A0A087Y9Z4_POEFO Loading...

BCL2 interacting protein 3 like a

AlphaFold DB , UniProt , Accession A0A087Y9Z4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M39.7Very low44Very low247 Ų247136.9 Ų136.9100%1.21782%0.816SS**  0131.10-75.7157.9111.400107.5
2S39.7Very low43.9Very low124 Ų124139.4 Ų139.487%0.86781%0.813SS**  trans-76.1152.1-155.6-55.20000116.1
3T45.9Very low44Very low145 Ų145140.2 Ų140.289%0.8981%0.813SS**  trans-64.8144159.73.10000112.2
4A46.9Very low44.5Very low97 Ų97138.7 Ų138.780%0.80281%0.81SS**  trans-162.2150.2146.200000111.9
5P50.9Low44.6Very low127 Ų127133.3 Ų133.383%0.82580%0.796SS**  trans-109.1177.4-159.137-22.7000114.9
6A47Very low44.4Very low91 Ų91136.4 Ų136.475%0.75281%0.805SS**PPolyproline II helixtrans-58.3149.717800000114.3
7P50.2Low44.5Very low128 Ų128139.5 Ų139.583%0.83181%0.81SS**PPolyproline II helixtrans-85.4117.217231.7-29.3000111.6
8Q42.3Very low44.6Very low188 Ų188134.7 Ų134.788%0.87980%0.796SS**PPolyproline II helixtrans-72.1128.9148.9-85.6174.4-75.600108.2
9N37.2Very low44.9Very low118 Ų118133.4 Ų133.463%0.63179%0.794SS**  trans-119.4108.8164.3160.9-45.7000105.8N11N9-N11 PolarHBondContact ND2-ND2 3.26Å; N9-N11 WeakPolarHBondContact OD1-CB 3.3Å; N9-N11 PolarHBondContact OD1-N 3.22Å
10N42.6Very low45.1Very low121 Ų121138.5 Ų138.565%0.64780%0.799SS**  trans-78.7119.5156.5-70.9-19.6000106.1
11N41.2Very low45.7Very low120 Ų120137.8 Ų137.864%0.64280%0.796SS**  trans-135.882.7161-88.4-14000107.5N9 D13N9-N11 PolarHBondContact ND2-ND2 3.26Å; N9-N11 WeakPolarHBondContact OD1-CB 3.3Å; N9-N11 PolarHBondContact OD1-N 3.22Å; N11-D13 PolarHBondContact O-N 2.9Å
12E43.4Very low46.3Very low167 Ų167134.4 Ų134.478%0.7878%0.778SS**  trans-59.3100149.945.6-149.1105.200109.2
13D45.6Very low47Very low150 Ų150135.8 Ų135.880%0.80278%0.775SS**  trans-100.8113.7169-103.1-36.7000110.1N11N11-D13 PolarHBondContact O-N 2.9Å
14P50.7Low47.5Very low119 Ų119137.5 Ų137.577%0.77377%0.772SS**  trans-82.8139.8172.133.4-30.4000110.3
15G45.2Very low47.8Very low58 Ų58141 Ų14160%0.59878%0.777SS**  trans82.974.315600000116.7
16L41.2Very low47.3Very low182 Ų182142.1 Ų142.195%0.95378%0.776SS**  trans-92.392144-73.6175.1000108G18L16-G18 PolarHBondContact O-N 3.1Å
17Q47.6Very low47.2Very low190 Ų190141.2 Ų141.289%0.88878%0.776SS**  trans-63.879.5170.2-60.9170.243.600108.7S19Q17-S19 PolarHBondContact O-N 2.91Å
18G45.8Very low46.8Very low53 Ų53141.3 Ų141.355%0.54677%0.769SS.*  trans-77.299.116200000107.7L16 W20L16-G18 PolarHBondContact O-N 3.1Å; G18-W20 PolarHBondContact O-N 3.09Å
19S50.7Low46.8Very low110 Ų110138.9 Ų138.977%0.76977%0.767SS**  trans-53.895.8175-1790000110.4Q17Q17-S19 PolarHBondContact O-N 2.91Å
20W47.9Very low46.8Very low235 Ų235136.2 Ų136.289%0.8977%0.768SS**  trans-89.7116.5155.5-65.999.5000105.6G18 E22G18-W20 PolarHBondContact O-N 3.09Å; W20-E22 VanDerWaalsContact C-N 3.3Å; W20-E22 PolarHBondContact O-N 2.76Å
21V57.2Low46.5Very low123 Ų123135.2 Ų135.275%0.74578%0.776SS**  trans-66.699.1165.9175.80000106L23V21-L23 PolarHBondContact O-N 2.92Å
22E53.8Low46.2Very low176 Ų176137.8 Ų137.882%0.82278%0.784SS**  trans-72.8109.2172.9-168.5165.117400107.7W20 E24W20-E22 VanDerWaalsContact C-N 3.3Å; W20-E22 PolarHBondContact O-N 2.76Å; E22-E24 PolarHBondContact O-N 2.99Å
23L53.7Low45.8Very low153 Ų153134.4 Ų134.480%0.80178%0.779SS**  trans-78.798.3172.7-87.4150.3000108.2V21 L25V21-L23 PolarHBondContact O-N 2.92Å; L23-L25 PolarHBondContact O-N 2.79Å
24E55.7Low45.3Very low181 Ų181138 Ų13885%0.84678%0.781SS**  trans-63.8111.1166.2-89.7-175.2129.100109.7E22 N26E22-E24 PolarHBondContact O-N 2.99Å; E24-N26 PolarHBondContact O-N 3.18Å
25L53.7Low44.9Very low172 Ų172137.5 Ų137.590%0.90178%0.778SS**  trans-81.197.6161.7-74.2156.8000107.3L23 G27L23-L25 PolarHBondContact O-N 2.79Å; L25-G27 VanDerWaalsContact C-N 3.31Å; L25-G27 PolarHBondContact O-N 3.1Å
26N41.4Very low44.3Very low150 Ų150141.1 Ų141.180%0.80279%0.788SS**  trans-65.884.9176.3-176.868.8000111E24 N28E24-N26 PolarHBondContact O-N 3.18Å; N26-N28 PolarHBondContact O-N 3.29Å
27G45.2Very low43.9Very low72 Ų72137.4 Ų137.474%0.74278%0.778SS**  trans-86.783165.900000110.4L25 T29L25-G27 VanDerWaalsContact C-N 3.31Å; L25-G27 PolarHBondContact O-N 3.1Å; G27-T29 PolarHBondContact O-N 2.76Å
28N40Very low43.1Very low130 Ų130136.7 Ų136.770%0.69577%0.774SS**  trans-73.1100165.6172.421.2000109.6N26N26-N28 PolarHBondContact O-N 3.29Å
29T43.5Very low42.3Very low137 Ų137140.8 Ų140.884%0.8478%0.783SS**  trans-135.4116.4142.450.80000107.3G27G27-T29 PolarHBondContact O-N 2.76Å
30G36.3Very low41.6Very low62 Ų62141.6 Ų141.664%0.63978%0.784SS**  trans-75.8-179.3-16600000115.6
31A37.1Very low42Very low99 Ų99135.8 Ų135.882%0.81878%0.776SS**  trans71.1134.5161.200000115.6
32E35.3Very low41.2Very low174 Ų174135.8 Ų135.881%0.81378%0.779SS**  cis-170.1142.1-4.4-167.6170.5111.200105.5
33S35.1Very low40.2Very low96 Ų96131.5 Ų131.567%0.67177%0.774SS**  trans45.7107.3151.367.90000122.3
34R33.9Very low39.3Very low227 Ų227132.9 Ų132.986%0.85778%0.776SS**  81.7132.6111.2-160179.1161.3154.7-4.9120.4
35P43.7Very low38.3Very low108 Ų108131.2 Ų131.270%0.70177%0.773SS**  trans-93.6158.6-17838.5-34.4000112.7
36T31.8Very low37.5Very low133 Ų133132.1 Ų132.182%0.81677%0.772SS**  trans-161.4132.4149.1-61.60000110.9
37S33.2Very low37.2Very low105 Ų105132.3 Ų132.373%0.73477%0.772SS**  trans-69.1152.4175.3-50.40000114.5
38Q30.2Very low36.8Very low174 Ų174136.2 Ų136.281%0.81378%0.776SS**  150.6139.7123.2-84.3-173.935.700115.8
39L28.5Very low36.5Very low140 Ų140133.4 Ų133.473%0.73377%0.771SS**  trans65.8110.5144.8-93.776.4000122.9
40T35.5Very low36.1Very low127 Ų127134.5 Ų134.578%0.77977%0.771SS**  39.9153.312943.80000124.4
41P56.7Low36Very low113 Ų113136.3 Ų136.373%0.73478%0.78SS**  trans-98.3179.8-156.944.6-37.3000113.6
42P41.7Very low35.7Very low122 Ų122134.6 Ų134.679%0.79277%0.772SS**  -152.5158.785.936.7-15.3000117.8
43A32.4Very low35.6Very low87 Ų87134.9 Ų134.972%0.71978%0.776SS**  trans27148.3140.900000125.6
44E33.9Very low35.5Very low182 Ų182134.5 Ų134.585%0.8577%0.773SS**  trans114.6115.3140.9-53.1-160.416700119.8
45D34.7Very low35.5Very low146 Ų146132.4 Ų132.478%0.78177%0.773SS**  trans31.1122.5141.9-83.6-15.4000121.2
46Q37.9Very low34.8Very low190 Ų190132.8 Ų132.889%0.88878%0.779SS**  -166.1117.4122.8-109.8160.493.400115
47I35.3Very low34.9Very low155 Ų155134.4 Ų134.480%0.79578%0.781SS**  trans-40.5142.7148.542.8170.3000115.2
48N36.1Very low35.5Very low154 Ų154134.7 Ų134.782%0.82478%0.78SS**  135.5112.3122.4-157.723.1000117.1
49A33.8Very low36.3Very low71 Ų71131.5 Ų131.559%0.58778%0.775SS**  trans35.6142.2140.400000125.7
50N35.8Very low36.7Very low160 Ų160132.3 Ų132.386%0.85678%0.779SS**  trans89.3146146.991.421000115.8
51A32.4Very low36.6Very low99 Ų99134.3 Ų134.382%0.81878%0.78SS**  cis-163.5158.45.600000109.6
52G32.3Very low35.4Very low64 Ų64137.4 Ų137.466%0.6678%0.784SS**  trans122.182.815700000114.4
53M33.4Very low35Very low180 Ų180134.9 Ų134.989%0.88778%0.781SS**  78.2117.186.883.7160114.300115.8
54S32.6Very low35.1Very low88 Ų88139.9 Ų139.962%0.61579%0.789SS**  trans92113.5142.8-54.60000121.6
55Q32.7Very low35.1Very low182 Ų182136.8 Ų136.885%0.8579%0.788SS**  66.1137.2128-56.8174.326.100116.8
56S28.9Very low35.5Very low117 Ų117137.3 Ų137.382%0.81879%0.791SS**  cis-173.916016.347.80000107.8
57L35.3Very low35.9Very low167 Ų167136.1 Ų136.187%0.87479%0.785SS**  trans-112.6169165.9-89.9163.2000107.7
58P46.1Very low35.8Very low110 Ų110135 Ų13571%0.71479%0.785SS**  cis-136.2-140.1-20.740.3-18.3000109.7
59P46.3Very low36Very low108 Ų108135.4 Ų135.470%0.70179%0.787SS**  cis-136.1177.8-2635.8-14.7000116.4
60L36.5Very low36.3Very low156 Ų156140.3 Ų140.382%0.81780%0.801SS**  trans6.9137.1149.8-73.7159.9000122.9
61E34Very low36.8Very low170 Ų170136 Ų13679%0.79480%0.795SS**  trans-157.6121.5143.5-63.3-8087.400107.5
62E32.3Very low37.6Very low177 Ų177134.4 Ų134.483%0.82779%0.788SS**  52.8133.3104.4-73.1-178167.600115.7
63G32.3Very low38.2Very low70 Ų70139.9 Ų139.972%0.72280%0.801SS**  cis124.763.88.800000112.3
64E34.8Very low39.2Very low191 Ų191140.6 Ų140.689%0.89380%0.803SS**  trans-152.9125.5172.5-100.3156.3120.800111.2
65S34.7Very low40.1Very low118 Ų118144.6 Ų144.683%0.82581%0.811SS**  trans-133109.7172.161.40000109.4
66D41.5Very low40.6Very low157 Ų157141.2 Ų141.284%0.8480%0.803SS**  trans-80.4151.3175.3-77.7-29.4000112.7
67E45.9Very low41.7Very low165 Ų165141.3 Ų141.377%0.77180%0.8SS**  trans-81170.8-17152.7-166.297.900116.4
68T35Very low42.2Very low130 Ų130137.4 Ų137.480%0.79879%0.787SS**  trans87.2131.7169.978.60000115.8
69L39.6Very low42.5Very low163 Ų163138 Ų13885%0.85379%0.794SS**  cis-165.2115.616.6-176.977.9000107.5
70I40.9Very low43.1Very low174 Ų174137.9 Ų137.989%0.89280%0.796SS**  trans-106.9113164.1-65.7-174.5000107.6
71G45.1Very low44Very low70 Ų70134.3 Ų134.372%0.72278%0.784SS**  trans-82.3134.1170.600000111.9
72G49.6Very low45.2Very low66 Ų66132.8 Ų132.868%0.6878%0.78SS**  trans90.886141.900000117.5
73L45.3Very low46.5Very low178 Ų178132.5 Ų132.593%0.93278%0.778SS**  trans-153.960145.5-71.1-174.2000109.9H75L73-H75 VanDerWaalsContact C-N 3.34Å; L73-H75 PolarHBondContact O-N 3.38Å; L73-H75 VanDerWaalsContact O-N 3.15Å
74E54.4Low47.5Very low196 Ų196135.4 Ų135.492%0.91678%0.777SS**  trans-82.372172.2-65.7-86.4153.300109.9
75H50.7Low48.9Very low171 Ų171129 Ų12979%0.79276%0.762SS**  trans-169.773.8151.8-144.2-121.1000113.6L73L73-H75 VanDerWaalsContact C-N 3.34Å; L73-H75 PolarHBondContact O-N 3.38Å; L73-H75 VanDerWaalsContact O-N 3.15Å
76V43.2Very low50.8Low111 Ų111126.9 Ų126.967%0.67374%0.741SS**  trans-145.3117147.8-175.60000105.8S78V76-S78 PolarHBondContact O-N 2.7Å
77P52.1Low52.6Low119 Ų119124 Ų12477%0.77372%0.724SS**  trans-63.687.4159.1-12.127.1000106.6S79P77-S79 PolarHBondContact O-N 3.4Å
78S45.1Very low53.9Low85 Ų85121.8 Ų121.859%0.59471%0.713SS**  trans-69126.6173.3-68.80000106.9V76 S80V76-S78 PolarHBondContact O-N 2.7Å; S78-S80 PolarHBondContact O-N 3.32Å
79S53.1Low56Low124 Ų124121 Ų12187%0.86770%0.699SS**  trans-55.776.4173.5-58.90000112.3P77P77-S79 PolarHBondContact O-N 3.4Å
80S58.4Low58.1Low105 Ų105118 Ų11873%0.73468%0.683SS**  trans-134.767.8175.366.30000111.1S78S78-S80 PolarHBondContact O-N 3.32Å
81S56.5Low60.2Low80 Ų80115 Ų11556%0.55967%0.668SS**  trans-170.681.5136.6-173.80000109.3H83S81-H83 PolarHBondContact O-N 2.77Å; S81-H83 PolarHBondContact OG-N 3.4Å
82I58.9Low61.8Low138 Ų138116.2 Ų116.271%0.70866%0.658SS**SBendtrans-76.913.6159.6-52.9171.6000109M87I82-M87 HydrophobicContact CG2-CE 3.26Å
83H59.5Low63.1Low171 Ų171117.2 Ų117.279%0.79265%0.647SS**SBendtrans-132.231-162.8-168.450.8000114.9S81S81-H83 PolarHBondContact O-N 2.77Å; S81-H83 PolarHBondContact OG-N 3.4Å
84N54.2Low64.6Low132 Ų132111.7 Ų111.771%0.70663%0.627SS**SBendtrans-146.774.2171.6-164.469.4000112.5D86N84-D86 PolarHBondContact O-N 2.78Å
85G64.1Low65.3Low55 Ų55108.5 Ų108.557%0.56761%0.612SS**SBendtrans59.93165.300000117.6
86D72.7Confident65.7Low74 Ų74107.1 Ų107.140%0.39661%0.606SS.*  trans-97.9-5.6-176-155.645.9000112N84 K89 I90N84-D86 PolarHBondContact O-N 2.78Å; D86-K89 PolarHBondContact O-N 3.29Å; D86-K89 WeakPolarHBondContact OD1-CD 3.01Å; D86-I90 WeakPolarHBondContact O-CD1 3.47Å; D86-I90 WeakPolarHBondContact O-CG1 3.46Å; D86-I90 PolarHBondContact O-N 2.76Å
87M80.4Confident66.5Low98 Ų98110.3 Ų110.348%0.48361%0.614SS.*Hα-helixtrans-65.8-44.2178.4-177.6-178.8-71.300111I82 K89 I90 L91I82-M87 HydrophobicContact CG2-CE 3.26Å; M87-K89 PolarHBondContact O-N 3.31Å; M87-I90 PolarHBondContact O-N 3.19Å; M87-L91 HydrophobicContact CG-CD1 4Å; M87-L91 HydrophobicContact CG-CG 4.39Å; M87-L91 WeakPolarHBondContact O-CB 3.42Å; M87-L91 VanDerWaalsContact O-CG 3.25Å; M87-L91 WeakPolarHBondContact O-CG 3.41Å; M87-L91 PolarHBondContact O-N 2.86Å
88E73.9Confident66.8Low117 Ų117108.8 Ų108.855%0.54761%0.605SS.*Hα-helixtrans-61.3-34.3175.758.6-98.3-139.800112.1L92E88-L92 WeakPolarHBondContact O-CB 3.46Å; E88-L92 WeakPolarHBondContact O-CD1 3.39Å; E88-L92 WeakPolarHBondContact O-CG 3.38Å; E88-L92 PolarHBondContact O-N 2.69Å
89K78.4Confident67.2Low113 Ų113108.8 Ų108.849%0.49161%0.605SS.*Hα-helixtrans-70.4-44.8177.8-171.5-158.3173.5-166.60111.4D86 M87 L91 L92 D93D86-K89 PolarHBondContact O-N 3.29Å; D86-K89 WeakPolarHBondContact OD1-CD 3.01Å; M87-K89 PolarHBondContact O-N 3.31Å; K89-L91 VanDerWaalsContact C-N 3.3Å; K89-L91 PolarHBondContact O-N 3.43Å; K89-L92 PolarHBondContact O-N 2.98Å; K89-D93 WeakPolarHBondContact O-CB 3.26Å; K89-D93 PolarHBondContact O-N 3.07Å
90I83.2Confident67.2Low102 Ų102108.5 Ų108.552%0.52360%0.601SS.*Hα-helixtrans-63.4-38.3176.9-63.6159.9000110.9D86 M87 A94D86-I90 WeakPolarHBondContact O-CD1 3.47Å; D86-I90 WeakPolarHBondContact O-CG1 3.46Å; D86-I90 PolarHBondContact O-N 2.76Å; M87-I90 PolarHBondContact O-N 3.19Å; I90-A94 WeakPolarHBondContact O-CB 3.5Å; I90-A94 PolarHBondContact O-N 3.08Å
91L84.6Confident66.4Low111 Ų111108.5 Ų108.558%0.58160%0.601SS**Hα-helixtrans-67.3-38.6175.3-69.8171.9000112.2M87 K89 Q95M87-L91 HydrophobicContact CG-CD1 4Å; M87-L91 HydrophobicContact CG-CG 4.39Å; M87-L91 WeakPolarHBondContact O-CB 3.42Å; M87-L91 VanDerWaalsContact O-CG 3.25Å; M87-L91 WeakPolarHBondContact O-CG 3.41Å; M87-L91 PolarHBondContact O-N 2.86Å; K89-L91 VanDerWaalsContact C-N 3.3Å; K89-L91 PolarHBondContact O-N 3.43Å; L91-Q95 PolarHBondContact O-N 3.31Å
92L80.1Confident66.2Low95 Ų95112.8 Ų112.850%0.49762%0.618SS.*Hα-helixtrans-69.5-40.7174.9-72.1169.6000112E88 K89 Q95 H96E88-L92 WeakPolarHBondContact O-CB 3.46Å; E88-L92 WeakPolarHBondContact O-CD1 3.39Å; E88-L92 WeakPolarHBondContact O-CG 3.38Å; E88-L92 PolarHBondContact O-N 2.69Å; K89-L92 PolarHBondContact O-N 2.98Å; L92-Q95 PolarHBondContact O-N 3.18Å; L92-H96 PolarHBondContact O-N 3.39Å
93D76.1Confident65.8Low87 Ų87110.5 Ų110.547%0.46561%0.614SS.*Hα-helixtrans-64.8-43.7177.2-87.4-2.1000111.5K89 Q95 H96 E97K89-D93 WeakPolarHBondContact O-CB 3.26Å; K89-D93 PolarHBondContact O-N 3.07Å; D93-Q95 PolarHBondContact O-N 3.07Å; D93-H96 PolarHBondContact O-N 2.88Å; D93-E97 WeakPolarHBondContact O-CB 3.3Å; D93-E97 PolarHBondContact O-N 2.86Å
94A76.7Confident65.2Low61 Ų61107.2 Ų107.250%0.50461%0.61SS.*Hα-helixtrans-61.2-29.7175.500000112.6I90 S98I90-A94 WeakPolarHBondContact O-CB 3.5Å; I90-A94 PolarHBondContact O-N 3.08Å; A94-S98 PolarHBondContact O-OG 2.67Å
95Q70.1Confident64.7Low129 Ų129105.7 Ų105.760%0.60361%0.608SS**Hα-helixtrans-83-33.1177.5-145.5178.5-30.100112.5L91 L92 D93 S98L91-Q95 PolarHBondContact O-N 3.31Å; L92-Q95 PolarHBondContact O-N 3.18Å; D93-Q95 PolarHBondContact O-N 3.07Å; Q95-S98 WeakPolarHBondContact CA-OG 3.08Å; Q95-S98 PolarHBondContact O-N 3.18Å; Q95-S98 PolarHBondContact O-OG 2.64Å; Q95-S98 VanDerWaalsContact O-OG 3.11Å
96H59.3Low63.8Low143 Ų143109.9 Ų109.966%0.66261%0.613SS**Hα-helixtrans-71.9-33.5173.3-77.6-169.1000112.3L92 D93 S98L92-H96 PolarHBondContact O-N 3.39Å; D93-H96 PolarHBondContact O-N 2.88Å; H96-S98 PolarHBondContact O-N 2.77Å
97E59.1Low62.7Low178 Ų178110.6 Ų110.683%0.83262%0.624SS**THydrogen-bonded Turntrans-70.1-15.3172.8-161.7-179.8115.500112.3D93D93-E97 WeakPolarHBondContact O-CB 3.3Å; D93-E97 PolarHBondContact O-N 2.86Å
98S57.9Low61.1Low86 Ų86111.9 Ų111.960%0.60164%0.64SS**THydrogen-bonded Turntrans-107.722.4-177.752.50000115.1A94 Q95 H96A94-S98 PolarHBondContact O-OG 2.67Å; Q95-S98 WeakPolarHBondContact CA-OG 3.08Å; Q95-S98 PolarHBondContact O-N 3.18Å; Q95-S98 PolarHBondContact O-OG 2.64Å; Q95-S98 VanDerWaalsContact O-OG 3.11Å; H96-S98 PolarHBondContact O-N 2.77Å
99S54Low59.5Low85 Ų85114.5 Ų114.559%0.59465%0.652SS**SBendtrans-119.9142.4172.3-65.30000113.1
100P52.8Low58.2Low118 Ų118120.2 Ų120.277%0.76667%0.67SS**  -73.5115.6-108.733.7-23.4000112.3N102P100-N102 PolarHBondContact O-N 3.12Å
101S41.7Very low56.1Low106 Ų106120.5 Ų120.574%0.74168%0.678SS**  trans-54.3126152.3-55.30000107.2S103S101-S103 PolarHBondContact O-N 3.35Å
102N51.8Low54.2Low170 Ų170121.6 Ų121.691%0.90969%0.693SS**  trans-5180.3166.2-87.9-8000109.3P100 S104P100-N102 PolarHBondContact O-N 3.12Å; N102-S104 VanDerWaalsContact C-N 3.32Å; N102-S104 PolarHBondContact O-N 3.45Å
103S50.2Low51.9Low90 Ų90122.6 Ų122.663%0.62971%0.707SS**  trans-80.196.5160.544.50000104.1S101 C105S101-S103 PolarHBondContact O-N 3.35Å; S103-C105 PolarHBondContact O-N 3.37Å; S103-C105 PolarHBondContact O-SG 3.38Å
104S48.9Very low50Low102 Ų102123.8 Ų123.871%0.71372%0.722SS**  trans-57.687.5157.7-168.10000106.5N102 E106N102-S104 VanDerWaalsContact C-N 3.32Å; N102-S104 PolarHBondContact O-N 3.45Å; S104-E106 PolarHBondContact O-N 2.91Å
105C43.8Very low48.3Very low99 Ų99125.2 Ų125.267%0.66973%0.734SS**  trans-69.280.5166.7-56.20000105.9S103 S107S103-C105 PolarHBondContact O-N 3.37Å; S103-C105 PolarHBondContact O-SG 3.38Å; C105-S107 PolarHBondContact O-N 3.04Å
106E44.5Very low46.7Very low144 Ų144128 Ų12867%0.67375%0.747SS**  trans-63.283.3167.7-165.877.5-150.500107.2S104S104-E106 PolarHBondContact O-N 2.91Å
107S48.7Very low45.6Very low89 Ų89128 Ų12862%0.62275%0.752SS**PPolyproline II helixtrans-70.3130.2170.4-77.10000108.1C105 H109C105-S107 PolarHBondContact O-N 3.04Å; S107-H109 PolarHBondContact O-N 3.15Å
108P47Very low44.6Very low125 Ų125126 Ų12681%0.81275%0.747SS**PPolyproline II helixtrans-55.8125.5172.7-24.433.4000110.6R110P108-R110 PolarHBondContact O-N 3Å
109H41Very low43.7Very low171 Ų171125.3 Ų125.379%0.79275%0.753SS**PPolyproline II helixtrans-49.1121.6179.5-64.7-67.4000112S107S107-H109 PolarHBondContact O-N 3.15Å
110R51.1Low43Very low233 Ų233130.3 Ų130.388%0.87977%0.767SS**PPolyproline II helixtrans-74.8135.7165.4-166.9178-16997.60.1108.5P108P108-R110 PolarHBondContact O-N 3Å
111P39.6Very low42.2Very low108 Ų108132.9 Ų132.970%0.70177%0.773SS**PPolyproline II helixtrans-67.5154.5178.928-33.6000111.5
112P43Very low42.1Very low135 Ų135133.6 Ų133.688%0.87777%0.773SS**PPolyproline II helixtrans-77.7127.9-169.130.9-32.9000111.3
113S32.7Very low41.3Very low116 Ų116135.7 Ų135.781%0.81177%0.774SS**  trans-104.3122.1160.359.20000109.7
114S35.8Very low40.7Very low111 Ų111138.5 Ų138.578%0.77678%0.782SS**  trans-28.7135.7172.851.80000119.7
115A41.2Very low40.3Very low91 Ų91138.8 Ų138.875%0.75278%0.78SS**  trans71.3105.213300000120.5
116Q35.6Very low39.9Very low189 Ų189142.2 Ų142.288%0.88379%0.786SS**  trans178.3112.8132.1-99.2175-61.800105.9
117D36.2Very low39.5Very low143 Ų143143.3 Ų143.377%0.76579%0.793SS**  48.3124.389.8-139.845.7000109.6
118D39.6Very low38.8Very low135 Ų135144.6 Ų144.672%0.72280%0.802SS**  cis179.215218.637-61000106.7
119G38.5Very low38.4Very low71 Ų71143.7 Ų143.773%0.73280%0.798SS**  trans91.591.7149.500000120.8
120Q38.9Very low38.5Very low190 Ų190141.8 Ų141.889%0.88880%0.801SS**  66.8106.1126.2-133.2169.975.700119.9
121I35.8Very low38.1Very low172 Ų172142.4 Ų142.488%0.88280%0.804SS**  trans-163.8117.7131.531.2176.5000110.6
122T40.3Very low37.9Very low121 Ų121140.7 Ų140.774%0.74281%0.805SS**  trans-77.1141.917541.30000112.1
123F33.8Very low37.6Very low214 Ų214139.8 Ų139.894%0.93980%0.803SS**  trans-147.1124.2138.9-86.2-74000110.9
124D38.3Very low38Very low149 Ų149142 Ų14280%0.79780%0.8SS**  trans-84.9131-178.4-174.936.8000109.6
125V40.6Very low38.1Very low109 Ų109142.6 Ų142.666%0.66180%0.804SS**  trans-132.2105.6171.8155.20000108.3M127V125-M127 HydrophobicContact CG1-CE 3.66Å; V125-M127 HydrophobicContact CG1-CG 4.43Å; V125-M127 HydrophobicContact CG1-SD 4.41Å
126E35.6Very low38.1Very low170 Ų170145.3 Ų145.379%0.79480%0.801SS**  trans-79.2124.8173.5-175.1173.9-17200109.9
127M36.8Very low38.5Very low168 Ų168144 Ų14483%0.82880%0.8SS**  trans-108.9120.7176.3-80.6140.9-178.200110.3V125V125-M127 HydrophobicContact CG1-CE 3.66Å; V125-M127 HydrophobicContact CG1-CG 4.43Å; V125-M127 HydrophobicContact CG1-SD 4.41Å
128S32.7Very low38.9Very low115 Ų115144.7 Ų144.780%0.80480%0.804SS**  trans-110.7124.5169.9-72.50000110.9
129S39.5Very low39.3Very low106 Ų106143 Ų14374%0.74180%0.798SS**  trans-99.7155.8176.6167.30000111.5
130P43.5Very low39.9Very low132 Ų132142.8 Ų142.886%0.85779%0.79SS**  trans-134155.9137.49.713.5000115.9
131R42.2Very low40.6Very low246 Ų246139.3 Ų139.393%0.92878%0.777SS**  trans-96.6165.8-168.9-60.9175.3-168.1172.12.9116.1
132G35.9Very low41.4Very low71 Ų71136 Ų13673%0.73276%0.759SS**  trans101148.1139.400000116.2
133S36.3Very low42.2Very low117 Ų117134.8 Ų134.882%0.81875%0.748SS**  cis-170.1145.78.4-70.40000111.2
134Q41.6Very low43.4Very low163 Ų163132 Ų13276%0.76273%0.731SS**  trans42126.6134.6-156.9175.514.400124.1E136Q134-E136 PolarHBondContact NE2-OE2 2.85Å
135S37Very low44.5Very low122 Ų122128.4 Ų128.485%0.85371%0.71SS**  trans-163.1127.313763.60000111.4
136E42.3Very low45.5Very low149 Ų149126.7 Ų126.770%0.69670%0.697SS**  trans-105.5162.1-178.3-64.1153.9102.300109.8Q134Q134-E136 PolarHBondContact NE2-OE2 2.85Å
137D43.9Very low46.9Very low161 Ų161122.1 Ų122.186%0.86168%0.678SS**SBendtrans87.471.5172.8-70.8-81.1000119
138D44.8Very low48.4Very low158 Ų158119.7 Ų119.785%0.84567%0.667SS**SBendtrans-171.142.5144.8-162.840.7000111.8
139T47.2Very low50.2Low98 Ų98118.7 Ų118.760%0.60165%0.652SS**  trans-126.2-0.9-166.555.90000115.3D143T139-D143 WeakPolarHBondContact O-CB 3.17Å; T139-D143 PolarHBondContact O-N 2.87Å
140A51.9Low51.8Low67 Ų67118.6 Ų118.655%0.55464%0.642SS**THydrogen-bonded Turntrans-79.7-20.6-172.100000114.6R144A140-R144 PolarHBondContact O-NH1 3.18Å
141D51.9Low53.2Low118 Ų118117 Ų11763%0.63163%0.626SS**THydrogen-bonded Turntrans-86-46.5171.8-71.2-43.6000109.8D143 R144 E145D141-D143 PolarHBondContact O-N 3.32Å; D141-R144 PolarHBondContact O-N 3.03Å; D141-E145 VanDerWaalsContact C-CD 3.49Å; D141-E145 VanDerWaalsContact C-OE1 3.27Å
142M54.3Low54.6Low102 Ų102112 Ų11250%0.50261%0.611SS.*Hα-helixtrans-50.8-38.1169.3-88.4-71.7126.300114.1R144 E145 D146M142-R144 PolarHBondContact O-N 3.28Å; M142-E145 VanDerWaalsContact CA-CD 3.45Å; M142-E145 WeakPolarHBondContact CA-OE1 3.47Å; M142-E145 HydrophobicContact CE-CG 3.7Å; M142-E145 WeakPolarHBondContact CE-OE1 3.28Å; M142-E145 PolarHBondContact N-OE1 3.11Å; M142-E145 WeakPolarHBondContact O-CG 3.5Å; M142-E145 PolarHBondContact O-N 3.32Å; M142-E145 HydrophobicContact SD-CG 4.02Å; M142-D146 WeakPolarHBondContact O-CB 3.33Å; M142-D146 PolarHBondContact O-N 2.78Å; M142-D146 VanDerWaalsContact O-OD2 3.12Å
143D55.6Low56.3Low95 Ų95112.8 Ų112.851%0.50860%0.596SS.*Hα-helixtrans-58-34.1176.8-129.644.7000112.5T139 D141 D147T139-D143 WeakPolarHBondContact O-CB 3.17Å; T139-D143 PolarHBondContact O-N 2.87Å; D141-D143 PolarHBondContact O-N 3.32Å; D143-D147 WeakPolarHBondContact O-CB 3.49Å; D143-D147 PolarHBondContact O-N 3.17Å
144R60.5Low58Low155 Ų155111.4 Ų111.459%0.58558%0.582SS**Hα-helixtrans-78.5-42.2-177.7-74.9-172.9-179.778.24.6112.7A140 D141 M142 I148A140-R144 PolarHBondContact O-NH1 3.18Å; D141-R144 PolarHBondContact O-N 3.03Å; M142-R144 PolarHBondContact O-N 3.28Å; R144-I148 WeakPolarHBondContact O-CB 3.23Å; R144-I148 VanDerWaalsContact O-CD1 3.29Å; R144-I148 WeakPolarHBondContact O-CD1 3.35Å; R144-I148 WeakPolarHBondContact O-CG1 3.17Å; R144-I148 PolarHBondContact O-N 3.15Å
145E60Low59.5Low74 Ų74108.8 Ų108.835%0.34657%0.573SS.*Hα-helixtrans-69.1-35.6173.346-91-157.600112.3D141 M142 I148 L149D141-E145 VanDerWaalsContact C-CD 3.49Å; D141-E145 VanDerWaalsContact C-OE1 3.27Å; M142-E145 VanDerWaalsContact CA-CD 3.45Å; M142-E145 WeakPolarHBondContact CA-OE1 3.47Å; M142-E145 HydrophobicContact CE-CG 3.7Å; M142-E145 WeakPolarHBondContact CE-OE1 3.28Å; M142-E145 PolarHBondContact N-OE1 3.11Å; M142-E145 WeakPolarHBondContact O-CG 3.5Å; M142-E145 PolarHBondContact O-N 3.32Å; M142-E145 HydrophobicContact SD-CG 4.02Å; E145-I148 PolarHBondContact O-N 3.14Å; E145-L149 WeakPolarHBondContact O-CB 3.32Å; E145-L149 WeakPolarHBondContact O-CG 3.32Å; E145-L149 PolarHBondContact O-N 3.46Å
146D61.5Low61.1Low74 Ų74109.5 Ų109.540%0.39656%0.557SS.*Hα-helixtrans-68.4-37.7174.2-69.4-30.7000110.8M142 L149 M150M142-D146 WeakPolarHBondContact O-CB 3.33Å; M142-D146 PolarHBondContact O-N 2.78Å; M142-D146 VanDerWaalsContact O-OD2 3.12Å; D146-L149 PolarHBondContact O-N 3.24Å; D146-M150 WeakPolarHBondContact O-CB 3.31Å; D146-M150 WeakPolarHBondContact O-CG 3.07Å; D146-M150 PolarHBondContact O-N 3.43Å
147D65.6Low62.5Low74 Ų74105.9 Ų105.940%0.39655%0.545SS..Hα-helixtrans-65-39.1169.9-82.3-19.1000111.8D143 M150 N151D143-D147 WeakPolarHBondContact O-CB 3.49Å; D143-D147 PolarHBondContact O-N 3.17Å; D147-M150 PolarHBondContact O-N 3.2Å; D147-N151 WeakPolarHBondContact O-CB 3.48Å; D147-N151 PolarHBondContact O-N 3.28Å; D147-N151 PolarHBondContact O-ND2 3Å
148I68.7Low63.8Low116 Ų116100.2 Ų100.260%0.59552%0.521SS*.Hα-helixtrans-69.3-37.4176.7-68.7160.1000110.4R144 E145 K152R144-I148 WeakPolarHBondContact O-CB 3.23Å; R144-I148 VanDerWaalsContact O-CD1 3.29Å; R144-I148 WeakPolarHBondContact O-CD1 3.35Å; R144-I148 WeakPolarHBondContact O-CG1 3.17Å; R144-I148 PolarHBondContact O-N 3.15Å; E145-I148 PolarHBondContact O-N 3.14Å; I148-K152 WeakPolarHBondContact O-CB 3.26Å; I148-K152 PolarHBondContact O-N 3.44Å
149L70Confident64.9Low94 Ų9498.3 Ų98.349%0.49251%0.511SS..Hα-helixtrans-66.6-43.6172.6-76.6168.1000111E145 D146 K152 E153E145-L149 WeakPolarHBondContact O-CB 3.32Å; E145-L149 WeakPolarHBondContact O-CG 3.32Å; E145-L149 PolarHBondContact O-N 3.46Å; D146-L149 PolarHBondContact O-N 3.24Å; L149-K152 PolarHBondContact O-N 2.87Å; L149-E153 WeakPolarHBondContact O-CB 3.12Å; L149-E153 VanDerWaalsContact O-CG 3.31Å; L149-E153 WeakPolarHBondContact O-CG 3.33Å; L149-E153 PolarHBondContact O-N 3.07Å
150M72.2Confident65.7Low105 Ų105102.1 Ų102.152%0.51751%0.514SS..Hα-helixtrans-62.7-42.9175.3-85.8-169.3176.600112.4D146 D147 E153 V154D146-M150 WeakPolarHBondContact O-CB 3.31Å; D146-M150 WeakPolarHBondContact O-CG 3.07Å; D146-M150 PolarHBondContact O-N 3.43Å; D147-M150 PolarHBondContact O-N 3.2Å; M150-E153 VanDerWaalsContact CA-CG 3.46Å; M150-E153 WeakPolarHBondContact CA-OE1 3.2Å; M150-E153 VanDerWaalsContact CG-OE1 3.3Å; M150-E153 WeakPolarHBondContact CG-OE1 3.46Å; M150-E153 WeakPolarHBondContact O-CG 3.36Å; M150-E153 PolarHBondContact O-N 3.32Å; M150-V154 WeakPolarHBondContact O-CB 3.19Å; M150-V154 WeakPolarHBondContact O-CG2 3.42Å; M150-V154 PolarHBondContact O-N 2.88Å
151N73.2Confident66.1Low97 Ų97103.4 Ų103.452%0.51952%0.519SS..Hα-helixtrans-71.7-37.1177.8-70.8-44000111D147 E153 V154 D155D147-N151 WeakPolarHBondContact O-CB 3.48Å; D147-N151 PolarHBondContact O-N 3.28Å; D147-N151 PolarHBondContact O-ND2 3Å; N151-E153 VanDerWaalsContact C-N 3.32Å; N151-V154 PolarHBondContact O-N 2.88Å; N151-D155 VanDerWaalsContact O-CB 3.28Å; N151-D155 WeakPolarHBondContact O-CB 3.45Å; N151-D155 PolarHBondContact O-N 3.1Å
152K72.8Confident66.4Low141 Ų141101.1 Ų101.161%0.61351%0.512SS*.Hα-helixtrans-68.6-32173.6-178.1177.3164.9-156.10112.1I148 L149 W156I148-K152 WeakPolarHBondContact O-CB 3.26Å; I148-K152 PolarHBondContact O-N 3.44Å; L149-K152 PolarHBondContact O-N 2.87Å; K152-W156 PolarHBondContact O-N 3.37Å
153E70.1Confident67Low89 Ų89105.1 Ų105.142%0.41652%0.522SS..Hα-helixtrans-72.4-41.8173.968.1-167.1-165.500113.3L149 M150 N151 D155 W156 V157L149-E153 WeakPolarHBondContact O-CB 3.12Å; L149-E153 VanDerWaalsContact O-CG 3.31Å; L149-E153 WeakPolarHBondContact O-CG 3.33Å; L149-E153 PolarHBondContact O-N 3.07Å; M150-E153 VanDerWaalsContact CA-CG 3.46Å; M150-E153 WeakPolarHBondContact CA-OE1 3.2Å; M150-E153 VanDerWaalsContact CG-OE1 3.3Å; M150-E153 WeakPolarHBondContact CG-OE1 3.46Å; M150-E153 WeakPolarHBondContact O-CG 3.36Å; M150-E153 PolarHBondContact O-N 3.32Å; N151-E153 VanDerWaalsContact C-N 3.32Å; E153-D155 VanDerWaalsContact C-N 3.3Å; E153-D155 PolarHBondContact O-N 3.35Å; E153-W156 VanDerWaalsContact CB-NE1 3.27Å; E153-W156 VanDerWaalsContact O-CD1 3.26Å; E153-W156 PolarHBondContact O-N 3.46Å; E153-W156 PolarHBondContact O-NE1 2.98Å; E153-V157 WeakPolarHBondContact O-CB 3.16Å; E153-V157 WeakPolarHBondContact O-CG2 3.38Å; E153-V157 PolarHBondContact O-N 2.81Å
154V72.9Confident67Low87 Ų87106.3 Ų106.353%0.52753%0.534SS..Hα-helixtrans-62.1-39.5171.21720000111M150 N151 V157 A158M150-V154 WeakPolarHBondContact O-CB 3.19Å; M150-V154 WeakPolarHBondContact O-CG2 3.42Å; M150-V154 PolarHBondContact O-N 2.88Å; N151-V154 PolarHBondContact O-N 2.88Å; V154-V157 PolarHBondContact O-N 3.34Å; V154-A158 WeakPolarHBondContact O-CB 3.37Å; V154-A158 PolarHBondContact O-N 2.74Å
155D72.8Confident67Low108 Ų108106.3 Ų106.358%0.57854%0.541SS*.Hα-helixtrans-68.1-38.8177.9-78.6-22.8000112.7N151 E153 N159N151-D155 VanDerWaalsContact O-CB 3.28Å; N151-D155 WeakPolarHBondContact O-CB 3.45Å; N151-D155 PolarHBondContact O-N 3.1Å; E153-D155 VanDerWaalsContact C-N 3.3Å; E153-D155 PolarHBondContact O-N 3.35Å; D155-N159 WeakPolarHBondContact O-CB 3.48Å; D155-N159 PolarHBondContact O-N 2.93Å
156W71.2Confident66.8Low138 Ų138109.7 Ų109.752%0.52356%0.561SS.*Hα-helixtrans-69.5-42.4173.278.9-113.6000110.8K152 E153 A158 N159 W160K152-W156 PolarHBondContact O-N 3.37Å; E153-W156 VanDerWaalsContact CB-NE1 3.27Å; E153-W156 VanDerWaalsContact O-CD1 3.26Å; E153-W156 PolarHBondContact O-N 3.46Å; E153-W156 PolarHBondContact O-NE1 2.98Å; W156-A158 VanDerWaalsContact C-N 3.27Å; W156-A158 PolarHBondContact O-N 3.17Å; W156-N159 PolarHBondContact O-N 3.36Å; W156-N159 VanDerWaalsContact O-N 3.13Å; W156-W160 AromaticContact CE3-CD1 3.95Å; W156-W160 HydrophobicContact CE3-CD2 4.46Å; W156-W160 HydrophobicContact CE3-CG 4.26Å; W156-W160 AromaticContact CE3-NE1 3.79Å; W156-W160 PolarHBondContact O-N 2.79Å; W156-W160 VanDerWaalsContact O-N 3.15Å
157V72.1Confident66.7Low72 Ų72111.4 Ų111.444%0.43657%0.57SS.*Hα-helixtrans-59.9-42.3176.2173.30000110.4E153 V154 N159 W160 S161E153-V157 WeakPolarHBondContact O-CB 3.16Å; E153-V157 WeakPolarHBondContact O-CG2 3.38Å; E153-V157 PolarHBondContact O-N 2.81Å; V154-V157 PolarHBondContact O-N 3.34Å; V157-N159 VanDerWaalsContact C-N 3.34Å; V157-N159 PolarHBondContact O-N 3.07Å; V157-W160 PolarHBondContact O-N 3.37Å; V157-W160 VanDerWaalsContact O-N 3.14Å; V157-S161 PolarHBondContact O-N 3.39Å
158A70.9Confident66.4Low43 Ų43111.6 Ų111.636%0.35558%0.575SS.*Hα-helixtrans-61.4-41.8176.700000111.4V154 W156 W160 S161 S162V154-A158 WeakPolarHBondContact O-CB 3.37Å; V154-A158 PolarHBondContact O-N 2.74Å; W156-A158 VanDerWaalsContact C-N 3.27Å; W156-A158 PolarHBondContact O-N 3.17Å; A158-W160 PolarHBondContact O-N 2.82Å; A158-S161 PolarHBondContact O-N 2.85Å; A158-S161 VanDerWaalsContact O-N 3.17Å; A158-S161 PolarHBondContact O-OG 3.13Å; A158-S162 VanDerWaalsContact O-CB 3.28Å; A158-S162 WeakPolarHBondContact O-CB 3.44Å; A158-S162 PolarHBondContact O-N 3.45Å; A158-S162 PolarHBondContact O-OG 3.24Å
159N67.1Low66.2Low118 Ų118110.5 Ų110.563%0.63158%0.575SS**Hα-helixtrans-67.4-20177.5-128.31.7000114.1D155 W156 V157 S162D155-N159 WeakPolarHBondContact O-CB 3.48Å; D155-N159 PolarHBondContact O-N 2.93Å; W156-N159 PolarHBondContact O-N 3.36Å; W156-N159 VanDerWaalsContact O-N 3.13Å; V157-N159 VanDerWaalsContact C-N 3.34Å; V157-N159 PolarHBondContact O-N 3.07Å; N159-S162 WeakPolarHBondContact CA-OG 3.25Å; N159-S162 PolarHBondContact O-OG 3.44Å
160W64.6Low65.8Low178 Ų178115.2 Ų115.267%0.67459%0.592SS**Hα-helixtrans-86.4-32.9174-72.550.2000111.5W156 V157 A158W156-W160 AromaticContact CE3-CD1 3.95Å; W156-W160 HydrophobicContact CE3-CD2 4.46Å; W156-W160 HydrophobicContact CE3-CG 4.26Å; W156-W160 AromaticContact CE3-NE1 3.79Å; W156-W160 PolarHBondContact O-N 2.79Å; W156-W160 VanDerWaalsContact O-N 3.15Å; V157-W160 PolarHBondContact O-N 3.37Å; V157-W160 VanDerWaalsContact O-N 3.14Å; A158-W160 PolarHBondContact O-N 2.82Å
161S61.2Low65.3Low93 Ų93117.4 Ų117.465%0.6560%0.6SS**Hα-helixtrans-77.8-26175.7770000113.5V157 A158 R163V157-S161 PolarHBondContact O-N 3.39Å; A158-S161 PolarHBondContact O-N 2.85Å; A158-S161 VanDerWaalsContact O-N 3.17Å; A158-S161 PolarHBondContact O-OG 3.13Å; S161-R163 VanDerWaalsContact C-N 3.29Å; S161-R163 PolarHBondContact O-N 3.22Å
162S58.1Low64.6Low70 Ų70119.1 Ų119.149%0.4960%0.604SS.*THydrogen-bonded Turntrans-84.34.1-174.8700000114.5A158 N159 P164A158-S162 VanDerWaalsContact O-CB 3.28Å; A158-S162 WeakPolarHBondContact O-CB 3.44Å; A158-S162 PolarHBondContact O-N 3.45Å; A158-S162 PolarHBondContact O-OG 3.24Å; N159-S162 WeakPolarHBondContact CA-OG 3.25Å; N159-S162 PolarHBondContact O-OG 3.44Å; S162-P164 VanDerWaalsContact O-N 3.08Å
163R65.9Low63.9Low187 Ų187119.6 Ų119.671%0.70661%0.608SS**SBendtrans-55.4122.1171.4-67.7-164.1-177.2-148.12.8107.5S161 E165S161-R163 VanDerWaalsContact C-N 3.29Å; S161-R163 PolarHBondContact O-N 3.22Å; R163-E165 PolarHBondContact O-N 3.01Å
164P56.6Low63.3Low120 Ų120123.4 Ų123.478%0.77962%0.623SS**  trans-58.2114.3-175.723.5-32.1000106.8S162 N166S162-P164 VanDerWaalsContact O-N 3.08Å; P164-N166 PolarHBondContact O-N 2.81Å
165E58.8Low62.8Low155 Ų155129.7 Ų129.772%0.72464%0.638SS**  trans892.4153.7-160.8-178.3149.800110.2R163 I167R163-E165 PolarHBondContact O-N 3.01Å; E165-I167 HydrophobicContact CB-CG1 4.2Å; E165-I167 HydrophobicContact CG-CG1 3.7Å; E165-I167 PolarHBondContact O-N 3.21Å; E165-I167 WeakPolarHBondContact OE1-CG1 3.45Å
166N56Low62Low144 Ų144131.9 Ų131.977%0.7764%0.644SS**  trans-66.281.9165-172-64000104.5P164 P168P164-N166 PolarHBondContact O-N 2.81Å; N166-P168 VanDerWaalsContact C-N 3.33Å; N166-P168 WeakPolarHBondContact O-CD 3.24Å
167I60.8Low61.2Low111 Ų111131 Ų13157%0.56966%0.656SS**  trans-60.8105.1169.7-62.4158.3000101.9E165 P169E165-I167 HydrophobicContact CB-CG1 4.2Å; E165-I167 HydrophobicContact CG-CG1 3.7Å; E165-I167 PolarHBondContact O-N 3.21Å; E165-I167 WeakPolarHBondContact OE1-CG1 3.45Å; I167-P169 WeakPolarHBondContact O-CD 3.27Å; I167-P169 VanDerWaalsContact O-N 3.08Å
168P58.4Low60.4Low77 Ų77138.1 Ų138.150%0.568%0.675SS.*  trans-54.4128.5172.823.6-30.3000104.5N166 K170 F172N166-P168 VanDerWaalsContact C-N 3.33Å; N166-P168 WeakPolarHBondContact O-CD 3.24Å; P168-K170 PolarHBondContact O-N 2.97Å; P168-F172 HydrophobicContact CB-CE2 3.84Å
169P64.1Low59.8Low93 Ų93146.4 Ų146.460%0.60470%0.697SS**  trans-46.4112.7174.1-26.132.7000106.5I167 E171I167-P169 WeakPolarHBondContact O-CD 3.27Å; I167-P169 VanDerWaalsContact O-N 3.08Å; P169-E171 PolarHBondContact O-N 2.99Å
170K61.6Low59.3Low194 Ų194146.5 Ų146.584%0.84371%0.707SS**SBendtrans-51.8136.3177.5-150.9165.2-178.6172.90104.1P168P168-K170 PolarHBondContact O-N 2.97Å
171E62.5Low59Low150 Ų150144.1 Ų144.170%0.70171%0.712SS**  trans69.268.3-17351.1-179.617700117.8P169 H173P169-E171 PolarHBondContact O-N 2.99Å; E171-H173 VanDerWaalsContact C-N 3.32Å; E171-H173 PolarHBondContact O-N 2.95Å; E171-H173 PolarHBondContact O-ND1 3.33Å; E171-H173 VanDerWaalsContact O-ND1 3.1Å; E171-H173 IonicContact OE2-CE1 3.26Å; E171-H173 PolarHBondContact OE2-CE1 3.34Å; E171-H173 VanDerWaalsContact OE2-CE1 3.26Å; E171-H173 IonicContact OE2-NE2 3.89Å
172F57.8Low58.9Low134 Ų134144.3 Ų144.359%0.58871%0.713SS**  trans-58.596.8148.7-78.5-81.9000109.6P168 F174P168-F172 HydrophobicContact CB-CE2 3.84Å; F172-F174 VanDerWaalsContact C-N 3.27Å; F172-F174 HydrophobicContact CB-CD2 4.03Å; F172-F174 HydrophobicContact CB-CE2 3.69Å; F172-F174 HydrophobicContact CB-CZ 4.2Å; F172-F174 HydrophobicContact CG-CE2 4.37Å; F172-F174 HydrophobicContact CG-CZ 4.5Å; F172-F174 PolarHBondContact O-N 3.3Å
173H58.3Low58.7Low151 Ų151149.5 Ų149.570%0.69973%0.734SS**  trans-70.387.7167.5-72.179.9000108.6E171 R175E171-H173 VanDerWaalsContact C-N 3.32Å; E171-H173 PolarHBondContact O-N 2.95Å; E171-H173 PolarHBondContact O-ND1 3.33Å; E171-H173 VanDerWaalsContact O-ND1 3.1Å; E171-H173 IonicContact OE2-CE1 3.26Å; E171-H173 PolarHBondContact OE2-CE1 3.34Å; E171-H173 VanDerWaalsContact OE2-CE1 3.26Å; E171-H173 IonicContact OE2-NE2 3.89Å; H173-R175 PolarHBondContact O-N 2.96Å
174F58Low58.2Low169 Ų169142.5 Ų142.574%0.74171%0.714SS**  trans-6877.4168.4-73.6-73.8000109.9F172 H176F172-F174 VanDerWaalsContact C-N 3.27Å; F172-F174 HydrophobicContact CB-CD2 4.03Å; F172-F174 HydrophobicContact CB-CE2 3.69Å; F172-F174 HydrophobicContact CB-CZ 4.2Å; F172-F174 HydrophobicContact CG-CE2 4.37Å; F172-F174 HydrophobicContact CG-CZ 4.5Å; F172-F174 PolarHBondContact O-N 3.3Å; F174-H176 PolarHBondContact O-N 3.27Å; F174-H176 VanDerWaalsContact O-N 3.09Å
175R62.6Low57.9Low219 Ų219144.1 Ų144.183%0.82671%0.713SS**  trans-71.899.3165.8-128.5-87.2-177.6149.41.4106.3H173 P177H173-R175 PolarHBondContact O-N 2.96Å; R175-P177 VanDerWaalsContact O-CD 3.3Å; R175-P177 WeakPolarHBondContact O-CD 3.38Å; R175-P177 VanDerWaalsContact O-N 3.14Å
176H56.4Low57.9Low153 Ų153145.7 Ų145.771%0.70871%0.712SS**  trans-51.3121.8172.6-63.1-50.5000109.5F174 R178F174-H176 PolarHBondContact O-N 3.27Å; F174-H176 VanDerWaalsContact O-N 3.09Å; H176-R178 PolarHBondContact O-N 2.84Å
177P54.1Low57.8Low119 Ų119148.5 Ų148.577%0.77372%0.718SS**  trans-59.8107.3173.8-21.532.3000108.3R175 R179R175-P177 VanDerWaalsContact O-CD 3.3Å; R175-P177 WeakPolarHBondContact O-CD 3.38Å; R175-P177 VanDerWaalsContact O-N 3.14Å; P177-R179 PolarHBondContact O-N 2.91Å
178R54.2Low57.4Low223 Ų223145.6 Ų145.684%0.84271%0.707SS**SBendtrans-74.152.7177.3-72.3-143.374.5163.45.7112.2H176H176-R178 PolarHBondContact O-N 2.84Å
179R59.7Low57.3Low216 Ų216145 Ų14582%0.81572%0.716SS**SBendtrans-177.3108.9157.7-97.7145.6-165.6135.4-1.5108.3P177 V181P177-R179 PolarHBondContact O-N 2.91Å; R179-V181 PolarHBondContact O-N 3.43Å
180S56.4Low57Low120 Ų120145.6 Ų145.684%0.83972%0.717SS**  trans-50.1101.5157.644.80000109.5S182S180-S182 PolarHBondContact O-N 3.29Å; S180-S182 VanDerWaalsContact O-N 3.1Å
181V58.3Low56.6Low129 Ų129141.7 Ų141.778%0.78270%0.703SS**  trans-75.5101.3170.7-1650000106.3R179 L183R179-V181 PolarHBondContact O-N 3.43Å; V181-L183 PolarHBondContact O-N 3.02Å
182S58Low56.4Low96 Ų96142.5 Ų142.567%0.67170%0.704SS**  trans-25.3125.5166.5175.30000111.9S180 S184S180-S182 PolarHBondContact O-N 3.29Å; S180-S182 VanDerWaalsContact O-N 3.1Å; S182-S184 PolarHBondContact O-N 2.93Å
183L54.1Low56.4Low180 Ų180145 Ų14594%0.94272%0.715SS**  trans-60.183.1169.1-63.8179.9000108.6V181V181-L183 PolarHBondContact O-N 3.02Å
184S55.7Low56.4Low40 Ų40141.5 Ų141.528%0.2872%0.719SS.*  trans-81.8128.5-176.4-176.30000108.4S182 R186 K187S182-S184 PolarHBondContact O-N 2.93Å; S184-R186 PolarHBondContact O-N 3.26Å; S184-R186 WeakPolarHBondContact OG-CB 3.45Å; S184-R186 WeakPolarHBondContact OG-CG 3.3Å; S184-R186 VanDerWaalsContact OG-CZ 3.27Å; S184-R186 PolarHBondContact OG-N 3.39Å; S184-R186 PolarHBondContact OG-NE 3.26Å; S184-K187 PolarHBondContact O-N 3.36Å
185M50.6Low56.7Low153 Ų153135.1 Ų135.175%0.75470%0.701SS**G310 helixtrans-49.7-8.3167.2-68.1167.66400113.8K187 S188 M191M185-K187 PolarHBondContact O-N 3.37Å; M185-K187 VanDerWaalsContact O-N 3.07Å; M185-S188 PolarHBondContact O-N 3.49Å; M185-S188 VanDerWaalsContact O-N 3.07Å; M185-M191 VanDerWaalsContact O-SD 3.37Å
186R59Low56.7Low189 Ų189130.2 Ų130.271%0.71369%0.69SS**G310 helixtrans-57.9-9.2168-81-173.2-107.4116-3115.6S184 K192S184-R186 PolarHBondContact O-N 3.26Å; S184-R186 WeakPolarHBondContact OG-CB 3.45Å; S184-R186 WeakPolarHBondContact OG-CG 3.3Å; S184-R186 VanDerWaalsContact OG-CZ 3.27Å; S184-R186 PolarHBondContact OG-N 3.39Å; S184-R186 PolarHBondContact OG-NE 3.26Å; R186-K192 WeakPolarHBondContact O-CD 3.36Å
187K53.1Low57Low202 Ų202129.6 Ų129.688%0.87869%0.686SS**G310 helixtrans-10627.2171.2-156.1-164.4161.5-172.40112.8S184 M185S184-K187 PolarHBondContact O-N 3.36Å; M185-K187 PolarHBondContact O-N 3.37Å; M185-K187 VanDerWaalsContact O-N 3.07Å
188S53.8Low57.5Low51 Ų51126.7 Ų126.736%0.35767%0.669SS.*  trans-83.5114.4157.5171.10000108.7M185 V190 M191M185-S188 PolarHBondContact O-N 3.49Å; M185-S188 VanDerWaalsContact O-N 3.07Å; S188-V190 PolarHBondContact O-N 2.93Å; S188-V190 VanDerWaalsContact O-N 3.08Å; S188-M191 WeakPolarHBondContact O-CG 3.08Å; S188-M191 PolarHBondContact O-N 3.36Å
189G56.2Low58.5Low65 Ų65120 Ų12067%0.6766%0.661SS**THydrogen-bonded Turntrans-66.8-1.4179.700000114.7
190V55.8Low59.4Low104 Ų104116.6 Ų116.663%0.6365%0.654SS**THydrogen-bonded Turntrans-93.4-17.2178.7-1770000112.2S188S188-V190 PolarHBondContact O-N 2.93Å; S188-V190 VanDerWaalsContact O-N 3.08Å
191M54.2Low60.3Low113 Ų113117.6 Ų117.656%0.55764%0.644SS**THydrogen-bonded Turntrans-102-10.5179.320.7167.764.200114.1M185 S188M185-M191 VanDerWaalsContact O-SD 3.37Å; S188-M191 WeakPolarHBondContact O-CG 3.08Å; S188-M191 PolarHBondContact O-N 3.36Å
192K58Low61.6Low167 Ų167114.5 Ų114.573%0.72662%0.623SS**THydrogen-bonded Turntrans-92.1-16.9179.4-59-170.689.1-177.30114.5R186R186-K192 WeakPolarHBondContact O-CD 3.36Å
193K58.3Low62.8Low186 Ų186117.5 Ų117.581%0.80962%0.623SS**THydrogen-bonded Turntrans-109.885.2169.4-161.3103.3175.3-172.90105.3G195K193-G195 PolarHBondContact O-N 2.89Å
194G58.8Low64.5Low77 Ų77113.7 Ų113.779%0.79461%0.608SS**THydrogen-bonded Turntrans-38.194.7-16700000113.9
195G64.3Low66.1Low35 Ų35115.9 Ų115.936%0.36161%0.612SS.*  trans-72.8148.416700000108.3K193 F197K193-G195 PolarHBondContact O-N 2.89Å; G195-F197 VanDerWaalsContact O-CD2 3.3Å; G195-F197 WeakPolarHBondContact O-CD2 3.18Å; G195-F197 PolarHBondContact O-N 2.72Å
196I62.6Low68Low117 Ų117112.7 Ų112.760%0.660%0.597SS**SBendtrans-5229.3-169.956157000118.6S198 F201 F205I196-S198 VanDerWaalsContact C-N 3.27Å; I196-S198 PolarHBondContact O-N 3.44Å; I196-F201 WeakPolarHBondContact O-CB 3.2Å; I196-F205 HydrophobicContact CD1-CE2 4.49Å
197F61.1Low69.6Low139 Ų139106.6 Ų106.661%0.6158%0.582SS**  trans-83.956.5-176.1-59.2-72.9000112.6G195 L202G195-F197 VanDerWaalsContact O-CD2 3.3Å; G195-F197 WeakPolarHBondContact O-CD2 3.18Å; G195-F197 PolarHBondContact O-N 2.72Å; F197-L202 HydrophobicContact CD1-CD1 4.23Å; F197-L202 HydrophobicContact CE1-CD1 4.44Å
198S66Low71.6Confident59 Ų5999.6 Ų99.641%0.41356%0.558SS.*  trans-70141.2152-165.50000107.8I196 E200 F201 L202I196-S198 VanDerWaalsContact C-N 3.27Å; I196-S198 PolarHBondContact O-N 3.44Å; S198-E200 PolarHBondContact O-N 2.77Å; S198-E200 VanDerWaalsContact O-N 3.15Å; S198-F201 PolarHBondContact O-N 2.76Å; S198-L202 PolarHBondContact O-N 2.78Å
199A74.7Confident73.5Confident82 Ų82100.6 Ų100.668%0.67856%0.56SS**Hα-helixtrans-56.1-31.4175.800000111.9K203A199-K203 WeakPolarHBondContact O-CB 3.31Å; A199-K203 PolarHBondContact O-N 2.93Å; A199-K203 VanDerWaalsContact O-N 3.12Å
200E78.1Confident75.4Confident145 Ų145102.7 Ų102.768%0.67856%0.555SS**Hα-helixtrans-68.7-43.2175.5-63.6-84.1111.700112.2S198 K203S198-E200 PolarHBondContact O-N 2.77Å; S198-E200 VanDerWaalsContact O-N 3.15Å; E200-K203 PolarHBondContact O-N 3.42Å
201F76.4Confident77.3Confident140 Ų140102.8 Ų102.861%0.61455%0.551SS**Hα-helixtrans-69.8-40.2176.4-78.4-69.4000111.2I196 S198 K203 V204 F205I196-F201 WeakPolarHBondContact O-CB 3.2Å; S198-F201 PolarHBondContact O-N 2.76Å; F201-K203 VanDerWaalsContact C-N 3.26Å; F201-K203 PolarHBondContact O-N 2.94Å; F201-V204 PolarHBondContact O-N 3.26Å; F201-V204 VanDerWaalsContact O-N 3.17Å; F201-F205 WeakPolarHBondContact O-CA 3.41Å; F201-F205 WeakPolarHBondContact O-CB 3.31Å; F201-F205 PolarHBondContact O-N 2.87Å
202L84.1Confident79.3Confident65 Ų65100.2 Ų100.234%0.3454%0.544SS..Hα-helixtrans-62.8-35177.9-170.263.1000111.8F197 S198 V204 F205 I206F197-L202 HydrophobicContact CD1-CD1 4.23Å; F197-L202 HydrophobicContact CE1-CD1 4.44Å; S198-L202 PolarHBondContact O-N 2.78Å; L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 PolarHBondContact O-N 3.34Å; L202-F205 PolarHBondContact O-N 3.04Å; L202-I206 HydrophobicContact CD1-CD1 3.81Å; L202-I206 HydrophobicContact CD1-CG1 3.7Å; L202-I206 HydrophobicContact CD2-CD1 4.25Å; L202-I206 HydrophobicContact CG-CD1 3.6Å; L202-I206 HydrophobicContact CG-CG1 4Å; L202-I206 WeakPolarHBondContact O-CB 3.32Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.37Å; L202-I206 PolarHBondContact O-N 3.2Å
203K84.1Confident81.2Confident158 Ų15897.2 Ų97.269%0.68753%0.532SS*.Hα-helixtrans-62.7-32.6176.1-175.9174.5177.3179.60113.2A199 E200 F201 P207A199-K203 WeakPolarHBondContact O-CB 3.31Å; A199-K203 PolarHBondContact O-N 2.93Å; A199-K203 VanDerWaalsContact O-N 3.12Å; E200-K203 PolarHBondContact O-N 3.42Å; F201-K203 VanDerWaalsContact C-N 3.26Å; F201-K203 PolarHBondContact O-N 2.94Å; K203-P207 WeakPolarHBondContact O-CD 3.28Å; K203-P207 WeakPolarHBondContact O-CG 3.48Å
204V89Confident83Confident101 Ų10194.3 Ų94.361%0.61252%0.523SS*.Hα-helixtrans-92.4-31.8176.3-1760000111.3F201 L202 P207 S208F201-V204 PolarHBondContact O-N 3.26Å; F201-V204 VanDerWaalsContact O-N 3.17Å; L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 PolarHBondContact O-N 3.34Å; V204-P207 WeakPolarHBondContact O-CD 3.38Å; V204-P207 VanDerWaalsContact O-CG 3.31Å; V204-P207 WeakPolarHBondContact O-CG 3.32Å; V204-S208 WeakPolarHBondContact O-CB 3.04Å; V204-S208 PolarHBondContact O-N 2.97Å; V204-S208 VanDerWaalsContact O-N 3.1Å; V204-S208 PolarHBondContact O-OG 2.78Å; V204-S208 VanDerWaalsContact O-OG 3.07Å
205F89.3Confident84.8Confident85 Ų8596.3 Ų96.337%0.37352%0.515SS..Hα-helixtrans-71.7-43.2-176.1-174.2-104.3000112.7I196 F201 L202 S208 L209I196-F205 HydrophobicContact CD1-CE2 4.49Å; F201-F205 WeakPolarHBondContact O-CA 3.41Å; F201-F205 WeakPolarHBondContact O-CB 3.31Å; F201-F205 PolarHBondContact O-N 2.87Å; L202-F205 PolarHBondContact O-N 3.04Å; F205-S208 VanDerWaalsContact CA-OG 3.26Å; F205-S208 WeakPolarHBondContact CA-OG 3.22Å; F205-S208 PolarHBondContact O-N 3.49Å; F205-S208 PolarHBondContact O-OG 3.33Å; F205-L209 HydrophobicContact CE1-CD2 4.09Å; F205-L209 HydrophobicContact CZ-CD1 4.32Å; F205-L209 WeakPolarHBondContact O-CB 3.11Å; F205-L209 PolarHBondContact O-N 3.25Å
206I91.2Very high86.4Confident87 Ų8797.7 Ų97.745%0.44652%0.523SS..Hα-helixtrans-57-54.9176.9-66.2166.4000111.2L202 S208 L209 L210L202-I206 HydrophobicContact CD1-CD1 3.81Å; L202-I206 HydrophobicContact CD1-CG1 3.7Å; L202-I206 HydrophobicContact CD2-CD1 4.25Å; L202-I206 HydrophobicContact CG-CD1 3.6Å; L202-I206 HydrophobicContact CG-CG1 4Å; L202-I206 WeakPolarHBondContact O-CB 3.32Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.37Å; L202-I206 PolarHBondContact O-N 3.2Å; I206-S208 PolarHBondContact O-N 2.84Å; I206-L209 PolarHBondContact O-N 3.41Å; I206-L210 HydrophobicContact CG2-CD1 4.17Å; I206-L210 WeakPolarHBondContact O-CG 3.45Å; I206-L210 PolarHBondContact O-N 2.84Å; I206-L210 VanDerWaalsContact O-N 3.07Å
207P93.6Very high88Confident60 Ų6097.2 Ų97.239%0.3952%0.521SS..Hα-helixtrans-64.8-38.6178.523.1-31.1000112.2K203 V204 L209 L210 I211K203-P207 WeakPolarHBondContact O-CD 3.28Å; K203-P207 WeakPolarHBondContact O-CG 3.48Å; V204-P207 WeakPolarHBondContact O-CD 3.38Å; V204-P207 VanDerWaalsContact O-CG 3.31Å; V204-P207 WeakPolarHBondContact O-CG 3.32Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 2.9Å; P207-L210 PolarHBondContact O-N 2.79Å; P207-I211 WeakPolarHBondContact O-CD1 3.1Å; P207-I211 VanDerWaalsContact O-CG1 3.23Å; P207-I211 WeakPolarHBondContact O-CG1 3.16Å; P207-I211 PolarHBondContact O-N 3.44Å
208S94.3Very high89.6Confident55 Ų5592.5 Ų92.539%0.38551%0.512SS..Hα-helixtrans-63.9-38.7177.364.30000112.9V204 F205 I206 I211 S212V204-S208 WeakPolarHBondContact O-CB 3.04Å; V204-S208 PolarHBondContact O-N 2.97Å; V204-S208 VanDerWaalsContact O-N 3.1Å; V204-S208 PolarHBondContact O-OG 2.78Å; V204-S208 VanDerWaalsContact O-OG 3.07Å; F205-S208 VanDerWaalsContact CA-OG 3.26Å; F205-S208 WeakPolarHBondContact CA-OG 3.22Å; F205-S208 PolarHBondContact O-N 3.49Å; F205-S208 PolarHBondContact O-OG 3.33Å; I206-S208 PolarHBondContact O-N 2.84Å; S208-I211 PolarHBondContact O-N 3.36Å; S208-S212 PolarHBondContact O-N 2.8Å
209L93.1Very high91Very high73 Ų7395.3 Ų95.338%0.38252%0.522SS..Hα-helixtrans-67.4-41.1179.1-175.170.5000111F205 I206 P207 S212 H213F205-L209 HydrophobicContact CE1-CD2 4.09Å; F205-L209 HydrophobicContact CZ-CD1 4.32Å; F205-L209 WeakPolarHBondContact O-CB 3.11Å; F205-L209 PolarHBondContact O-N 3.25Å; I206-L209 PolarHBondContact O-N 3.41Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 2.9Å; L209-S212 PolarHBondContact O-N 3.26Å; L209-S212 PolarHBondContact O-OG 2.9Å; L209-H213 PolarHBondContact O-N 3.45Å; L209-H213 PolarHBondContact O-ND1 2.81Å
210L95.7Very high92Very high109 Ų10993.3 Ų93.357%0.57151%0.509SS*.Hα-helixtrans-61.4-46174.7-71173.2000111I206 P207 S212 H213 M214I206-L210 HydrophobicContact CG2-CD1 4.17Å; I206-L210 WeakPolarHBondContact O-CG 3.45Å; I206-L210 PolarHBondContact O-N 2.84Å; I206-L210 VanDerWaalsContact O-N 3.07Å; P207-L210 PolarHBondContact O-N 2.79Å; L210-S212 PolarHBondContact O-N 2.83Å; L210-H213 PolarHBondContact O-N 3.27Å; L210-M214 VanDerWaalsContact O-CG 3.27Å; L210-M214 WeakPolarHBondContact O-CG 3.33Å; L210-M214 PolarHBondContact O-N 3.46Å
211I96.4Very high92.8Very high105 Ų10591.4 Ų91.454%0.53851%0.507SS..Hα-helixtrans-62.8-43.8178.3-65.9158.4000110.7P207 S208 H213 M214 L215P207-I211 WeakPolarHBondContact O-CD1 3.1Å; P207-I211 VanDerWaalsContact O-CG1 3.23Å; P207-I211 WeakPolarHBondContact O-CG1 3.16Å; P207-I211 PolarHBondContact O-N 3.44Å; S208-I211 PolarHBondContact O-N 3.36Å; I211-H213 VanDerWaalsContact C-N 3.28Å; I211-H213 PolarHBondContact O-N 2.72Å; I211-M214 PolarHBondContact O-N 2.93Å; I211-L215 HydrophobicContact CG2-CD1 4.13Å; I211-L215 WeakPolarHBondContact O-CG 3.1Å; I211-L215 PolarHBondContact O-N 3.25Å
212S97.3Very high93.6Very high60 Ų6091 Ų9142%0.4250%0.502SS..Hα-helixtrans-61.3-39.1177.998.90000111.6S208 L209 L210 L215 A216S208-S212 PolarHBondContact O-N 2.8Å; L209-S212 PolarHBondContact O-N 3.26Å; L209-S212 PolarHBondContact O-OG 2.9Å; L210-S212 PolarHBondContact O-N 2.83Å; S212-L215 PolarHBondContact O-N 2.84Å; S212-A216 WeakPolarHBondContact O-CB 3.33Å; S212-A216 PolarHBondContact O-N 2.86Å
213H96.9Very high94Very high103 Ų10392.2 Ų92.248%0.47751%0.508SS..Hα-helixtrans-69.8-40.6177.5-81.966.3000112.2L209 L210 I211 L215 A216 L217L209-H213 PolarHBondContact O-N 3.45Å; L209-H213 PolarHBondContact O-ND1 2.81Å; L210-H213 PolarHBondContact O-N 3.27Å; I211-H213 VanDerWaalsContact C-N 3.28Å; I211-H213 PolarHBondContact O-N 2.72Å; H213-L215 VanDerWaalsContact C-N 3.29Å; H213-L215 PolarHBondContact O-N 3.41Å; H213-A216 PolarHBondContact O-N 3.41Å; H213-L217 VanDerWaalsContact O-CB 3.32Å; H213-L217 WeakPolarHBondContact O-CB 3.22Å; H213-L217 VanDerWaalsContact O-CG 3.24Å; H213-L217 WeakPolarHBondContact O-CG 3.37Å; H213-L217 PolarHBondContact O-N 3.36Å
214M97Very high94.4Very high125 Ų12586.3 Ų86.362%0.61649%0.493SS*.Hα-helixtrans-61.5-39.6174.7-67.6-69.287.500111.7L210 I211 L217 G218L210-M214 VanDerWaalsContact O-CG 3.27Å; L210-M214 WeakPolarHBondContact O-CG 3.33Å; L210-M214 PolarHBondContact O-N 3.46Å; I211-M214 PolarHBondContact O-N 2.93Å; M214-L217 HydrophobicContact CE-CD1 3.67Å; M214-G218 PolarHBondContact O-N 3.03Å
215L96.6Very high94.3Very high120 Ų12088 Ų8863%0.62849%0.492SS*.Hα-helixtrans-68.1-43.7174.6-69.8173000112I211 S212 H213 G218 L219I211-L215 HydrophobicContact CG2-CD1 4.13Å; I211-L215 WeakPolarHBondContact O-CG 3.1Å; I211-L215 PolarHBondContact O-N 3.25Å; S212-L215 PolarHBondContact O-N 2.84Å; H213-L215 VanDerWaalsContact C-N 3.29Å; H213-L215 PolarHBondContact O-N 3.41Å; L215-G218 PolarHBondContact O-N 3.2Å; L215-L219 WeakPolarHBondContact O-CB 3.27Å; L215-L219 PolarHBondContact O-N 2.84Å
216A97Very high94.1Very high63 Ų6391.1 Ų91.152%0.52150%0.501SS..Hα-helixtrans-62.1-45.1177.400000111.7S212 H213 G220S212-A216 WeakPolarHBondContact O-CB 3.33Å; S212-A216 PolarHBondContact O-N 2.86Å; H213-A216 PolarHBondContact O-N 3.41Å; A216-G220 PolarHBondContact O-N 3.17Å
217L96.3Very high93.9Very high107 Ų10792.1 Ų92.156%0.5651%0.506SS*.Hα-helixtrans-66.8-44.3176.5-69.8170.2000111.4H213 M214 L219 G220 V221H213-L217 VanDerWaalsContact O-CB 3.32Å; H213-L217 WeakPolarHBondContact O-CB 3.22Å; H213-L217 VanDerWaalsContact O-CG 3.24Å; H213-L217 WeakPolarHBondContact O-CG 3.37Å; H213-L217 PolarHBondContact O-N 3.36Å; M214-L217 HydrophobicContact CE-CD1 3.67Å; L217-L219 PolarHBondContact O-N 3.3Å; L217-G220 PolarHBondContact O-N 2.85Å; L217-V221 VanDerWaalsContact O-CG2 3.31Å; L217-V221 WeakPolarHBondContact O-CG2 3.18Å; L217-V221 PolarHBondContact O-N 2.96Å
218G94.9Very high93.1Very high41 Ų4192.1 Ų92.142%0.42351%0.511SS..Hα-helixtrans-62.6-41.2176.800000112.5M214 L215 Y222M214-G218 PolarHBondContact O-N 3.03Å; L215-G218 PolarHBondContact O-N 3.2Å; G218-Y222 WeakPolarHBondContact O-CB 2.89Å; G218-Y222 PolarHBondContact O-N 3.41Å
219L95.4Very high92.1Very high118 Ų11892.9 Ų92.962%0.61851%0.513SS*.Hα-helixtrans-68.8-41.3176-17064.7000111.2L215 L217 Y222 I223L215-L219 WeakPolarHBondContact O-CB 3.27Å; L215-L219 PolarHBondContact O-N 2.84Å; L217-L219 PolarHBondContact O-N 3.3Å; L219-Y222 PolarHBondContact O-N 2.89Å; L219-I223 WeakPolarHBondContact O-CG2 3.1Å; L219-I223 PolarHBondContact O-N 2.93Å
220G95.3Very high90.8Very high40 Ų4092.4 Ų92.441%0.41252%0.52SS..Hα-helixtrans-59.8-43.7173.800000113A216 L217 I223 G224A216-G220 PolarHBondContact O-N 3.17Å; L217-G220 PolarHBondContact O-N 2.85Å; G220-I223 VanDerWaalsContact O-CG2 3.27Å; G220-I223 WeakPolarHBondContact O-CG2 3.43Å; G220-G224 PolarHBondContact O-N 3.2Å
221V95Very high89.2Confident105 Ų10590 Ų9064%0.63652%0.516SS*.Hα-helixtrans-70.4-37.7174.6173.60000111.3L217 G224 K225L217-V221 VanDerWaalsContact O-CG2 3.31Å; L217-V221 WeakPolarHBondContact O-CG2 3.18Å; L217-V221 PolarHBondContact O-N 2.96Å; V221-G224 PolarHBondContact O-N 2.74Å; V221-K225 WeakPolarHBondContact O-CB 3.29Å; V221-K225 PolarHBondContact O-N 2.8Å
222Y93.8Very high87.3Confident130 Ų13090.1 Ų90.151%0.5152%0.522SS..Hα-helixtrans-64.3-48.6177.7177.6-103.3000111.6G218 L219 K225 R226G218-Y222 WeakPolarHBondContact O-CB 2.89Å; G218-Y222 PolarHBondContact O-N 3.41Å; L219-Y222 PolarHBondContact O-N 2.89Å; Y222-K225 PolarHBondContact O-N 3.44Å; Y222-R226 HydrophobicContact CD1-CG 4.35Å; Y222-R226 HydrophobicContact CE1-CG 4Å; Y222-R226 HydrophobicContact CE2-CG 4.2Å; Y222-R226 WeakPolarHBondContact O-CB 3.29Å; Y222-R226 VanDerWaalsContact O-CG 3.25Å; Y222-R226 WeakPolarHBondContact O-CG 3.4Å; Y222-R226 PolarHBondContact O-N 2.92Å
223I93.1Very high85.3Confident91 Ų9192 Ų9247%0.46754%0.535SS..Hα-helixtrans-65.6-41.2176.3-166.661.9000110.8L219 G220 K225 R226 I227L219-I223 WeakPolarHBondContact O-CG2 3.1Å; L219-I223 PolarHBondContact O-N 2.93Å; G220-I223 VanDerWaalsContact O-CG2 3.27Å; G220-I223 WeakPolarHBondContact O-CG2 3.43Å; I223-K225 VanDerWaalsContact C-N 3.34Å; I223-K225 PolarHBondContact O-N 3.43Å; I223-R226 PolarHBondContact O-N 3.46Å; I223-I227 HydrophobicContact CD1-CD1 4.42Å; I223-I227 HydrophobicContact CD1-CG1 4.5Å; I223-I227 HydrophobicContact CG1-CD1 3.87Å; I223-I227 HydrophobicContact CG1-CG1 4.39Å; I223-I227 VanDerWaalsContact O-CG1 3.26Å; I223-I227 WeakPolarHBondContact O-CG1 3.29Å; I223-I227 PolarHBondContact O-N 3.48Å
224G90.8Very high83.4Confident35 Ų3591.7 Ų91.736%0.36154%0.544SS..Hα-helixtrans-59-43.6174.900000112.4G220 V221 I227 A228G220-G224 PolarHBondContact O-N 3.2Å; V221-G224 PolarHBondContact O-N 2.74Å; G224-I227 PolarHBondContact O-N 2.88Å; G224-A228 VanDerWaalsContact O-CB 3.29Å; G224-A228 WeakPolarHBondContact O-CB 3.26Å; G224-A228 PolarHBondContact O-N 2.94Å
225K87.2Confident80.9Confident136 Ų13699.1 Ų99.159%0.59157%0.567SS**Hα-helixtrans-66.3-43.5175.1-167.4173.675.4176.30111.4V221 Y222 I223 I227 A228 T229V221-K225 WeakPolarHBondContact O-CB 3.29Å; V221-K225 PolarHBondContact O-N 2.8Å; Y222-K225 PolarHBondContact O-N 3.44Å; I223-K225 VanDerWaalsContact C-N 3.34Å; I223-K225 PolarHBondContact O-N 3.43Å; K225-I227 VanDerWaalsContact C-N 3.34Å; K225-I227 PolarHBondContact O-N 3.32Å; K225-A228 PolarHBondContact O-N 3.2Å; K225-T229 HydrophobicContact CG-CG2 4.17Å; K225-T229 WeakPolarHBondContact O-CB 3.43Å; K225-T229 VanDerWaalsContact O-CG2 3.29Å; K225-T229 WeakPolarHBondContact O-CG2 3.25Å; K225-T229 PolarHBondContact O-N 3.39Å; K225-T229 PolarHBondContact O-OG1 2.9Å
226R85.8Confident80.2Confident151 Ų15198.1 Ų98.157%0.5756%0.564SS**Hα-helixtrans-59.2-44.5177.3-73.5-73.6-66.1-179.8-0.7111.4Y222 I223 T229 A230Y222-R226 HydrophobicContact CD1-CG 4.35Å; Y222-R226 HydrophobicContact CE1-CG 4Å; Y222-R226 HydrophobicContact CE2-CG 4.2Å; Y222-R226 WeakPolarHBondContact O-CB 3.29Å; Y222-R226 VanDerWaalsContact O-CG 3.25Å; Y222-R226 WeakPolarHBondContact O-CG 3.4Å; Y222-R226 PolarHBondContact O-N 2.92Å; I223-R226 PolarHBondContact O-N 3.46Å; R226-T229 WeakPolarHBondContact CA-OG1 3.47Å; R226-T229 PolarHBondContact O-OG1 3.15Å; R226-A230 WeakPolarHBondContact O-CB 3.35Å; R226-A230 PolarHBondContact O-N 3.47Å
227I86.3Confident79.3Confident107 Ų10799.9 Ų99.955%0.54957%0.567SS.*Hα-helixtrans-66.5-45.9176.8-63.6164.8000110.6I223 G224 K225 T229 A230 A231I223-I227 HydrophobicContact CD1-CD1 4.42Å; I223-I227 HydrophobicContact CD1-CG1 4.5Å; I223-I227 HydrophobicContact CG1-CD1 3.87Å; I223-I227 HydrophobicContact CG1-CG1 4.39Å; I223-I227 VanDerWaalsContact O-CG1 3.26Å; I223-I227 WeakPolarHBondContact O-CG1 3.29Å; I223-I227 PolarHBondContact O-N 3.48Å; G224-I227 PolarHBondContact O-N 2.88Å; K225-I227 VanDerWaalsContact C-N 3.34Å; K225-I227 PolarHBondContact O-N 3.32Å; I227-T229 PolarHBondContact O-N 3.19Å; I227-A230 PolarHBondContact O-N 3.02Å; I227-A231 WeakPolarHBondContact O-CB 3.37Å; I227-A231 PolarHBondContact O-N 3.26Å
228A77.8Confident78.3Confident61 Ų6199.5 Ų99.550%0.50457%0.567SS.*Hα-helixtrans-63.8-38.3177.800000112.8G224 K225 A231 T232G224-A228 VanDerWaalsContact O-CB 3.29Å; G224-A228 WeakPolarHBondContact O-CB 3.26Å; G224-A228 PolarHBondContact O-N 2.94Å; K225-A228 PolarHBondContact O-N 3.2Å; A228-A231 PolarHBondContact O-N 2.9Å; A228-T232 PolarHBondContact O-N 2.84Å
229T72.4Confident77.4Confident70 Ų70102.9 Ų102.943%0.42958%0.576SS.*Hα-helixtrans-71.7-30174.355.80000113K225 R226 I227 T232K225-T229 HydrophobicContact CG-CG2 4.17Å; K225-T229 WeakPolarHBondContact O-CB 3.43Å; K225-T229 VanDerWaalsContact O-CG2 3.29Å; K225-T229 WeakPolarHBondContact O-CG2 3.25Å; K225-T229 PolarHBondContact O-N 3.39Å; K225-T229 PolarHBondContact O-OG1 2.9Å; R226-T229 WeakPolarHBondContact CA-OG1 3.47Å; R226-T229 PolarHBondContact O-OG1 3.15Å; I227-T229 PolarHBondContact O-N 3.19Å; T229-T232 WeakPolarHBondContact O-CG2 3.32Å
230A67.3Low76.2Confident64 Ų64102 Ų10253%0.52957%0.573SS.*Hα-helixtrans-71.9-40.3172.300000110.7R226 I227 T232 S233R226-A230 WeakPolarHBondContact O-CB 3.35Å; R226-A230 PolarHBondContact O-N 3.47Å; I227-A230 PolarHBondContact O-N 3.02Å; A230-T232 PolarHBondContact O-N 3.2Å; A230-S233 PolarHBondContact O-N 2.92Å
231A60.4Low75Confident58 Ų58106.1 Ų106.148%0.47958%0.584SS.*Hα-helixtrans-66.3-32.3177.300000113.2I227 A228 S233 S234I227-A231 WeakPolarHBondContact O-CB 3.37Å; I227-A231 PolarHBondContact O-N 3.26Å; A228-A231 PolarHBondContact O-N 2.9Å; A231-S233 VanDerWaalsContact C-N 3.3Å; A231-S234 PolarHBondContact O-OG 3.19Å
232T57.8Low73.5Confident108 Ų108106.2 Ų106.266%0.66358%0.58SS**THydrogen-bonded Turntrans-78.8-10.9175-164.20000113.9A228 T229 A230A228-T232 PolarHBondContact O-N 2.84Å; T229-T232 WeakPolarHBondContact O-CG2 3.32Å; A230-T232 PolarHBondContact O-N 3.2Å
233S55.3Low72Confident98 Ų98104.4 Ų104.469%0.68559%0.585SS**THydrogen-bonded Turntrans-91.7-4.8178.2-173.30000113.1A230 A231A230-S233 PolarHBondContact O-N 2.92Å; A231-S233 VanDerWaalsContact C-N 3.3Å
234S56.6Low70.2Confident97 Ų97105.5 Ų105.568%0.67860%0.595SS**  trans-99.922.3-179.774.40000113.8A231A231-S234 PolarHBondContact O-OG 3.19Å
235Y45.1Very low68.4Low281 Ų281111.9 Ų111.9100%1.10262%0.616SS**  trans-118.90172.2-95.9-83.7000110.7

Retrieved 235 of 235 residues in 98.2 ms (Link to these results)