A0A077ZB26_TRITR Loading...

Cyclin fold protein 1 variant b

AlphaFold DB , UniProt , Accession A0A077ZB26, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 276 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
1M42.2Very low38.4Very low257 Ų257143.1 Ų143.1100%1.26686%0.856SS**  0121.80-76.9170.4167.700108
2G44.2Very low38.2Very low82 Ų82145.8 Ų145.885%0.84585%0.852SS**  trans94.266.8159.800000118.9
3N35.2Very low37.9Very low163 Ų163141.1 Ų141.187%0.87283%0.833SS**  trans-73.9143.6152.4-81.3-20.6000109.5
4V46.4Very low37.6Very low154 Ų154148.5 Ų148.593%0.93384%0.839SS**  trans-139.4127.7149.2179.70000109.6
5C35.2Very low37.2Very low97 Ų97143.5 Ų143.566%0.65583%0.833SS**  trans-112.2165.9-175.21800000111
6C35.1Very low36.9Very low107 Ų107141.3 Ų141.372%0.72383%0.828SS**  trans78.7148.3142.8-54.40000114.8
7S40.6Very low36.7Very low115 Ų115143.9 Ų143.980%0.80483%0.828SS**  cis-167.5146.718.9-14.60000105.5
8G31.8Very low36.3Very low71 Ų71144.2 Ų144.273%0.73282%0.82SS**  88.3107.774.500000112.2
9F40.8Very low36.1Very low221 Ų221148.1 Ų148.197%0.96982%0.82SS**  trans-134.4121.6159.5-108.3-86.5000110.3
10K32.7Very low35.6Very low200 Ų200149.5 Ų149.587%0.8782%0.82SS**  trans-102.2149.1172.7-86.2178.2170.7178.10109.4
11S38.2Very low35.4Very low107 Ų107148.6 Ų148.675%0.74882%0.824SS**  trans-176.9107.5144.5-1770000109.1
12H35.8Very low34.8Very low175 Ų175141.7 Ų141.781%0.8180%0.796SS**  59.2133.5104.7-77.2-75.6000114.2
13S34.8Very low34.2Very low85 Ų85145.6 Ų145.659%0.59480%0.796SS**  cis-176149.429.7-151.30000111.6
14R33.1Very low33.8Very low245 Ų245144.5 Ų144.593%0.92579%0.79SS**  trans69.9126.5143.8-73.8165.2-177.2-1670122
15G32.4Very low33.1Very low73 Ų73145.8 Ų145.875%0.75378%0.778SS**  trans15269.8137.700000120.2
16S31.3Very low32.7Very low108 Ų108152 Ų15276%0.75579%0.788SS**  trans50128138.6-80.20000124.5
17K34.9Very low32.6Very low187 Ų187155.4 Ų155.481%0.81379%0.787SS**  trans76.5146.5141.4-66.5176.8-179.6-175.40118.4
18E29.3Very low32.2Very low148 Ų148155.7 Ų155.769%0.69279%0.786SS**  cis-178.7148.9-15.9-170179.5172.300104.1
19R31.8Very low32.1Very low218 Ų218161.5 Ų161.582%0.82379%0.794SS**  trans115.491.8156.3-60.5177.6-178.5-163.8-1.7118.1
20E26.2Very low31.9Very low177 Ų177156.9 Ų156.983%0.82779%0.789SS**  trans-53.5137.6140.8-86.2170118.600111.5
21C32.1Very low31.9Very low131 Ų131150.7 Ų150.789%0.88578%0.781SS**  trans-128.7100.3155.2-99.30000109.1
22V28.6Very low31.7Very low112 Ų112154.1 Ų154.168%0.67979%0.785SS**  trans-64.3128.2161.5173.20000108.7N24V22-N24 HydrophobicContact CG1-CB 4.3Å
23L32.8Very low31.7Very low164 Ų164154.8 Ų154.886%0.85979%0.786SS**  trans-131.379.6159-140.699.2000110.4
24N26.4Very low31.3Very low139 Ų139154.3 Ų154.374%0.74379%0.794SS**  trans-91.3109.3163.1-154.23.1000106.6V22V22-N24 HydrophobicContact CG1-CB 4.3Å
25R31.7Very low31.2Very low182 Ų182152.3 Ų152.369%0.68779%0.793SS**  trans-128.397.9172.6-124.4-176.5-155.2-163.29.9110.5Y27R25-Y27 HydrophobicContact CB-CE2 4.47Å; R25-Y27 HydrophobicContact CG-CE2 4.3Å; R25-Y27 PolarHBondContact NH1-OH 3.15Å
26R26.6Very low31.2Very low228 Ų228154.9 Ų154.986%0.8679%0.794SS**  trans-66.5137.5159-70.4178-177.6175.1-0.1109.1
27Y33.7Very low31Very low177 Ų177155.9 Ų155.969%0.69480%0.799SS**  trans-120.2142.7157.9-79.3-81.3000109.6R25R25-Y27 HydrophobicContact CB-CE2 4.47Å; R25-Y27 HydrophobicContact CG-CE2 4.3Å; R25-Y27 PolarHBondContact NH1-OH 3.15Å
28P32.3Very low30.9Very low122 Ų122152 Ų15279%0.79280%0.796SS**  trans-90.3164.4-164.836.5-35.8000114.7
29H29.5Very low31Very low193 Ų193150.1 Ų150.189%0.89481%0.806SS**  trans-40.4142.2175.1-85.1-74.9000118.1
30S35.4Very low31.2Very low124 Ų124145 Ų14587%0.86780%0.803SS**  -162.8144.3124.5600000110.9
31G33Very low31.4Very low69 Ų69142.5 Ų142.571%0.71181%0.805SS**  trans115.169.2154.800000120
32H34.8Very low31.7Very low179 Ų179141 Ų14183%0.82980%0.796SS**  42.1110.1129.6-94.9-74.7000121.5
33K34.4Very low31.9Very low190 Ų190143.5 Ų143.583%0.82681%0.805SS**  160.7117.3108.4-86.9169.8-173.4-177.10110.2
34G28.2Very low32Very low74 Ų74147.9 Ų147.976%0.76381%0.81SS**  trans-80.3153.3179.600000113.1
35F30.5Very low32.4Very low204 Ų204148.6 Ų148.690%0.89581%0.814SS**  trans-130.8116.3160.3-98.1-88.1000108.6
36T31.3Very low32.7Very low127 Ų127148.7 Ų148.778%0.77982%0.819SS**  trans-93.6126.6166.547.60000108.2
37C28.8Very low33.2Very low129 Ų129144.6 Ų144.687%0.87282%0.815SS**  trans-98.1107.2168.8-68.60000109.1
38S32.8Very low33.4Very low106 Ų106141.4 Ų141.474%0.74182%0.818SS**  trans-86.7126.1168.5-40.20000108.6
39A31.2Very low34Very low108 Ų108141.5 Ų141.589%0.89382%0.816SS**  trans-74124170.900000110.1
40S34.5Very low34.5Very low110 Ų110138.2 Ų138.277%0.76982%0.815SS**  trans-141.9124.2159.647.90000109.9
41S31.6Very low35.1Very low124 Ų124138.7 Ų138.787%0.86781%0.812SS**  trans-58.1130.3176.7500000112.4
42S38Very low36Very low101 Ų101138.8 Ų138.871%0.70680%0.802SS**  trans-154148.4151.156.30000111.2
43L32.9Very low36.9Very low163 Ų163134.7 Ų134.785%0.85381%0.809SS**  trans-45.9134.5-172.3-78.969.4000114.1N45L43-N45 PolarHBondContact O-N 2.97Å; L43-N45 VanDerWaalsContact O-N 3.15Å
44W33.8Very low38.2Very low256 Ų256132 Ų13297%0.9780%0.802SS**  trans-84.492169.4-73.247.8000108.6
45N35.6Very low40.1Very low155 Ų155133.4 Ų133.483%0.82979%0.789SS**  trans-67.9140.7163.8-117.1-12.7000109.4L43L43-N45 PolarHBondContact O-N 2.97Å; L43-N45 VanDerWaalsContact O-N 3.15Å
46K37.6Very low42.3Very low183 Ų183129.4 Ų129.480%0.79677%0.773SS**SBendtrans-71.6142176.9-162.3169.3174.91760109
47D37.3Very low44Very low143 Ų143129.6 Ų129.677%0.76577%0.768SS**  trans82.189172.7-48.8-33.6000117.9
48S39.1Very low45.9Very low110 Ų110133 Ų13377%0.76976%0.762SS**  trans-171.3116.1144.158.80000112.6
49V44.5Very low47.6Very low124 Ų124134 Ų13475%0.75276%0.755SS**  trans53.999.9149-163.90000117.6V51V49-V51 HydrophobicContact CG1-CG2 3.81Å; V49-V51 PolarHBondContact O-N 3.29Å
50S40.3Very low49.3Very low123 Ų123135 Ų13586%0.8674%0.736SS**  trans-73.389.8166.8-1570000109.9S52S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 2.86Å
51V46.4Very low50.7Low134 Ų134136 Ų13681%0.81273%0.729SS**  trans-74.787.6171-179.20000108.9V49V49-V51 HydrophobicContact CG1-CG2 3.81Å; V49-V51 PolarHBondContact O-N 3.29Å
52S51.9Low52Low72 Ų72137.3 Ų137.350%0.50372%0.72SS.*  trans-160105.8152.1178.20000105.6S50 L54S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 2.86Å; S52-L54 PolarHBondContact O-N 3.2Å
53G54.6Low53Low93 Ų93139.7 Ų139.796%0.95973%0.725SS**  trans-66.926.4-178.700000114.6Q55G53-Q55 PolarHBondContact O-N 2.83Å
54L61.2Low54.2Low133 Ų133136.2 Ų136.270%0.69671%0.708SS**  trans-78.199.6168-71.9172.4000107.8S52 H56S52-L54 PolarHBondContact O-N 3.2Å; L54-H56 PolarHBondContact O-N 3.05Å
55Q68.5Low55.3Low103 Ų103129 Ų12948%0.48169%0.692SS.*  trans-42.6132.7169.7-167.9167.718.300110G53 E59 R60G53-Q55 PolarHBondContact O-N 2.83Å; Q55-E59 HydrophobicContact CG-CB 3.58Å; Q55-E59 PolarHBondContact NE2-O 3.08Å; Q55-R60 HydrophobicContact CB-CG 4.3Å; Q55-R60 HydrophobicContact CG-CG 3.98Å; Q55-R60 PolarHBondContact O-NH1 3Å; Q55-R60 PolarHBondContact O-NH2 3.01Å
56H76.5Confident56.4Low121 Ų121130.8 Ų130.856%0.5670%0.695SS**  trans-65.4147.6177.5-173.5-97.3000108.8L54 R58 E59 R60L54-H56 PolarHBondContact O-N 3.05Å; H56-R58 VanDerWaalsContact ND1-CB 3.29Å; H56-R58 WeakPolarHBondContact ND1-CB 3.27Å; H56-R58 PolarHBondContact ND1-N 3.43Å; H56-R58 PolarHBondContact O-N 2.8Å; H56-E59 HydrophobicContact CB-CG 4.03Å; H56-E59 PolarHBondContact N-OE2 2.88Å; H56-E59 WeakPolarHBondContact O-CA 3.39Å; H56-E59 WeakPolarHBondContact O-CB 3.45Å; H56-E59 PolarHBondContact O-N 2.78Å; H56-R60 PolarHBondContact O-N 2.99Å
57I66.4Low57.6Low131 Ų131129.6 Ų129.667%0.67269%0.692SS**G310 helixtrans-56.7-37.4-176.6-68.4169.2000111.4E59 R60I57-E59 PolarHBondContact O-N 3.06Å; I57-R60 PolarHBondContact O-N 3.26Å; I57-R60 VanDerWaalsContact O-N 3.12Å
58R69.4Low58.8Low201 Ų201125.7 Ų125.776%0.75867%0.671SS**G310 helixtrans-60.8-23.3174-164.3-178.7-177.9176.31.6114.1H56H56-R58 VanDerWaalsContact ND1-CB 3.29Å; H56-R58 WeakPolarHBondContact ND1-CB 3.27Å; H56-R58 PolarHBondContact ND1-N 3.43Å; H56-R58 PolarHBondContact O-N 2.8Å
59E68.1Low59.9Low125 Ų125123.5 Ų123.558%0.58465%0.654SS**G310 helixtrans-93.5-7.7-179.5-63166-17800112.3Q55 H56 I57Q55-E59 HydrophobicContact CG-CB 3.58Å; Q55-E59 PolarHBondContact NE2-O 3.08Å; H56-E59 HydrophobicContact CB-CG 4.03Å; H56-E59 PolarHBondContact N-OE2 2.88Å; H56-E59 WeakPolarHBondContact O-CA 3.39Å; H56-E59 WeakPolarHBondContact O-CB 3.45Å; H56-E59 PolarHBondContact O-N 2.78Å; I57-E59 PolarHBondContact O-N 3.06Å
60R66.5Low61Low130 Ų130122 Ų12249%0.49165%0.65SS.*SBendtrans-85.8-10.1175.8-70.5-171.4-177.476.58.8113.3Q55 H56 I57 H62Q55-R60 HydrophobicContact CB-CG 4.3Å; Q55-R60 HydrophobicContact CG-CG 3.98Å; Q55-R60 PolarHBondContact O-NH1 3Å; Q55-R60 PolarHBondContact O-NH2 3.01Å; H56-R60 PolarHBondContact O-N 2.99Å; I57-R60 PolarHBondContact O-N 3.26Å; I57-R60 VanDerWaalsContact O-N 3.12Å; R60-H62 PolarHBondContact O-N 2.86Å
61E63.9Low62.3Low132 Ų132119.6 Ų119.662%0.61763%0.63SS**SBendtrans-71.1125.4178.8-69.9176.8173.900108.8
62H59.4Low63.2Low150 Ų150116.2 Ų116.269%0.69461%0.607SS**  trans-68.3137.6174.7-156.8-82.8000108.1R60 D64R60-H62 PolarHBondContact O-N 2.86Å; H62-D64 IonicContact CE1-OD1 3.03Å; H62-D64 IonicContact CE1-OD2 3.55Å; H62-D64 PolarHBondContact CE1-OD2 3.22Å; H62-D64 IonicContact CG-OD2 2.7Å; H62-D64 IonicContact ND1-OD1 3.84Å; H62-D64 IonicContact ND1-OD2 3.48Å; H62-D64 PolarHBondContact ND1-OD2 2.6Å; H62-D64 PolarHBondContact O-N 3.25Å
63D59.3Low63.9Low151 Ų151119.3 Ų119.381%0.80763%0.625SS**SBendtrans-64.313.6177.1-74.3-49.9000113.9V65D63-V65 VanDerWaalsContact O-CG2 3.27Å; D63-V65 WeakPolarHBondContact O-CG2 3.3Å; D63-V65 PolarHBondContact O-N 2.93Å
64D57.1Low64.9Low91 Ų91126.3 Ų126.349%0.48762%0.623SS.*  trans-78.768.7173.2-72.1-25.6000110.1H62 E66 Q67H62-D64 IonicContact CE1-OD1 3.03Å; H62-D64 IonicContact CE1-OD2 3.55Å; H62-D64 PolarHBondContact CE1-OD2 3.22Å; H62-D64 IonicContact CG-OD2 2.7Å; H62-D64 IonicContact ND1-OD1 3.84Å; H62-D64 IonicContact ND1-OD2 3.48Å; H62-D64 PolarHBondContact ND1-OD2 2.6Å; H62-D64 PolarHBondContact O-N 3.25Å; D64-E66 PolarHBondContact O-N 3.13Å; D64-Q67 PolarHBondContact O-N 3.17Å
65V56.9Low65.1Low104 Ų104125.2 Ų125.263%0.6361%0.613SS**THydrogen-bonded Turntrans-58.8-15-179.9-154.10000112.4D63 T71D63-V65 VanDerWaalsContact O-CG2 3.27Å; D63-V65 WeakPolarHBondContact O-CG2 3.3Å; D63-V65 PolarHBondContact O-N 2.93Å; V65-T71 PolarHBondContact O-OG1 2.82Å
66E59.9Low65Low192 Ų192122.9 Ų122.990%0.89762%0.616SS**THydrogen-bonded Turntrans-92-15.9-174-145.9167-164.400114.2D64D64-E66 PolarHBondContact O-N 3.13Å
67Q62.1Low64.3Low158 Ų158119.8 Ų119.874%0.73861%0.607SS**THydrogen-bonded Turntrans-103.5-18.7179.4-86.2-176.719.900115.1D64 P69D64-Q67 PolarHBondContact O-N 3.17Å; Q67-P69 WeakPolarHBondContact O-CD 3.42Å
68D62.5Low64.1Low62 Ų62121 Ų12133%0.33261%0.613SS.*  trans-72.6114-177.1-172.20.1000111.7S70 T71D68-S70 PolarHBondContact O-N 3.38Å; D68-S70 VanDerWaalsContact O-N 3.13Å; D68-S70 WeakPolarHBondContact OD1-CB 3.29Å; D68-S70 PolarHBondContact OD1-N 3.12Å; D68-S70 PolarHBondContact OD1-OG 3.39Å; D68-S70 PolarHBondContact OD2-OG 3.37Å; D68-T71 HydrophobicContact CB-CG2 4.17Å; D68-T71 PolarHBondContact O-N 2.69Å; D68-T71 PolarHBondContact O-OG1 2.89Å
69P63.3Low63.7Low63 Ų63118.5 Ų118.541%0.40961%0.608SS.*THydrogen-bonded Turntrans-62.1-16.5173.427.3-34.6000113.4Q67 K75Q67-P69 WeakPolarHBondContact O-CD 3.42Å; P69-K75 HydrophobicContact CB-CB 4.41Å; P69-K75 HydrophobicContact CB-CD 3.86Å
70S66.6Low63.2Low93 Ų93118 Ų11865%0.6561%0.607SS**THydrogen-bonded Turntrans-74.3-23.1177.896.60000113.9D68D68-S70 PolarHBondContact O-N 3.38Å; D68-S70 VanDerWaalsContact O-N 3.13Å; D68-S70 WeakPolarHBondContact OD1-CB 3.29Å; D68-S70 PolarHBondContact OD1-N 3.12Å; D68-S70 PolarHBondContact OD1-OG 3.39Å; D68-S70 PolarHBondContact OD2-OG 3.37Å
71T67.8Low62.7Low73 Ų73120.4 Ų120.445%0.44862%0.624SS.*THydrogen-bonded Turntrans-89.9-10.6179.160.10000113.3V65 D68 P73V65-T71 PolarHBondContact O-OG1 2.82Å; D68-T71 HydrophobicContact CB-CG2 4.17Å; D68-T71 PolarHBondContact O-N 2.69Å; D68-T71 PolarHBondContact O-OG1 2.89Å; T71-P73 VanDerWaalsContact O-CD 3.3Å; T71-P73 WeakPolarHBondContact O-CD 3.21Å
72N66.3Low62.2Low63 Ų63125 Ų12534%0.33764%0.635SS.*  trans-96.2106.8179.7-172.1-26.6000110.8R74 K75N72-R74 PolarHBondContact O-N 2.79Å; N72-R74 WeakPolarHBondContact OD1-CB 3.18Å; N72-R74 PolarHBondContact OD1-N 3.36Å; N72-K75 HydrophobicContact CB-CB 4.03Å; N72-K75 HydrophobicContact CB-CD 4.01Å; N72-K75 HydrophobicContact CB-CG 3.87Å; N72-K75 PolarHBondContact O-N 3.21Å
73P66.3Low62.1Low136 Ų136119.5 Ų119.588%0.88361%0.614SS**THydrogen-bonded Turntrans-64.4-13.5-177.525.4-34.1000114.1T71T71-P73 VanDerWaalsContact O-CD 3.3Å; T71-P73 WeakPolarHBondContact O-CD 3.21Å
74R74.9Confident61.7Low240 Ų240119.4 Ų119.491%0.90661%0.608SS**THydrogen-bonded Turntrans-88.1-15.3171.9-71.7-176.1170.1-150.6-1.3113.4N72 G76N72-R74 PolarHBondContact O-N 2.79Å; N72-R74 WeakPolarHBondContact OD1-CB 3.18Å; N72-R74 PolarHBondContact OD1-N 3.36Å; R74-G76 PolarHBondContact O-N 2.79Å
75K65.5Low61.6Low111 Ų111119.8 Ų119.848%0.48362%0.619SS.*  trans-86103.8176.7-73.3-170.7175.8-179.10108.8P69 N72P69-K75 HydrophobicContact CB-CB 4.41Å; P69-K75 HydrophobicContact CB-CD 3.86Å; N72-K75 HydrophobicContact CB-CB 4.03Å; N72-K75 HydrophobicContact CB-CD 4.01Å; N72-K75 HydrophobicContact CB-CG 3.87Å; N72-K75 PolarHBondContact O-N 3.21Å
76G66.1Low61.5Low54 Ų54119.8 Ų119.856%0.55761%0.612SS**  trans-65.2156.6169.800000111.4R74 I78R74-G76 PolarHBondContact O-N 2.79Å; G76-I78 PolarHBondContact O-N 3.14Å
77P61.2Low61.1Low55 Ų55116.2 Ų116.236%0.35760%0.596SS.*  trans-61.3135.4175.522-31.5000112.1F79 M80P77-F79 HydrophobicContact CB-CD1 3.45Å; P77-F79 VanDerWaalsContact CB-CD1 3.45Å; P77-F79 HydrophobicContact CB-CD2 4.39Å; P77-F79 HydrophobicContact CB-CE1 3.13Å; P77-F79 HydrophobicContact CB-CE2 4.13Å; P77-F79 HydrophobicContact CB-CG 4.08Å; P77-F79 HydrophobicContact CB-CZ 3.5Å; P77-F79 VanDerWaalsContact CB-CZ 3.5Å; P77-F79 HydrophobicContact CG-CD1 4.44Å; P77-F79 HydrophobicContact CG-CE1 3.9Å; P77-F79 HydrophobicContact CG-CE2 4.13Å; P77-F79 HydrophobicContact CG-CZ 3.7Å; P77-F79 PolarHBondContact O-N 3.08Å; P77-F79 VanDerWaalsContact O-N 3.08Å; P77-M80 HydrophobicContact CG-CB 4.43Å; P77-M80 HydrophobicContact CG-CE 3.5Å; P77-M80 HydrophobicContact CG-CG 4.32Å; P77-M80 PolarHBondContact O-N 3.48Å; P77-M80 VanDerWaalsContact O-N 3.14Å
78I63.1Low60.7Low157 Ų157117.6 Ų117.681%0.80560%0.6SS**THydrogen-bonded Turntrans-59.5-24.2178.6-53.7168000111.6G76 M80G76-I78 PolarHBondContact O-N 3.14Å; I78-M80 VanDerWaalsContact C-N 3.32Å; I78-M80 PolarHBondContact O-N 2.87Å
79F61.6Low60.5Low148 Ų148120.7 Ų120.765%0.64962%0.616SS**THydrogen-bonded Turntrans-77.1-12.2-178.366.5-103.8000114.4P77 E81 S83P77-F79 HydrophobicContact CB-CD1 3.45Å; P77-F79 VanDerWaalsContact CB-CD1 3.45Å; P77-F79 HydrophobicContact CB-CD2 4.39Å; P77-F79 HydrophobicContact CB-CE1 3.13Å; P77-F79 HydrophobicContact CB-CE2 4.13Å; P77-F79 HydrophobicContact CB-CG 4.08Å; P77-F79 HydrophobicContact CB-CZ 3.5Å; P77-F79 VanDerWaalsContact CB-CZ 3.5Å; P77-F79 HydrophobicContact CG-CD1 4.44Å; P77-F79 HydrophobicContact CG-CE1 3.9Å; P77-F79 HydrophobicContact CG-CE2 4.13Å; P77-F79 HydrophobicContact CG-CZ 3.7Å; P77-F79 PolarHBondContact O-N 3.08Å; P77-F79 VanDerWaalsContact O-N 3.08Å; F79-E81 PolarHBondContact O-N 3.43Å; F79-S83 PolarHBondContact O-OG 3.06Å
80M56.1Low59.9Low115 Ų115125.4 Ų125.457%0.56763%0.625SS**THydrogen-bonded Turntrans-68.3-33.4-175.1-113.9-162.8-82.100112.8P77 I78 R82 S83P77-M80 HydrophobicContact CG-CB 4.43Å; P77-M80 HydrophobicContact CG-CE 3.5Å; P77-M80 HydrophobicContact CG-CG 4.32Å; P77-M80 PolarHBondContact O-N 3.48Å; P77-M80 VanDerWaalsContact O-N 3.14Å; I78-M80 VanDerWaalsContact C-N 3.32Å; I78-M80 PolarHBondContact O-N 2.87Å; M80-R82 PolarHBondContact O-N 2.84Å; M80-S83 WeakPolarHBondContact O-CB 3.41Å; M80-S83 PolarHBondContact O-N 3.3Å; M80-S83 VanDerWaalsContact O-N 3.12Å
81E57.2Low59.1Low181 Ų181130.1 Ų130.185%0.84664%0.637SS**THydrogen-bonded Turntrans-73.7-25.6-172.1-159170-165.600114F79F79-E81 PolarHBondContact O-N 3.43Å
82R53.9Low58.3Low227 Ų227134.3 Ų134.386%0.85766%0.657SS**THydrogen-bonded Turntrans-84.6-11.6171.2-94.2-169.8176.9114.7-0.6114M80 E84M80-R82 PolarHBondContact O-N 2.84Å; R82-E84 PolarHBondContact O-N 3.43Å
83S55.7Low57.8Low35 Ų35140 Ų14025%0.24567%0.673CS.*Hα-helixtrans-81.3-14.3-169.8-62.30000114F79 M80 S85 E86 M87F79-S83 PolarHBondContact O-OG 3.06Å; M80-S83 WeakPolarHBondContact O-CB 3.41Å; M80-S83 PolarHBondContact O-N 3.3Å; M80-S83 VanDerWaalsContact O-N 3.12Å; S83-S85 PolarHBondContact O-N 3.12Å; S83-E86 PolarHBondContact O-N 3.4Å; S83-M87 WeakPolarHBondContact O-CB 3.47Å; S83-M87 PolarHBondContact O-N 3.22Å
84E51.5Low56.8Low149 Ų149143.5 Ų143.570%0.69667%0.669SS**Hα-helixtrans-70-31.7-174.6-64.1-163.215900113.5R82 M87R82-E84 PolarHBondContact O-N 3.43Å; E84-M87 WeakPolarHBondContact O-CG 3.29Å
85S55.4Low55.6Low100 Ų100136.1 Ų136.170%0.69965%0.654SS**Hα-helixtrans-80.3-30.1175.856.70000112.6S83S83-S85 PolarHBondContact O-N 3.12Å
86E54.2Low54.6Low104 Ų104134.3 Ų134.349%0.48666%0.655SS.*Hα-helixtrans-82.2-21.6178.2-150.3179.2150.200112.5S83 K88 L89 R93S83-E86 PolarHBondContact O-N 3.4Å; E86-K88 PolarHBondContact O-N 3.02Å; E86-L89 PolarHBondContact O-N 2.76Å; E86-R93 IonicContact OE1-NH1 3.28Å; E86-R93 PolarHBondContact OE1-NH1 2.83Å
87M52.8Low53.7Low116 Ų116137.9 Ų137.957%0.57165%0.653SS**G310 helixtrans-66.4-23.7178.986167.4-167.900113.9S83 E84 L89 R90S83-M87 WeakPolarHBondContact O-CB 3.47Å; S83-M87 PolarHBondContact O-N 3.22Å; E84-M87 WeakPolarHBondContact O-CG 3.29Å; M87-L89 PolarHBondContact O-N 2.85Å; M87-R90 VanDerWaalsContact O-CB 3.29Å; M87-R90 WeakPolarHBondContact O-CB 3.43Å; M87-R90 PolarHBondContact O-N 2.98Å; M87-R90 VanDerWaalsContact O-N 3.1Å
88K52.4Low53Low188 Ų188144.3 Ų144.382%0.81768%0.675SS**G310 helixtrans-68-15.8176.2-75.5-176.7177.6175.10113.4E86E86-K88 PolarHBondContact O-N 3.02Å
89L58Low52Low127 Ų127143.2 Ų143.267%0.66568%0.675SS**G310 helixtrans-93-2.7174.1-74.7163.1000113.2E86 M87 E91E86-L89 PolarHBondContact O-N 2.76Å; M87-L89 PolarHBondContact O-N 2.85Å; L89-E91 PolarHBondContact O-N 3.49Å
90R51.1Low51.2Low161 Ų161142.8 Ų142.861%0.60868%0.68SS**G310 helixtrans-76.9-13.1-161.8-84.8-174.8161.3-162.1-8.2117.1M87 N92 R93M87-R90 VanDerWaalsContact O-CB 3.29Å; M87-R90 WeakPolarHBondContact O-CB 3.43Å; M87-R90 PolarHBondContact O-N 2.98Å; M87-R90 VanDerWaalsContact O-N 3.1Å; R90-N92 VanDerWaalsContact C-N 3.29Å; R90-N92 PolarHBondContact O-N 3.3Å; R90-R93 PolarHBondContact O-N 2.95Å
91E49.2Very low50.5Low192 Ų192139.8 Ų139.890%0.89768%0.679SS**G310 helixtrans-68.2-29.1-177.1-109.6171.4177.800113.2L89L89-E91 PolarHBondContact O-N 3.49Å
92N52Low49.9Very low161 Ų161139.1 Ų139.186%0.86168%0.675SS**G310 helixtrans-92.8-5.3-179.5-100.82.5000115.5R90R90-N92 VanDerWaalsContact C-N 3.29Å; R90-N92 PolarHBondContact O-N 3.3Å
93R56.2Low49.3Very low182 Ų182136.4 Ų136.469%0.68768%0.677SS**G310 helixtrans-92.73.5-177.9-92-175.2174.9171.1-1.4114.5E86 R90 S95E86-R93 IonicContact OE1-NH1 3.28Å; E86-R93 PolarHBondContact OE1-NH1 2.83Å; R90-R93 PolarHBondContact O-N 2.95Å; R93-S95 PolarHBondContact O-N 3.46Å
94R45.3Very low48.6Very low210 Ų210146.2 Ų146.279%0.79271%0.709SS**SBendtrans-77.1104168.6-72.9-173.3174.7-165.4-0.5109.3C96R94-C96 VanDerWaalsContact C-N 3.27Å; R94-C96 PolarHBondContact O-N 3.4Å; R94-C96 PolarHBondContact O-SG 3.3Å
95S49.8Very low47.9Very low85 Ų85151.1 Ų151.159%0.59472%0.721SS**  trans-50.688.3164.7171.80000110.7R93R93-S95 PolarHBondContact O-N 3.46Å
96C44.7Very low47.1Very low74 Ų74150.8 Ų150.850%0.572%0.719SS.*  trans-117.782.1169-42.90000106.3R94 F98R94-C96 VanDerWaalsContact C-N 3.27Å; R94-C96 PolarHBondContact O-N 3.4Å; R94-C96 PolarHBondContact O-SG 3.3Å; C96-F98 VanDerWaalsContact C-N 3.33Å; C96-F98 HydrophobicContact CB-CD2 4.33Å; C96-F98 HydrophobicContact CB-CE2 4.1Å; C96-F98 PolarHBondContact O-N 2.81Å
97Y47Very low46.5Very low129 Ų129155.3 Ų155.351%0.50674%0.74SS.*  trans-69.999.5163.6-67.6-80.3000107.3V99 R115Y97-V99 PolarHBondContact O-N 3.01Å; Y97-R115 PolarHBondContact O-NH1 2.89Å
98F45.8Very low45.9Very low189 Ų189154.1 Ų154.183%0.82974%0.739SS**  trans-68106.8158.9-75.6-88.8000106.6C96 D100C96-F98 VanDerWaalsContact C-N 3.33Å; C96-F98 HydrophobicContact CB-CD2 4.33Å; C96-F98 HydrophobicContact CB-CE2 4.1Å; C96-F98 PolarHBondContact O-N 2.81Å; F98-D100 PolarHBondContact O-N 3.34Å
99V43.2Very low45.3Very low134 Ų134151 Ų15181%0.81274%0.738SS**  trans-69.2111.2158.9178.80000104.7Y97 G101Y97-V99 PolarHBondContact O-N 3.01Å; V99-G101 PolarHBondContact O-N 3.44Å
100D43.8Very low44.5Very low140 Ų140149.9 Ų149.975%0.74974%0.737SS**  trans-60.682.9171.3-171.219.8000108.5F98 Q102F98-D100 PolarHBondContact O-N 3.34Å; D100-Q102 PolarHBondContact O-N 3.3Å
101G42.4Very low44.2Very low52 Ų52151.8 Ų151.854%0.53675%0.75SS.*  trans-80.792.4165.400000106.5V99 L103V99-G101 PolarHBondContact O-N 3.44Å; G101-L103 PolarHBondContact O-N 2.77Å
102Q43.6Very low44.2Very low166 Ų166149.7 Ų149.778%0.77674%0.744SS**  trans-51.6106.8169.1-75.4-139.9-28.100108.8D100 R104D100-Q102 PolarHBondContact O-N 3.3Å; Q102-R104 VanDerWaalsContact C-N 3.28Å; Q102-R104 PolarHBondContact O-N 2.96Å
103L42.3Very low44.2Very low170 Ų170147.8 Ų147.889%0.8974%0.741SS**  trans-59.289.6173.9-123.387.7000108.1G101 R105G101-L103 PolarHBondContact O-N 2.77Å; L103-R105 PolarHBondContact O-N 3.27Å
104R40.2Very low44.1Very low242 Ų242147 Ų14791%0.91375%0.749SS**  trans-70.890.5152.9-81.9-151.6172.9-146.60.8107.5Q102 S106Q102-R104 VanDerWaalsContact C-N 3.28Å; Q102-R104 PolarHBondContact O-N 2.96Å; R104-S106 PolarHBondContact O-N 3.1Å
105R37.2Very low44.9Very low251 Ų251143.3 Ų143.395%0.94774%0.735SS**  trans-686.6145.8-149.2175.7-163.7168.62.8112.9L103L103-R105 PolarHBondContact O-N 3.27Å
106S38.5Very low45.3Very low94 Ų94146.2 Ų146.266%0.65774%0.737SS**  trans-147.3128160.7-174.50000107.8R104 T108R104-S106 PolarHBondContact O-N 3.1Å; S106-T108 PolarHBondContact O-N 3.24Å
107Q40.9Very low46.1Very low199 Ų199151.4 Ų151.493%0.9375%0.748SS**  trans-74.285.6-175.9-63.8168.318.500109.1
108T41.3Very low46.9Very low90 Ų90149.6 Ų149.655%0.55275%0.747SS**  trans-142.9138.3159.552.30000108.5S106 T110S106-T108 PolarHBondContact O-N 3.24Å; T108-T110 PolarHBondContact O-N 3.17Å
109P38.4Very low48Very low122 Ų122145.7 Ų145.779%0.79274%0.743SS**  trans-7383.5175.830.4-31.2000108F111P109-F111 PolarHBondContact O-N 2.95Å
110T41.8Very low48.6Very low105 Ų105144.3 Ų144.364%0.64474%0.738SS**  trans-74107.7167.527.60000107.7T108 L112T108-T110 PolarHBondContact O-N 3.17Å; T110-L112 VanDerWaalsContact C-N 3.34Å; T110-L112 PolarHBondContact O-N 3.19Å
111F45.1Very low49.9Very low200 Ų200144 Ų14488%0.87775%0.746SS**  trans-49.599.8163.9-75.5-96.4000108.4P109P109-F111 PolarHBondContact O-N 2.95Å
112L49.1Very low51.1Low148 Ų148145.5 Ų145.578%0.77575%0.745SS**  trans-66.7124.5170.6-64.2179.1000106.7T110 L114T110-L112 VanDerWaalsContact C-N 3.34Å; T110-L112 PolarHBondContact O-N 3.19Å; L112-L114 PolarHBondContact O-N 3.47Å
113P51.7Low52.5Low122 Ų122143.1 Ų143.179%0.79274%0.737SS**  trans-59.3117.7179.121.8-29.8000108.6R115P113-R115 PolarHBondContact O-N 2.92Å
114L55Low53.7Low166 Ų166139.6 Ų139.687%0.86971%0.714SS**  trans-53.8109.8172-78.9152.4000107.9L112 K116L112-L114 PolarHBondContact O-N 3.47Å; L114-K116 PolarHBondContact O-N 3.12Å
115R61.6Low55Low131 Ų131133.9 Ų133.949%0.49470%0.701SS.*  trans-62110.6176.4-172.5176.4-176.6168.54.9108.2Y97 P113Y97-R115 PolarHBondContact O-NH1 2.89Å; P113-R115 PolarHBondContact O-N 2.92Å
116K57Low56.5Low147 Ų147126.1 Ų126.164%0.63968%0.679SS**  trans-76.2137.8176.1-70179178.5179.60109.6L114 F124L114-K116 PolarHBondContact O-N 3.12Å; K116-F124 HydrophobicContact CB-CD2 3.82Å; K116-F124 HydrophobicContact CB-CE2 3.55Å; K116-F124 HydrophobicContact CB-CZ 4.08Å; K116-F124 HydrophobicContact CD-CE1 4.14Å; K116-F124 HydrophobicContact CD-CE2 3.67Å; K116-F124 HydrophobicContact CD-CZ 3.38Å; K116-F124 HydrophobicContact CG-CE2 4.25Å; K116-F124 HydrophobicContact CG-CZ 4.35Å
117Y61.4Low58Low183 Ų183128.2 Ų128.272%0.71868%0.683SS**  trans-87.6145.3177.6-59.1-84.8000110.2S119Y117-S119 PolarHBondContact O-N 2.92Å
118N65.7Low59.1Low91 Ų91121 Ų12149%0.48765%0.654SS.*SBendtrans-7539.2-179.6-72.1-20.4000113.6F124N118-F124 PolarHBondContact ND2-O 2.91Å; N118-F124 PolarHBondContact OD1-N 2.87Å
119S67Low60.6Low107 Ų107118.3 Ų118.375%0.74864%0.638SS**  trans-911.4-175.4-57.90000114.4Y117Y117-S119 PolarHBondContact O-N 2.92Å
120C57.4Low62.1Low105 Ų105121 Ų12171%0.70964%0.643SS**SBendtrans-134.9172178.6-67.40000110.7T122C120-T122 CarbonylContact O-C 3.53Å; C120-T122 PolarHBondContact O-N 3.3Å
121S70.4Confident63.7Low132 Ų132120.6 Ų120.692%0.92365%0.645SS**SBendtrans-51.9-7.4-17353.60000117.8
122T68.6Low65.2Low84 Ų84116.8 Ų116.852%0.51563%0.63SS.*  trans-103.1112.9171.5-50.90000109.6C120 F124C120-T122 CarbonylContact O-C 3.53Å; C120-T122 PolarHBondContact O-N 3.3Å; T122-F124 HydrophobicContact CG2-CE2 4.26Å; T122-F124 HydrophobicContact CG2-CZ 4.15Å
123I73.1Confident66.8Low117 Ų117111.5 Ų111.560%0.660%0.604SS**  trans-83.1115169.1-170.3169.7000108.9L125I123-L125 HydrophobicContact CD1-CD2 3.92Å; I123-L125 HydrophobicContact CG1-CD2 4.03Å; I123-L125 HydrophobicContact CG2-CD2 4.41Å; I123-L125 HydrophobicContact CG2-CG 4.49Å; I123-L125 PolarHBondContact O-N 2.76Å
124F66.8Low68.4Low96 Ų96110 Ų11042%0.42159%0.587SS.*  trans-78.4107.6166.3-65.7-83.9000107.1K116 N118 T122K116-F124 HydrophobicContact CB-CD2 3.82Å; K116-F124 HydrophobicContact CB-CE2 3.55Å; K116-F124 HydrophobicContact CB-CZ 4.08Å; K116-F124 HydrophobicContact CD-CE1 4.14Å; K116-F124 HydrophobicContact CD-CE2 3.67Å; K116-F124 HydrophobicContact CD-CZ 3.38Å; K116-F124 HydrophobicContact CG-CE2 4.25Å; K116-F124 HydrophobicContact CG-CZ 4.35Å; N118-F124 PolarHBondContact ND2-O 2.91Å; N118-F124 PolarHBondContact OD1-N 2.87Å; T122-F124 HydrophobicContact CG2-CE2 4.26Å; T122-F124 HydrophobicContact CG2-CZ 4.15Å
125L68Low70.2Confident122 Ų122105.4 Ų105.464%0.63956%0.562SS**  trans-77.9122.7169.3-60.9176.4000107.2I123 T129I123-L125 HydrophobicContact CD1-CD2 3.92Å; I123-L125 HydrophobicContact CG1-CD2 4.03Å; I123-L125 HydrophobicContact CG2-CD2 4.41Å; I123-L125 HydrophobicContact CG2-CG 4.49Å; I123-L125 PolarHBondContact O-N 2.76Å; L125-T129 HydrophobicContact CB-CG2 4.16Å; L125-T129 HydrophobicContact CD1-CG2 4.24Å; L125-T129 HydrophobicContact CD2-CG2 4.42Å
126D68.1Low71.6Confident88 Ų88104.8 Ų104.847%0.47156%0.564SS.*  trans-76.4173.6158.764.89.9000108.7S128D126-S128 PolarHBondContact O-N 3.22Å; D126-S128 VanDerWaalsContact OD1-CA 3.29Å; D126-S128 WeakPolarHBondContact OD1-CA 3.21Å; D126-S128 WeakPolarHBondContact OD1-CB 3.4Å; D126-S128 PolarHBondContact OD1-N 3Å
127D69.2Low73.3Confident138 Ų13899.7 Ų99.774%0.73854%0.543SS*.SBendtrans-67.13.8176-58.3-31.9000112.6T129 Q132D127-T129 PolarHBondContact O-N 3.22Å; D127-Q132 WeakPolarHBondContact O-CB 3.29Å
128S64.9Low74.8Confident46 Ų4692 Ų9232%0.32252%0.515SS..  trans-99.455.9175.8-54.30000110.8D126D126-S128 PolarHBondContact O-N 3.22Å; D126-S128 VanDerWaalsContact OD1-CA 3.29Å; D126-S128 WeakPolarHBondContact OD1-CA 3.21Å; D126-S128 WeakPolarHBondContact OD1-CB 3.4Å; D126-S128 PolarHBondContact OD1-N 3Å
129T72.6Confident76.3Confident35 Ų3587.9 Ų87.922%0.21549%0.493CS..  trans-74.5165.7170.360.60000110.6L125 D127 S131 Q132L125-T129 HydrophobicContact CB-CG2 4.16Å; L125-T129 HydrophobicContact CD1-CG2 4.24Å; L125-T129 HydrophobicContact CD2-CG2 4.42Å; D127-T129 PolarHBondContact O-N 3.22Å; T129-S131 PolarHBondContact O-N 3.36Å; T129-S131 VanDerWaalsContact O-N 3.12Å; T129-S131 PolarHBondContact OG1-OG 3.39Å; T129-Q132 CarbonylContact O-C 3.21Å; T129-Q132 PolarHBondContact O-N 3.34Å; T129-Q132 PolarHBondContact OG1-N 3.08Å
130I70.6Confident77.6Confident177 Ų17787.2 Ų87.291%0.90848%0.477SS*.THydrogen-bonded Turntrans-53.2-31.6170.9-69.9173.8000111.6
131S75.1Confident79.4Confident98 Ų9885.4 Ų85.469%0.68547%0.465SS*.THydrogen-bonded Turntrans-82.1-12.4177.6530000114.7T129T129-S131 PolarHBondContact O-N 3.36Å; T129-S131 VanDerWaalsContact O-N 3.12Å; T129-S131 PolarHBondContact OG1-OG 3.39Å
132Q75.1Confident80.7Confident120 Ų12079.2 Ų79.256%0.56142%0.421SS*.SBendtrans-137.164.5-179.8-66.6-172.4-500110.4D127 T129 H134D127-Q132 WeakPolarHBondContact O-CB 3.29Å; T129-Q132 CarbonylContact O-C 3.21Å; T129-Q132 PolarHBondContact O-N 3.34Å; T129-Q132 PolarHBondContact OG1-N 3.08Å; Q132-H134 PolarHBondContact O-N 3.12Å
133P83.2Confident82.1Confident37 Ų3775.3 Ų75.324%0.2440%0.397CS..  trans-64128.2-177.927.2-35.4000111.5L135 A206 E207P133-L135 PolarHBondContact O-N 2.6Å; P133-L135 VanDerWaalsContact O-N 3.12Å; P133-A206 HydrophobicContact CB-CB 3.64Å; P133-A206 HydrophobicContact CG-CB 3.74Å; P133-E207 HydrophobicContact CG-CG 4.43Å; P133-E207 VanDerWaalsContact CG-OE1 3.32Å; P133-E207 WeakPolarHBondContact CG-OE1 3.24Å
134H86.6Confident83.2Confident90 Ų9073 Ų7342%0.41739%0.386SS..  trans-76.9103.1-178.5-167.2-36.4000111.7Q132 K136 N137 T138Q132-H134 PolarHBondContact O-N 3.12Å; H134-K136 VanDerWaalsContact CE1-CB 3.45Å; H134-K136 WeakPolarHBondContact CE1-CB 3.45Å; H134-K136 PolarHBondContact ND1-N 2.83Å; H134-K136 PolarHBondContact O-N 3.31Å; H134-N137 HydrophobicContact CB-CB 4.34Å; H134-N137 PolarHBondContact O-N 2.95Å; H134-T138 PolarHBondContact O-N 2.98Å; H134-T138 VanDerWaalsContact O-N 3.08Å; H134-T138 PolarHBondContact O-OG1 2.83Å
135L91.4Very high84.7Confident69 Ų6969.6 Ų69.636%0.36138%0.375SS..Hα-helixtrans-49-48.2-176.817760.3000114.4P133 N137 T138 V139 F199 A206P133-L135 PolarHBondContact O-N 2.6Å; P133-L135 VanDerWaalsContact O-N 3.12Å; L135-N137 VanDerWaalsContact C-N 3.27Å; L135-N137 PolarHBondContact O-N 3.21Å; L135-T138 WeakPolarHBondContact O-CB 3.32Å; L135-T138 PolarHBondContact O-N 3.28Å; L135-T138 VanDerWaalsContact O-N 3.15Å; L135-V139 HydrophobicContact CD1-CG2 3.94Å; L135-V139 HydrophobicContact CG-CG2 4.4Å; L135-V139 WeakPolarHBondContact O-CG2 3Å; L135-V139 PolarHBondContact O-N 3.14Å; L135-F199 HydrophobicContact CD1-CD1 3.8Å; L135-F199 HydrophobicContact CD1-CE1 4.3Å; L135-A206 HydrophobicContact CB-CB 4.43Å; L135-A206 HydrophobicContact CD1-CB 4.38Å
136K91.8Very high86Confident119 Ų11963.8 Ų63.852%0.51735%0.345SS..Hα-helixtrans-56.1-39.4178.5-170.6179.8-179.2178.70113.1H134 K140H134-K136 VanDerWaalsContact CE1-CB 3.45Å; H134-K136 WeakPolarHBondContact CE1-CB 3.45Å; H134-K136 PolarHBondContact ND1-N 2.83Å; H134-K136 PolarHBondContact O-N 3.31Å; K136-K140 WeakPolarHBondContact O-CG 3.44Å; K136-K140 PolarHBondContact O-N 3.27Å
137N92Very high87.4Confident40 Ų4062.8 Ų62.821%0.21434%0.335CS..Hα-helixtrans-73.6-41.8178.6-69.4-18.3000110.3H134 L135 V139 K140 C141H134-N137 HydrophobicContact CB-CB 4.34Å; H134-N137 PolarHBondContact O-N 2.95Å; L135-N137 VanDerWaalsContact C-N 3.27Å; L135-N137 PolarHBondContact O-N 3.21Å; N137-V139 PolarHBondContact O-N 3.17Å; N137-K140 WeakPolarHBondContact O-CB 3.39Å; N137-K140 PolarHBondContact O-N 2.86Å; N137-K140 VanDerWaalsContact O-N 3.12Å; N137-C141 PolarHBondContact O-N 2.9Å; N137-C141 PolarHBondContact O-SG 2.89Å
138T94.3Very high88.7Confident21 Ų2162.1 Ų62.113%0.12932%0.323CS..Hα-helixtrans-57.4-47.2174.9-56.10000112.2H134 L135 K140 C141 I142 A206 I210H134-T138 PolarHBondContact O-N 2.98Å; H134-T138 VanDerWaalsContact O-N 3.08Å; H134-T138 PolarHBondContact O-OG1 2.83Å; L135-T138 WeakPolarHBondContact O-CB 3.32Å; L135-T138 PolarHBondContact O-N 3.28Å; L135-T138 VanDerWaalsContact O-N 3.15Å; T138-K140 VanDerWaalsContact C-N 3.31Å; T138-K140 PolarHBondContact O-N 3.39Å; T138-C141 WeakPolarHBondContact O-CB 3.49Å; T138-C141 PolarHBondContact O-N 3.37Å; T138-C141 VanDerWaalsContact O-N 3.14Å; T138-I142 HydrophobicContact CG2-CD1 3.87Å; T138-I142 HydrophobicContact CG2-CG1 4.44Å; T138-I142 VanDerWaalsContact O-CG1 3.28Å; T138-I142 WeakPolarHBondContact O-CG1 3.35Å; T138-I142 PolarHBondContact O-N 3.23Å; T138-A206 HydrophobicContact CG2-CB 4.37Å; T138-A206 WeakPolarHBondContact CG2-O 3.25Å; T138-I210 HydrophobicContact CG2-CG1 4.29Å
139V95.5Very high90.1Very high5 Ų563.1 Ų63.13%0.0332%0.322CS..Hα-helixtrans-60.5-41176.3174.70000111.2L135 N137 S143 Y192 V195 R196 F199L135-V139 HydrophobicContact CD1-CG2 3.94Å; L135-V139 HydrophobicContact CG-CG2 4.4Å; L135-V139 WeakPolarHBondContact O-CG2 3Å; L135-V139 PolarHBondContact O-N 3.14Å; N137-V139 PolarHBondContact O-N 3.17Å; V139-S143 WeakPolarHBondContact O-CB 3.26Å; V139-S143 PolarHBondContact O-N 3.39Å; V139-S143 PolarHBondContact O-OG 3.05Å; V139-Y192 HydrophobicContact CB-CE2 4.28Å; V139-Y192 HydrophobicContact CG1-CD2 3.83Å; V139-Y192 HydrophobicContact CG1-CE2 3.62Å; V139-V195 HydrophobicContact CG1-CB 4.33Å; V139-V195 HydrophobicContact CG1-CG1 3.94Å; V139-R196 HydrophobicContact CG1-CB 4.11Å; V139-F199 HydrophobicContact CG2-CB 4.38Å; V139-F199 HydrophobicContact CG2-CD1 4.06Å; V139-F199 HydrophobicContact CG2-CG 4.06Å
140K95.8Very high91.1Very high93 Ų9361.5 Ų61.540%0.40431%0.312SS..Hα-helixtrans-61.8-45.3173.8-74.1175.5177.2-176.40111.9K136 N137 T138 S143 L144 Y192K136-K140 WeakPolarHBondContact O-CG 3.44Å; K136-K140 PolarHBondContact O-N 3.27Å; N137-K140 WeakPolarHBondContact O-CB 3.39Å; N137-K140 PolarHBondContact O-N 2.86Å; N137-K140 VanDerWaalsContact O-N 3.12Å; T138-K140 VanDerWaalsContact C-N 3.31Å; T138-K140 PolarHBondContact O-N 3.39Å; K140-S143 PolarHBondContact O-N 2.84Å; K140-L144 WeakPolarHBondContact O-CG 3.44Å; K140-L144 PolarHBondContact O-N 3.02Å; K140-Y192 HydrophobicContact CG-CD2 4.03Å; K140-Y192 HydrophobicContact CG-CE2 3.64Å
141C95.5Very high92.2Very high66 Ų6654.2 Ų54.245%0.44628%0.278SS..Hα-helixtrans-60.9-47.2179.1-67.80000111.6N137 T138 S143 L144 A145N137-C141 PolarHBondContact O-N 2.9Å; N137-C141 PolarHBondContact O-SG 2.89Å; T138-C141 WeakPolarHBondContact O-CB 3.49Å; T138-C141 PolarHBondContact O-N 3.37Å; T138-C141 VanDerWaalsContact O-N 3.14Å; C141-S143 VanDerWaalsContact C-N 3.29Å; C141-S143 PolarHBondContact O-N 3.15Å; C141-L144 PolarHBondContact O-N 3.12Å; C141-A145 WeakPolarHBondContact O-CB 3.28Å; C141-A145 PolarHBondContact O-N 3.42Å
142I96.9Very high92.9Very high3 Ų355.4 Ų55.42%0.01528%0.276CS..Hα-helixtrans-57.5-46.2175.9-66.5162.1000110.3T138 L144 A145 I146 V195 F199 G209T138-I142 HydrophobicContact CG2-CD1 3.87Å; T138-I142 HydrophobicContact CG2-CG1 4.44Å; T138-I142 VanDerWaalsContact O-CG1 3.28Å; T138-I142 WeakPolarHBondContact O-CG1 3.35Å; T138-I142 PolarHBondContact O-N 3.23Å; I142-L144 VanDerWaalsContact C-N 3.33Å; I142-L144 PolarHBondContact O-N 3.21Å; I142-A145 PolarHBondContact O-N 3.46Å; I142-I146 HydrophobicContact CG2-CD1 3.66Å; I142-I146 HydrophobicContact CG2-CG1 4.45Å; I142-I146 WeakPolarHBondContact O-CD1 3.41Å; I142-I146 VanDerWaalsContact O-CG1 3.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.49Å; I142-I146 PolarHBondContact O-N 3.18Å; I142-V195 HydrophobicContact CG2-CG1 4.23Å; I142-F199 HydrophobicContact CD1-CZ 4.19Å; I142-G209 VanDerWaalsContact CD1-O 3.26Å; I142-G209 WeakPolarHBondContact CD1-O 3.3Å
143S97.1Very high93.7Very high2 Ų251 Ų511%0.01425%0.254CS..Hα-helixtrans-62.7-40.7-178.4-530000112.4V139 K140 C141 Y147 Y192V139-S143 WeakPolarHBondContact O-CB 3.26Å; V139-S143 PolarHBondContact O-N 3.39Å; V139-S143 PolarHBondContact O-OG 3.05Å; K140-S143 PolarHBondContact O-N 2.84Å; C141-S143 VanDerWaalsContact C-N 3.29Å; C141-S143 PolarHBondContact O-N 3.15Å; S143-Y147 VanDerWaalsContact O-CB 3.3Å; S143-Y147 WeakPolarHBondContact O-CB 3.44Å; S143-Y147 PolarHBondContact O-N 3.06Å; S143-Y192 WeakPolarHBondContact OG-CA 3.19Å
144L97.3Very high93.9Very high69 Ų6960.3 Ų60.336%0.36129%0.285SS..Hα-helixtrans-68.7-40.2174.8-73.7171.1000111.9K140 C141 I142 Y147 Y148 H188K140-L144 WeakPolarHBondContact O-CG 3.44Å; K140-L144 PolarHBondContact O-N 3.02Å; C141-L144 PolarHBondContact O-N 3.12Å; I142-L144 VanDerWaalsContact C-N 3.33Å; I142-L144 PolarHBondContact O-N 3.21Å; L144-Y147 WeakPolarHBondContact O-CB 3.38Å; L144-Y147 PolarHBondContact O-N 3.38Å; L144-Y148 HydrophobicContact CB-CD2 4.4Å; L144-Y148 HydrophobicContact CB-CE2 4.27Å; L144-Y148 HydrophobicContact CD2-CE2 4.41Å; L144-Y148 WeakPolarHBondContact O-CD2 3.49Å; L144-Y148 PolarHBondContact O-N 3.48Å; L144-H188 HydrophobicContact CD2-CB 4.15Å
145A96.8Very high93.9Very high24 Ų2458.3 Ų58.320%0.19828%0.277CS..Hα-helixtrans-61.2-48.1177.300000111.2C141 I142 Y147 Y148 H149 L213C141-A145 WeakPolarHBondContact O-CB 3.28Å; C141-A145 PolarHBondContact O-N 3.42Å; I142-A145 PolarHBondContact O-N 3.46Å; A145-Y147 VanDerWaalsContact C-N 3.34Å; A145-Y147 PolarHBondContact O-N 3.41Å; A145-Y148 PolarHBondContact O-N 3.21Å; A145-H149 PolarHBondContact O-CD2 2.85Å; A145-H149 PolarHBondContact O-N 3.02Å; A145-L213 HydrophobicContact CB-CD1 3.59Å; A145-L213 HydrophobicContact CB-CD2 4.14Å
146I96.9Very high93.7Very high0 Ų061.5 Ų61.50%028%0.284CS..Hα-helixtrans-57-48.2173.1-67.2161000110.4I142 Y148 H149 I150 I191 V195 I216 L227 W232 V236I142-I146 HydrophobicContact CG2-CD1 3.66Å; I142-I146 HydrophobicContact CG2-CG1 4.45Å; I142-I146 WeakPolarHBondContact O-CD1 3.41Å; I142-I146 VanDerWaalsContact O-CG1 3.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.49Å; I142-I146 PolarHBondContact O-N 3.18Å; I146-Y148 VanDerWaalsContact C-N 3.33Å; I146-Y148 PolarHBondContact O-N 3.2Å; I146-H149 PolarHBondContact O-N 2.92Å; I146-I150 HydrophobicContact CG2-CD1 4.13Å; I146-I150 WeakPolarHBondContact O-CG1 3.22Å; I146-I150 PolarHBondContact O-N 3.38Å; I146-I191 HydrophobicContact CB-CG2 3.93Å; I146-I191 HydrophobicContact CD1-CG2 3.98Å; I146-I191 HydrophobicContact CG2-CD1 3.93Å; I146-I191 HydrophobicContact CG2-CG1 4.3Å; I146-I191 HydrophobicContact CG2-CG2 3.71Å; I146-V195 HydrophobicContact CD1-CG2 4.07Å; I146-I216 HydrophobicContact CD1-CD1 4.33Å; I146-I216 HydrophobicContact CG1-CD1 4.25Å; I146-L227 HydrophobicContact CB-CD2 4.42Å; I146-L227 HydrophobicContact CG2-CD2 3.69Å; I146-W232 HydrophobicContact CG2-CE3 4.34Å; I146-V236 HydrophobicContact CD1-CG1 4.19Å; I146-V236 HydrophobicContact CD1-CG2 3.5Å; I146-V236 HydrophobicContact CG1-CG2 4.04Å; I146-V236 HydrophobicContact CG2-CG2 4.32Å
147Y96.7Very high93.2Very high66 Ų6659.2 Ų59.226%0.25930%0.295SS..Hα-helixtrans-57.6-44178.7170.1-102.1000112.4S143 L144 A145 I150 S151 H188 I191S143-Y147 VanDerWaalsContact O-CB 3.3Å; S143-Y147 WeakPolarHBondContact O-CB 3.44Å; S143-Y147 PolarHBondContact O-N 3.06Å; L144-Y147 WeakPolarHBondContact O-CB 3.38Å; L144-Y147 PolarHBondContact O-N 3.38Å; A145-Y147 VanDerWaalsContact C-N 3.34Å; A145-Y147 PolarHBondContact O-N 3.41Å; Y147-I150 PolarHBondContact O-N 3.13Å; Y147-S151 WeakPolarHBondContact CE2-OG 3.49Å; Y147-S151 VanDerWaalsContact O-CB 3.27Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 3.25Å; Y147-S151 PolarHBondContact O-OG 2.96Å; Y147-H188 HydrophobicContact CD1-CB 4.36Å; Y147-H188 HydrophobicContact CD2-CB 4.07Å; Y147-H188 HydrophobicContact CG-CB 3.89Å; Y147-I191 HydrophobicContact CD2-CD1 4.34Å
148Y95.8Very high93Very high125 Ų12563.8 Ų63.849%0.4932%0.319SS..Hα-helixtrans-71.8-33.2178.3-73.4-56.7000112.6L144 A145 I146 I150 S151 N152L144-Y148 HydrophobicContact CB-CD2 4.4Å; L144-Y148 HydrophobicContact CB-CE2 4.27Å; L144-Y148 HydrophobicContact CD2-CE2 4.41Å; L144-Y148 WeakPolarHBondContact O-CD2 3.49Å; L144-Y148 PolarHBondContact O-N 3.48Å; A145-Y148 PolarHBondContact O-N 3.21Å; I146-Y148 VanDerWaalsContact C-N 3.33Å; I146-Y148 PolarHBondContact O-N 3.2Å; Y148-I150 VanDerWaalsContact C-N 3.35Å; Y148-S151 PolarHBondContact O-N 3.2Å; Y148-N152 WeakPolarHBondContact O-CB 3.06Å; Y148-N152 PolarHBondContact O-N 3.42Å
149H94.3Very high92.7Very high66 Ų6665.5 Ų65.531%0.30633%0.326SS..Hα-helixtrans-60.8-43.1170.9-84.4-66.1000112A145 I146 R153 L227A145-H149 PolarHBondContact O-CD2 2.85Å; A145-H149 PolarHBondContact O-N 3.02Å; I146-H149 PolarHBondContact O-N 2.92Å; H149-R153 PolarHBondContact O-N 3.27Å; H149-L227 HydrophobicContact CB-CB 4.26Å; H149-L227 HydrophobicContact CB-CD2 4.18Å
150I94.6Very high92.5Very high1 Ų170.1 Ų70.11%0.00534%0.342CS..Hα-helixtrans-69.1-49.2176.7-60.2170.5000110.2I146 Y147 Y148 N152 R153 D185 P186 I191 L227 W232I146-I150 HydrophobicContact CG2-CD1 4.13Å; I146-I150 WeakPolarHBondContact O-CG1 3.22Å; I146-I150 PolarHBondContact O-N 3.38Å; Y147-I150 PolarHBondContact O-N 3.13Å; Y148-I150 VanDerWaalsContact C-N 3.35Å; I150-N152 VanDerWaalsContact C-N 3.34Å; I150-N152 PolarHBondContact O-N 2.98Å; I150-R153 WeakPolarHBondContact O-CD 3.25Å; I150-R153 VanDerWaalsContact O-CG 3.29Å; I150-R153 WeakPolarHBondContact O-CG 3.41Å; I150-R153 PolarHBondContact O-N 2.63Å; I150-R153 PolarHBondContact O-NH1 3.27Å; I150-D185 HydrophobicContact CG2-CB 4.21Å; I150-P186 HydrophobicContact CD1-CG 3.63Å; I150-I191 HydrophobicContact CD1-CD1 4.23Å; I150-L227 HydrophobicContact CD1-CD2 4.14Å; I150-L227 HydrophobicContact CG1-CB 4.07Å; I150-L227 HydrophobicContact CG1-CD2 3.71Å; I150-L227 HydrophobicContact CG1-CG 4.04Å; I150-W232 HydrophobicContact CD1-CB 3.81Å; I150-W232 HydrophobicContact CD1-CD2 4.45Å; I150-W232 HydrophobicContact CD1-CG 3.91Å
151S92.6Very high92Very high25 Ų2568 Ų6818%0.17534%0.339CS..Hα-helixtrans-64.1-40.7-173.4-60.40000112.1Y147 Y148 R156Y147-S151 WeakPolarHBondContact CE2-OG 3.49Å; Y147-S151 VanDerWaalsContact O-CB 3.27Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 3.25Å; Y147-S151 PolarHBondContact O-OG 2.96Å; Y148-S151 PolarHBondContact O-N 3.2Å; S151-R156 PolarHBondContact O-NH2 3.41Å
152N91.7Very high91.6Very high122 Ų12268.8 Ų68.865%0.65234%0.337SS*.THydrogen-bonded Turntrans-99.817.6-175.7-56.2-17.8000112.8Y148 I150 R154Y148-N152 WeakPolarHBondContact O-CB 3.06Å; Y148-N152 PolarHBondContact O-N 3.42Å; I150-N152 VanDerWaalsContact C-N 3.34Å; I150-N152 PolarHBondContact O-N 2.98Å; N152-R154 PolarHBondContact O-N 2.94Å
153R91.6Very high91.2Very high29 Ų2974.1 Ų74.111%0.10937%0.366CS..  trans-58.8133.917771.8-172.6178.8-89.912.9110.4H149 I150 R156 E159 D185 L227H149-R153 PolarHBondContact O-N 3.27Å; I150-R153 WeakPolarHBondContact O-CD 3.25Å; I150-R153 VanDerWaalsContact O-CG 3.29Å; I150-R153 WeakPolarHBondContact O-CG 3.41Å; I150-R153 PolarHBondContact O-N 2.63Å; I150-R153 PolarHBondContact O-NH1 3.27Å; R153-R156 HydrophobicContact CG-CG 3.81Å; R153-E159 IonicContact CZ-OE1 2.88Å; R153-E159 IonicContact NE-OE1 2.94Å; R153-E159 PolarHBondContact NE-OE1 3.19Å; R153-E159 IonicContact NH2-OE1 2.91Å; R153-E159 PolarHBondContact NH2-OE1 2.97Å; R153-D185 IonicContact CZ-OD1 2.88Å; R153-D185 VanDerWaalsContact CZ-OD1 3.3Å; R153-D185 IonicContact CZ-OD2 2.88Å; R153-D185 IonicContact NH1-OD1 3.92Å; R153-D185 PolarHBondContact NH1-OD1 3.28Å; R153-D185 IonicContact NH1-OD2 3.46Å; R153-D185 PolarHBondContact NH1-OD2 3.21Å; R153-D185 IonicContact NH2-OD1 3.26Å; R153-D185 PolarHBondContact NH2-OD1 3.44Å; R153-D185 IonicContact NH2-OD2 3.6Å; R153-L227 WeakPolarHBondContact CD-O 3.45Å
154R87Confident90.8Very high231 Ų23178.6 Ų78.687%0.87239%0.389SS*.SBendtrans-71.9-36.2-173.1-176.9176.6171.2173.3-2.9112.8N152 R156N152-R154 PolarHBondContact O-N 2.94Å; R154-R156 PolarHBondContact O-N 2.9Å
155N87.2Confident90.3Very high49 Ų4977 Ų7726%0.26238%0.379SS..  trans-102.148.8-169.5-55-46.4000112.7G157 N158 E159 R160 D226N155-G157 PolarHBondContact O-N 3.16Å; N155-N158 WeakPolarHBondContact CB-O 3.41Å; N155-N158 CarbonylContact O-C 3.54Å; N155-N158 VanDerWaalsContact O-C 3.31Å; N155-N158 PolarHBondContact O-N 3.03Å; N155-E159 VanDerWaalsContact O-CG 3.31Å; N155-E159 WeakPolarHBondContact O-CG 3.3Å; N155-E159 PolarHBondContact O-N 3.01Å; N155-R160 PolarHBondContact ND2-NE 3.02Å; N155-D226 PolarHBondContact ND2-OD2 3.47Å
156R85.5Confident89.7Confident136 Ų13676.6 Ų76.651%0.51337%0.373SS..THydrogen-bonded Turntrans-56.4122.2177.9-80.6-173.2177.7-99.1-2.3110.9S151 R153 R154 E159 D185S151-R156 PolarHBondContact O-NH2 3.41Å; R153-R156 HydrophobicContact CG-CG 3.81Å; R154-R156 PolarHBondContact O-N 2.9Å; R156-E159 WeakPolarHBondContact CA-OE1 3.47Å; R156-D185 IonicContact CZ-OD2 2.93Å; R156-D185 VanDerWaalsContact CZ-OD2 3.28Å; R156-D185 IonicContact NH1-OD2 2.89Å; R156-D185 PolarHBondContact NH1-OD2 3.02Å; R156-D185 IonicContact NH2-OD2 3.3Å; R156-D185 PolarHBondContact NH2-OD2 3.04Å
157G81.8Confident89.1Confident71 Ų7176.8 Ų76.873%0.73237%0.374SS*.THydrogen-bonded Turntrans86.4-4.9-179.200000115.7N155 E159N155-G157 PolarHBondContact O-N 3.16Å; G157-E159 VanDerWaalsContact CA-OE2 3.28Å; G157-E159 WeakPolarHBondContact CA-OE2 3.31Å; G157-E159 PolarHBondContact N-OE1 3.5Å; G157-E159 PolarHBondContact N-OE2 2.89Å
158N88.2Confident88.4Confident135 Ų13578.9 Ų78.972%0.72239%0.387SS*.SBendtrans-141.149.8169.8-171.233.8000109.1N155N155-N158 WeakPolarHBondContact CB-O 3.41Å; N155-N158 CarbonylContact O-C 3.54Å; N155-N158 VanDerWaalsContact O-C 3.31Å; N155-N158 PolarHBondContact O-N 3.03Å
159E88.5Confident87.7Confident58 Ų5879.3 Ų79.327%0.27139%0.391SS..  trans-68133.9-173.9-67.491.9164.300111.6R153 N155 R156 G157 S161 D226 C228R153-E159 IonicContact CZ-OE1 2.88Å; R153-E159 IonicContact NE-OE1 2.94Å; R153-E159 PolarHBondContact NE-OE1 3.19Å; R153-E159 IonicContact NH2-OE1 2.91Å; R153-E159 PolarHBondContact NH2-OE1 2.97Å; N155-E159 VanDerWaalsContact O-CG 3.31Å; N155-E159 WeakPolarHBondContact O-CG 3.3Å; N155-E159 PolarHBondContact O-N 3.01Å; R156-E159 WeakPolarHBondContact CA-OE1 3.47Å; G157-E159 VanDerWaalsContact CA-OE2 3.28Å; G157-E159 WeakPolarHBondContact CA-OE2 3.31Å; G157-E159 PolarHBondContact N-OE1 3.5Å; G157-E159 PolarHBondContact N-OE2 2.89Å; E159-S161 PolarHBondContact O-N 3.2Å; E159-D226 HydrophobicContact CB-CB 4.35Å; E159-C228 WeakPolarHBondContact CB-SG 3.39Å; E159-C228 WeakPolarHBondContact CG-SG 3.21Å
160R89.8Confident87Confident101 Ų10180 Ų8038%0.38139%0.394SS..  trans-76.4106.7173.3-63.3173.7-64.316412.8108.1N155 E224 I225 D226N155-R160 PolarHBondContact ND2-NE 3.02Å; R160-E224 WeakPolarHBondContact CB-O 3.31Å; R160-E224 WeakPolarHBondContact CD-O 3.43Å; R160-E224 PolarHBondContact NE-O 2.93Å; R160-E224 VanDerWaalsContact NH1-CB 3.34Å; R160-E224 PolarHBondContact NH1-O 3.22Å; R160-E224 IonicContact NH1-OE2 3.85Å; R160-I225 CarbonylContact O-C 3.43Å; R160-I225 WeakPolarHBondContact O-CA 3.24Å; R160-I225 WeakPolarHBondContact O-CG2 3.46Å; R160-D226 IonicContact CZ-OD1 2.88Å; R160-D226 PolarHBondContact N-OD2 3.46Å; R160-D226 VanDerWaalsContact N-OD2 3.08Å; R160-D226 IonicContact NE-OD1 2.84Å; R160-D226 IonicContact NE-OD2 3.65Å; R160-D226 PolarHBondContact NE-OD2 2.88Å; R160-D226 IonicContact NH2-OD1 3.8Å; R160-D226 PolarHBondContact NH2-OD1 3.02Å; R160-D226 IonicContact NH2-OD2 2.91Å; R160-D226 PolarHBondContact O-N 3.44Å
161S86.8Confident86.2Confident49 Ų4983.4 Ų83.434%0.34342%0.417SS..  trans-121.4162.5177.6-163.30000110.5E159 N231E159-S161 PolarHBondContact O-N 3.2Å; S161-N231 PolarHBondContact OG-ND2 3.46Å
162M87Confident85.3Confident82 Ų8283.5 Ų83.540%0.40442%0.415SS..  trans-119.6136.9170.6-63.9-178.175.200109.3I164 F165 D166 A223 I225M162-I164 HydrophobicContact CB-CG1 4.05Å; M162-I164 HydrophobicContact CE-CD1 4.28Å; M162-I164 PolarHBondContact O-N 3.39Å; M162-I164 VanDerWaalsContact O-N 3.08Å; M162-F165 HydrophobicContact CB-CD2 4.09Å; M162-F165 PolarHBondContact O-N 3.38Å; M162-F165 HydrophobicContact SD-CE2 4.35Å; M162-D166 PolarHBondContact O-N 2.93Å; M162-A223 HydrophobicContact SD-CB 4.44Å; M162-I225 HydrophobicContact CB-CD1 4.36Å; M162-I225 HydrophobicContact CG-CD1 3.65Å; M162-I225 HydrophobicContact CG-CG1 3.96Å; M162-I225 HydrophobicContact SD-CD1 3.41Å; M162-I225 WeakPolarHBondContact SD-CD1 3.46Å; M162-I225 HydrophobicContact SD-CG1 4.11Å
163D87.8Confident84.2Confident116 Ų11678.8 Ų78.862%0.6239%0.39SS*.G310 helixtrans-53.5-35.7-175.9-55.6-7.7000113.1F165 D166 H170D163-F165 PolarHBondContact O-N 3.2Å; D163-F165 VanDerWaalsContact O-N 3.14Å; D163-D166 WeakPolarHBondContact O-CB 3.48Å; D163-D166 PolarHBondContact O-N 2.75Å; D163-H170 PolarHBondContact O-CD2 2.99Å; D163-H170 VanDerWaalsContact O-CD2 3.31Å
164I88.1Confident82.9Confident95 Ų9582.5 Ų82.549%0.48743%0.427SS..G310 helixtrans-60.7-25.6179.461.3170.8000113.4M162M162-I164 HydrophobicContact CB-CG1 4.05Å; M162-I164 HydrophobicContact CE-CD1 4.28Å; M162-I164 PolarHBondContact O-N 3.39Å; M162-I164 VanDerWaalsContact O-N 3.08Å
165F87.3Confident81.9Confident35 Ų3572.4 Ų72.415%0.15440%0.395CS..G310 helixtrans-101-5.1178.3-60.5-57.1000112.8M162 D163 E167 L219 I225 N231 R234 I235M162-F165 HydrophobicContact CB-CD2 4.09Å; M162-F165 PolarHBondContact O-N 3.38Å; M162-F165 HydrophobicContact SD-CE2 4.35Å; D163-F165 PolarHBondContact O-N 3.2Å; D163-F165 VanDerWaalsContact O-N 3.14Å; F165-E167 PolarHBondContact O-N 2.94Å; F165-L219 HydrophobicContact CE2-CD1 4.41Å; F165-L219 HydrophobicContact CE2-CD2 4.12Å; F165-L219 HydrophobicContact CZ-CD1 4.46Å; F165-L219 HydrophobicContact CZ-CD2 3.95Å; F165-I225 HydrophobicContact CD2-CD1 3.97Å; F165-I225 HydrophobicContact CE2-CD1 3.81Å; F165-N231 HydrophobicContact CB-CB 4.04Å; F165-N231 VanDerWaalsContact O-CA 3.26Å; F165-N231 WeakPolarHBondContact O-CA 3.21Å; F165-N231 WeakPolarHBondContact O-CB 3.07Å; F165-R234 VanDerWaalsContact C-CD 3.45Å; F165-R234 HydrophobicContact CB-CB 4.26Å; F165-R234 HydrophobicContact CD1-CB 4.17Å; F165-R234 WeakPolarHBondContact O-CB 3.41Å; F165-R234 WeakPolarHBondContact O-CD 3.45Å; F165-I235 HydrophobicContact CB-CD1 4.37Å; F165-I235 HydrophobicContact CB-CG1 3.95Å; F165-I235 HydrophobicContact CD1-CG1 3.8Å; F165-I235 HydrophobicContact CD2-CD1 4.38Å; F165-I235 HydrophobicContact CD2-CG1 4.02Å; F165-I235 HydrophobicContact CE1-CG1 4.29Å; F165-I235 HydrophobicContact CE2-CG1 4.5Å; F165-I235 HydrophobicContact CG-CD1 4.32Å; F165-I235 HydrophobicContact CG-CG1 3.65Å
166D85.4Confident80.7Confident16 Ų1676.2 Ų76.29%0.08642%0.423CS..  trans-76.2125.4179.3-174.5-15.6000110.6M162 D163 Q168 F169 H170M162-D166 PolarHBondContact O-N 2.93Å; D163-D166 WeakPolarHBondContact O-CB 3.48Å; D163-D166 PolarHBondContact O-N 2.75Å; D166-Q168 VanDerWaalsContact C-N 3.32Å; D166-Q168 VanDerWaalsContact OD1-CB 3.3Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.3Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.36Å; D166-Q168 PolarHBondContact OD1-N 3Å; D166-F169 HydrophobicContact CB-CD2 3.83Å; D166-F169 VanDerWaalsContact OD2-CD2 3.26Å; D166-F169 WeakPolarHBondContact OD2-CD2 3.36Å; D166-F169 VanDerWaalsContact OD2-CE2 3.23Å; D166-F169 WeakPolarHBondContact OD2-CE2 3.29Å; D166-H170 PolarHBondContact O-N 2.88Å
167E84.1Confident79.8Confident4 Ų473 Ų732%0.01941%0.413CS..THydrogen-bonded Turntrans-78.8-12.6-178.7-67.4-165.5-105.200115.1F165 H170 P171 I172 L182 E230 R233 R234F165-E167 PolarHBondContact O-N 2.94Å; E167-H170 WeakPolarHBondContact CA-O 3.29Å; E167-H170 CarbonylContact O-C 3.31Å; E167-P171 WeakPolarHBondContact O-CA 3.35Å; E167-I172 WeakPolarHBondContact OE2-CD1 3.34Å; E167-I172 WeakPolarHBondContact OE2-CG1 3.27Å; E167-L182 HydrophobicContact CB-CD2 4.26Å; E167-E230 VanDerWaalsContact CB-O 3.28Å; E167-E230 WeakPolarHBondContact CB-O 3.29Å; E167-E230 WeakPolarHBondContact CG-O 2.81Å; E167-E230 PolarHBondContact N-O 3.24Å; E167-R233 VanDerWaalsContact OE1-CB 3.31Å; E167-R233 WeakPolarHBondContact OE1-CB 3.41Å; E167-R233 IonicContact OE1-CZ 2.75Å; E167-R233 IonicContact OE1-NE 3.42Å; E167-R233 PolarHBondContact OE1-NE 2.75Å; E167-R233 IonicContact OE1-NH1 2.6Å; E167-R233 IonicContact OE1-NH2 2.88Å; E167-R233 PolarHBondContact OE1-NH2 2.8Å; E167-R233 IonicContact OE2-CZ 2.89Å; E167-R233 IonicContact OE2-NE 3.85Å; E167-R233 PolarHBondContact OE2-NE 3.26Å; E167-R233 IonicContact OE2-NH1 3.76Å; E167-R233 PolarHBondContact OE2-NH1 3.08Å; E167-R233 IonicContact OE2-NH2 3.87Å; E167-R233 PolarHBondContact OE2-NH2 2.99Å; E167-R234 HydrophobicContact CG-CG 3.64Å
168Q81.2Confident79.3Confident111 Ų11173.7 Ų73.752%0.51940%0.404SS..THydrogen-bonded Turntrans-67.2-48.8168.5-60.5-168.930.900110.6D166 L182 E230D166-Q168 VanDerWaalsContact C-N 3.32Å; D166-Q168 VanDerWaalsContact OD1-CB 3.3Å; D166-Q168 WeakPolarHBondContact OD1-CB 3.3Å; D166-Q168 WeakPolarHBondContact OD1-CG 3.36Å; D166-Q168 PolarHBondContact OD1-N 3Å; Q168-L182 HydrophobicContact CG-CD1 3.43Å; Q168-L182 VanDerWaalsContact CG-CD1 3.43Å; Q168-E230 PolarHBondContact NE2-OE1 2.92Å
169F80.6Confident78.2Confident133 Ų13372.6 Ų72.658%0.58341%0.405SS*.THydrogen-bonded Turntrans-78.6-31.3179.8-62.2-64.7000112.5D166D166-F169 HydrophobicContact CB-CD2 3.83Å; D166-F169 VanDerWaalsContact OD2-CD2 3.26Å; D166-F169 WeakPolarHBondContact OD2-CD2 3.36Å; D166-F169 VanDerWaalsContact OD2-CE2 3.23Å; D166-F169 WeakPolarHBondContact OD2-CE2 3.29Å
170H80.6Confident77.6Confident81 Ų8174.9 Ų74.938%0.37542%0.419SS..SBendtrans-130.788.4-178.7-55.2-58.4000108.9D163 D166 E167 I172 R234D163-H170 PolarHBondContact O-CD2 2.99Å; D163-H170 VanDerWaalsContact O-CD2 3.31Å; D166-H170 PolarHBondContact O-N 2.88Å; E167-H170 WeakPolarHBondContact CA-O 3.29Å; E167-H170 CarbonylContact O-C 3.31Å; H170-I172 PolarHBondContact O-N 3.35Å; H170-R234 PolarHBondContact O-NE 3.19Å; H170-R234 PolarHBondContact O-NH2 3.14Å
171P77.1Confident77.1Confident73 Ų7373.8 Ų73.847%0.47442%0.415SS..  trans-69.3134.8177.925.1-32.9000111.1E167 F177 R234E167-P171 WeakPolarHBondContact O-CA 3.35Å; P171-F177 HydrophobicContact CB-CE2 4.34Å; P171-R234 PolarHBondContact O-NH2 3.04Å
172I73.5Confident76.8Confident27 Ų2772.7 Ų72.714%0.13841%0.405CS..SBendtrans-75.3-36.2169-63.6177.4000110.6E167 H170 R233 R234 L237 L261E167-I172 WeakPolarHBondContact OE2-CD1 3.34Å; E167-I172 WeakPolarHBondContact OE2-CG1 3.27Å; H170-I172 PolarHBondContact O-N 3.35Å; I172-R233 HydrophobicContact CD1-CB 3.4Å; I172-R234 HydrophobicContact CD1-CB 4.42Å; I172-R234 HydrophobicContact CD1-CG 3.63Å; I172-R234 HydrophobicContact CG1-CG 3.75Å; I172-L237 HydrophobicContact CD1-CD2 4.31Å; I172-L261 HydrophobicContact CG2-CD2 4.05Å
173T69.8Low76.6Confident22 Ų2274.7 Ų74.714%0.13542%0.416CS..SBendtrans-109.3128.9-176.4-79.80000109.7G175 F177 N265T173-G175 PolarHBondContact O-N 3.43Å; T173-G175 VanDerWaalsContact O-N 3.11Å; T173-F177 HydrophobicContact CG2-CE1 3.91Å; T173-F177 HydrophobicContact CG2-CZ 3.92Å; T173-F177 WeakPolarHBondContact O-CZ 3.48Å; T173-N265 WeakPolarHBondContact CB-OD1 3.23Å; T173-N265 WeakPolarHBondContact CG2-ND2 3.36Å; T173-N265 WeakPolarHBondContact CG2-OD1 3.26Å; T173-N265 PolarHBondContact OG1-OD1 2.87Å
174A63.6Low76.6Confident107 Ų10777.6 Ų77.688%0.88442%0.419SS*.  trans-81.931.5179.300000113.9
175G65.2Low76.7Confident19 Ų1975 Ų7520%0.19641%0.405CS..SBendtrans-120.2158.8-175.400000112.7T173 F177T173-G175 PolarHBondContact O-N 3.43Å; T173-G175 VanDerWaalsContact O-N 3.11Å; G175-F177 PolarHBondContact O-N 3.14Å
176P62.4Low76.9Confident130 Ų13074 Ų7484%0.84440%0.402SS*.PPolyproline II helixtrans-63.7121.5174.227-32.3000109.4
177F66.3Low77.3Confident68 Ų6875.9 Ų75.930%0.29841%0.413SS..PPolyproline II helixtrans-85.2145.2172-60-75.2000109.6P171 T173 G175 Y181P171-F177 HydrophobicContact CB-CE2 4.34Å; T173-F177 HydrophobicContact CG2-CE1 3.91Å; T173-F177 HydrophobicContact CG2-CZ 3.92Å; T173-F177 WeakPolarHBondContact O-CZ 3.48Å; G175-F177 PolarHBondContact O-N 3.14Å; F177-Y181 HydrophobicContact CB-CD1 3.94Å; F177-Y181 HydrophobicContact CB-CG 4.32Å; F177-Y181 AromaticContact CD1-CD1 3.26Å; F177-Y181 HydrophobicContact CD1-CD1 3.26Å; F177-Y181 AromaticContact CD1-CE1 3.32Å; F177-Y181 HydrophobicContact CD1-CE1 3.32Å; F177-Y181 HydrophobicContact CD1-CG 4.12Å; F177-Y181 AromaticContact CE1-CD1 3.91Å; F177-Y181 HydrophobicContact CE1-CD1 3.91Å; F177-Y181 AromaticContact CE1-CE1 3.48Å; F177-Y181 HydrophobicContact CE1-CE1 3.48Å; F177-Y181 VanDerWaalsContact CE1-CE1 3.48Å; F177-Y181 AromaticContact CG-CD1 3.74Å; F177-Y181 HydrophobicContact CG-CD1 3.74Å; F177-Y181 HydrophobicContact CG-CE1 4.2Å; F177-Y181 HydrophobicContact CZ-CE1 4.46Å
178P71.6Confident77.7Confident86 Ų8679 Ų7956%0.55843%0.427SS*.PPolyproline II helixtrans-52.5141.7161.5-21.531.6000109.5D180 Y181P178-D180 PolarHBondContact O-N 2.92Å; P178-D180 VanDerWaalsContact O-N 3.08Å; P178-Y181 WeakPolarHBondContact O-CB 3.46Å; P178-Y181 PolarHBondContact O-N 2.87Å
179P65.9Low78.3Confident112 Ų11282.1 Ų82.173%0.72743%0.434SS*.THydrogen-bonded Turntrans-57-30-176.321.8-32.6000112.8Y181P179-Y181 VanDerWaalsContact C-N 3.34Å; P179-Y181 PolarHBondContact O-N 3.33Å
180D76.4Confident78.9Confident106 Ų10678.2 Ų78.257%0.56742%0.422SS*.THydrogen-bonded Turntrans-87.2-0.7-177.8-53.6-32.3000114P178 L182 I183 R184P178-D180 PolarHBondContact O-N 2.92Å; P178-D180 VanDerWaalsContact O-N 3.08Å; D180-L182 VanDerWaalsContact C-N 3.31Å; D180-L182 PolarHBondContact O-N 3.06Å; D180-I183 PolarHBondContact O-N 3.36Å; D180-I183 VanDerWaalsContact O-N 3.12Å; D180-R184 WeakPolarHBondContact O-CB 3.37Å; D180-R184 PolarHBondContact O-N 3.49Å
181Y78.1Confident79.5Confident77 Ų7774.4 Ų74.430%0.30240%0.404SS..THydrogen-bonded Turntrans-64.4-35.3-171.1179.1-117000113.4F177 P178 P179 R233F177-Y181 HydrophobicContact CB-CD1 3.94Å; F177-Y181 HydrophobicContact CB-CG 4.32Å; F177-Y181 AromaticContact CD1-CD1 3.26Å; F177-Y181 HydrophobicContact CD1-CD1 3.26Å; F177-Y181 AromaticContact CD1-CE1 3.32Å; F177-Y181 HydrophobicContact CD1-CE1 3.32Å; F177-Y181 HydrophobicContact CD1-CG 4.12Å; F177-Y181 AromaticContact CE1-CD1 3.91Å; F177-Y181 HydrophobicContact CE1-CD1 3.91Å; F177-Y181 AromaticContact CE1-CE1 3.48Å; F177-Y181 HydrophobicContact CE1-CE1 3.48Å; F177-Y181 VanDerWaalsContact CE1-CE1 3.48Å; F177-Y181 AromaticContact CG-CD1 3.74Å; F177-Y181 HydrophobicContact CG-CD1 3.74Å; F177-Y181 HydrophobicContact CG-CE1 4.2Å; F177-Y181 HydrophobicContact CZ-CE1 4.46Å; P178-Y181 WeakPolarHBondContact O-CB 3.46Å; P178-Y181 PolarHBondContact O-N 2.87Å; P179-Y181 VanDerWaalsContact C-N 3.34Å; P179-Y181 PolarHBondContact O-N 3.33Å; Y181-R233 WeakPolarHBondContact OH-CD 3.47Å; Y181-R233 PolarHBondContact OH-NE 2.98Å; Y181-R233 VanDerWaalsContact OH-NE 3.1Å; Y181-R233 PolarHBondContact OH-NH1 2.94Å
182L81.6Confident80.4Confident27 Ų2773.6 Ų73.614%0.14139%0.392CS..THydrogen-bonded Turntrans-88.4-9.4178.5-61.2-176.4000112.6E167 Q168 D180 P229 E230E167-L182 HydrophobicContact CB-CD2 4.26Å; Q168-L182 HydrophobicContact CG-CD1 3.43Å; Q168-L182 VanDerWaalsContact CG-CD1 3.43Å; D180-L182 VanDerWaalsContact C-N 3.31Å; D180-L182 PolarHBondContact O-N 3.06Å; L182-P229 WeakPolarHBondContact O-CB 3.37Å; L182-E230 HydrophobicContact CB-CG 4.17Å; L182-E230 VanDerWaalsContact O-CG 3.25Å; L182-E230 WeakPolarHBondContact O-CG 3.2Å
183I82.8Confident81.3Confident124 Ų12475.1 Ų75.164%0.63640%0.396SS*.THydrogen-bonded Turntrans-93.8-35.5-179.6-57175.3000110.5D180D180-I183 PolarHBondContact O-N 3.36Å; D180-I183 VanDerWaalsContact O-N 3.12Å
184R86.5Confident82.3Confident177 Ų17775.3 Ų75.367%0.66840%0.395SS*.SBendtrans-89.9126.7-172-178.5173.4174-100.3-1.4112.7D180D180-R184 WeakPolarHBondContact O-CB 3.37Å; D180-R184 PolarHBondContact O-N 3.49Å
185D91.5Very high83.7Confident39 Ų3970.2 Ų70.221%0.20935%0.352CS..PPolyproline II helixtrans-53127.3170.5-68.3-9000111.4I150 R153 R156 P229I150-D185 HydrophobicContact CG2-CB 4.21Å; R153-D185 IonicContact CZ-OD1 2.88Å; R153-D185 VanDerWaalsContact CZ-OD1 3.3Å; R153-D185 IonicContact CZ-OD2 2.88Å; R153-D185 IonicContact NH1-OD1 3.92Å; R153-D185 PolarHBondContact NH1-OD1 3.28Å; R153-D185 IonicContact NH1-OD2 3.46Å; R153-D185 PolarHBondContact NH1-OD2 3.21Å; R153-D185 IonicContact NH2-OD1 3.26Å; R153-D185 PolarHBondContact NH2-OD1 3.44Å; R153-D185 IonicContact NH2-OD2 3.6Å; R156-D185 IonicContact CZ-OD2 2.93Å; R156-D185 VanDerWaalsContact CZ-OD2 3.28Å; R156-D185 IonicContact NH1-OD2 2.89Å; R156-D185 PolarHBondContact NH1-OD2 3.02Å; R156-D185 IonicContact NH2-OD2 3.3Å; R156-D185 PolarHBondContact NH2-OD2 3.04Å; D185-P229 WeakPolarHBondContact OD1-CG 3.21Å
186P91.7Very high85Confident14 Ų1475 Ų759%0.09137%0.365CS..PPolyproline II helixtrans-70.8142.1179.430.7-37.7000111.4I150 T190 I191 W232I150-P186 HydrophobicContact CD1-CG 3.63Å; P186-T190 HydrophobicContact CB-CG2 4.41Å; P186-I191 HydrophobicContact CB-CD1 4.43Å; P186-I191 HydrophobicContact CB-CG1 4.11Å; P186-I191 HydrophobicContact CG-CD1 4.02Å; P186-I191 HydrophobicContact CG-CG1 4.04Å; P186-W232 HydrophobicContact CB-CZ2 4Å; P186-W232 HydrophobicContact CG-CD2 4.24Å; P186-W232 HydrophobicContact CG-CG 4.42Å; P186-W232 HydrophobicContact CG-CZ2 4.17Å
187D92.3Very high86.3Confident56 Ų5669.6 Ų69.630%0.29933%0.329SS..PPolyproline II helixtrans-71.5153.8170.2-175.531.2000111R189 T190 I191D187-R189 PolarHBondContact O-N 3.15Å; D187-R189 VanDerWaalsContact O-N 3.08Å; D187-R189 WeakPolarHBondContact OD2-CG 3.06Å; D187-T190 WeakPolarHBondContact O-CB 3.38Å; D187-T190 PolarHBondContact O-N 3.18Å; D187-I191 PolarHBondContact O-N 2.84Å; D187-I191 VanDerWaalsContact O-N 3.15Å
188H93.6Very high87.4Confident71 Ų7166.5 Ų66.533%0.32932%0.316SS..Hα-helixtrans-55.3-29.917867.2-94.7000112.3L144 Y147 Y192L144-H188 HydrophobicContact CD2-CB 4.15Å; Y147-H188 HydrophobicContact CD1-CB 4.36Å; Y147-H188 HydrophobicContact CD2-CB 4.07Å; Y147-H188 HydrophobicContact CG-CB 3.89Å; H188-Y192 WeakPolarHBondContact O-CB 3.29Å; H188-Y192 PolarHBondContact O-N 3.36Å
189R93.8Very high88.3Confident175 Ų17562.7 Ų62.766%0.6629%0.291SS*.Hα-helixtrans-66.7-40.6175.5-63.3-177.2178.2-174.51112.3D187 Y192 R193D187-R189 PolarHBondContact O-N 3.15Å; D187-R189 VanDerWaalsContact O-N 3.08Å; D187-R189 WeakPolarHBondContact OD2-CG 3.06Å; R189-Y192 PolarHBondContact O-N 2.94Å; R189-R193 VanDerWaalsContact O-CG 3.29Å; R189-R193 WeakPolarHBondContact O-CG 3.37Å; R189-R193 PolarHBondContact O-N 3.34Å
190T91.8Very high89.3Confident52 Ų5260.8 Ų60.832%0.31928%0.284SS..Hα-helixtrans-65-46177.3-59.50000110.3P186 D187 R193 F194 W232P186-T190 HydrophobicContact CB-CG2 4.41Å; D187-T190 WeakPolarHBondContact O-CB 3.38Å; D187-T190 PolarHBondContact O-N 3.18Å; T190-R193 PolarHBondContact O-N 2.85Å; T190-F194 PolarHBondContact O-N 3.08Å; T190-F194 VanDerWaalsContact O-N 3.08Å; T190-W232 HydrophobicContact CG2-CZ2 4.42Å
191I94.7Very high89.7Confident0 Ų058 Ų580%028%0.275CS..Hα-helixtrans-61-47.9175.7-61.2162000110.1I146 Y147 I150 P186 D187 R193 F194 V195 W232I146-I191 HydrophobicContact CB-CG2 3.93Å; I146-I191 HydrophobicContact CD1-CG2 3.98Å; I146-I191 HydrophobicContact CG2-CD1 3.93Å; I146-I191 HydrophobicContact CG2-CG1 4.3Å; I146-I191 HydrophobicContact CG2-CG2 3.71Å; Y147-I191 HydrophobicContact CD2-CD1 4.34Å; I150-I191 HydrophobicContact CD1-CD1 4.23Å; P186-I191 HydrophobicContact CB-CD1 4.43Å; P186-I191 HydrophobicContact CB-CG1 4.11Å; P186-I191 HydrophobicContact CG-CD1 4.02Å; P186-I191 HydrophobicContact CG-CG1 4.04Å; D187-I191 PolarHBondContact O-N 2.84Å; D187-I191 VanDerWaalsContact O-N 3.15Å; I191-R193 VanDerWaalsContact C-N 3.31Å; I191-R193 PolarHBondContact O-N 3.43Å; I191-F194 PolarHBondContact O-N 2.93Å; I191-V195 HydrophobicContact CG2-CG2 4.16Å; I191-V195 WeakPolarHBondContact O-CG2 3.26Å; I191-V195 PolarHBondContact O-N 2.92Å; I191-W232 HydrophobicContact CB-CH2 4.42Å; I191-W232 HydrophobicContact CB-CZ3 4.14Å; I191-W232 HydrophobicContact CG1-CE3 4.16Å; I191-W232 HydrophobicContact CG1-CH2 4Å; I191-W232 HydrophobicContact CG1-CZ2 4.46Å; I191-W232 HydrophobicContact CG1-CZ3 3.84Å; I191-W232 HydrophobicContact CG2-CZ3 4.07Å
192Y95.6Very high90Very high56 Ų5655.3 Ų55.322%0.2227%0.269CS..Hα-helixtrans-57.5-43.2178.7174.5-100.6000112.9V139 K140 S143 H188 R189 R196V139-Y192 HydrophobicContact CB-CE2 4.28Å; V139-Y192 HydrophobicContact CG1-CD2 3.83Å; V139-Y192 HydrophobicContact CG1-CE2 3.62Å; K140-Y192 HydrophobicContact CG-CD2 4.03Å; K140-Y192 HydrophobicContact CG-CE2 3.64Å; S143-Y192 WeakPolarHBondContact OG-CA 3.19Å; H188-Y192 WeakPolarHBondContact O-CB 3.29Å; H188-Y192 PolarHBondContact O-N 3.36Å; R189-Y192 PolarHBondContact O-N 2.94Å; Y192-R196 WeakPolarHBondContact O-CB 3.45Å; Y192-R196 PolarHBondContact O-N 3.36Å
193R91.5Very high90.3Very high59 Ų5962.4 Ų62.422%0.22330%0.302CS..Hα-helixtrans-61.3-50.2176.2-75.417758.3-127.1-9111.2R189 T190 I191 V195 R196 T197 D268R189-R193 VanDerWaalsContact O-CG 3.29Å; R189-R193 WeakPolarHBondContact O-CG 3.37Å; R189-R193 PolarHBondContact O-N 3.34Å; T190-R193 PolarHBondContact O-N 2.85Å; I191-R193 VanDerWaalsContact C-N 3.31Å; I191-R193 PolarHBondContact O-N 3.43Å; R193-V195 PolarHBondContact O-N 2.86Å; R193-R196 PolarHBondContact O-N 2.9Å; R193-T197 WeakPolarHBondContact O-CB 3.27Å; R193-T197 PolarHBondContact O-N 3.32Å; R193-T197 PolarHBondContact O-OG1 3.48Å; R193-D268 IonicContact CZ-OD1 3.08Å; R193-D268 IonicContact NE-OD1 3.62Å; R193-D268 VanDerWaalsContact NH2-C 3.31Å; R193-D268 PolarHBondContact NH2-O 2.8Å; R193-D268 IonicContact NH2-OD1 3.71Å; R193-D268 PolarHBondContact NH2-OD1 2.98Å
194F91.2Very high90.6Very high26 Ų2657.2 Ų57.211%0.11428%0.275CS..Hα-helixtrans-56.4-52.8178.5-178.9-106.1000112.2T190 I191 R196 T197 L198 W232 R233 V236 L237T190-F194 PolarHBondContact O-N 3.08Å; T190-F194 VanDerWaalsContact O-N 3.08Å; I191-F194 PolarHBondContact O-N 2.93Å; F194-R196 PolarHBondContact O-N 2.86Å; F194-T197 PolarHBondContact O-N 3.4Å; F194-L198 HydrophobicContact CD1-CD1 3.98Å; F194-L198 HydrophobicContact CE1-CD1 3.5Å; F194-L198 VanDerWaalsContact CE1-CD1 3.5Å; F194-L198 HydrophobicContact CE2-CD1 4.28Å; F194-L198 HydrophobicContact CZ-CD1 3.67Å; F194-L198 HydrophobicContact CZ-CG 4.49Å; F194-L198 WeakPolarHBondContact O-CG 3.25Å; F194-L198 PolarHBondContact O-N 2.91Å; F194-L198 VanDerWaalsContact O-N 3.1Å; F194-W232 HydrophobicContact CB-CH2 3.95Å; F194-W232 HydrophobicContact CB-CZ3 4.16Å; F194-W232 HydrophobicContact CD1-CH2 4.16Å; F194-W232 AromaticContact CD1-CZ3 3.7Å; F194-W232 HydrophobicContact CD1-CZ3 3.7Å; F194-W232 HydrophobicContact CE1-CZ3 4.4Å; F194-W232 HydrophobicContact CG-CH2 4.11Å; F194-W232 HydrophobicContact CG-CZ3 4.12Å; F194-R233 HydrophobicContact CD1-CG 4.41Å; F194-R233 HydrophobicContact CD2-CG 4.5Å; F194-R233 HydrophobicContact CE1-CB 3.96Å; F194-R233 HydrophobicContact CE1-CG 4.18Å; F194-R233 HydrophobicContact CE2-CB 4.25Å; F194-R233 HydrophobicContact CE2-CG 4.28Å; F194-R233 HydrophobicContact CZ-CB 3.72Å; F194-R233 HydrophobicContact CZ-CG 4.11Å; F194-V236 HydrophobicContact CD1-CG1 4.22Å; F194-V236 HydrophobicContact CE1-CB 4.24Å; F194-V236 HydrophobicContact CE1-CG1 3.95Å; F194-L237 HydrophobicContact CZ-CB 4.45Å
195V93.7Very high90.8Very high0 Ų051.7 Ų51.70%026%0.262CS..Hα-helixtrans-62.3-46.3179.4-179.80000110.6V139 I142 I146 I191 R193 T197 L198 F199 V236V139-V195 HydrophobicContact CG1-CB 4.33Å; V139-V195 HydrophobicContact CG1-CG1 3.94Å; I142-V195 HydrophobicContact CG2-CG1 4.23Å; I146-V195 HydrophobicContact CD1-CG2 4.07Å; I191-V195 HydrophobicContact CG2-CG2 4.16Å; I191-V195 WeakPolarHBondContact O-CG2 3.26Å; I191-V195 PolarHBondContact O-N 2.92Å; R193-V195 PolarHBondContact O-N 2.86Å; V195-T197 VanDerWaalsContact C-N 3.3Å; V195-T197 PolarHBondContact O-N 3.44Å; V195-L198 PolarHBondContact O-N 3.18Å; V195-F199 HydrophobicContact CG1-CD2 3.67Å; V195-F199 HydrophobicContact CG1-CE2 3.71Å; V195-F199 VanDerWaalsContact O-CD2 3.25Å; V195-F199 WeakPolarHBondContact O-CD2 3.46Å; V195-F199 PolarHBondContact O-N 3.48Å; V195-V236 HydrophobicContact CG2-CG1 4.03Å
196R92.7Very high90.9Very high120 Ų12050 Ų5045%0.45325%0.253SS..Hα-helixtrans-58.6-42.6178.6-176.4-166.470.4117.74.6111.7V139 Y192 R193 F194 F199 A200V139-R196 HydrophobicContact CG1-CB 4.11Å; Y192-R196 WeakPolarHBondContact O-CB 3.45Å; Y192-R196 PolarHBondContact O-N 3.36Å; R193-R196 PolarHBondContact O-N 2.9Å; F194-R196 PolarHBondContact O-N 2.86Å; R196-F199 PolarHBondContact O-N 3.26Å; R196-A200 VanDerWaalsContact O-CB 3.26Å; R196-A200 WeakPolarHBondContact O-CB 3.29Å; R196-A200 PolarHBondContact O-N 3.31Å
197T88.1Confident90.8Very high16 Ų1652.3 Ų52.310%0.09826%0.262CS..Hα-helixtrans-66.4-41-179.1-54.40000110.9R193 F194 V195 A200 A201 C264 D268R193-T197 WeakPolarHBondContact O-CB 3.27Å; R193-T197 PolarHBondContact O-N 3.32Å; R193-T197 PolarHBondContact O-OG1 3.48Å; F194-T197 PolarHBondContact O-N 3.4Å; V195-T197 VanDerWaalsContact C-N 3.3Å; V195-T197 PolarHBondContact O-N 3.44Å; T197-A200 PolarHBondContact O-N 3.48Å; T197-A201 VanDerWaalsContact O-CB 3.24Å; T197-A201 WeakPolarHBondContact O-CB 3.24Å; T197-A201 PolarHBondContact O-N 3.33Å; T197-C264 HydrophobicContact CG2-CB 3.93Å; T197-C264 VanDerWaalsContact CG2-SG 3.6Å; T197-D268 WeakPolarHBondContact CB-OD2 3.33Å; T197-D268 PolarHBondContact OG1-OD2 3.31Å
198L90Very high90.8Very high4 Ų449.7 Ų49.72%0.02125%0.249CC..Hα-helixtrans-62.2-48.1173.3-68.9173.6000112.3F194 V195 A200 A201 A202 L237 I240 I260F194-L198 HydrophobicContact CD1-CD1 3.98Å; F194-L198 HydrophobicContact CE1-CD1 3.5Å; F194-L198 VanDerWaalsContact CE1-CD1 3.5Å; F194-L198 HydrophobicContact CE2-CD1 4.28Å; F194-L198 HydrophobicContact CZ-CD1 3.67Å; F194-L198 HydrophobicContact CZ-CG 4.49Å; F194-L198 WeakPolarHBondContact O-CG 3.25Å; F194-L198 PolarHBondContact O-N 2.91Å; F194-L198 VanDerWaalsContact O-N 3.1Å; V195-L198 PolarHBondContact O-N 3.18Å; L198-A200 VanDerWaalsContact C-N 3.32Å; L198-A200 PolarHBondContact O-N 2.93Å; L198-A201 PolarHBondContact O-N 3.45Å; L198-A202 WeakPolarHBondContact O-CB 3.42Å; L198-A202 PolarHBondContact O-N 2.9Å; L198-L237 HydrophobicContact CD1-CD1 4.18Å; L198-L237 HydrophobicContact CD2-CD1 3.84Å; L198-I240 HydrophobicContact CB-CD1 4.19Å; L198-I240 HydrophobicContact CD1-CD1 3.63Å; L198-I260 HydrophobicContact CD2-CG2 3.99Å
199F90.9Very high90.9Very high6 Ų646.3 Ų46.33%0.02623%0.233CC..Hα-helixtrans-62.5-39.4178.8-89-107.7000112.3L135 V139 I142 V195 R196 Q203 L204 G209 I240L135-F199 HydrophobicContact CD1-CD1 3.8Å; L135-F199 HydrophobicContact CD1-CE1 4.3Å; V139-F199 HydrophobicContact CG2-CB 4.38Å; V139-F199 HydrophobicContact CG2-CD1 4.06Å; V139-F199 HydrophobicContact CG2-CG 4.06Å; I142-F199 HydrophobicContact CD1-CZ 4.19Å; V195-F199 HydrophobicContact CG1-CD2 3.67Å; V195-F199 HydrophobicContact CG1-CE2 3.71Å; V195-F199 VanDerWaalsContact O-CD2 3.25Å; V195-F199 WeakPolarHBondContact O-CD2 3.46Å; V195-F199 PolarHBondContact O-N 3.48Å; R196-F199 PolarHBondContact O-N 3.26Å; F199-Q203 WeakPolarHBondContact O-CA 3.5Å; F199-Q203 PolarHBondContact O-N 3.1Å; F199-L204 HydrophobicContact CD1-CB 3.56Å; F199-L204 HydrophobicContact CD1-CD1 4.36Å; F199-L204 HydrophobicContact CD2-CD1 4.32Å; F199-L204 HydrophobicContact CE1-CB 3.82Å; F199-L204 HydrophobicContact CE1-CD1 4.35Å; F199-L204 HydrophobicContact CE2-CD1 4.32Å; F199-L204 HydrophobicContact CG-CB 4.14Å; F199-L204 HydrophobicContact CG-CD1 4.34Å; F199-L204 HydrophobicContact CZ-CD1 4.3Å; F199-L204 PolarHBondContact O-N 3.35Å; F199-G209 VanDerWaalsContact CZ-CA 3.48Å; F199-I240 HydrophobicContact CD2-CD1 4.28Å; F199-I240 HydrophobicContact CE2-CD1 3.8Å; F199-I240 HydrophobicContact CE2-CG1 4.03Å
200A87.9Confident90.9Very high72 Ų7242.6 Ų42.660%0.59523%0.225SC*.Hα-helixtrans-68.6-43.3177.100000111.9R196 T197 L198 Q203R196-A200 VanDerWaalsContact O-CB 3.26Å; R196-A200 WeakPolarHBondContact O-CB 3.29Å; R196-A200 PolarHBondContact O-N 3.31Å; T197-A200 PolarHBondContact O-N 3.48Å; L198-A200 VanDerWaalsContact C-N 3.32Å; L198-A200 PolarHBondContact O-N 2.93Å; A200-Q203 PolarHBondContact O-N 2.92Å
201A84.3Confident91Very high46 Ų4641.8 Ų41.838%0.3822%0.219SC..Hα-helixtrans-68.9-38.3-178.800000112.7T197 L198 I260T197-A201 VanDerWaalsContact O-CB 3.24Å; T197-A201 WeakPolarHBondContact O-CB 3.24Å; T197-A201 PolarHBondContact O-N 3.33Å; L198-A201 PolarHBondContact O-N 3.45Å; A201-I260 HydrophobicContact CB-CB 4.41Å; A201-I260 HydrophobicContact CB-CG1 4.19Å; A201-I260 HydrophobicContact CB-CG2 3.82Å
202A84.5Confident91Very high21 Ų2141.8 Ų41.817%0.17422%0.219CC..THydrogen-bonded Turntrans-93.25.1178.800000113.7L198 L204 W253 I260L198-A202 WeakPolarHBondContact O-CB 3.42Å; L198-A202 PolarHBondContact O-N 2.9Å; A202-L204 HydrophobicContact CB-CD1 4.08Å; A202-L204 HydrophobicContact CB-CD2 3.96Å; A202-L204 HydrophobicContact CB-CG 3.71Å; A202-L204 PolarHBondContact O-N 3.42Å; A202-W253 HydrophobicContact CB-CZ3 4.28Å; A202-I260 HydrophobicContact CB-CD1 4.13Å
203Q86.8Confident91Very high176 Ų17640.9 Ų40.982%0.82222%0.217SC*.THydrogen-bonded Turntrans50.540.1-179.9-59.8-174.2-32.900114F199 A200F199-Q203 WeakPolarHBondContact O-CA 3.5Å; F199-Q203 PolarHBondContact O-N 3.1Å; A200-Q203 PolarHBondContact O-N 2.92Å
204L88.9Confident91.3Very high15 Ų1541.1 Ų41.18%0.07923%0.225CC..  trans-78147-173.1-58.5177.3000112.3F199 A202 C208 I240 W253F199-L204 HydrophobicContact CD1-CB 3.56Å; F199-L204 HydrophobicContact CD1-CD1 4.36Å; F199-L204 HydrophobicContact CD2-CD1 4.32Å; F199-L204 HydrophobicContact CE1-CB 3.82Å; F199-L204 HydrophobicContact CE1-CD1 4.35Å; F199-L204 HydrophobicContact CE2-CD1 4.32Å; F199-L204 HydrophobicContact CG-CB 4.14Å; F199-L204 HydrophobicContact CG-CD1 4.34Å; F199-L204 HydrophobicContact CZ-CD1 4.3Å; F199-L204 PolarHBondContact O-N 3.35Å; A202-L204 HydrophobicContact CB-CD1 4.08Å; A202-L204 HydrophobicContact CB-CD2 3.96Å; A202-L204 HydrophobicContact CB-CG 3.71Å; A202-L204 PolarHBondContact O-N 3.42Å; L204-C208 HydrophobicContact CB-CB 4.31Å; L204-I240 HydrophobicContact CD1-CG2 3.41Å; L204-I240 VanDerWaalsContact CD1-CG2 3.41Å; L204-W253 HydrophobicContact CD2-CH2 4.4Å
205T91.4Very high91.5Very high62 Ų6243.2 Ų43.238%0.3823%0.233SC..  trans-87.2171.1177.674.80000112.2E207 C208 G209T205-E207 VanDerWaalsContact C-N 3.31Å; T205-E207 WeakPolarHBondContact CB-OE2 3.41Å; T205-E207 PolarHBondContact O-N 3.47Å; T205-E207 PolarHBondContact OG1-OE2 3.39Å; T205-C208 WeakPolarHBondContact O-CB 3.07Å; T205-C208 PolarHBondContact O-N 3.44Å; T205-G209 PolarHBondContact O-N 3.26Å
206A92.6Very high91.6Very high3 Ų343.2 Ų43.23%0.02523%0.233CC..Hα-helixtrans-67.1-34-179.300000112.2P133 L135 T138 G209 I210P133-A206 HydrophobicContact CB-CB 3.64Å; P133-A206 HydrophobicContact CG-CB 3.74Å; L135-A206 HydrophobicContact CB-CB 4.43Å; L135-A206 HydrophobicContact CD1-CB 4.38Å; T138-A206 HydrophobicContact CG2-CB 4.37Å; T138-A206 WeakPolarHBondContact CG2-O 3.25Å; A206-G209 WeakPolarHBondContact O-CA 3.19Å; A206-G209 PolarHBondContact O-N 3.4Å; A206-I210 PolarHBondContact O-N 2.94Å
207E91.4Very high91.8Very high62 Ų6241.9 Ų41.929%0.2923%0.232SC..Hα-helixtrans-60.5-45.3176.5-5783.5175.500110.9P133 T205 G209 I210 I211 W247P133-E207 HydrophobicContact CG-CG 4.43Å; P133-E207 VanDerWaalsContact CG-OE1 3.32Å; P133-E207 WeakPolarHBondContact CG-OE1 3.24Å; T205-E207 VanDerWaalsContact C-N 3.31Å; T205-E207 WeakPolarHBondContact CB-OE2 3.41Å; T205-E207 PolarHBondContact O-N 3.47Å; T205-E207 PolarHBondContact OG1-OE2 3.39Å; E207-G209 PolarHBondContact O-N 3.41Å; E207-I210 PolarHBondContact O-N 3.03Å; E207-I211 WeakPolarHBondContact O-CG1 3.21Å; E207-I211 PolarHBondContact O-N 3.42Å; E207-W247 HydrophobicContact CB-CD2 4.37Å; E207-W247 HydrophobicContact CB-CH2 3.99Å; E207-W247 HydrophobicContact CB-CZ2 3.39Å; E207-W247 HydrophobicContact CG-CH2 4.25Å; E207-W247 HydrophobicContact CG-CZ2 3.67Å
208C92.5Very high92.1Very high2 Ų247.3 Ų47.31%0.01425%0.25CS..Hα-helixtrans-57.3-34.1173.1-172.80000111.8L204 T205 T212L204-C208 HydrophobicContact CB-CB 4.31Å; T205-C208 WeakPolarHBondContact O-CB 3.07Å; T205-C208 PolarHBondContact O-N 3.44Å; C208-T212 WeakPolarHBondContact O-CB 3.42Å; C208-T212 PolarHBondContact O-N 3.39Å; C208-T212 PolarHBondContact O-OG1 3.4Å
209G94.1Very high92.4Very high0 Ų049.4 Ų49.40%026%0.261CS..Hα-helixtrans-67.5-40.3173.800000114.6I142 F199 T205 A206 E207 I211 T212 L213I142-G209 VanDerWaalsContact CD1-O 3.26Å; I142-G209 WeakPolarHBondContact CD1-O 3.3Å; F199-G209 VanDerWaalsContact CZ-CA 3.48Å; T205-G209 PolarHBondContact O-N 3.26Å; A206-G209 WeakPolarHBondContact O-CA 3.19Å; A206-G209 PolarHBondContact O-N 3.4Å; E207-G209 PolarHBondContact O-N 3.41Å; G209-I211 VanDerWaalsContact C-N 3.35Å; G209-T212 WeakPolarHBondContact O-CB 3.28Å; G209-T212 PolarHBondContact O-N 2.78Å; G209-L213 PolarHBondContact O-N 3.02Å
210I94.3Very high92.5Very high96 Ų9650 Ų5049%0.49227%0.265SS..Hα-helixtrans-63.2-45.6174.7-61.5169.7000109.6T138 A206 E207 T212 L213 V214T138-I210 HydrophobicContact CG2-CG1 4.29Å; A206-I210 PolarHBondContact O-N 2.94Å; E207-I210 PolarHBondContact O-N 3.03Å; I210-T212 VanDerWaalsContact C-N 3.33Å; I210-T212 PolarHBondContact O-N 3.41Å; I210-L213 PolarHBondContact O-N 2.87Å; I210-V214 WeakPolarHBondContact O-CG2 3.29Å; I210-V214 PolarHBondContact O-N 3.38Å; I210-V214 VanDerWaalsContact O-N 3.13Å
211I94.2Very high92.8Very high36 Ų3651.2 Ų51.219%0.18527%0.265CS..Hα-helixtrans-61.8-41.4178.4-63.2166.1000111.3E207 G209 L213 V214 Y215 A243 W247E207-I211 WeakPolarHBondContact O-CG1 3.21Å; E207-I211 PolarHBondContact O-N 3.42Å; G209-I211 VanDerWaalsContact C-N 3.35Å; I211-L213 VanDerWaalsContact C-N 3.31Å; I211-L213 PolarHBondContact O-N 3.43Å; I211-V214 WeakPolarHBondContact O-CB 3.45Å; I211-V214 PolarHBondContact O-N 3.24Å; I211-Y215 HydrophobicContact CG2-CD2 4.05Å; I211-Y215 HydrophobicContact CG2-CE1 4.45Å; I211-Y215 HydrophobicContact CG2-CE2 3.69Å; I211-Y215 PolarHBondContact O-N 2.94Å; I211-A243 HydrophobicContact CB-CB 4.16Å; I211-A243 HydrophobicContact CG2-CB 3.78Å; I211-W247 HydrophobicContact CD1-CB 4.06Å; I211-W247 HydrophobicContact CD1-CD2 3.75Å; I211-W247 HydrophobicContact CD1-CE3 3.3Å; I211-W247 HydrophobicContact CD1-CG 4.08Å; I211-W247 HydrophobicContact CD1-CZ3 3.99Å
212T95.1Very high93.3Very high0 Ų056.9 Ų56.90%028%0.278CS..Hα-helixtrans-55-47.7175.4-61.80000111.1C208 G209 I210 V214 Y215 I216 A239 I240 A243C208-T212 WeakPolarHBondContact O-CB 3.42Å; C208-T212 PolarHBondContact O-N 3.39Å; C208-T212 PolarHBondContact O-OG1 3.4Å; G209-T212 WeakPolarHBondContact O-CB 3.28Å; G209-T212 PolarHBondContact O-N 2.78Å; I210-T212 VanDerWaalsContact C-N 3.33Å; I210-T212 PolarHBondContact O-N 3.41Å; T212-V214 VanDerWaalsContact C-N 3.35Å; T212-V214 PolarHBondContact O-N 3.39Å; T212-Y215 PolarHBondContact O-N 2.93Å; T212-I216 HydrophobicContact CG2-CD1 4.09Å; T212-I216 WeakPolarHBondContact O-CG1 3.29Å; T212-I216 PolarHBondContact O-N 2.86Å; T212-A239 HydrophobicContact CG2-CB 4.04Å; T212-I240 HydrophobicContact CG2-CB 4.45Å; T212-I240 HydrophobicContact CG2-CD1 4.49Å; T212-I240 HydrophobicContact CG2-CG1 3.46Å; T212-I240 VanDerWaalsContact CG2-CG1 3.46Å; T212-A243 WeakPolarHBondContact OG1-CB 3.25Å
213L95.9Very high93.6Very high37 Ų3757.9 Ų57.919%0.19429%0.286CS..Hα-helixtrans-63.3-42.2-180-175.860.6000111.6A145 G209 I210 I211 Y215 I216 E217A145-L213 HydrophobicContact CB-CD1 3.59Å; A145-L213 HydrophobicContact CB-CD2 4.14Å; G209-L213 PolarHBondContact O-N 3.02Å; I210-L213 PolarHBondContact O-N 2.87Å; I211-L213 VanDerWaalsContact C-N 3.31Å; I211-L213 PolarHBondContact O-N 3.43Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 3.26Å; L213-I216 PolarHBondContact O-N 3.13Å; L213-E217 PolarHBondContact O-N 3.48Å
214V95.9Very high93.8Very high64 Ų6455.2 Ų55.239%0.38827%0.273SS..Hα-helixtrans-58.9-41.7174.2173.50000111.4I210 I211 T212 E217 R218I210-V214 WeakPolarHBondContact O-CG2 3.29Å; I210-V214 PolarHBondContact O-N 3.38Å; I210-V214 VanDerWaalsContact O-N 3.13Å; I211-V214 WeakPolarHBondContact O-CB 3.45Å; I211-V214 PolarHBondContact O-N 3.24Å; T212-V214 VanDerWaalsContact C-N 3.35Å; T212-V214 PolarHBondContact O-N 3.39Å; V214-E217 PolarHBondContact O-N 3.29Å; V214-R218 HydrophobicContact CG1-CG 4.37Å; V214-R218 WeakPolarHBondContact O-CB 3.35Å; V214-R218 WeakPolarHBondContact O-CG 3.18Å; V214-R218 PolarHBondContact O-N 3.22Å
215Y96.4Very high94Very high69 Ų6954.7 Ų54.727%0.27127%0.271SS..Hα-helixtrans-66.8-38176.9-74.4-20.3000113.3I211 T212 L213 L219 L242 A243 V246I211-Y215 HydrophobicContact CG2-CD2 4.05Å; I211-Y215 HydrophobicContact CG2-CE1 4.45Å; I211-Y215 HydrophobicContact CG2-CE2 3.69Å; I211-Y215 PolarHBondContact O-N 2.94Å; T212-Y215 PolarHBondContact O-N 2.93Å; L213-Y215 VanDerWaalsContact C-N 3.31Å; L213-Y215 PolarHBondContact O-N 3.26Å; Y215-L219 VanDerWaalsContact O-CB 3.27Å; Y215-L219 WeakPolarHBondContact O-CB 3.47Å; Y215-L219 PolarHBondContact O-N 3.49Å; Y215-L242 HydrophobicContact CD2-CB 4.06Å; Y215-L242 HydrophobicContact CE2-CB 4.05Å; Y215-A243 HydrophobicContact CD2-CB 4.07Å; Y215-A243 HydrophobicContact CE2-CB 4.17Å; Y215-V246 WeakPolarHBondContact OH-CG2 3.17Å
216I96.6Very high94.1Very high0 Ų052.5 Ų52.50%026%0.257CS..Hα-helixtrans-62.8-52.2174-66.5169.3000109.8I146 T212 L213 R218 L219 L220 I235 V236 A239I146-I216 HydrophobicContact CD1-CD1 4.33Å; I146-I216 HydrophobicContact CG1-CD1 4.25Å; T212-I216 HydrophobicContact CG2-CD1 4.09Å; T212-I216 WeakPolarHBondContact O-CG1 3.29Å; T212-I216 PolarHBondContact O-N 2.86Å; L213-I216 PolarHBondContact O-N 3.13Å; I216-R218 VanDerWaalsContact C-N 3.31Å; I216-R218 PolarHBondContact O-N 3.35Å; I216-L219 PolarHBondContact O-N 2.96Å; I216-L219 VanDerWaalsContact O-N 3.14Å; I216-L220 HydrophobicContact CG2-CD1 3.84Å; I216-L220 HydrophobicContact CG2-CG 4.24Å; I216-L220 VanDerWaalsContact O-CG 3.3Å; I216-L220 WeakPolarHBondContact O-CG 3.45Å; I216-L220 PolarHBondContact O-N 3.47Å; I216-I235 HydrophobicContact CG1-CG2 4.35Å; I216-I235 HydrophobicContact CG2-CG2 4.46Å; I216-V236 HydrophobicContact CD1-CG2 4Å; I216-A239 HydrophobicContact CD1-CB 4.24Å; I216-A239 HydrophobicContact CG1-CB 3.58Å
217E95.6Very high94.2Very high92 Ų9252.5 Ų52.543%0.4326%0.256SS..Hα-helixtrans-58.6-42.7-179.3-72.8-178.217400112.2L213 V214 T221L213-E217 PolarHBondContact O-N 3.48Å; V214-E217 PolarHBondContact O-N 3.29Å; E217-T221 WeakPolarHBondContact O-CB 3.11Å; E217-T221 PolarHBondContact O-N 2.7Å; E217-T221 PolarHBondContact O-OG1 2.88Å
218R96Very high94.2Very high130 Ų13049.8 Ų49.849%0.49124%0.244SC..Hα-helixtrans-65.3-41.4176.5-72.7176.170.7121.21.9112.2V214 I216 T221 Y222V214-R218 HydrophobicContact CG1-CG 4.37Å; V214-R218 WeakPolarHBondContact O-CB 3.35Å; V214-R218 WeakPolarHBondContact O-CG 3.18Å; V214-R218 PolarHBondContact O-N 3.22Å; I216-R218 VanDerWaalsContact C-N 3.31Å; I216-R218 PolarHBondContact O-N 3.35Å; R218-T221 PolarHBondContact O-N 2.72Å; R218-Y222 VanDerWaalsContact O-CB 3.3Å; R218-Y222 WeakPolarHBondContact O-CB 3.32Å; R218-Y222 PolarHBondContact O-N 2.93Å
219L94.5Very high94.1Very high49 Ų4950 Ų5026%0.25725%0.246SC..Hα-helixtrans-62.1-49.9177.1178.966.3000110.9F165 Y215 I216 T221 Y222 A223 I225 I235F165-L219 HydrophobicContact CE2-CD1 4.41Å; F165-L219 HydrophobicContact CE2-CD2 4.12Å; F165-L219 HydrophobicContact CZ-CD1 4.46Å; F165-L219 HydrophobicContact CZ-CD2 3.95Å; Y215-L219 VanDerWaalsContact O-CB 3.27Å; Y215-L219 WeakPolarHBondContact O-CB 3.47Å; Y215-L219 PolarHBondContact O-N 3.49Å; I216-L219 PolarHBondContact O-N 2.96Å; I216-L219 VanDerWaalsContact O-N 3.14Å; L219-T221 VanDerWaalsContact C-N 3.27Å; L219-T221 PolarHBondContact O-N 2.84Å; L219-Y222 PolarHBondContact O-N 3.27Å; L219-A223 HydrophobicContact CD1-CB 4Å; L219-A223 VanDerWaalsContact O-CB 3.29Å; L219-A223 WeakPolarHBondContact O-CB 3.34Å; L219-A223 PolarHBondContact O-N 3.08Å; L219-I225 HydrophobicContact CD1-CD1 4.33Å; L219-I225 HydrophobicContact CG-CD1 4.39Å; L219-I235 HydrophobicContact CD2-CG1 4.24Å; L219-I235 HydrophobicContact CD2-CG2 3.83Å
220L93.8Very high93.9Very high18 Ų1852.9 Ų52.99%0.09426%0.259CS..Hα-helixtrans-60.6-38.3179.4-62.6176.6000111.7I216 E224 I225 L227I216-L220 HydrophobicContact CG2-CD1 3.84Å; I216-L220 HydrophobicContact CG2-CG 4.24Å; I216-L220 VanDerWaalsContact O-CG 3.3Å; I216-L220 WeakPolarHBondContact O-CG 3.45Å; I216-L220 PolarHBondContact O-N 3.47Å; L220-E224 WeakPolarHBondContact O-CA 3.43Å; L220-E224 PolarHBondContact O-N 2.65Å; L220-I225 HydrophobicContact CD2-CB 4.32Å; L220-I225 HydrophobicContact CD2-CG2 4.35Å; L220-I225 WeakPolarHBondContact CD2-O 3.39Å; L220-I225 PolarHBondContact O-N 2.89Å; L220-L227 HydrophobicContact CD1-CB 4.4Å; L220-L227 HydrophobicContact CD1-CD1 4.36Å; L220-L227 HydrophobicContact CD2-CB 4.24Å; L220-L227 HydrophobicContact CD2-CD1 3.81Å
221T93.2Very high93.8Very high98 Ų9848.3 Ų48.360%0.60124%0.236SC*.Hα-helixtrans-74.2-48.1-179.8-54.20000112.5E217 R218 L219E217-T221 WeakPolarHBondContact O-CB 3.11Å; E217-T221 PolarHBondContact O-N 2.7Å; E217-T221 PolarHBondContact O-OG1 2.88Å; R218-T221 PolarHBondContact O-N 2.72Å; L219-T221 VanDerWaalsContact C-N 3.27Å; L219-T221 PolarHBondContact O-N 2.84Å
222Y94.7Very high93.7Very high165 Ų16547 Ų4765%0.64723%0.228SC*.Hα-helixtrans-84.8-35.9-171.4-66.6-14.3000113.8R218 L219 E224R218-Y222 VanDerWaalsContact O-CB 3.3Å; R218-Y222 WeakPolarHBondContact O-CB 3.32Å; R218-Y222 PolarHBondContact O-N 2.93Å; L219-Y222 PolarHBondContact O-N 3.27Å; Y222-E224 VanDerWaalsContact C-N 3.26Å
223A92.3Very high93.6Very high42 Ų4247.2 Ų47.235%0.34723%0.229SC..SBendtrans-87.9-0.2175.500000112.1M162 L219 I225M162-A223 HydrophobicContact SD-CB 4.44Å; L219-A223 HydrophobicContact CD1-CB 4Å; L219-A223 VanDerWaalsContact O-CB 3.29Å; L219-A223 WeakPolarHBondContact O-CB 3.34Å; L219-A223 PolarHBondContact O-N 3.08Å; A223-I225 HydrophobicContact CB-CD1 3.64Å; A223-I225 HydrophobicContact CB-CG1 3.74Å; A223-I225 WeakPolarHBondContact O-CG1 3.47Å; A223-I225 PolarHBondContact O-N 2.88Å
224E91.4Very high93.3Very high119 Ų11948.4 Ų48.456%0.55623%0.231SC*.  trans55.536.1179.4-71.9-163.8154.700113R160 L220 Y222R160-E224 WeakPolarHBondContact CB-O 3.31Å; R160-E224 WeakPolarHBondContact CD-O 3.43Å; R160-E224 PolarHBondContact NE-O 2.93Å; R160-E224 VanDerWaalsContact NH1-CB 3.34Å; R160-E224 PolarHBondContact NH1-O 3.22Å; R160-E224 IonicContact NH1-OE2 3.85Å; L220-E224 WeakPolarHBondContact O-CA 3.43Å; L220-E224 PolarHBondContact O-N 2.65Å; Y222-E224 VanDerWaalsContact C-N 3.26Å
225I92.2Very high93.2Very high4 Ų445.4 Ų45.42%0.02121%0.213CC..PPolyproline II helixtrans-95.2142.3-178.6-57.8173000109.4R160 M162 F165 L219 L220 A223 I235R160-I225 CarbonylContact O-C 3.43Å; R160-I225 WeakPolarHBondContact O-CA 3.24Å; R160-I225 WeakPolarHBondContact O-CG2 3.46Å; M162-I225 HydrophobicContact CB-CD1 4.36Å; M162-I225 HydrophobicContact CG-CD1 3.65Å; M162-I225 HydrophobicContact CG-CG1 3.96Å; M162-I225 HydrophobicContact SD-CD1 3.41Å; M162-I225 WeakPolarHBondContact SD-CD1 3.46Å; M162-I225 HydrophobicContact SD-CG1 4.11Å; F165-I225 HydrophobicContact CD2-CD1 3.97Å; F165-I225 HydrophobicContact CE2-CD1 3.81Å; L219-I225 HydrophobicContact CD1-CD1 4.33Å; L219-I225 HydrophobicContact CG-CD1 4.39Å; L220-I225 HydrophobicContact CD2-CB 4.32Å; L220-I225 HydrophobicContact CD2-CG2 4.35Å; L220-I225 WeakPolarHBondContact CD2-O 3.39Å; L220-I225 PolarHBondContact O-N 2.89Å; A223-I225 HydrophobicContact CB-CD1 3.64Å; A223-I225 HydrophobicContact CB-CG1 3.74Å; A223-I225 WeakPolarHBondContact O-CG1 3.47Å; A223-I225 PolarHBondContact O-N 2.88Å; I225-I235 HydrophobicContact CG2-CD1 4.08Å
226D93.8Very high93.1Very high17 Ų1742.1 Ų42.19%0.09120%0.2CC..PPolyproline II helixtrans-99.7138.8170.8-57.4-49.7000110.2N155 E159 R160 C228 N231N155-D226 PolarHBondContact ND2-OD2 3.47Å; E159-D226 HydrophobicContact CB-CB 4.35Å; R160-D226 IonicContact CZ-OD1 2.88Å; R160-D226 PolarHBondContact N-OD2 3.46Å; R160-D226 VanDerWaalsContact N-OD2 3.08Å; R160-D226 IonicContact NE-OD1 2.84Å; R160-D226 IonicContact NE-OD2 3.65Å; R160-D226 PolarHBondContact NE-OD2 2.88Å; R160-D226 IonicContact NH2-OD1 3.8Å; R160-D226 PolarHBondContact NH2-OD1 3.02Å; R160-D226 IonicContact NH2-OD2 2.91Å; R160-D226 PolarHBondContact O-N 3.44Å; D226-C228 PolarHBondContact O-N 3.05Å; D226-C228 PolarHBondContact O-SG 3.48Å; D226-N231 PolarHBondContact O-ND2 2.74Å
227L94Very high92.8Very high3 Ų343 Ų432%0.01621%0.205CC..PPolyproline II helixtrans-78.8122.9178.5-14680.4000110.1I146 H149 I150 R153 L220 W232 I235I146-L227 HydrophobicContact CB-CD2 4.42Å; I146-L227 HydrophobicContact CG2-CD2 3.69Å; H149-L227 HydrophobicContact CB-CB 4.26Å; H149-L227 HydrophobicContact CB-CD2 4.18Å; I150-L227 HydrophobicContact CD1-CD2 4.14Å; I150-L227 HydrophobicContact CG1-CB 4.07Å; I150-L227 HydrophobicContact CG1-CD2 3.71Å; I150-L227 HydrophobicContact CG1-CG 4.04Å; R153-L227 WeakPolarHBondContact CD-O 3.45Å; L220-L227 HydrophobicContact CD1-CB 4.4Å; L220-L227 HydrophobicContact CD1-CD1 4.36Å; L220-L227 HydrophobicContact CD2-CB 4.24Å; L220-L227 HydrophobicContact CD2-CD1 3.81Å; L227-W232 HydrophobicContact CD2-CB 4.1Å; L227-W232 HydrophobicContact CG-CB 3.98Å; L227-I235 HydrophobicContact CD1-CB 4.08Å; L227-I235 HydrophobicContact CD1-CD1 3.7Å; L227-I235 HydrophobicContact CD1-CG1 4.5Å; L227-I235 HydrophobicContact CD1-CG2 3.76Å
228C92.3Very high92.6Very high5 Ų539.8 Ų39.83%0.03420%0.196CC..  trans-133.1161.8-168.6-54.20000111.6E159 D226 E230 N231 W232E159-C228 WeakPolarHBondContact CB-SG 3.39Å; E159-C228 WeakPolarHBondContact CG-SG 3.21Å; D226-C228 PolarHBondContact O-N 3.05Å; D226-C228 PolarHBondContact O-SG 3.48Å; C228-E230 PolarHBondContact O-N 3.2Å; C228-E230 VanDerWaalsContact O-N 3.12Å; C228-N231 PolarHBondContact N-OD1 3.12Å; C228-N231 PolarHBondContact O-N 3.15Å; C228-N231 VanDerWaalsContact O-N 3.15Å; C228-N231 PolarHBondContact O-OD1 3.02Å; C228-W232 WeakPolarHBondContact O-CB 3.31Å; C228-W232 VanDerWaalsContact O-CD1 3.31Å; C228-W232 PolarHBondContact O-N 2.83Å
229P90.3Very high92.5Very high7 Ų733.9 Ų33.95%0.04518%0.175CC..THydrogen-bonded Turntrans-57.5-28.1176.8-22.133.8000113.4L182 D185 W232L182-P229 WeakPolarHBondContact O-CB 3.37Å; D185-P229 WeakPolarHBondContact OD1-CG 3.21Å; P229-W232 PolarHBondContact O-NE1 3.29Å
230E89Confident92.4Very high60 Ų6031.9 Ų31.928%0.2816%0.164SC..THydrogen-bonded Turntrans-80.6-21.7-178.4-52.6-168.4136.500114.4E167 Q168 L182 C228E167-E230 VanDerWaalsContact CB-O 3.28Å; E167-E230 WeakPolarHBondContact CB-O 3.29Å; E167-E230 WeakPolarHBondContact CG-O 2.81Å; E167-E230 PolarHBondContact N-O 3.24Å; Q168-E230 PolarHBondContact NE2-OE1 2.92Å; L182-E230 HydrophobicContact CB-CG 4.17Å; L182-E230 VanDerWaalsContact O-CG 3.25Å; L182-E230 WeakPolarHBondContact O-CG 3.2Å; C228-E230 PolarHBondContact O-N 3.2Å; C228-E230 VanDerWaalsContact O-N 3.12Å
231N91.7Very high92.1Very high0 Ų033.5 Ų33.50%017%0.172CC..THydrogen-bonded Turntrans-124.4-16.9-169.170.523.8000114.8S161 F165 D226 C228 R233 R234 I235S161-N231 PolarHBondContact OG-ND2 3.46Å; F165-N231 HydrophobicContact CB-CB 4.04Å; F165-N231 VanDerWaalsContact O-CA 3.26Å; F165-N231 WeakPolarHBondContact O-CA 3.21Å; F165-N231 WeakPolarHBondContact O-CB 3.07Å; D226-N231 PolarHBondContact O-ND2 2.74Å; C228-N231 PolarHBondContact N-OD1 3.12Å; C228-N231 PolarHBondContact O-N 3.15Å; C228-N231 VanDerWaalsContact O-N 3.15Å; C228-N231 PolarHBondContact O-OD1 3.02Å; N231-R233 VanDerWaalsContact C-N 3.34Å; N231-R233 PolarHBondContact O-N 3.04Å; N231-R234 PolarHBondContact O-N 3.48Å; N231-R234 VanDerWaalsContact O-N 3.14Å; N231-I235 HydrophobicContact CB-CD1 4.15Å; N231-I235 PolarHBondContact O-N 2.84Å
232W93.9Very high91.9Very high7 Ų733.8 Ų33.83%0.02717%0.169CC..Hα-helixtrans-61.3-38.4-16871.9-82.1000113.1I146 I150 P186 T190 I191 F194 L227 C228 P229 R234 V236I146-W232 HydrophobicContact CG2-CE3 4.34Å; I150-W232 HydrophobicContact CD1-CB 3.81Å; I150-W232 HydrophobicContact CD1-CD2 4.45Å; I150-W232 HydrophobicContact CD1-CG 3.91Å; P186-W232 HydrophobicContact CB-CZ2 4Å; P186-W232 HydrophobicContact CG-CD2 4.24Å; P186-W232 HydrophobicContact CG-CG 4.42Å; P186-W232 HydrophobicContact CG-CZ2 4.17Å; T190-W232 HydrophobicContact CG2-CZ2 4.42Å; I191-W232 HydrophobicContact CB-CH2 4.42Å; I191-W232 HydrophobicContact CB-CZ3 4.14Å; I191-W232 HydrophobicContact CG1-CE3 4.16Å; I191-W232 HydrophobicContact CG1-CH2 4Å; I191-W232 HydrophobicContact CG1-CZ2 4.46Å; I191-W232 HydrophobicContact CG1-CZ3 3.84Å; I191-W232 HydrophobicContact CG2-CZ3 4.07Å; F194-W232 HydrophobicContact CB-CH2 3.95Å; F194-W232 HydrophobicContact CB-CZ3 4.16Å; F194-W232 HydrophobicContact CD1-CH2 4.16Å; F194-W232 AromaticContact CD1-CZ3 3.7Å; F194-W232 HydrophobicContact CD1-CZ3 3.7Å; F194-W232 HydrophobicContact CE1-CZ3 4.4Å; F194-W232 HydrophobicContact CG-CH2 4.11Å; F194-W232 HydrophobicContact CG-CZ3 4.12Å; L227-W232 HydrophobicContact CD2-CB 4.1Å; L227-W232 HydrophobicContact CG-CB 3.98Å; C228-W232 WeakPolarHBondContact O-CB 3.31Å; C228-W232 VanDerWaalsContact O-CD1 3.31Å; C228-W232 PolarHBondContact O-N 2.83Å; P229-W232 PolarHBondContact O-NE1 3.29Å; W232-R234 VanDerWaalsContact C-N 3.34Å; W232-R234 PolarHBondContact O-N 3.4Å; W232-V236 HydrophobicContact CE3-CG2 4.38Å; W232-V236 VanDerWaalsContact O-CB 3.25Å; W232-V236 WeakPolarHBondContact O-CB 3.33Å; W232-V236 WeakPolarHBondContact O-CG2 3.46Å; W232-V236 PolarHBondContact O-N 2.96Å
233R91.5Very high91.7Very high6 Ų625.9 Ų25.92%0.02314%0.138CC..Hα-helixtrans-68.7-37.5-178.6-64.5171.6-82.7138.9-4.7111E167 I172 Y181 F194 N231 L237E167-R233 VanDerWaalsContact OE1-CB 3.31Å; E167-R233 WeakPolarHBondContact OE1-CB 3.41Å; E167-R233 IonicContact OE1-CZ 2.75Å; E167-R233 IonicContact OE1-NE 3.42Å; E167-R233 PolarHBondContact OE1-NE 2.75Å; E167-R233 IonicContact OE1-NH1 2.6Å; E167-R233 IonicContact OE1-NH2 2.88Å; E167-R233 PolarHBondContact OE1-NH2 2.8Å; E167-R233 IonicContact OE2-CZ 2.89Å; E167-R233 IonicContact OE2-NE 3.85Å; E167-R233 PolarHBondContact OE2-NE 3.26Å; E167-R233 IonicContact OE2-NH1 3.76Å; E167-R233 PolarHBondContact OE2-NH1 3.08Å; E167-R233 IonicContact OE2-NH2 3.87Å; E167-R233 PolarHBondContact OE2-NH2 2.99Å; I172-R233 HydrophobicContact CD1-CB 3.4Å; Y181-R233 WeakPolarHBondContact OH-CD 3.47Å; Y181-R233 PolarHBondContact OH-NE 2.98Å; Y181-R233 VanDerWaalsContact OH-NE 3.1Å; Y181-R233 PolarHBondContact OH-NH1 2.94Å; F194-R233 HydrophobicContact CD1-CG 4.41Å; F194-R233 HydrophobicContact CD2-CG 4.5Å; F194-R233 HydrophobicContact CE1-CB 3.96Å; F194-R233 HydrophobicContact CE1-CG 4.18Å; F194-R233 HydrophobicContact CE2-CB 4.25Å; F194-R233 HydrophobicContact CE2-CG 4.28Å; F194-R233 HydrophobicContact CZ-CB 3.72Å; F194-R233 HydrophobicContact CZ-CG 4.11Å; N231-R233 VanDerWaalsContact C-N 3.34Å; N231-R233 PolarHBondContact O-N 3.04Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 PolarHBondContact O-N 3.24Å
234R90.4Very high91.5Very high61 Ų6124.1 Ų24.123%0.2312%0.123CC..Hα-helixtrans-67.8-45.7178.3-76.9-166.6157.4-95-16.9111.9F165 E167 H170 P171 I172 N231 W232 L237 G238F165-R234 VanDerWaalsContact C-CD 3.45Å; F165-R234 HydrophobicContact CB-CB 4.26Å; F165-R234 HydrophobicContact CD1-CB 4.17Å; F165-R234 WeakPolarHBondContact O-CB 3.41Å; F165-R234 WeakPolarHBondContact O-CD 3.45Å; E167-R234 HydrophobicContact CG-CG 3.64Å; H170-R234 PolarHBondContact O-NE 3.19Å; H170-R234 PolarHBondContact O-NH2 3.14Å; P171-R234 PolarHBondContact O-NH2 3.04Å; I172-R234 HydrophobicContact CD1-CB 4.42Å; I172-R234 HydrophobicContact CD1-CG 3.63Å; I172-R234 HydrophobicContact CG1-CG 3.75Å; N231-R234 PolarHBondContact O-N 3.48Å; N231-R234 VanDerWaalsContact O-N 3.14Å; W232-R234 VanDerWaalsContact C-N 3.34Å; W232-R234 PolarHBondContact O-N 3.4Å; R234-L237 PolarHBondContact O-N 3.44Å; R234-G238 PolarHBondContact O-N 3.45Å
235I93.6Very high91Very high1 Ų124.8 Ų24.81%0.00512%0.124CC..Hα-helixtrans-60.5-48.5176.8-71.6171.5000110F165 I216 L219 I225 L227 N231 G238 A239F165-I235 HydrophobicContact CB-CD1 4.37Å; F165-I235 HydrophobicContact CB-CG1 3.95Å; F165-I235 HydrophobicContact CD1-CG1 3.8Å; F165-I235 HydrophobicContact CD2-CD1 4.38Å; F165-I235 HydrophobicContact CD2-CG1 4.02Å; F165-I235 HydrophobicContact CE1-CG1 4.29Å; F165-I235 HydrophobicContact CE2-CG1 4.5Å; F165-I235 HydrophobicContact CG-CD1 4.32Å; F165-I235 HydrophobicContact CG-CG1 3.65Å; I216-I235 HydrophobicContact CG1-CG2 4.35Å; I216-I235 HydrophobicContact CG2-CG2 4.46Å; L219-I235 HydrophobicContact CD2-CG1 4.24Å; L219-I235 HydrophobicContact CD2-CG2 3.83Å; I225-I235 HydrophobicContact CG2-CD1 4.08Å; L227-I235 HydrophobicContact CD1-CB 4.08Å; L227-I235 HydrophobicContact CD1-CD1 3.7Å; L227-I235 HydrophobicContact CD1-CG1 4.5Å; L227-I235 HydrophobicContact CD1-CG2 3.76Å; N231-I235 HydrophobicContact CB-CD1 4.15Å; N231-I235 PolarHBondContact O-N 2.84Å; I235-G238 PolarHBondContact O-N 3.14Å; I235-A239 VanDerWaalsContact O-CB 3.28Å; I235-A239 WeakPolarHBondContact O-CB 3.41Å; I235-A239 PolarHBondContact O-N 3.5Å
236V94.3Very high90.7Very high0 Ų029.2 Ų29.20%015%0.152CC..Hα-helixtrans-62.9-46.1179.6170.40000111.2I146 F194 V195 I216 W232 A239 I240I146-V236 HydrophobicContact CD1-CG1 4.19Å; I146-V236 HydrophobicContact CD1-CG2 3.5Å; I146-V236 HydrophobicContact CG1-CG2 4.04Å; I146-V236 HydrophobicContact CG2-CG2 4.32Å; F194-V236 HydrophobicContact CD1-CG1 4.22Å; F194-V236 HydrophobicContact CE1-CB 4.24Å; F194-V236 HydrophobicContact CE1-CG1 3.95Å; V195-V236 HydrophobicContact CG2-CG1 4.03Å; I216-V236 HydrophobicContact CD1-CG2 4Å; W232-V236 HydrophobicContact CE3-CG2 4.38Å; W232-V236 VanDerWaalsContact O-CB 3.25Å; W232-V236 WeakPolarHBondContact O-CB 3.33Å; W232-V236 WeakPolarHBondContact O-CG2 3.46Å; W232-V236 PolarHBondContact O-N 2.96Å; V236-A239 PolarHBondContact O-N 3.42Å; V236-I240 HydrophobicContact CG1-CD1 3.74Å; V236-I240 HydrophobicContact CG1-CG1 4.48Å; V236-I240 WeakPolarHBondContact O-CB 3.49Å; V236-I240 VanDerWaalsContact O-CG1 3.24Å; V236-I240 WeakPolarHBondContact O-CG1 3.47Å; V236-I240 PolarHBondContact O-N 2.84Å
237L91.3Very high90.2Very high20 Ų2035 Ų3511%0.10517%0.172CC..Hα-helixtrans-59.3-51.1176.5175.465.9000111.2I172 F194 L198 R233 R234 A239 I240 M241 L261I172-L237 HydrophobicContact CD1-CD2 4.31Å; F194-L237 HydrophobicContact CZ-CB 4.45Å; L198-L237 HydrophobicContact CD1-CD1 4.18Å; L198-L237 HydrophobicContact CD2-CD1 3.84Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 PolarHBondContact O-N 3.24Å; R234-L237 PolarHBondContact O-N 3.44Å; L237-A239 VanDerWaalsContact C-N 3.33Å; L237-A239 PolarHBondContact O-N 3.13Å; L237-I240 PolarHBondContact O-N 3.41Å; L237-M241 HydrophobicContact CD1-CG 4.25Å; L237-M241 HydrophobicContact CD1-SD 4.11Å; L237-M241 HydrophobicContact CG-CG 4.47Å; L237-M241 HydrophobicContact CG-SD 3.91Å; L237-M241 WeakPolarHBondContact O-CG 3.39Å; L237-M241 PolarHBondContact O-N 3.03Å; L237-L261 HydrophobicContact CD1-CD2 3.68Å; L237-L261 HydrophobicContact CD2-CD1 4.14Å; L237-L261 HydrophobicContact CD2-CD2 3.55Å; L237-L261 HydrophobicContact CD2-CG 4.43Å; L237-L261 HydrophobicContact CG-CD2 4.25Å
238G90.7Very high89.2Confident24 Ų2438.6 Ų38.625%0.24719%0.191CC..Hα-helixtrans-60.1-42.5179.400000112.3R234 I235 M241 L242R234-G238 PolarHBondContact O-N 3.45Å; I235-G238 PolarHBondContact O-N 3.14Å; G238-M241 PolarHBondContact O-N 3.46Å; G238-L242 WeakPolarHBondContact O-CB 3.24Å; G238-L242 VanDerWaalsContact O-CG 3.29Å; G238-L242 WeakPolarHBondContact O-CG 3.28Å; G238-L242 PolarHBondContact O-N 3.1Å
239A93.7Very high88Confident5 Ų545.7 Ų45.74%0.04123%0.229CC..Hα-helixtrans-63.8-42.2176.200000112.3T212 I216 I235 V236 L237 L242 A243T212-A239 HydrophobicContact CG2-CB 4.04Å; I216-A239 HydrophobicContact CD1-CB 4.24Å; I216-A239 HydrophobicContact CG1-CB 3.58Å; I235-A239 VanDerWaalsContact O-CB 3.28Å; I235-A239 WeakPolarHBondContact O-CB 3.41Å; I235-A239 PolarHBondContact O-N 3.5Å; V236-A239 PolarHBondContact O-N 3.42Å; L237-A239 VanDerWaalsContact C-N 3.33Å; L237-A239 PolarHBondContact O-N 3.13Å; A239-L242 PolarHBondContact O-N 3.01Å; A239-A243 VanDerWaalsContact O-CB 3.29Å; A239-A243 WeakPolarHBondContact O-CB 3.2Å; A239-A243 PolarHBondContact O-N 2.79Å
240I92.4Very high86.3Confident7 Ų752.2 Ų52.24%0.03626%0.259CS..Hα-helixtrans-62.9-46.1176.3-72.1169.1000110.6L198 F199 L204 T212 V236 L237 L242 A243 S244L198-I240 HydrophobicContact CB-CD1 4.19Å; L198-I240 HydrophobicContact CD1-CD1 3.63Å; F199-I240 HydrophobicContact CD2-CD1 4.28Å; F199-I240 HydrophobicContact CE2-CD1 3.8Å; F199-I240 HydrophobicContact CE2-CG1 4.03Å; L204-I240 HydrophobicContact CD1-CG2 3.41Å; L204-I240 VanDerWaalsContact CD1-CG2 3.41Å; T212-I240 HydrophobicContact CG2-CB 4.45Å; T212-I240 HydrophobicContact CG2-CD1 4.49Å; T212-I240 HydrophobicContact CG2-CG1 3.46Å; T212-I240 VanDerWaalsContact CG2-CG1 3.46Å; V236-I240 HydrophobicContact CG1-CD1 3.74Å; V236-I240 HydrophobicContact CG1-CG1 4.48Å; V236-I240 WeakPolarHBondContact O-CB 3.49Å; V236-I240 VanDerWaalsContact O-CG1 3.24Å; V236-I240 WeakPolarHBondContact O-CG1 3.47Å; V236-I240 PolarHBondContact O-N 2.84Å; L237-I240 PolarHBondContact O-N 3.41Å; I240-L242 VanDerWaalsContact C-N 3.31Å; I240-L242 PolarHBondContact O-N 3.35Å; I240-A243 PolarHBondContact O-N 3.41Å; I240-S244 PolarHBondContact O-N 2.81Å; I240-S244 PolarHBondContact O-OG 3.29Å
241M87.3Confident84.6Confident53 Ų5351.8 Ų51.826%0.26127%0.266SS..Hα-helixtrans-61.9-39.6178.5-68174.168.700112.2L237 G238 S244 K245 Y257L237-M241 HydrophobicContact CD1-CG 4.25Å; L237-M241 HydrophobicContact CD1-SD 4.11Å; L237-M241 HydrophobicContact CG-CG 4.47Å; L237-M241 HydrophobicContact CG-SD 3.91Å; L237-M241 WeakPolarHBondContact O-CG 3.39Å; L237-M241 PolarHBondContact O-N 3.03Å; G238-M241 PolarHBondContact O-N 3.46Å; M241-S244 PolarHBondContact O-OG 2.81Å; M241-S244 VanDerWaalsContact O-OG 3.13Å; M241-K245 WeakPolarHBondContact O-CB 3.28Å; M241-K245 PolarHBondContact O-N 2.71Å; M241-Y257 HydrophobicContact CB-CE1 4.01Å; M241-Y257 HydrophobicContact CE-CD1 3.48Å; M241-Y257 VanDerWaalsContact CE-CD1 3.48Å; M241-Y257 HydrophobicContact CE-CD2 3.53Å; M241-Y257 HydrophobicContact CE-CE1 3.47Å; M241-Y257 VanDerWaalsContact CE-CE1 3.47Å; M241-Y257 HydrophobicContact CE-CE2 3.48Å; M241-Y257 VanDerWaalsContact CE-CE2 3.48Å; M241-Y257 HydrophobicContact CE-CG 3.53Å; M241-Y257 VanDerWaalsContact CE-CZ 3.45Å; M241-Y257 HydrophobicContact CG-CD1 3.91Å; M241-Y257 HydrophobicContact CG-CE1 3.47Å; M241-Y257 VanDerWaalsContact CG-CE1 3.47Å; M241-Y257 HydrophobicContact SD-CD1 4.09Å; M241-Y257 HydrophobicContact SD-CE1 4.12Å
242L89.3Confident82.7Confident103 Ų10357.5 Ų57.554%0.53930%0.3SS..Hα-helixtrans-68.8-43.3175.3-71.9172.1000111.4Y215 G238 A239 I240 K245 V246Y215-L242 HydrophobicContact CD2-CB 4.06Å; Y215-L242 HydrophobicContact CE2-CB 4.05Å; G238-L242 WeakPolarHBondContact O-CB 3.24Å; G238-L242 VanDerWaalsContact O-CG 3.29Å; G238-L242 WeakPolarHBondContact O-CG 3.28Å; G238-L242 PolarHBondContact O-N 3.1Å; A239-L242 PolarHBondContact O-N 3.01Å; I240-L242 VanDerWaalsContact C-N 3.31Å; I240-L242 PolarHBondContact O-N 3.35Å; L242-K245 PolarHBondContact O-N 3.45Å; L242-V246 WeakPolarHBondContact O-CG2 3.24Å; L242-V246 PolarHBondContact O-N 3.04Å
243A91.2Very high81.1Confident0 Ų058.7 Ų58.70%031%0.305CS..Hα-helixtrans-62.5-45.1178.800000111.9I211 T212 Y215 A239 I240 K245 V246 W247I211-A243 HydrophobicContact CB-CB 4.16Å; I211-A243 HydrophobicContact CG2-CB 3.78Å; T212-A243 WeakPolarHBondContact OG1-CB 3.25Å; Y215-A243 HydrophobicContact CD2-CB 4.07Å; Y215-A243 HydrophobicContact CE2-CB 4.17Å; A239-A243 VanDerWaalsContact O-CB 3.29Å; A239-A243 WeakPolarHBondContact O-CB 3.2Å; A239-A243 PolarHBondContact O-N 2.79Å; I240-A243 PolarHBondContact O-N 3.41Å; A243-K245 VanDerWaalsContact C-N 3.31Å; A243-K245 PolarHBondContact O-N 3.17Å; A243-V246 PolarHBondContact O-N 2.98Å; A243-W247 VanDerWaalsContact O-CB 3.25Å; A243-W247 WeakPolarHBondContact O-CB 3.35Å; A243-W247 PolarHBondContact O-N 2.91Å
244S86.4Confident79.5Confident5 Ų565.7 Ų65.74%0.03534%0.342CS..Hα-helixtrans-64.5-38.3178.469.30000111.7I240 M241 V246 D248I240-S244 PolarHBondContact O-N 2.81Å; I240-S244 PolarHBondContact O-OG 3.29Å; M241-S244 PolarHBondContact O-OG 2.81Å; M241-S244 VanDerWaalsContact O-OG 3.13Å; S244-V246 PolarHBondContact O-N 2.88Å; S244-D248 VanDerWaalsContact O-CB 3.29Å; S244-D248 WeakPolarHBondContact O-CB 3.34Å; S244-D248 PolarHBondContact O-N 3.22Å
245K82.5Confident77.8Confident133 Ų13367.5 Ų67.558%0.57836%0.36SS*.Hα-helixtrans-66.5-35176.9-176.4177.6178.5-179.20113.2M241 L242 A243 A251M241-K245 WeakPolarHBondContact O-CB 3.28Å; M241-K245 PolarHBondContact O-N 2.71Å; L242-K245 PolarHBondContact O-N 3.45Å; A243-K245 VanDerWaalsContact C-N 3.31Å; A243-K245 PolarHBondContact O-N 3.17Å; K245-A251 HydrophobicContact CG-CB 4.49Å
246V84.9Confident76.2Confident97 Ų9770.8 Ų70.859%0.58838%0.378SS*.Hα-helixtrans-84.5-31.7-177.9173.20000111.6Y215 L242 A243 S244Y215-V246 WeakPolarHBondContact OH-CG2 3.17Å; L242-V246 WeakPolarHBondContact O-CG2 3.24Å; L242-V246 PolarHBondContact O-N 3.04Å; A243-V246 PolarHBondContact O-N 2.98Å; S244-V246 PolarHBondContact O-N 2.88Å
247W83.7Confident74.5Confident139 Ų13972.6 Ų72.653%0.52739%0.385SS..Hα-helixtrans-81.4-32-180-172-110.8000113.3E207 I211 A243E207-W247 HydrophobicContact CB-CD2 4.37Å; E207-W247 HydrophobicContact CB-CH2 3.99Å; E207-W247 HydrophobicContact CB-CZ2 3.39Å; E207-W247 HydrophobicContact CG-CH2 4.25Å; E207-W247 HydrophobicContact CG-CZ2 3.67Å; I211-W247 HydrophobicContact CD1-CB 4.06Å; I211-W247 HydrophobicContact CD1-CD2 3.75Å; I211-W247 HydrophobicContact CD1-CE3 3.3Å; I211-W247 HydrophobicContact CD1-CG 4.08Å; I211-W247 HydrophobicContact CD1-CZ3 3.99Å; A243-W247 VanDerWaalsContact O-CB 3.25Å; A243-W247 WeakPolarHBondContact O-CB 3.35Å; A243-W247 PolarHBondContact O-N 2.91Å
248D73.4Confident73Confident78 Ų7874.8 Ų74.842%0.41740%0.401SS..  trans-104.8117.3-177.8-159.6-32.7000111.8S244 Q250 W253S244-D248 VanDerWaalsContact O-CB 3.29Å; S244-D248 WeakPolarHBondContact O-CB 3.34Å; S244-D248 PolarHBondContact O-N 3.22Å; D248-Q250 PolarHBondContact O-N 3.03Å; D248-Q250 PolarHBondContact OD1-N 2.91Å; D248-W253 HydrophobicContact CB-CZ2 4.43Å
249D67Low71.4Confident154 Ų15478.9 Ų78.982%0.82441%0.414SS*.SBendtrans-69.8-5.8-179.4-157.929.7000112.7
250Q53.9Low70Confident144 Ų14479.5 Ų79.567%0.67342%0.416SS*.  trans-119.880.3-179.6-65.7-62.4-41.900112.3D248 V252D248-Q250 PolarHBondContact O-N 3.03Å; D248-Q250 PolarHBondContact OD1-N 2.91Å; Q250-V252 PolarHBondContact O-N 2.6Å
251A54Low68.5Low51 Ų5181.4 Ų81.442%0.42143%0.426SS..  trans-97.277.8-166.900000115.2K245 W253K245-A251 HydrophobicContact CG-CB 4.49Å; A251-W253 VanDerWaalsContact C-N 3.35Å; A251-W253 VanDerWaalsContact CB-NE1 3.28Å; A251-W253 PolarHBondContact O-N 3.42Å
252V52.2Low67.2Low120 Ų12087 Ų8773%0.72744%0.444SS*.  trans-90.854.1175.4-164.50000112Q250Q250-V252 PolarHBondContact O-N 2.6Å
253W60.4Low65.5Low31 Ų3185.4 Ų85.412%0.11744%0.442CS..  trans-94.4-12.3-162.6-54.897.5000117.1A202 L204 D248 A251 V255 D256 Y257A202-W253 HydrophobicContact CB-CZ3 4.28Å; L204-W253 HydrophobicContact CD2-CH2 4.4Å; D248-W253 HydrophobicContact CB-CZ2 4.43Å; A251-W253 VanDerWaalsContact C-N 3.35Å; A251-W253 VanDerWaalsContact CB-NE1 3.28Å; A251-W253 PolarHBondContact O-N 3.42Å; W253-V255 VanDerWaalsContact C-N 3.28Å; W253-V255 PolarHBondContact O-N 3.34Å; W253-V255 VanDerWaalsContact O-N 3.13Å; W253-D256 PolarHBondContact O-N 3.08Å; W253-Y257 HydrophobicContact CB-CD2 3.99Å; W253-Y257 HydrophobicContact CB-CE1 4.08Å; W253-Y257 HydrophobicContact CB-CE2 3.15Å; W253-Y257 WeakPolarHBondContact CB-OH 3.14Å; W253-Y257 HydrophobicContact CE3-CE1 4.12Å; W253-Y257 HydrophobicContact CG-CE2 4.22Å; W253-Y257 AromaticContact CG-CZ 3.82Å; W253-Y257 WeakPolarHBondContact O-CD2 3.45Å; W253-Y257 WeakPolarHBondContact O-CE2 3.29Å; W253-Y257 PolarHBondContact O-N 3.02Å
254N56.6Low64Low153 Ų15385.8 Ų85.882%0.81845%0.445SS*.THydrogen-bonded Turntrans-64.7-25.7-167.5-73.1-11.8000114.9
255V55Low62.6Low100 Ų10087.3 Ų87.361%0.60645%0.452SS*.THydrogen-bonded Turntrans-97.3-33.1-178.3-179.50000112W253 Y257W253-V255 VanDerWaalsContact C-N 3.28Å; W253-V255 PolarHBondContact O-N 3.34Å; W253-V255 VanDerWaalsContact O-N 3.13Å; V255-Y257 PolarHBondContact O-N 3.4Å
256D59.9Low61.2Low69 Ų6985 Ų8537%0.36945%0.449SS..Hα-helixtrans-75.7-27.9-172.6-63.3-27.9000112.4W253 C258 Q259 I260W253-D256 PolarHBondContact O-N 3.08Å; D256-C258 VanDerWaalsContact C-N 3.31Å; D256-C258 PolarHBondContact O-N 2.88Å; D256-Q259 CarbonylContact O-C 3.53Å; D256-Q259 WeakPolarHBondContact O-CA 3.2Å; D256-Q259 WeakPolarHBondContact O-CB 3.33Å; D256-Q259 PolarHBondContact O-N 3.36Å; D256-I260 HydrophobicContact CB-CD1 4.13Å; D256-I260 WeakPolarHBondContact O-CB 3.17Å; D256-I260 VanDerWaalsContact O-CG1 3.24Å; D256-I260 WeakPolarHBondContact O-CG1 3.46Å; D256-I260 PolarHBondContact O-N 2.69Å
257Y59.3Low59.5Low38 Ų3887.5 Ų87.515%0.14945%0.454CS..Hα-helixtrans-56.8-43.9177.5-67.4-54.6000113.1M241 W253 V255 Q259 I260 L261M241-Y257 HydrophobicContact CB-CE1 4.01Å; M241-Y257 HydrophobicContact CE-CD1 3.48Å; M241-Y257 VanDerWaalsContact CE-CD1 3.48Å; M241-Y257 HydrophobicContact CE-CD2 3.53Å; M241-Y257 HydrophobicContact CE-CE1 3.47Å; M241-Y257 VanDerWaalsContact CE-CE1 3.47Å; M241-Y257 HydrophobicContact CE-CE2 3.48Å; M241-Y257 VanDerWaalsContact CE-CE2 3.48Å; M241-Y257 HydrophobicContact CE-CG 3.53Å; M241-Y257 VanDerWaalsContact CE-CZ 3.45Å; M241-Y257 HydrophobicContact CG-CD1 3.91Å; M241-Y257 HydrophobicContact CG-CE1 3.47Å; M241-Y257 VanDerWaalsContact CG-CE1 3.47Å; M241-Y257 HydrophobicContact SD-CD1 4.09Å; M241-Y257 HydrophobicContact SD-CE1 4.12Å; W253-Y257 HydrophobicContact CB-CD2 3.99Å; W253-Y257 HydrophobicContact CB-CE1 4.08Å; W253-Y257 HydrophobicContact CB-CE2 3.15Å; W253-Y257 WeakPolarHBondContact CB-OH 3.14Å; W253-Y257 HydrophobicContact CE3-CE1 4.12Å; W253-Y257 HydrophobicContact CG-CE2 4.22Å; W253-Y257 AromaticContact CG-CZ 3.82Å; W253-Y257 WeakPolarHBondContact O-CD2 3.45Å; W253-Y257 WeakPolarHBondContact O-CE2 3.29Å; W253-Y257 PolarHBondContact O-N 3.02Å; V255-Y257 PolarHBondContact O-N 3.4Å; Y257-Q259 PolarHBondContact O-N 3.49Å; Y257-I260 PolarHBondContact O-N 3.37Å; Y257-L261 WeakPolarHBondContact O-CB 3.09Å; Y257-L261 WeakPolarHBondContact O-CG 3.44Å; Y257-L261 PolarHBondContact O-N 3.18Å
258C58.4Low58.1Low66 Ų6682.2 Ų82.245%0.44644%0.437SS..Hα-helixtrans-64.1-34.1177.1-71.80000111.6D256 R262D256-C258 VanDerWaalsContact C-N 3.31Å; D256-C258 PolarHBondContact O-N 2.88Å; C258-R262 VanDerWaalsContact O-CB 3.29Å; C258-R262 WeakPolarHBondContact O-CB 3.16Å; C258-R262 WeakPolarHBondContact O-CD 3.26Å; C258-R262 WeakPolarHBondContact O-CG 3.44Å; C258-R262 PolarHBondContact O-N 2.93Å; C258-R262 VanDerWaalsContact O-N 3.08Å
259Q59Low57.1Low110 Ų11082.3 Ų82.351%0.51444%0.436SS..Hα-helixtrans-75.2-43.2178.2-61.7-172.86.900111.4D256 Y257 R262 S263D256-Q259 CarbonylContact O-C 3.53Å; D256-Q259 WeakPolarHBondContact O-CA 3.2Å; D256-Q259 WeakPolarHBondContact O-CB 3.33Å; D256-Q259 PolarHBondContact O-N 3.36Å; Y257-Q259 PolarHBondContact O-N 3.49Å; Q259-R262 PolarHBondContact O-N 3.14Å; Q259-S263 VanDerWaalsContact O-CB 3.24Å; Q259-S263 WeakPolarHBondContact O-CB 3.46Å; Q259-S263 PolarHBondContact O-N 3.08Å; Q259-S263 PolarHBondContact O-OG 3.12Å
260I62.3Low56.3Low19 Ų1982.6 Ų82.610%0.09743%0.426CS..Hα-helixtrans-58.4-50.6175.3-68.6161.4000109.1L198 A201 A202 D256 Y257 R262 S263 C264L198-I260 HydrophobicContact CD2-CG2 3.99Å; A201-I260 HydrophobicContact CB-CB 4.41Å; A201-I260 HydrophobicContact CB-CG1 4.19Å; A201-I260 HydrophobicContact CB-CG2 3.82Å; A202-I260 HydrophobicContact CB-CD1 4.13Å; D256-I260 HydrophobicContact CB-CD1 4.13Å; D256-I260 WeakPolarHBondContact O-CB 3.17Å; D256-I260 VanDerWaalsContact O-CG1 3.24Å; D256-I260 WeakPolarHBondContact O-CG1 3.46Å; D256-I260 PolarHBondContact O-N 2.69Å; Y257-I260 PolarHBondContact O-N 3.37Å; I260-R262 PolarHBondContact O-N 2.56Å; I260-S263 PolarHBondContact O-N 3.08Å; I260-C264 WeakPolarHBondContact O-CB 3Å; I260-C264 PolarHBondContact O-N 3.33Å; I260-C264 PolarHBondContact O-SG 3.48Å
261L62.1Low56.3Low46 Ų4677.8 Ų77.824%0.24141%0.411CS..Hα-helixtrans-63.2-42178.6-68.9175.1000112.8I172 L237 Y257 S263 N265I172-L261 HydrophobicContact CG2-CD2 4.05Å; L237-L261 HydrophobicContact CD1-CD2 3.68Å; L237-L261 HydrophobicContact CD2-CD1 4.14Å; L237-L261 HydrophobicContact CD2-CD2 3.55Å; L237-L261 HydrophobicContact CD2-CG 4.43Å; L237-L261 HydrophobicContact CG-CD2 4.25Å; Y257-L261 WeakPolarHBondContact O-CB 3.09Å; Y257-L261 WeakPolarHBondContact O-CG 3.44Å; Y257-L261 PolarHBondContact O-N 3.18Å; L261-S263 VanDerWaalsContact C-N 3.35Å; L261-N265 VanDerWaalsContact O-CB 3.24Å; L261-N265 WeakPolarHBondContact O-CB 3.5Å; L261-N265 PolarHBondContact O-N 2.99Å
262R59.4Low56.2Low171 Ų17177.6 Ų77.665%0.64541%0.414SS*.Hα-helixtrans-64-39.6174.6-76.4174.7-176.2131.21.7112.2C258 Q259 I260 N265 V266C258-R262 VanDerWaalsContact O-CB 3.29Å; C258-R262 WeakPolarHBondContact O-CB 3.16Å; C258-R262 WeakPolarHBondContact O-CD 3.26Å; C258-R262 WeakPolarHBondContact O-CG 3.44Å; C258-R262 PolarHBondContact O-N 2.93Å; C258-R262 VanDerWaalsContact O-N 3.08Å; Q259-R262 PolarHBondContact O-N 3.14Å; I260-R262 PolarHBondContact O-N 2.56Å; R262-N265 PolarHBondContact O-N 2.9Å; R262-V266 WeakPolarHBondContact O-CG2 3.41Å; R262-V266 PolarHBondContact O-N 3.41Å
263S54.2Low56Low70 Ų7079 Ų7949%0.4942%0.417SS..Hα-helixtrans-72.9-38.3-179.1-56.20000111.7Q259 I260 L261 N265Q259-S263 VanDerWaalsContact O-CB 3.24Å; Q259-S263 WeakPolarHBondContact O-CB 3.46Å; Q259-S263 PolarHBondContact O-N 3.08Å; Q259-S263 PolarHBondContact O-OG 3.12Å; I260-S263 PolarHBondContact O-N 3.08Å; L261-S263 VanDerWaalsContact C-N 3.35Å; S263-N265 VanDerWaalsContact C-N 3.32Å
264C58.9Low55.3Low8 Ų887.7 Ų87.75%0.05445%0.449CS..Hα-helixtrans-62.6-40.9173.4-66.40000111.3T197 I260 D268T197-C264 HydrophobicContact CG2-CB 3.93Å; T197-C264 VanDerWaalsContact CG2-SG 3.6Å; I260-C264 WeakPolarHBondContact O-CB 3Å; I260-C264 PolarHBondContact O-N 3.33Å; I260-C264 PolarHBondContact O-SG 3.48Å; C264-D268 WeakPolarHBondContact O-CB 3.3Å; C264-D268 PolarHBondContact O-N 2.8Å
265N57.9Low54.8Low36 Ų3689 Ų8919%0.19345%0.449CS..Hα-helixtrans-68.2-45.7-175.1-173.516000113T173 L261 R262 S263 M269T173-N265 WeakPolarHBondContact CB-OD1 3.23Å; T173-N265 WeakPolarHBondContact CG2-ND2 3.36Å; T173-N265 WeakPolarHBondContact CG2-OD1 3.26Å; T173-N265 PolarHBondContact OG1-OD1 2.87Å; L261-N265 VanDerWaalsContact O-CB 3.24Å; L261-N265 WeakPolarHBondContact O-CB 3.5Å; L261-N265 PolarHBondContact O-N 2.99Å; R262-N265 PolarHBondContact O-N 2.9Å; S263-N265 VanDerWaalsContact C-N 3.32Å; N265-M269 WeakPolarHBondContact O-CB 3.46Å; N265-M269 PolarHBondContact O-N 3.24Å
266V51.9Low54Low86 Ų8696.4 Ų96.452%0.52148%0.476SS..Hα-helixtrans-70.7-43-173.3178.60000111.8R262 Y270R262-V266 WeakPolarHBondContact O-CG2 3.41Å; R262-V266 PolarHBondContact O-N 3.41Å; V266-Y270 HydrophobicContact CG1-CE2 4.35Å; V266-Y270 WeakPolarHBondContact O-CD2 3.4Å
267Q49.8Very low53.8Low148 Ų14897.8 Ų97.869%0.69248%0.481SS*.Hα-helixtrans-76.5-32.6-175.7-69.2-165.7-13.500113.2
268D54.8Low53.5Low29 Ų29100.9 Ų100.916%0.15550%0.499CS..Hα-helixtrans-84.6-25.6-175-81.7-33.4000114.3R193 T197 C264 Y270R193-D268 IonicContact CZ-OD1 3.08Å; R193-D268 IonicContact NE-OD1 3.62Å; R193-D268 VanDerWaalsContact NH2-C 3.31Å; R193-D268 PolarHBondContact NH2-O 2.8Å; R193-D268 IonicContact NH2-OD1 3.71Å; R193-D268 PolarHBondContact NH2-OD1 2.98Å; T197-D268 WeakPolarHBondContact CB-OD2 3.33Å; T197-D268 PolarHBondContact OG1-OD2 3.31Å; C264-D268 WeakPolarHBondContact O-CB 3.3Å; C264-D268 PolarHBondContact O-N 2.8Å; D268-Y270 VanDerWaalsContact C-N 3.3Å; D268-Y270 PolarHBondContact O-N 3.11Å
269M51.8Low53.2Low80 Ų80102.9 Ų102.939%0.39450%0.502SS..Hα-helixtrans-63.7-34.8176.2-171.1168.96300112.3N265N265-M269 WeakPolarHBondContact O-CB 3.46Å; N265-M269 PolarHBondContact O-N 3.24Å
270Y51.3Low52.8Low159 Ų159102.5 Ų102.562%0.62450%0.501SS*.Hα-helixtrans-89.8-22.9-179.1-61.2-69.1000114.3V266 D268 G272V266-Y270 HydrophobicContact CG1-CE2 4.35Å; V266-Y270 WeakPolarHBondContact O-CD2 3.4Å; D268-Y270 VanDerWaalsContact C-N 3.3Å; D268-Y270 PolarHBondContact O-N 3.11Å; Y270-G272 VanDerWaalsContact C-N 3.34Å
271A53.5Low52.3Low44 Ų44107.7 Ų107.736%0.36453%0.526SS..Hα-helixtrans-77.5-18.9-178.700000113.5
272G51.8Low51.6Low47 Ų47111.8 Ų111.849%0.48555%0.545SS..THydrogen-bonded Turntrans-80.5-20.8176.500000115.1Y270Y270-G272 VanDerWaalsContact C-N 3.34Å
273L47.9Very low51Low149 Ų149107.6 Ų107.678%0.7854%0.538SS*.THydrogen-bonded Turntrans-914.1-178.9-89.498.2000114.2
274R46Very low50.8Low213 Ų213110.5 Ų110.580%0.80454%0.542SS*.SBendtrans-105.512.3-175-118.5179.2-167.41764.2115.4
275F46.2Very low50.1Low182 Ų182119 Ų11980%0.79858%0.582SS**  trans-132.658.5178.3-67-80000110.7
276H38.8Very low49.4Very low255 Ų255126.5 Ų126.5100%1.18162%0.618SS**  trans-1650153.4-122.7-68.2000108.3

Retrieved 276 of 276 residues in 181.5 ms (Link to these results)