272-F276 WeakPolarHBondContact O-CD2 3.33Å; C272-F276 PolarHBondContact O-N 3.05Å; C272-I281 HydrophobicContact CB-CD1 4.33Å; C272-W295 HydrophobicContact CB-CE3 4Å; C272-W295 HydrophobicContact CB-CZ3 4.19Å; C272-Y299 VanDerWaalsContact SG-CA 3.57Å; C272-Y299 VanDerWaalsContact SG-CB 3.59Å
273Q93.1Very high92.6Very high93 Ų9369.3 Ų69.344%0.43531%0.309SS..Hα-helixtrans-67.4-25.5179.7-70178.4-45.100112.8K269 K270 L271 I281K269-Q273 VanDerWaalsContact O-CG 3.32Å; K269-Q273 WeakPolarHBondContact O-CG 3.46Å; K269-Q273 PolarHBondContact O-N 3.46Å; K270-Q273 PolarHBondContact O-N 3.48Å; L271-Q273 PolarHBondContact O-N 3.2Å; Q273-I281 HydrophobicContact CG-CD1 4.23Å
274Y92.1Very high92.3Very high68 Ų6869.2 Ų69.227%0.26730%0.304SS..Hα-helixtrans-71.1-39.7176.1174.3-102.1000112.4T243 K270 L271 C272 R309 Q311T243-Y274 HydrophobicContact CG2-CE1 3.88Å; K270-Y274 WeakPolarHBondContact O-CB 3.29Å; K270-Y274 PolarHBondContact O-N 2.96Å; L271-Y274 WeakPolarHBondContact O-CB 3.45Å; L271-Y274 PolarHBondContact O-N 3.21Å; C272-Y274 PolarHBondContact O-N 2.92Å; Y274-R309 VanDerWaalsContact O-CD 3.24Å; Y274-R309 WeakPolarHBondContact O-CD 3.38Å; Y274-Q311 PolarHBondContact OH-OE1 3.46Å
275H91.2Very high92.1Very high19 Ų1971.1 Ų71.19%0.08831%0.314CS..Hα-helixtrans-94.4-29.9-178.1-67.5-73.1000114.8T243 L271 C272 Y299 H308T243-H275 PolarHBondContact O-CE1 2.86Å; T243-H275 PolarHBondContact O-NE2 3.48Å; L271-H275 PolarHBondContact O-CD2 3.26Å; L271-H275 VanDerWaalsContact O-CD2 3.29Å; L271-H275 PolarHBondContact O-N 3.44Å; C272-H275 PolarHBondContact O-N 3.08Å; H275-Y299 AromaticContact CD2-CE2 3.83Å; H275-H308 AromaticContact ND1-CD2 3.99Å
276F93.3Very high91.9Very high6 Ų666.9 Ų66.93%0.02630%0.3CS..SBendtrans-124.3142.2-168.3-48.9-64.9000111.4C272 Q280 I281 Y299 L302 Y306C272-F276 WeakPolarHBondContact O-CB 3.5Å; C272-F276 WeakPolarHBondContact O-CD2 3.33Å; C272-F276 PolarHBondContact O-N 3.05Å; F276-Q280 HydrophobicContact CB-CB 4.33Å; F276-I281 HydrophobicContact CB-CD1 4.32Å; F276-I281 HydrophobicContact CB-CG1 3.93Å; F276-Y299 HydrophobicContact CE2-CD2 4.09Å; F276-Y299 HydrophobicContact CE2-CE2 4.31Å; F276-L302 HydrophobicContact CB-CD1 4.43Å; F276-L302 HydrophobicContact CD1-CB 4.21Å; F276-L302 HydrophobicContact CD2-CB 3.69Å; F276-L302 HydrophobicContact CD2-CD1 3.63Å; F276-L302 HydrophobicContact CD2-CG 4.25Å; F276-L302 HydrophobicContact CE1-CB 4Å; F276-L302 HydrophobicContact CE2-CB 3.45Å; F276-L302 VanDerWaalsContact CE2-CB 3.45Å; F276-L302 HydrophobicContact CE2-CD1 4.14Å; F276-L302 HydrophobicContact CE2-CG 4.43Å; F276-L302 HydrophobicContact CG-CB 4.06Å; F276-L302 HydrophobicContact CG-CD1 4.11Å; F276-L302 HydrophobicContact CZ-CB 3.63Å; F276-Y306 HydrophobicContact CD1-CD2 4.49Å
277T92.3Very high91.7Very high80 Ų8066.8 Ų66.849%0.49130%0.303SS..  trans-69.9153.4174.262.80000111.2R279 Q280 I281T277-R279 PolarHBondContact O-N 3.41Å; T277-R279 VanDerWaalsContact O-N 3.08Å; T277-Q280 WeakPolarHBondContact O-CB 3.39Å; T277-Q280 PolarHBondContact O-N 2.91Å; T277-Q280 WeakPolarHBondContact OG1-CG 3.32Å; T277-Q280 PolarHBondContact OG1-N 3.43Å; T277-Q280 PolarHBondContact OG1-OE1 3.34Å; T277-I281 WeakPolarHBondContact O-CG1 3.37Å; T277-I281 PolarHBondContact O-N 2.88Å
278D91.8Very high91.3Very high92 Ų9268.1 Ų68.149%0.49231%0.313SS..Hα-helixtrans-55.5-32.2175.6-69.2-35.4000112.5I281 R282D278-I281 PolarHBondContact O-N 3.28Å; D278-R282 WeakPolarHBondContact O-CB 3.39Å; D278-R282 VanDerWaalsContact O-CG 3.27Å; D278-R282 WeakPolarHBondContact O-CG 3.49Å; D278-R282 PolarHBondContact O-N 3.29Å
279R92Very high90.6Very high174 Ų17478 Ų7866%0.65736%0.359SS*.Hα-helixtrans-64.6-43.3175.1-172.4179.1-177.7-170.70111.9T277 K283T277-R279 PolarHBondContact O-N 3.41Å; T277-R279 VanDerWaalsContact O-N 3.08Å; R279-K283 WeakPolarHBondContact O-CG 3.5Å; R279-K283 PolarHBondContact O-N 3.11Å
280Q91.6Very high90.1Very high50 Ų5082.9 Ų82.923%0.23438%0.38CS..Hα-helixtrans-66.8-42.6177.3-72.9163.3-41.300111.2F276 T277 K283 Y306F276-Q280 HydrophobicContact CB-CB 4.33Å; T277-Q280 WeakPolarHBondContact O-CB 3.39Å; T277-Q280 PolarHBondContact O-N 2.91Å; T277-Q280 WeakPolarHBondContact OG1-CG 3.32Å; T277-Q280 PolarHBondContact OG1-N 3.43Å; T277-Q280 PolarHBondContact OG1-OE1 3.34Å; Q280-K283 PolarHBondContact O-N 2.95Å; Q280-Y306 HydrophobicContact CB-CD2 4.11Å; Q280-Y306 HydrophobicContact CB-CE2 3.78Å; Q280-Y306 HydrophobicContact CG-CD1 4.06Å; Q280-Y306 HydrophobicContact CG-CD2 4.21Å; Q280-Y306 HydrophobicContact CG-CE1 3.85Å; Q280-Y306 HydrophobicContact CG-CE2 4Å; Q280-Y306 HydrophobicContact CG-CG 4.23Å
281I91.8Very high89.6Confident8 Ų880.5 Ų80.54%0.04139%0.385CS..Hα-helixtrans-61.8-49.5178.6-64.4171000110.6C272 Q273 F276 T277 D278 K283 R284 L285 W295 M298 L302C272-I281 HydrophobicContact CB-CD1 4.33Å; Q273-I281 HydrophobicContact CG-CD1 4.23Å; F276-I281 HydrophobicContact CB-CD1 4.32Å; F276-I281 HydrophobicContact CB-CG1 3.93Å; T277-I281 WeakPolarHBondContact O-CG1 3.37Å; T277-I281 PolarHBondContact O-N 2.88Å; D278-I281 PolarHBondContact O-N 3.28Å; I281-K283 PolarHBondContact O-N 2.9Å; I281-R284 CarbonylContact O-C 3.58Å; I281-R284 PolarHBondContact O-N 3.4Å; I281-L285 HydrophobicContact CG2-CD2 4.34Å; I281-L285 PolarHBondContact O-N 3.34Å; I281-W295 HydrophobicContact CG2-CH2 4.33Å; I281-W295 HydrophobicContact CG2-CZ3 3.95Å; I281-M298 HydrophobicContact CG2-CE 3.71Å; I281-L302 HydrophobicContact CG1-CD1 3.95Å
282R89.9Confident89.2Confident167 Ų16785.4 Ų85.463%0.6341%0.408SS*.Hα-helixtrans-59.6-30.6179.5-76.5-172.2-68.9-114.73.5113.6D278 R284D278-R282 WeakPolarHBondContact O-CB 3.39Å; D278-R282 VanDerWaalsContact O-CG 3.27Å; D278-R282 WeakPolarHBondContact O-CG 3.49Å; D278-R282 PolarHBondContact O-N 3.29Å; R282-R284 PolarHBondContact O-N 3.36Å
283K90.1Very high89Confident119 Ų11988 Ų8852%0.51742%0.422SS..THydrogen-bonded Turntrans-71.8-12.2177.9-77.4-177.8176.4-170.70114.3R279 Q280 I281R279-K283 WeakPolarHBondContact O-CG 3.5Å; R279-K283 PolarHBondContact O-N 3.11Å; Q280-K283 PolarHBondContact O-N 2.95Å; I281-K283 PolarHBondContact O-N 2.9Å
284R87.1Confident89Confident106 Ų10686.3 Ų86.340%0.441%0.414SS..THydrogen-bonded Turntrans-140.338.5-171.5-62.5-67.7-175.1-111.17111.7I281 R282 L302I281-R284 CarbonylContact O-C 3.58Å; I281-R284 PolarHBondContact O-N 3.4Å; R282-R284 PolarHBondContact O-N 3.36Å; R284-L302 HydrophobicContact CB-CD2 3.87Å; R284-L302 HydrophobicContact CG-CD2 4.09Å
285L89.3Confident89.1Confident91 Ų9184.2 Ų84.248%0.47641%0.405SS..  trans-61.2138.8175.9-63.5175.3000110.7I281 L293 M298I281-L285 HydrophobicContact CG2-CD2 4.34Å; I281-L285 PolarHBondContact O-N 3.34Å; L285-L293 HydrophobicContact CB-CD2 4.38Å; L285-L293 HydrophobicContact CD2-CD2 4.01Å; L285-M298 HydrophobicContact CD2-CE 3.81Å
286M86.9Confident89.2Confident49 Ų4986 Ų8624%0.24141%0.413CS..  trans-128.6126.6171.7-60.6-178.362.300107.9L293 E294 K297 M298 K301M286-L293 WeakPolarHBondContact O-CA 3.22Å; M286-E294 HydrophobicContact CB-CB 4.47Å; M286-E294 PolarHBondContact O-N 2.82Å; M286-K297 HydrophobicContact CE-CB 4.05Å; M286-K297 HydrophobicContact CE-CD 4.27Å; M286-K297 HydrophobicContact SD-CB 4.15Å; M286-M298 HydrophobicContact CB-CG 3.68Å; M286-M298 HydrophobicContact CB-SD 4.38Å; M286-M298 HydrophobicContact CG-CG 3.88Å; M286-M298 HydrophobicContact SD-CG 4.33Å; M286-K301 HydrophobicContact SD-CB 4.41Å; M286-K301 HydrophobicContact SD-CD 3.65Å
287V88.5Confident89.2Confident83 Ų8391 Ų9150%0.50344%0.435SS..BIsolated β-bridgetrans-117.5135.3-177-167.30000107.4G291 H292 L293V287-G291 VanDerWaalsContact CG1-CA 3.43Å; V287-H292 CarbonylContact C-O 3.55Å; V287-H292 WeakPolarHBondContact CA-O 3.12Å; V287-L293 HydrophobicContact CG2-CD2 4.1Å
288S86.8Confident89.3Confident32 Ų3287.2 Ų87.222%0.22441%0.411CS..  trans-72.5167.6172.470.60000110.8K290 G291 H292S288-K290 PolarHBondContact O-N 3.23Å; S288-K290 PolarHBondContact OG-N 3.46Å; S288-G291 PolarHBondContact O-N 3.45Å; S288-H292 PolarHBondContact N-O 3.35Å; S288-H292 PolarHBondContact OG-N 3.3Å; S288-H292 PolarHBondContact OG-O 2.86Å
289E81.1Confident89.4Confident210 Ų21082.9 Ų82.998%0.98139%0.388SS*.THydrogen-bonded Turntrans-55.3-26.5174.3-63.6175.4-179.900112.9G291E289-G291 VanDerWaalsContact C-N 3.29Å; E289-G291 PolarHBondContact O-N 3Å
290K82.2Confident89.5Confident179 Ų17978 Ų7878%0.77837%0.372SS*.THydrogen-bonded Turntrans-85.67.1177.4-59.5-177.1-179.6-179.20113.7S288 H292S288-K290 PolarHBondContact O-N 3.23Å; S288-K290 PolarHBondContact OG-N 3.46Å; K290-H292 VanDerWaalsContact C-N 3.34Å; K290-H292 PolarHBondContact O-N 3.23Å
291G82.7Confident89.5Confident55 Ų5580.2 Ų80.257%0.56738%0.381SS*.SBendtrans78.711.1179.800000114.8V287 S288 E289V287-G291 VanDerWaalsContact CG1-CA 3.43Å; S288-G291 PolarHBondContact O-N 3.45Å; E289-G291 VanDerWaalsContact C-N 3.29Å; E289-G291 PolarHBondContact O-N 3Å
292H86.6Confident89.5Confident112 Ų11279.8 Ų79.852%0.51938%0.379SS..  trans-99.1142.9-179.1-62.2-37.4000112.4V287 S288 K290 E294V287-H292 CarbonylContact C-O 3.55Å; V287-H292 WeakPolarHBondContact CA-O 3.12Å; S288-H292 PolarHBondContact N-O 3.35Å; S288-H292 PolarHBondContact OG-N 3.3Å; S288-H292 PolarHBondContact OG-O 2.86Å; K290-H292 VanDerWaalsContact C-N 3.34Å; K290-H292 PolarHBondContact O-N 3.23Å; H292-E294 PolarHBondContact O-N 3.48Å
293L88.8Confident89.5Confident56 Ų5673.1 Ų73.129%0.29336%0.357SS..BIsolated β-bridgetrans-67.2127176.1-69.4173.1000112L285 M286 V287 W295 M298L285-L293 HydrophobicContact CB-CD2 4.38Å; L285-L293 HydrophobicContact CD2-CD2 4.01Å; M286-L293 WeakPolarHBondContact O-CA 3.22Å; V287-L293 HydrophobicContact CG2-CD2 4.1Å; L293-W295 HydrophobicContact CB-CZ2 4.4Å; L293-W295 HydrophobicContact CD1-CH2 4.21Å; L293-W295 HydrophobicContact CD1-CZ2 3.56Å; L293-W295 PolarHBondContact O-N 3.21Å; L293-W295 VanDerWaalsContact O-N 3.15Å; L293-M298 HydrophobicContact CB-SD 4.39Å; L293-M298 HydrophobicContact CD2-SD 4.2Å
294E92.5Very high89.5Confident56 Ų5678.4 Ų78.426%0.26237%0.374SS..  trans-8869.5178.7-63-163.2108.200111.4M286 H292 K296 K297 M298M286-E294 HydrophobicContact CB-CB 4.47Å; M286-E294 PolarHBondContact O-N 2.82Å; H292-E294 PolarHBondContact O-N 3.48Å; E294-K296 VanDerWaalsContact C-N 3.26Å; E294-K296 PolarHBondContact O-N 3.08Å; E294-K296 VanDerWaalsContact O-N 3.14Å; E294-K297 HydrophobicContact CB-CB 4.24Å; E294-K297 HydrophobicContact CB-CD 4.36Å; E294-K297 HydrophobicContact CB-CG 4.48Å; E294-K297 PolarHBondContact O-N 3.38Å; E294-K297 VanDerWaalsContact O-N 3.08Å; E294-K297 WeakPolarHBondContact OE1-CE 3.17Å; E294-K297 IonicContact OE1-NZ 3.11Å; E294-K297 PolarHBondContact OE1-NZ 2.66Å; E294-K297 VanDerWaalsContact OE2-CD 3.3Å; E294-K297 WeakPolarHBondContact OE2-CD 3.42Å; E294-K297 IonicContact OE2-NZ 2.88Å; E294-K297 PolarHBondContact OE2-NZ 2.87Å; E294-M298 WeakPolarHBondContact O-CG 3.45Å; E294-M298 PolarHBondContact O-N 3.01Å
295W94.2Very high89.5Confident25 Ų2576.5 Ų76.510%0.09538%0.376CS..Hα-helixtrans-52.7-38.8-173.4-68.898.6000114.4R265 W268 K269 C272 I281 L293 M298 Y299R265-W295 VanDerWaalsContact CG-CD1 3.43Å; R265-W295 HydrophobicContact CG-CG 4.49Å; W268-W295 HydrophobicContact CB-CB 3.54Å; K269-W295 HydrophobicContact CB-CD2 3.68Å; K269-W295 HydrophobicContact CB-CE3 4.09Å; K269-W295 HydrophobicContact CB-CG 3.98Å; K269-W295 HydrophobicContact CB-CZ2 4.26Å; K269-W295 HydrophobicContact CD-CH2 4.34Å; K269-W295 HydrophobicContact CD-CZ2 3.8Å; K269-W295 HydrophobicContact CG-CD2 3.98Å; K269-W295 HydrophobicContact CG-CE3 4.15Å; K269-W295 HydrophobicContact CG-CH2 3.86Å; K269-W295 HydrophobicContact CG-CZ2 3.67Å; K269-W295 HydrophobicContact CG-CZ3 4.09Å; C272-W295 HydrophobicContact CB-CE3 4Å; C272-W295 HydrophobicContact CB-CZ3 4.19Å; I281-W295 HydrophobicContact CG2-CH2 4.33Å; I281-W295 HydrophobicContact CG2-CZ3 3.95Å; L293-W295 HydrophobicContact CB-CZ2 4.4Å; L293-W295 HydrophobicContact CD1-CH2 4.21Å; L293-W295 HydrophobicContact CD1-CZ2 3.56Å; L293-W295 PolarHBondContact O-N 3.21Å; L293-W295 VanDerWaalsContact O-N 3.15Å; W295-M298 HydrophobicContact CE3-CE 4.31Å; W295-M298 HydrophobicContact CZ3-CE 4.21Å; W295-M298 PolarHBondContact O-N 3Å; W295-Y299 WeakPolarHBondContact O-CB 3.36Å; W295-Y299 PolarHBondContact O-N 3.3Å
296K94.2Very high89.4Confident56 Ų5674.7 Ų74.724%0.24336%0.364CS..Hα-helixtrans-62-48.5177.1-177.8174.3-177-175.10112.4E263 W268 E294 Y299 F300E263-K296 IonicContact OE1-NZ 2.68Å; E263-K296 PolarHBondContact OE1-NZ 3.41Å; E263-K296 IonicContact OE2-NZ 3.14Å; E263-K296 PolarHBondContact OE2-NZ 2.92Å; W268-K296 HydrophobicContact CD2-CB 3.69Å; W268-K296 HydrophobicContact CD2-CD 4.48Å; W268-K296 HydrophobicContact CD2-CG 3.83Å; W268-K296 HydrophobicContact CE3-CB 4.15Å; W268-K296 HydrophobicContact CE3-CG 4.1Å; W268-K296 HydrophobicContact CG-CB 3.85Å; W268-K296 HydrophobicContact CG-CG 4.47Å; W268-K296 HydrophobicContact CH2-CD 4.41Å; W268-K296 HydrophobicContact CH2-CG 3.93Å; W268-K296 HydrophobicContact CZ2-CB 4.42Å; W268-K296 HydrophobicContact CZ2-CD 3.75Å; W268-K296 HydrophobicContact CZ2-CG 3.67Å; W268-K296 HydrophobicContact CZ3-CG 4.14Å; E294-K296 VanDerWaalsContact C-N 3.26Å; E294-K296 PolarHBondContact O-N 3.08Å; E294-K296 VanDerWaalsContact O-N 3.14Å; K296-Y299 WeakPolarHBondContact O-CB 3.12Å; K296-Y299 PolarHBondContact O-N 3.49Å; K296-F300 HydrophobicContact CG-CE2 4.21Å; K296-F300 VanDerWaalsContact O-CD2 3.24Å; K296-F300 WeakPolarHBondContact O-CD2 3.48Å; K296-F300 PolarHBondContact O-N 3.41Å
297K93Very high89.1Confident111 Ų11176.2 Ų76.248%0.48338%0.384SS..Hα-helixtrans-67.3-39.4176.8-66.2-176.2-169.5160.70111.3M286 E294 Y299 F300 K301M286-K297 HydrophobicContact CE-CB 4.05Å; M286-K297 HydrophobicContact CE-CD 4.27Å; M286-K297 HydrophobicContact SD-CB 4.15Å; E294-K297 HydrophobicContact CB-CB 4.24Å; E294-K297 HydrophobicContact CB-CD 4.36Å; E294-K297 HydrophobicContact CB-CG 4.48Å; E294-K297 PolarHBondContact O-N 3.38Å; E294-K297 VanDerWaalsContact O-N 3.08Å; E294-K297 WeakPolarHBondContact OE1-CE 3.17Å; E294-K297 IonicContact OE1-NZ 3.11Å; E294-K297 PolarHBondContact OE1-NZ 2.66Å; E294-K297 VanDerWaalsContact OE2-CD 3.3Å; E294-K297 WeakPolarHBondContact OE2-CD 3.42Å; E294-K297 IonicContact OE2-NZ 2.88Å; E294-K297 PolarHBondContact OE2-NZ 2.87Å; K297-Y299 VanDerWaalsContact C-N 3.33Å; K297-Y299 PolarHBondContact O-N 3.22Å; K297-F300 PolarHBondContact O-N 3.46Å; K297-K301 WeakPolarHBondContact O-CB 3.38Å; K297-K301 PolarHBondContact O-N 2.91Å; K297-K301 VanDerWaalsContact O-N 3.07Å
298M93.6Very high88.8Confident0 Ų075.6 Ų75.60%038%0.375CS..Hα-helixtrans-59.2-43.6175.1-70.9175.356.700111.7I281 L285 M286 L293 E294 W295 F300 K301 L302I281-M298 HydrophobicContact CG2-CE 3.71Å; L285-M298 HydrophobicContact CD2-CE 3.81Å; M286-M298 HydrophobicContact CB-CG 3.68Å; M286-M298 HydrophobicContact CB-SD 4.38Å; M286-M298 HydrophobicContact CG-CG 3.88Å; M286-M298 HydrophobicContact SD-CG 4.33Å; L293-M298 HydrophobicContact CB-SD 4.39Å; L293-M298 HydrophobicContact CD2-SD 4.2Å; E294-M298 WeakPolarHBondContact O-CG 3.45Å; E294-M298 PolarHBondContact O-N 3.01Å; W295-M298 HydrophobicContact CE3-CE 4.31Å; W295-M298 HydrophobicContact CZ3-CE 4.21Å; W295-M298 PolarHBondContact O-N 3Å; M298-F300 PolarHBondContact O-N 3.13Å; M298-K301 PolarHBondContact O-N 3.37Å; M298-L302 WeakPolarHBondContact O-CB 3.46Å; M298-L302 VanDerWaalsContact O-CG 3.25Å; M298-L302 WeakPolarHBondContact O-CG 3.25Å; M298-L302 PolarHBondContact O-N 2.98Å
299Y94.2Very high88.6Confident2 Ų280.7 Ų80.71%0.00839%0.39CS..Hα-helixtrans-52.7-58.1176.9175.3-96.6000110.9G245 W268 L271 C272 H275 F276 W295 K296 K297 K301 L302 S303G245-Y299 PolarHBondContact N-OH 3.45Å; W268-Y299 HydrophobicContact CE3-CD1 4.29Å; W268-Y299 HydrophobicContact CE3-CG 4.1Å; W268-Y299 AromaticContact CZ3-CD1 3.73Å; W268-Y299 HydrophobicContact CZ3-CD1 3.73Å; W268-Y299 HydrophobicContact CZ3-CE1 4.37Å; W268-Y299 HydrophobicContact CZ3-CG 4.02Å; L271-Y299 HydrophobicContact CD1-CE2 4.31Å; L271-Y299 HydrophobicContact CD2-CD2 3.8Å; L271-Y299 HydrophobicContact CD2-CE1 4.31Å; L271-Y299 HydrophobicContact CD2-CE2 3.54Å; L271-Y299 HydrophobicContact CD2-CG 4.29Å; L271-Y299 HydrophobicContact CG-CD2 3.83Å; L271-Y299 HydrophobicContact CG-CE2 3.53Å; C272-Y299 VanDerWaalsContact SG-CA 3.57Å; C272-Y299 VanDerWaalsContact SG-CB 3.59Å; H275-Y299 AromaticContact CD2-CE2 3.83Å; F276-Y299 HydrophobicContact CE2-CD2 4.09Å; F276-Y299 HydrophobicContact CE2-CE2 4.31Å; W295-Y299 WeakPolarHBondContact O-CB 3.36Å; W295-Y299 PolarHBondContact O-N 3.3Å; K296-Y299 WeakPolarHBondContact O-CB 3.12Å; K296-Y299 PolarHBondContact O-N 3.49Å; K297-Y299 VanDerWaalsContact C-N 3.33Å; K297-Y299 PolarHBondContact O-N 3.22Å; Y299-K301 VanDerWaalsContact C-N 3.27Å; Y299-K301 PolarHBondContact O-N 3.45Å; Y299-L302 PolarHBondContact O-N 3.37Å; Y299-L302 VanDerWaalsContact O-N 3.13Å; Y299-S303 WeakPolarHBondContact O-CB 3.39Å; Y299-S303 PolarHBondContact O-N 2.84Å; Y299-S303 PolarHBondContact O-OG 3.45Å
300F93.7Very high88.5Confident72 Ų7274 Ų7432%0.31636%0.359SS..Hα-helixtrans-63-32.8-178.5-70.1-68.3000113.3R246 V249 W268 K296 K297 M298 R304R246-F300 HydrophobicContact CG-CE1 3.95Å; V249-F300 HydrophobicContact CG2-CE2 4.16Å; V249-F300 HydrophobicContact CG2-CZ 3.81Å; W268-F300 AromaticContact CH2-CE2 3.97Å; W268-F300 HydrophobicContact CH2-CE2 3.97Å; W268-F300 HydrophobicContact CH2-CZ 4.13Å; W268-F300 HydrophobicContact CZ3-CE2 4.06Å; W268-F300 HydrophobicContact CZ3-CZ 4.31Å; K296-F300 HydrophobicContact CG-CE2 4.21Å; K296-F300 VanDerWaalsContact O-CD2 3.24Å; K296-F300 WeakPolarHBondContact O-CD2 3.48Å; K296-F300 PolarHBondContact O-N 3.41Å; K297-F300 PolarHBondContact O-N 3.46Å; M298-F300 PolarHBondContact O-N 3.13Å; F300-R304 WeakPolarHBondContact O-CG 3.34Å; F300-R304 PolarHBondContact O-N 3.12Å
301K92.2Very high88.3Confident95 Ų9571.9 Ų71.941%0.41335%0.351SS..Hα-helixtrans-68.8-43.6174.8-169.8170-174.4173.30111.8M286 K297 M298 Y299 R304 C305M286-K301 HydrophobicContact SD-CB 4.41Å; M286-K301 HydrophobicContact SD-CD 3.65Å; K297-K301 WeakPolarHBondContact O-CB 3.38Å; K297-K301 PolarHBondContact O-N 2.91Å; K297-K301 VanDerWaalsContact O-N 3.07Å; M298-K301 PolarHBondContact O-N 3.37Å; Y299-K301 VanDerWaalsContact C-N 3.27Å; Y299-K301 PolarHBondContact O-N 3.45Å; K301-R304 PolarHBondContact O-N 3.36Å; K301-C305 PolarHBondContact O-N 3.18Å; K301-C305 PolarHBondContact O-SG 3.1Å
302L92.3Very high88.4Confident0 Ų071.2 Ų71.20%033%0.332CS..Hα-helixtrans-65.2-43176.7-71.3169.2000111.2F276 I281 R284 M298 Y299 R304 C305 Y306F276-L302 HydrophobicContact CB-CD1 4.43Å; F276-L302 HydrophobicContact CD1-CB 4.21Å; F276-L302 HydrophobicContact CD2-CB 3.69Å; F276-L302 HydrophobicContact CD2-CD1 3.63Å; F276-L302 HydrophobicContact CD2-CG 4.25Å; F276-L302 HydrophobicContact CE1-CB 4Å; F276-L302 HydrophobicContact CE2-CB 3.45Å; F276-L302 VanDerWaalsContact CE2-CB 3.45Å; F276-L302 HydrophobicContact CE2-CD1 4.14Å; F276-L302 HydrophobicContact CE2-CG 4.43Å; F276-L302 HydrophobicContact CG-CB 4.06Å; F276-L302 HydrophobicContact CG-CD1 4.11Å; F276-L302 HydrophobicContact CZ-CB 3.63Å; I281-L302 HydrophobicContact CG1-CD1 3.95Å; R284-L302 HydrophobicContact CB-CD2 3.87Å; R284-L302 HydrophobicContact CG-CD2 4.09Å; M298-L302 WeakPolarHBondContact O-CB 3.46Å; M298-L302 VanDerWaalsContact O-CG 3.25Å; M298-L302 WeakPolarHBondContact O-CG 3.25Å; M298-L302 PolarHBondContact O-N 2.98Å; Y299-L302 PolarHBondContact O-N 3.37Å; Y299-L302 VanDerWaalsContact O-N 3.13Å; L302-R304 PolarHBondContact O-N 3.18Å; L302-R304 VanDerWaalsContact O-N 3.17Å; L302-C305 PolarHBondContact O-N 3.35Å; L302-Y306 HydrophobicContact CB-CD2 4.43Å; L302-Y306 HydrophobicContact CD2-CD2 3.77Å; L302-Y306 HydrophobicContact CD2-CE2 3.59Å; L302-Y306 PolarHBondContact O-N 3.19Å
303S90.2Very high88.2Confident26 Ų2669.1 Ų69.118%0.18233%0.33CS..Hα-helixtrans-57.2-27.1175.7-66.80000114.1Y299 H308Y299-S303 WeakPolarHBondContact O-CB 3.39Å; Y299-S303 PolarHBondContact O-N 2.84Å; Y299-S303 PolarHBondContact O-OG 3.45Å; S303-H308 VanDerWaalsContact CB-CE1 3.44Å; S303-H308 WeakPolarHBondContact CB-CE1 3.35Å; S303-H308 VanDerWaalsContact CB-NE2 3.27Å; S303-H308 WeakPolarHBondContact CB-NE2 3.26Å; S303-H308 PolarHBondContact OG-CE1 3.14Å; S303-H308 PolarHBondContact OG-NE2 2.97Å
304R88.9Confident88.1Confident230 Ų23067 Ų6787%0.86832%0.319SS*.Hα-helixtrans-83.6-24.5174.9-70.8175.265.6173.92.1113.3F300 K301 L302F300-R304 WeakPolarHBondContact O-CG 3.34Å; F300-R304 PolarHBondContact O-N 3.12Å; K301-R304 PolarHBondContact O-N 3.36Å; L302-R304 PolarHBondContact O-N 3.18Å; L302-R304 VanDerWaalsContact O-N 3.17Å
305C86.9Confident88Confident67 Ų6765.4 Ų65.445%0.45331%0.313SS..Hα-helixtrans-98.6-25.2-175.3-66.80000113.4K301 L302K301-C305 PolarHBondContact O-N 3.18Å; K301-C305 PolarHBondContact O-SG 3.1Å; L302-C305 PolarHBondContact O-N 3.35Å
306Y87.3Confident87.9Confident53 Ų5364.2 Ų64.221%0.20831%0.308CS..SBendtrans-133.5146.2-173.3-55.7-68.4000110F276 Q280 L302F276-Y306 HydrophobicContact CD1-CD2 4.49Å; Q280-Y306 HydrophobicContact CB-CD2 4.11Å; Q280-Y306 HydrophobicContact CB-CE2 3.78Å; Q280-Y306 HydrophobicContact CG-CD1 4.06Å; Q280-Y306 HydrophobicContact CG-CD2 4.21Å; Q280-Y306 HydrophobicContact CG-CE1 3.85Å; Q280-Y306 HydrophobicContact CG-CE2 4Å; Q280-Y306 HydrophobicContact CG-CG 4.23Å; L302-Y306 HydrophobicContact CB-CD2 4.43Å; L302-Y306 HydrophobicContact CD2-CD2 3.77Å; L302-Y306 HydrophobicContact CD2-CE2 3.59Å; L302-Y306 PolarHBondContact O-N 3.19Å
307A82.2Confident87.9Confident81 Ų8162.4 Ų62.467%0.66930%0.301SS*.PPolyproline II helixtrans-63142.1170.800000110.1
308H81.4Confident87.8Confident70 Ų7058.2 Ų58.232%0.32428%0.283SS..PPolyproline II helixtrans-69.7149.9173.2-65.684.1000109.8H275 S303 E310H275-H308 AromaticContact ND1-CD2 3.99Å; S303-H308 VanDerWaalsContact CB-CE1 3.44Å; S303-H308 WeakPolarHBondContact CB-CE1 3.35Å; S303-H308 VanDerWaalsContact CB-NE2 3.27Å; S303-H308 WeakPolarHBondContact CB-NE2 3.26Å; S303-H308 PolarHBondContact OG-CE1 3.14Å; S303-H308 PolarHBondContact OG-NE2 2.97Å; H308-E310 PolarHBondContact O-N 3.37Å; H308-E310 VanDerWaalsContact O-N 3.15Å
309R82.3Confident87.7Confident139 Ų13958.2 Ų58.253%0.52528%0.283SS..PPolyproline II helixtrans-56.9119.2164.9-176178.8-177.21791.5110Y274Y274-R309 VanDerWaalsContact O-CD 3.24Å; Y274-R309 WeakPolarHBondContact O-CD 3.38Å
310E80.1Confident87.4Confident70 Ų7061.8 Ų61.833%0.32731%0.306SS..PPolyproline II helixtrans-91.8130.9174.3-67.5175.2-176.100109.2R126 H308 Y312R126-E310 IonicContact CZ-OE1 2.64Å; R126-E310 IonicContact NE-OE1 2.88Å; R126-E310 PolarHBondContact NE-OE1 3.32Å; R126-E310 IonicContact NE-OE2 3.3Å; R126-E310 IonicContact NH2-OE1 3.84Å; R126-E310 PolarHBondContact NH2-OE1 3.11Å; H308-E310 PolarHBondContact O-N 3.37Å; H308-E310 VanDerWaalsContact O-N 3.15Å; E310-Y312 HydrophobicContact CB-CE2 3.78Å; E310-Y312 PolarHBondContact OE2-OH 3.28Å; E310-Y312 VanDerWaalsContact OE2-OH 3.06Å
311Q77.3Confident87.1Confident133 Ų13363 Ų6362%0.62131%0.312SS*.  trans-135.2125.5173-170.9173.15.800109.5Y274Y274-Q311 PolarHBondContact OH-OE1 3.46Å
312Y85Confident86.7Confident42 Ų4259.5 Ų59.517%0.16530%0.299CS..  trans-112.4142.8179.4-55.8-70000109.2N122 Y123 R126 E310 D314 T315 P348N122-Y312 HydrophobicContact CB-CD1 4.19Å; N122-Y312 HydrophobicContact CB-CE1 4.31Å; N122-Y312 WeakPolarHBondContact O-CE1 3.28Å; Y123-Y312 VanDerWaalsContact CA-CD1 3.5Å; Y123-Y312 HydrophobicContact CD2-CD1 4.35Å; Y123-Y312 AromaticContact CD2-CD2 3.91Å; Y123-Y312 HydrophobicContact CD2-CD2 3.91Å; Y123-Y312 HydrophobicContact CD2-CE2 4.38Å; Y123-Y312 AromaticContact CD2-CG 3.9Å; Y123-Y312 HydrophobicContact CD2-CG 3.9Å; Y123-Y312 HydrophobicContact CG-CG 4.49Å; R126-Y312 HydrophobicContact CB-CE1 4.27Å; R126-Y312 WeakPolarHBondContact CB-OH 3.48Å; R126-Y312 VanDerWaalsContact CG-OH 3.23Å; R126-Y312 WeakPolarHBondContact CG-OH 3.39Å; E310-Y312 HydrophobicContact CB-CE2 3.78Å; E310-Y312 PolarHBondContact OE2-OH 3.28Å; E310-Y312 VanDerWaalsContact OE2-OH 3.06Å; Y312-D314 VanDerWaalsContact C-N 3.31Å; Y312-T315 HydrophobicContact CD2-CG2 4.31Å; Y312-T315 HydrophobicContact CG-CG2 4.42Å; Y312-P348 HydrophobicContact CE2-CG 3.76Å
313S82.6Confident86.5Confident68 Ų6863.9 Ų63.948%0.47632%0.32SS..SBendtrans-73.9-30.7176.9-63.10000111.2
314D85.9Confident86.5Confident12 Ų1262.6 Ų62.66%0.06431%0.311CS..SBendtrans-143.5147.3174.8-166.38.5000110R119 R120 Y312 K328R119-D314 HydrophobicContact CB-CB 4Å; R119-D314 PolarHBondContact O-N 2.8Å; R120-D314 HydrophobicContact CG-CB 3.84Å; R120-D314 IonicContact CZ-OD2 3.28Å; R120-D314 VanDerWaalsContact CZ-OD2 3.25Å; R120-D314 IonicContact NE-OD2 3.07Å; R120-D314 PolarHBondContact NE-OD2 2.97Å; R120-D314 IonicContact NH2-OD2 3.51Å; R120-D314 PolarHBondContact NH2-OD2 3.49Å; Y312-D314 VanDerWaalsContact C-N 3.31Å; D314-K328 WeakPolarHBondContact OD1-CB 3.48Å
315T90.8Very high86.6Confident21 Ų2151.7 Ų51.713%0.12927%0.27CS..  trans-137.7165.4-170.851.30000111.1Y123 Y312 H317 K328Y123-T315 HydrophobicContact CD2-CG2 3.95Å; Y123-T315 HydrophobicContact CE2-CG2 4.1Å; Y312-T315 HydrophobicContact CD2-CG2 4.31Å; Y312-T315 HydrophobicContact CG-CG2 4.42Å; T315-H317 PolarHBondContact O-CD2 3.14Å; T315-H317 PolarHBondContact OG1-NE2 2.83Å; T315-K328 PolarHBondContact O-N 3.49Å
316L92.6Very high86.8Confident0 Ų049 Ų490%025%0.25CS..EExtended strand (participates in β ladder)trans-74.5145.6164-73.7170000110L109 F111 Y123 L325 F326 W327 L346 F351L109-L316 HydrophobicContact CD1-CD1 4.12Å; L109-L316 HydrophobicContact CD1-CD2 4.27Å; F111-L316 HydrophobicContact CE1-CD1 4.18Å; F111-L316 HydrophobicContact CZ-CD1 3.99Å; Y123-L316 HydrophobicContact CE1-CD1 3.99Å; Y123-L316 HydrophobicContact CE1-CG 4.16Å; L316-L325 HydrophobicContact CB-CD1 4.05Å; L316-F326 CarbonylContact C-O 3.57Å; L316-F326 WeakPolarHBondContact CA-O 3.31Å; L316-F326 WeakPolarHBondContact CD2-O 3.29Å; L316-W327 HydrophobicContact CD2-CD2 3.56Å; L316-W327 HydrophobicContact CD2-CE3 3.86Å; L316-W327 HydrophobicContact CD2-CG 3.96Å; L316-W327 HydrophobicContact CD2-CH2 4.31Å; L316-W327 HydrophobicContact CD2-CZ2 4.04Å; L316-W327 HydrophobicContact CD2-CZ3 4.22Å; L316-W327 HydrophobicContact CG-CD2 4.22Å; L316-W327 HydrophobicContact CG-CE3 4.03Å; L316-W327 HydrophobicContact CG-CH2 4.07Å; L316-W327 HydrophobicContact CG-CZ2 4.24Å; L316-W327 HydrophobicContact CG-CZ3 3.95Å; L316-L346 HydrophobicContact CB-CD1 4.46Å; L316-L346 PolarHBondContact O-N 2.99Å; L316-F351 HydrophobicContact CD1-CD2 3.73Å; L316-F351 HydrophobicContact CD1-CE2 3.99Å; L316-F351 HydrophobicContact CD1-CG 4.19Å
317H92.7Very high86.9Confident19 Ų1946.8 Ų46.89%0.08824%0.242CC..EExtended strand (participates in β ladder)trans-121.3138.4178.3-76.1-120000109.6T315 L325 F326 T344T315-H317 PolarHBondContact O-CD2 3.14Å; T315-H317 PolarHBondContact OG1-NE2 2.83Å; H317-L325 WeakPolarHBondContact O-CA 3.33Å; H317-L325 WeakPolarHBondContact O-CD1 3.28Å; H317-F326 HydrophobicContact CB-CD1 4.38Å; H317-F326 HydrophobicContact CB-CE1 3.89Å; H317-F326 HydrophobicContact CB-CE2 4.07Å; H317-F326 HydrophobicContact CB-CZ 3.7Å; H317-F326 PolarHBondContact N-O 3.36Å; H317-F326 WeakPolarHBondContact O-CD1 3.34Å; H317-F326 PolarHBondContact O-N 2.88Å; H317-T344 WeakPolarHBondContact CA-O 3.47Å
318L92Very high87Confident22 Ų2249.3 Ų49.312%0.11524%0.238CC..EExtended strand (participates in β ladder)trans-107.2126.3169.5179.567000108.9V88 L325 T344 L346 L354V88-L318 HydrophobicContact CB-CD1 4.38Å; V88-L318 HydrophobicContact CG2-CD1 4.43Å; L318-L325 HydrophobicContact CB-CD1 4.5Å; L318-L325 HydrophobicContact CD1-CB 4.48Å; L318-T344 PolarHBondContact N-O 2.99Å; L318-T344 PolarHBondContact O-N 2.92Å; L318-L346 HydrophobicContact CB-CD1 4.09Å; L318-L346 HydrophobicContact CB-CD2 4.37Å; L318-L346 HydrophobicContact CB-CG 4.38Å; L318-L354 HydrophobicContact CD2-CD1 4.17Å; L318-L354 HydrophobicContact CD2-CD2 3.91Å
319C91.1Very high87Confident0 Ų050.6 Ų50.60%025%0.247CC..EExtended strand (participates in β ladder)trans-82.1121.5167.1-175.20000109.7H321 C322 H323 I324 F326 H332 C342 T343C319-H321 VanDerWaalsContact C-N 3.25Å; C319-H321 PolarHBondContact O-N 3.49Å; C319-C322 WeakPolarHBondContact CB-SG 3.46Å; C319-C322 PolarHBondContact SG-SG 2.86Å; C319-H323 WeakPolarHBondContact O-CA 3.44Å; C319-H323 PolarHBondContact O-N 2.89Å; C319-I324 PolarHBondContact N-O 3.34Å; C319-F326 HydrophobicContact CB-CE1 4.29Å; C319-H332 WeakPolarHBondContact CB-NE2 3.27Å; C319-C342 CarbonylContact C-O 3.58Å; C319-C342 WeakPolarHBondContact CA-O 3.48Å; C319-T343 HydrophobicContact CB-CG2 4.37Å
320T88.1Confident86.8Confident78 Ų7845 Ų4548%0.47923%0.228SC..THydrogen-bonded Turntrans-72.6-19.5177.956.80000113H323 C342T320-H323 PolarHBondContact O-CE1 2.75Å; T320-C342 PolarHBondContact N-O 3.25Å; T320-C342 PolarHBondContact OG1-O 3.2Å; T320-C342 VanDerWaalsContact OG1-O 3.08Å
321H86.4Confident86.6Confident96 Ų9649 Ų4944%0.44425%0.251SS..THydrogen-bonded Turntrans-81.5-52.6179.9-178.5-89.7000112.9C319 T335 A336 C342C319-H321 VanDerWaalsContact C-N 3.25Å; C319-H321 PolarHBondContact O-N 3.49Å; H321-T335 PolarHBondContact CE1-OG1 2.83Å; H321-A336 HydrophobicContact CB-CB 4.35Å; H321-C342 HydrophobicContact CB-CB 4.12Å
322C85.7Confident86.9Confident22 Ų2244 Ų4415%0.14923%0.228CC..THydrogen-bonded Turntrans-101.5-2.2-177.260.40000113.9C319 I324 H332C319-C322 WeakPolarHBondContact CB-SG 3.46Å; C319-C322 PolarHBondContact SG-SG 2.86Å; C322-I324 HydrophobicContact CB-CD1 4.11Å; C322-I324 HydrophobicContact CB-CG1 4.09Å; C322-I324 PolarHBondContact O-N 3.24Å; C322-I324 VanDerWaalsContact SG-CD1 3.59Å; C322-I324 VanDerWaalsContact SG-CG1 3.51Å; C322-H332 PolarHBondContact SG-CD2 2.98Å
323H87.8Confident86.7Confident92 Ų9245.3 Ų45.343%0.42624%0.242SC..  trans5534.4-175.8-57.3-62.4000113.6V88 C319 T320V88-H323 PolarHBondContact N-O 3.44Å; V88-H323 WeakPolarHBondContact O-CB 3.48Å; C319-H323 WeakPolarHBondContact O-CA 3.44Å; C319-H323 PolarHBondContact O-N 2.89Å; T320-H323 PolarHBondContact O-CE1 2.75Å
324I89.4Confident86.8Confident0 Ų043.2 Ų43.20%023%0.227CC..EExtended strand (participates in β ladder)trans-93.7133176.3-64.3177.9000109.6W85 I86 Y87 C319 C322 F326 H332 P333W85-I324 HydrophobicContact CB-CG2 3.53Å; W85-I324 HydrophobicContact CD2-CG2 4.2Å; W85-I324 HydrophobicContact CE3-CD1 4.27Å; W85-I324 HydrophobicContact CE3-CG2 4.03Å; W85-I324 HydrophobicContact CG-CG2 4.04Å; I86-I324 CarbonylContact O-C 3.31Å; I86-I324 WeakPolarHBondContact O-CA 3.43Å; Y87-I324 HydrophobicContact CD1-CD1 4.21Å; Y87-I324 HydrophobicContact CD1-CG1 3.54Å; Y87-I324 HydrophobicContact CE1-CD1 3.53Å; Y87-I324 HydrophobicContact CE1-CG1 3.39Å; Y87-I324 HydrophobicContact CG-CG1 4.35Å; C319-I324 PolarHBondContact N-O 3.34Å; C322-I324 HydrophobicContact CB-CD1 4.11Å; C322-I324 HydrophobicContact CB-CG1 4.09Å; C322-I324 PolarHBondContact O-N 3.24Å; C322-I324 VanDerWaalsContact SG-CD1 3.59Å; C322-I324 VanDerWaalsContact SG-CG1 3.51Å; I324-F326 HydrophobicContact CG2-CB 4.47Å; I324-F326 HydrophobicContact CG2-CD1 4.22Å; I324-H332 HydrophobicContact CB-CB 4.49Å; I324-H332 HydrophobicContact CD1-CB 4.38Å; I324-H332 HydrophobicContact CG2-CB 3.85Å; I324-P333 HydrophobicContact CD1-CG 4.05Å
325L91.1Very high86.7Confident0 Ų048.5 Ų48.50%026%0.26CS..EExtended strand (participates in β ladder)trans-103.9128.8172.9179.874.9000109.9W85 I86 V88 L109 L316 H317 L318 L346 F351W85-L325 CarbonylContact C-O 3.55Å; W85-L325 WeakPolarHBondContact CA-O 3.48Å; I86-L325 HydrophobicContact CD1-CD2 4.07Å; I86-L325 HydrophobicContact CG1-CB 3.9Å; I86-L325 HydrophobicContact CG1-CD2 4.22Å; I86-L325 PolarHBondContact N-O 3.3Å; I86-L325 PolarHBondContact O-N 3.12Å; V88-L325 HydrophobicContact CG2-CB 3.55Å; V88-L325 HydrophobicContact CG2-CD2 4.17Å; V88-L325 HydrophobicContact CG2-CG 4.45Å; L109-L325 HydrophobicContact CD1-CD2 3.61Å; L109-L325 HydrophobicContact CD1-CG 4.28Å; L316-L325 HydrophobicContact CB-CD1 4.05Å; H317-L325 WeakPolarHBondContact O-CA 3.33Å; H317-L325 WeakPolarHBondContact O-CD1 3.28Å; L318-L325 HydrophobicContact CB-CD1 4.5Å; L318-L325 HydrophobicContact CD1-CB 4.48Å; L325-L346 HydrophobicContact CD1-CD1 3.35Å; L325-F351 HydrophobicContact CD1-CD2 4.49Å; L325-F351 HydrophobicContact CD2-CD2 3.74Å; L325-F351 HydrophobicContact CD2-CE2 3.46Å; L325-F351 VanDerWaalsContact CD2-CE2 3.46Å
326F90.9Very high86.2Confident11 Ų1148.3 Ų48.35%0.04826%0.26CS..EExtended strand (participates in β ladder)trans-155.7166.2-170.566.7-81.7000111.4W85 L316 H317 C319 I324 T330 H332 T343W85-F326 HydrophobicContact CB-CB 3.61Å; L316-F326 CarbonylContact C-O 3.57Å; L316-F326 WeakPolarHBondContact CA-O 3.31Å; L316-F326 WeakPolarHBondContact CD2-O 3.29Å; H317-F326 HydrophobicContact CB-CD1 4.38Å; H317-F326 HydrophobicContact CB-CE1 3.89Å; H317-F326 HydrophobicContact CB-CE2 4.07Å; H317-F326 HydrophobicContact CB-CZ 3.7Å; H317-F326 PolarHBondContact N-O 3.36Å; H317-F326 WeakPolarHBondContact O-CD1 3.34Å; H317-F326 PolarHBondContact O-N 2.88Å; C319-F326 HydrophobicContact CB-CE1 4.29Å; I324-F326 HydrophobicContact CG2-CB 4.47Å; I324-F326 HydrophobicContact CG2-CD1 4.22Å; F326-T330 WeakPolarHBondContact CB-OG1 3.46Å; F326-T330 WeakPolarHBondContact CD2-O 3.44Å; F326-T330 WeakPolarHBondContact CE2-O 3.45Å; F326-H332 HydrophobicContact CD1-CB 4.24Å; F326-H332 AromaticContact CD1-CG 3.95Å; F326-H332 AromaticContact CD1-ND1 3.71Å; F326-H332 AromaticContact CD2-ND1 3.99Å; F326-H332 AromaticContact CE1-CE1 3.4Å; F326-H332 WeakPolarHBondContact CE1-CE1 3.44Å; F326-H332 AromaticContact CE1-CG 3.88Å; F326-H332 AromaticContact CE1-ND1 3.25Å; F326-H332 VanDerWaalsContact CE1-ND1 3.25Å; F326-H332 WeakPolarHBondContact CE1-ND1 3.46Å; F326-H332 AromaticContact CE2-ND1 3.58Å; F326-H332 HydrophobicContact CG-CB 4.28Å; F326-H332 AromaticContact CZ-CE1 3.38Å; F326-H332 WeakPolarHBondContact CZ-CE1 3.26Å; F326-H332 AromaticContact CZ-ND1 3.19Å; F326-H332 WeakPolarHBondContact CZ-ND1 3.46Å; F326-T343 HydrophobicContact CE1-CG2 4.15Å; F326-T343 HydrophobicContact CZ-CG2 3.77Å
327W89.6Confident85.5Confident6 Ų656.7 Ų56.72%0.02331%0.305CS..EExtended strand (participates in β ladder)trans-82.3146172.6-70.9105.4000109.6F111 A114 R120 Y123 V124 L316 D329 T330F111-W327 HydrophobicContact CD1-CH2 4.31Å; F111-W327 AromaticContact CD1-CZ2 3.75Å; F111-W327 HydrophobicContact CD1-CZ2 3.75Å; F111-W327 HydrophobicContact CE1-CH2 4.09Å; F111-W327 AromaticContact CE1-CZ2 3.7Å; F111-W327 HydrophobicContact CE1-CZ2 3.7Å; A114-W327 HydrophobicContact CB-CH2 4.08Å; A114-W327 HydrophobicContact CB-CZ2 3.54Å; R120-W327 HydrophobicContact CB-CH2 4.41Å; R120-W327 HydrophobicContact CB-CZ3 4.21Å; R120-W327 VanDerWaalsContact CD-CE3 3.48Å; R120-W327 HydrophobicContact CG-CE3 3.95Å; R120-W327 HydrophobicContact CG-CH2 4.45Å; R120-W327 HydrophobicContact CG-CZ3 3.86Å; Y123-W327 AromaticContact CD1-CH2 3.72Å; Y123-W327 HydrophobicContact CD1-CH2 3.72Å; Y123-W327 AromaticContact CD1-CZ3 3.97Å; Y123-W327 HydrophobicContact CD1-CZ3 3.97Å; Y123-W327 HydrophobicContact CE1-CH2 4.05Å; Y123-W327 HydrophobicContact CE1-CZ3 4.29Å; Y123-W327 HydrophobicContact CG-CZ3 4.44Å; V124-W327 HydrophobicContact CG2-CH2 4.15Å; L316-W327 HydrophobicContact CD2-CD2 3.56Å; L316-W327 HydrophobicContact CD2-CE3 3.86Å; L316-W327 HydrophobicContact CD2-CG 3.96Å; L316-W327 HydrophobicContact CD2-CH2 4.31Å; L316-W327 HydrophobicContact CD2-CZ2 4.04Å; L316-W327 HydrophobicContact CD2-CZ3 4.22Å; L316-W327 HydrophobicContact CG-CD2 4.22Å; L316-W327 HydrophobicContact CG-CE3 4.03Å; L316-W327 HydrophobicContact CG-CH2 4.07Å; L316-W327 HydrophobicContact CG-CZ2 4.24Å; L316-W327 HydrophobicContact CG-CZ3 3.95Å; W327-D329 WeakPolarHBondContact CB-OD1 3.47Å; W327-D329 PolarHBondContact O-N 3.19Å; W327-T330 HydrophobicContact CB-CG2 4.16Å; W327-T330 PolarHBondContact N-OG1 3Å; W327-T330 VanDerWaalsContact N-OG1 3.08Å; W327-T330 PolarHBondContact O-N 2.95Å; W327-T330 PolarHBondContact O-OG1 3.4Å
328K84.3Confident84.9Confident135 Ų13560 Ų6059%0.58732%0.323SS*.THydrogen-bonded Turntrans-50.6-34.6-172-170.6178.5175.7178.90115.2D314 T315D314-K328 WeakPolarHBondContact OD1-CB 3.48Å; T315-K328 PolarHBondContact O-N 3.49Å
329D81.1Confident84.2Confident97 Ų9761.2 Ų61.252%0.51933%0.333SS..THydrogen-bonded Turntrans-86.4-6.3-179.969.8-31.3000114.3R120 W327R120-D329 IonicContact CZ-OD1 3.06Å; R120-D329 IonicContact CZ-OD2 2.89Å; R120-D329 IonicContact NH1-OD1 2.61Å; R120-D329 PolarHBondContact NH1-OD1 2.89Å; R120-D329 IonicContact NH1-OD2 3.2Å; R120-D329 IonicContact NH2-OD1 2.73Å; R120-D329 PolarHBondContact NH2-OD1 3.47Å; R120-D329 IonicContact NH2-OD2 3.15Å; R120-D329 PolarHBondContact NH2-OD2 3.17Å; W327-D329 WeakPolarHBondContact CB-OD1 3.47Å; W327-D329 PolarHBondContact O-N 3.19Å
330T79.1Confident83.6Confident22 Ų2269 Ų6914%0.13537%0.369CS..SBendtrans-90.3118.8175.661.40000109.9K84 F326 W327K84-T330 HydrophobicContact CB-CG2 4.3Å; K84-T330 PolarHBondContact O-OG1 3.34Å; F326-T330 WeakPolarHBondContact CB-OG1 3.46Å; F326-T330 WeakPolarHBondContact CD2-O 3.44Å; F326-T330 WeakPolarHBondContact CE2-O 3.45Å; W327-T330 HydrophobicContact CB-CG2 4.16Å; W327-T330 PolarHBondContact N-OG1 3Å; W327-T330 VanDerWaalsContact N-OG1 3.08Å; W327-T330 PolarHBondContact O-N 2.95Å; W327-T330 PolarHBondContact O-OG1 3.4Å
331N75.9Confident83.4Confident152 Ų15269.3 Ų69.381%0.81338%0.375SS*.  trans-64.6142.5170.4-69.4-14.6000109.8
332H82.1Confident83.3Confident28 Ų2866.1 Ų66.113%0.1336%0.363CS..  trans-122149173.769.2-78.9000110.3W85 C319 C322 I324 F326 C334W85-H332 HydrophobicContact CB-CB 4.49Å; W85-H332 HydrophobicContact CG-CB 4.35Å; C319-H332 WeakPolarHBondContact CB-NE2 3.27Å; C322-H332 PolarHBondContact SG-CD2 2.98Å; I324-H332 HydrophobicContact CB-CB 4.49Å; I324-H332 HydrophobicContact CD1-CB 4.38Å; I324-H332 HydrophobicContact CG2-CB 3.85Å; F326-H332 HydrophobicContact CD1-CB 4.24Å; F326-H332 AromaticContact CD1-CG 3.95Å; F326-H332 AromaticContact CD1-ND1 3.71Å; F326-H332 AromaticContact CD2-ND1 3.99Å; F326-H332 AromaticContact CE1-CE1 3.4Å; F326-H332 WeakPolarHBondContact CE1-CE1 3.44Å; F326-H332 AromaticContact CE1-CG 3.88Å; F326-H332 AromaticContact CE1-ND1 3.25Å; F326-H332 VanDerWaalsContact CE1-ND1 3.25Å; F326-H332 WeakPolarHBondContact CE1-ND1 3.46Å; F326-H332 AromaticContact CE2-ND1 3.58Å; F326-H332 HydrophobicContact CG-CB 4.28Å; F326-H332 AromaticContact CZ-CE1 3.38Å; F326-H332 WeakPolarHBondContact CZ-CE1 3.26Å; F326-H332 AromaticContact CZ-ND1 3.19Å; F326-H332 WeakPolarHBondContact CZ-ND1 3.46Å; H332-C334 VanDerWaalsContact C-N 3.32Å; H332-C334 WeakPolarHBondContact NE2-CB 3.44Å; H332-C334 PolarHBondContact O-N 3.23Å
333P81.8Confident83.5Confident70 Ų7067 Ų6746%0.45537%0.368SS..  trans-74.584.8179.830.8-34.7000110.1W85 I324W85-P333 VanDerWaalsContact CE2-CD 3.47Å; W85-P333 HydrophobicContact CH2-CG 3.99Å; W85-P333 HydrophobicContact CZ2-CG 3.58Å; I324-P333 HydrophobicContact CD1-CG 4.05Å
334C83.7Confident83.6Confident25 Ų2566.4 Ų66.417%0.16937%0.371CS..  trans-99.6136.6173.6-160.20000110.8H332 P339H332-C334 VanDerWaalsContact C-N 3.32Å; H332-C334 WeakPolarHBondContact NE2-CB 3.44Å; H332-C334 PolarHBondContact O-N 3.23Å; C334-P339 HydrophobicContact CB-CB 4.16Å; C334-P339 HydrophobicContact CB-CG 4.32Å
335T84.3Confident83.7Confident122 Ų12269.8 Ų69.875%0.74839%0.394SS*.  trans-93.23174.651.90000113.3H321H321-T335 PolarHBondContact CE1-OG1 2.83Å
336A81.6Confident83.8Confident17 Ų1770.4 Ų70.414%0.1440%0.397CS..SBendtrans-70.5141.9177.400000111.4H321 N338 P339H321-A336 HydrophobicContact CB-CB 4.35Å; A336-N338 PolarHBondContact O-N 3.11Å; A336-P339 WeakPolarHBondContact O-CD 3.25Å
337N76.2Confident83.9Confident176 Ų17671.5 Ų71.594%0.94141%0.406SS*.SBendtrans-60.9-30.6177.9-68.3-14.3000113.1
338N81.8Confident84.1Confident88 Ų8871.2 Ų71.247%0.47141%0.405SS..SBendtrans-132.587.9173.2-173.7-8.9000110.4A336 E340 S341A336-N338 PolarHBondContact O-N 3.11Å; N338-E340 VanDerWaalsContact C-N 3.3Å; N338-E340 PolarHBondContact O-N 2.92Å; N338-E340 PolarHBondContact OD1-N 3.29Å; N338-S341 PolarHBondContact O-N 3.41Å; N338-S341 PolarHBondContact O-OG 2.97Å
339P76.6Confident84.4Confident49 Ų4969 Ų6932%0.31840%0.397SS..THydrogen-bonded Turntrans-60-36.2-175.6-24.934.8000113.8C334 A336 S341 C342 T343C334-P339 HydrophobicContact CB-CB 4.16Å; C334-P339 HydrophobicContact CB-CG 4.32Å; A336-P339 WeakPolarHBondContact O-CD 3.25Å; P339-S341 VanDerWaalsContact C-N 3.31Å; P339-S341 PolarHBondContact O-N 2.97Å; P339-C342 PolarHBondContact O-N 3.05Å; P339-T343 VanDerWaalsContact O-CG2 3.31Å; P339-T343 WeakPolarHBondContact O-CG2 3.37Å
340E78.7Confident84.9Confident162 Ų16268 Ų6876%0.75739%0.392SS*.G310 helixtrans-64-38-177.4-63.2-169.4167.900111.8N338 C342 T343N338-E340 VanDerWaalsContact C-N 3.3Å; N338-E340 PolarHBondContact O-N 2.92Å; N338-E340 PolarHBondContact OD1-N 3.29Å; E340-C342 PolarHBondContact O-N 3.34Å; E340-T343 PolarHBondContact O-N 3.29Å; E340-T343 VanDerWaalsContact O-N 3.17Å; E340-T343 PolarHBondContact O-OG1 3.44Å
341S82.6Confident85.6Confident85 Ų8566.9 Ų66.959%0.59439%0.385SS*.G310 helixtrans-64.3-20.7179.171.90000114.1N338 P339N338-S341 PolarHBondContact O-N 3.41Å; N338-S341 PolarHBondContact O-OG 2.97Å; P339-S341 VanDerWaalsContact C-N 3.31Å; P339-S341 PolarHBondContact O-N 2.97Å
342C85.1Confident86.3Confident30 Ų3059.7 Ų59.720%0.20335%0.347CS..G310 helixtrans-102.110.7-179.4-54.80000112.9C319 T320 H321 P339 E340C319-C342 CarbonylContact C-O 3.58Å; C319-C342 WeakPolarHBondContact CA-O 3.48Å; T320-C342 PolarHBondContact N-O 3.25Å; T320-C342 PolarHBondContact OG1-O 3.2Å; T320-C342 VanDerWaalsContact OG1-O 3.08Å; H321-C342 HydrophobicContact CB-CB 4.12Å; P339-C342 PolarHBondContact O-N 3.05Å; E340-C342 PolarHBondContact O-N 3.34Å
343T89Confident86.7Confident41 Ų4161 Ų6125%0.25236%0.359SS..EExtended strand (participates in β ladder)trans-106.9132.8-177.459.90000112C319 F326 P339 E340C319-T343 HydrophobicContact CB-CG2 4.37Å; F326-T343 HydrophobicContact CE1-CG2 4.15Å; F326-T343 HydrophobicContact CZ-CG2 3.77Å; P339-T343 VanDerWaalsContact O-CG2 3.31Å; P339-T343 WeakPolarHBondContact O-CG2 3.37Å; E340-T343 PolarHBondContact O-N 3.29Å; E340-T343 VanDerWaalsContact O-N 3.17Å; E340-T343 PolarHBondContact O-OG1 3.44Å
344T91.2Very high87Confident78 Ų7858.8 Ų58.848%0.47934%0.343SS..EExtended strand (participates in β ladder)trans-120.1128.2177-52.90000109.5H317 L318H317-T344 WeakPolarHBondContact CA-O 3.47Å; L318-T344 PolarHBondContact N-O 2.99Å; L318-T344 PolarHBondContact O-N 2.92Å
345S91.6Very high87.2Confident71 Ų7158.4 Ų58.450%0.49734%0.339SS..EExtended strand (participates in β ladder)trans-69.3138.817258.40000110.5
346L92.8Very high87Confident13 Ų1357.1 Ų57.17%0.06833%0.327CS..EExtended strand (participates in β ladder)trans-108135.6178.9-58.4172.1000110.1Y123 L316 L318 L325 D350 L354Y123-L346 VanDerWaalsContact CE2-O 3.31Å; Y123-L346 WeakPolarHBondContact CE2-O 3.27Å; L316-L346 HydrophobicContact CB-CD1 4.46Å; L316-L346 PolarHBondContact O-N 2.99Å; L318-L346 HydrophobicContact CB-CD1 4.09Å; L318-L346 HydrophobicContact CB-CD2 4.37Å; L318-L346 HydrophobicContact CB-CG 4.38Å; L325-L346 HydrophobicContact CD1-CD1 3.35Å; L346-D350 HydrophobicContact CB-CB 4.32Å; L346-D350 HydrophobicContact CD2-CB 4.19Å; L346-L354 HydrophobicContact CD1-CD1 3.44Å; L346-L354 VanDerWaalsContact CD1-CD1 3.44Å; L346-L354 HydrophobicContact CD2-CD1 4.13Å; L346-L354 HydrophobicContact CG-CD1 4.43Å
347S92.5Very high86.2Confident34 Ų3464.2 Ų64.224%0.23836%0.355CS..  trans-72.5162.5160.873.40000110.6Q349 D350 F351S347-Q349 PolarHBondContact O-N 3.39Å; S347-D350 VanDerWaalsContact CB-OD2 3.28Å; S347-D350 WeakPolarHBondContact CB-OD2 3.32Å; S347-D350 PolarHBondContact N-OD2 2.9Å; S347-D350 VanDerWaalsContact N-OD2 3.13Å; S347-D350 PolarHBondContact O-N 3.48Å; S347-D350 VanDerWaalsContact O-N 3.09Å; S347-D350 PolarHBondContact OG-N 2.81Å; S347-D350 PolarHBondContact OG-OD2 3.48Å; S347-F351 PolarHBondContact O-N 3.22Å
348P93.3Very high86.7Confident0 Ų058.7 Ų58.70%033%0.326CS..Hα-helixtrans-54.5-36173.6-27.636.4000113.2Y123 R126 L127 L130 Y312 I352Y123-P348 HydrophobicContact CD2-CG 3.67Å; Y123-P348 HydrophobicContact CE1-CG 4.47Å; Y123-P348 HydrophobicContact CE2-CB 4.45Å; Y123-P348 VanDerWaalsContact CE2-CD 3.47Å; Y123-P348 HydrophobicContact CE2-CG 3.61Å; Y123-P348 HydrophobicContact CG-CG 4.14Å; R126-P348 HydrophobicContact CB-CB 4.38Å; R126-P348 HydrophobicContact CB-CG 4.02Å; R126-P348 HydrophobicContact CG-CB 4.02Å; R126-P348 HydrophobicContact CG-CG 3.91Å; L127-P348 HydrophobicContact CB-CB 4.2Å; L130-P348 HydrophobicContact CD1-CB 3.8Å; Y312-P348 HydrophobicContact CE2-CG 3.76Å; P348-I352 PolarHBondContact O-N 3.3Å
349Q91.7Very high86.9Confident89 Ų8957.1 Ų57.142%0.41632%0.318SS..Hα-helixtrans-71.8-41.2176.7-173.359.655.400111.7L130 S347 F351 I352 S353L130-Q349 HydrophobicContact CD1-CB 4.09Å; S347-Q349 PolarHBondContact O-N 3.39Å; Q349-F351 VanDerWaalsContact C-N 3.32Å; Q349-F351 PolarHBondContact O-N 3.27Å; Q349-I352 PolarHBondContact O-N 3.1Å; Q349-S353 WeakPolarHBondContact O-CB 3.39Å; Q349-S353 PolarHBondContact O-N 2.87Å
350D91.7Very high87.5Confident75 Ų7557.6 Ų57.640%0.40132%0.318SS..Hα-helixtrans-62.9-42.1176.4-59.8-39.3000110.4L346 S347 I352 S353 L354L346-D350 HydrophobicContact CB-CB 4.32Å; L346-D350 HydrophobicContact CD2-CB 4.19Å; S347-D350 VanDerWaalsContact CB-OD2 3.28Å; S347-D350 WeakPolarHBondContact CB-OD2 3.32Å; S347-D350 PolarHBondContact N-OD2 2.9Å; S347-D350 VanDerWaalsContact N-OD2 3.13Å; S347-D350 PolarHBondContact O-N 3.48Å; S347-D350 VanDerWaalsContact O-N 3.09Å; S347-D350 PolarHBondContact OG-N 2.81Å; S347-D350 PolarHBondContact OG-OD2 3.48Å; D350-I352 VanDerWaalsContact C-N 3.35Å; D350-I352 PolarHBondContact O-N 2.82Å; D350-S353 WeakPolarHBondContact CA-OG 3.28Å; D350-S353 PolarHBondContact O-N 3.06Å; D350-S353 VanDerWaalsContact O-N 3.09Å; D350-S353 PolarHBondContact O-OG 2.83Å; D350-L354 WeakPolarHBondContact O-CG 3.41Å; D350-L354 PolarHBondContact O-N 3.21Å
351F92.7Very high88Confident0 Ų051.4 Ų51.40%029%0.292CS..Hα-helixtrans-56.6-45.3174.6166.8-98.1000112.2L102 A105 L109 F111 L127 L316 L325 S347 Q349 S353 L354 F355L102-F351 HydrophobicContact CD1-CD1 4.24Å; L102-F351 HydrophobicContact CD1-CE1 3.52Å; L102-F351 HydrophobicContact CD1-CZ 3.96Å; A105-F351 HydrophobicContact CB-CE2 4.31Å; A105-F351 HydrophobicContact CB-CZ 4.21Å; L109-F351 HydrophobicContact CD1-CE2 4.11Å; L109-F351 HydrophobicContact CD1-CZ 4.5Å; F111-F351 HydrophobicContact CZ-CE1 4.48Å; F111-F351 HydrophobicContact CZ-CZ 4.23Å; L127-F351 HydrophobicContact CD1-CD1 3.52Å; L127-F351 HydrophobicContact CD1-CE1 3.84Å; L127-F351 HydrophobicContact CD2-CD1 3.95Å; L127-F351 HydrophobicContact CD2-CE1 3.79Å; L127-F351 HydrophobicContact CG-CD1 4.41Å; L127-F351 HydrophobicContact CG-CE1 4.45Å; L316-F351 HydrophobicContact CD1-CD2 3.73Å; L316-F351 HydrophobicContact CD1-CE2 3.99Å; L316-F351 HydrophobicContact CD1-CG 4.19Å; L325-F351 HydrophobicContact CD1-CD2 4.49Å; L325-F351 HydrophobicContact CD2-CD2 3.74Å; L325-F351 HydrophobicContact CD2-CE2 3.46Å; L325-F351 VanDerWaalsContact CD2-CE2 3.46Å; S347-F351 PolarHBondContact O-N 3.22Å; Q349-F351 VanDerWaalsContact C-N 3.32Å; Q349-F351 PolarHBondContact O-N 3.27Å; F351-S353 VanDerWaalsContact C-N 3.35Å; F351-L354 WeakPolarHBondContact O-CB 3.37Å; F351-L354 PolarHBondContact O-N 3.48Å; F351-F355 AromaticContact CD2-CE2 3.97Å; F351-F355 HydrophobicContact CD2-CE2 3.97Å; F351-F355 AromaticContact CE2-CE2 3.56Å; F351-F355 HydrophobicContact CE2-CE2 3.56Å; F351-F355 HydrophobicContact CE2-CZ 4.15Å; F351-F355 AromaticContact CZ-CE2 3.9Å; F351-F355 HydrophobicContact CZ-CE2 3.9Å; F351-F355 WeakPolarHBondContact O-CD2 3.3Å; F351-F355 VanDerWaalsContact O-CE2 3.31Å; F351-F355 WeakPolarHBondContact O-CE2 3.09Å
352I91.8Very high88.4Confident1 Ų149.3 Ų49.31%0.00527%0.274CS..Hα-helixtrans-63.2-44.8174.5-68171.5000110.3L102 L127 L130 I131 Q135 P348 Q349 D350 L354 F355L102-I352 HydrophobicContact CD1-CG1 4.37Å; L102-I352 HydrophobicContact CD2-CG2 4.33Å; L127-I352 HydrophobicContact CD1-CD1 3.93Å; L127-I352 HydrophobicContact CD1-CG1 3.8Å; L130-I352 HydrophobicContact CB-CD1 3.46Å; L130-I352 VanDerWaalsContact CB-CD1 3.46Å; L130-I352 HydrophobicContact CD1-CD1 4.1Å; L130-I352 HydrophobicContact CG-CD1 4.43Å; I131-I352 HydrophobicContact CG1-CD1 4.3Å; Q135-I352 HydrophobicContact CG-CG2 3.96Å; P348-I352 PolarHBondContact O-N 3.3Å; Q349-I352 PolarHBondContact O-N 3.1Å; D350-I352 VanDerWaalsContact C-N 3.35Å; D350-I352 PolarHBondContact O-N 2.82Å; I352-L354 PolarHBondContact O-N 3.25Å; I352-F355 PolarHBondContact O-N 3.34Å; I352-F355 VanDerWaalsContact O-N 3.1Å
353S90.6Very high88.6Confident55 Ų5550.6 Ų50.639%0.38528%0.278SS..Hα-helixtrans-62.7-25-177.478.60000113.7Q349 D350 F351 F355 N356Q349-S353 WeakPolarHBondContact O-CB 3.39Å; Q349-S353 PolarHBondContact O-N 2.87Å; D350-S353 WeakPolarHBondContact CA-OG 3.28Å; D350-S353 PolarHBondContact O-N 3.06Å; D350-S353 VanDerWaalsContact O-N 3.09Å; D350-S353 PolarHBondContact O-OG 2.83Å; F351-S353 VanDerWaalsContact C-N 3.35Å; S353-F355 PolarHBondContact O-N 3.18Å; S353-F355 VanDerWaalsContact O-N 3.11Å; S353-N356 PolarHBondContact O-N 3Å
354L88.3Confident88.5Confident23 Ų2351.3 Ų51.312%0.1228%0.28CS..THydrogen-bonded Turntrans-59-22.2175.2-74.2178.7000113.4L318 L346 D350 F351 I352 F357L318-L354 HydrophobicContact CD2-CD1 4.17Å; L318-L354 HydrophobicContact CD2-CD2 3.91Å; L346-L354 HydrophobicContact CD1-CD1 3.44Å; L346-L354 VanDerWaalsContact CD1-CD1 3.44Å; L346-L354 HydrophobicContact CD2-CD1 4.13Å; L346-L354 HydrophobicContact CG-CD1 4.43Å; D350-L354 WeakPolarHBondContact O-CG 3.41Å; D350-L354 PolarHBondContact O-N 3.21Å; F351-L354 WeakPolarHBondContact O-CB 3.37Å; F351-L354 PolarHBondContact O-N 3.48Å; I352-L354 PolarHBondContact O-N 3.25Å; L354-F357 WeakPolarHBondContact O-CZ 3.28Å
355F86.8Confident88.3Confident18 Ų1849.2 Ų49.28%0.07927%0.265CS..THydrogen-bonded Turntrans-110.83.1-176-55.8-74.6000113.5V88 C100 L102 A105 F351 I352 S353 F357V88-F355 HydrophobicContact CG1-CE1 4.01Å; V88-F355 HydrophobicContact CG1-CZ 4.41Å; V88-F355 HydrophobicContact CG2-CZ 4.35Å; C100-F355 HydrophobicContact CB-CE1 4.27Å; C100-F355 VanDerWaalsContact O-CD1 3.22Å; C100-F355 WeakPolarHBondContact O-CD1 3.41Å; L102-F355 HydrophobicContact CB-CB 3.87Å; L102-F355 HydrophobicContact CB-CD2 4.06Å; L102-F355 HydrophobicContact CB-CG 4.03Å; L102-F355 HydrophobicContact CD1-CD2 3.79Å; L102-F355 HydrophobicContact CD1-CE2 4.25Å; A105-F355 HydrophobicContact CB-CE1 3.94Å; A105-F355 HydrophobicContact CB-CE2 3.95Å; A105-F355 HydrophobicContact CB-CZ 3.38Å; F351-F355 AromaticContact CD2-CE2 3.97Å; F351-F355 HydrophobicContact CD2-CE2 3.97Å; F351-F355 AromaticContact CE2-CE2 3.56Å; F351-F355 HydrophobicContact CE2-CE2 3.56Å; F351-F355 HydrophobicContact CE2-CZ 4.15Å; F351-F355 AromaticContact CZ-CE2 3.9Å; F351-F355 HydrophobicContact CZ-CE2 3.9Å; F351-F355 WeakPolarHBondContact O-CD2 3.3Å; F351-F355 VanDerWaalsContact O-CE2 3.31Å; F351-F355 WeakPolarHBondContact O-CE2 3.09Å; I352-F355 PolarHBondContact O-N 3.34Å; I352-F355 VanDerWaalsContact O-N 3.1Å; S353-F355 PolarHBondContact O-N 3.18Å; S353-F355 VanDerWaalsContact O-N 3.11Å; F355-F357 PolarHBondContact O-N 3.08Å
356N80.1Confident88.1Confident95 Ų9547.4 Ų47.451%0.50825%0.246SC..  trans-82.890.4171.4-68.1-13.6000107.7S353S353-N356 PolarHBondContact O-N 3Å
357F64.7Low87.6Confident166 Ų16650.5 Ų50.573%0.72826%0.262SS*.  trans-1000175.6-61.6-68.2000111.6K90 L354 F355K90-F357 HydrophobicContact CB-CE1 3.7Å; K90-F357 HydrophobicContact CB-CZ 4.03Å; K90-F357 HydrophobicContact CD-CE1 4.04Å; K90-F357 HydrophobicContact CG-CE1 3.64Å; K90-F357 HydrophobicContact CG-CZ 3.82Å; L354-F357 WeakPolarHBondContact O-CZ 3.28Å; F355-F357 PolarHBondContact O-N 3.08Å

Retrieved 357 of 357 residues in 986.2 ms (Link to these results)