A0A096NRI7_PAPAN Loading...

Chromosome 22 open reading frame 31

AlphaFold DB , UniProt , Accession A0A096NRI7, Species PAPAN (Papio anubis, Olive baboon), Gene C22orf31, Length 290 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M41.5Very low43.5Very low240 Ų240153.8 Ų153.8100%1.18280%0.798SS**  0138.20-78.3-162.216200108.6
2H33.6Very low44.3Very low185 Ų185150.8 Ų150.886%0.85678%0.782SS**  trans-91136.8-175.3-60.593.3000110.7
3P46.9Very low44.6Very low112 Ų112145.2 Ų145.273%0.72776%0.761SS**  trans-72.5129.417029.9-32000109.9N5P3-N5 PolarHBondContact O-N 2.87Å; P3-N5 VanDerWaalsContact O-N 3.17Å
4I37Very low45Very low156 Ų156145.4 Ų145.480%0.876%0.761SS**  trans-75.2104.3176.6-61.4169.4000107.9V6I4-V6 PolarHBondContact O-N 3.38Å; I4-V6 VanDerWaalsContact O-N 3.13Å
5N36.3Very low45.1Very low154 Ų154149 Ų14982%0.82476%0.762SS**  trans-72.1103.5169.5-84.8-35.6000109.3P3 R7P3-N5 PolarHBondContact O-N 2.87Å; P3-N5 VanDerWaalsContact O-N 3.17Å; N5-R7 PolarHBondContact O-N 3.3Å
6V41.1Very low44.9Very low121 Ų121144.2 Ų144.273%0.73376%0.761SS**  trans-64.9120.6167.3-178.30000107.7I4 Q8I4-V6 PolarHBondContact O-N 3.38Å; I4-V6 VanDerWaalsContact O-N 3.13Å; V6-Q8 PolarHBondContact O-N 3.06Å
7R40.9Very low45.2Very low248 Ų248145.4 Ų145.494%0.93677%0.767SS**  trans-63.395.6-176.9-169.1-179.6-169.1-130.95.9110.3N5N5-R7 PolarHBondContact O-N 3.3Å
8Q49.9Very low44.9Very low160 Ų160150 Ų15075%0.74877%0.772SS**  trans-75.7142.8174.2-78.8-179.5-26.600110.9V6V6-Q8 PolarHBondContact O-N 3.06Å
9D43.3Very low45.2Very low103 Ų103152.3 Ų152.355%0.55178%0.779SS**  trans-71.3127.9-177.3-172.629.3000110.8S11D9-S11 PolarHBondContact O-N 3.41Å; D9-S11 WeakPolarHBondContact OD2-CB 3.25Å; D9-S11 PolarHBondContact OD2-OG 2.88Å
10P55.7Low45.4Very low130 Ų130149.4 Ų149.484%0.84477%0.773SS**THydrogen-bonded Turntrans-64.4-7.7-177.6-23.234.4000115.3I12P10-I12 VanDerWaalsContact C-N 3.33Å; P10-I12 PolarHBondContact O-N 3.09Å
11S52.5Low45.9Very low83 Ų83148.1 Ų148.158%0.5877%0.766SS**THydrogen-bonded Turntrans-75.2-16.3-175.772.10000114.6D9 P13D9-S11 PolarHBondContact O-N 3.41Å; D9-S11 WeakPolarHBondContact OD2-CB 3.25Å; D9-S11 PolarHBondContact OD2-OG 2.88Å; S11-P13 WeakPolarHBondContact O-CD 3.5Å
12I52.8Low46.3Very low118 Ų118145 Ų14561%0.60575%0.753SS**SBendtrans-97.2110.3-172.8-53.4176.8000110.2P10 I14P10-I12 VanDerWaalsContact C-N 3.33Å; P10-I12 PolarHBondContact O-N 3.09Å; I12-I14 PolarHBondContact O-N 3.01Å; I12-I14 VanDerWaalsContact O-N 3.13Å
13P48.8Very low47.2Very low78 Ų78139.8 Ų139.851%0.50673%0.732SS.*  trans-65.6115.1175.825.3-33.1000111.1S11 Y15S11-P13 WeakPolarHBondContact O-CD 3.5Å; P13-Y15 HydrophobicContact CB-CE2 3.96Å; P13-Y15 HydrophobicContact CG-CE2 3.72Å; P13-Y15 WeakPolarHBondContact O-CD2 3.38Å; P13-Y15 PolarHBondContact O-N 3.24Å; P13-Y15 VanDerWaalsContact O-N 3.09Å
14I49.6Very low47.1Very low147 Ų147139 Ų13975%0.75472%0.721SS**  trans-77.693.9176.6-56.5176.7000109I12 G16I12-I14 PolarHBondContact O-N 3.01Å; I12-I14 VanDerWaalsContact O-N 3.13Å; I14-G16 PolarHBondContact O-N 3.49Å; I14-G16 VanDerWaalsContact O-N 3.14Å
15Y46.3Very low47.8Very low200 Ų200138 Ų13878%0.78472%0.722SS**  trans-74.2100.9171.6-62.8-74.9000110.8P13 L17P13-Y15 HydrophobicContact CB-CE2 3.96Å; P13-Y15 HydrophobicContact CG-CE2 3.72Å; P13-Y15 WeakPolarHBondContact O-CD2 3.38Å; P13-Y15 PolarHBondContact O-N 3.24Å; P13-Y15 VanDerWaalsContact O-N 3.09Å; Y15-L17 PolarHBondContact O-N 3.34Å
16G42.7Very low48.3Very low72 Ų72141.4 Ų141.474%0.74272%0.724SS**  trans-68.7108.6171.100000111.7I14 R18I14-G16 PolarHBondContact O-N 3.49Å; I14-G16 VanDerWaalsContact O-N 3.14Å; G16-R18 PolarHBondContact O-N 2.91Å; G16-R18 VanDerWaalsContact O-N 3.1Å
17L48.9Very low48.6Very low164 Ų164140.6 Ų140.686%0.85972%0.715SS**  trans-68105.4172.5-84.3164.8000110.4Y15 Q19Y15-L17 PolarHBondContact O-N 3.34Å; L17-Q19 PolarHBondContact O-N 2.74Å; L17-Q19 VanDerWaalsContact O-N 3.13Å
18R40.6Very low49Very low229 Ų229136.6 Ų136.686%0.86471%0.707SS**  trans-66.9109.4172.5-165.6179.4-172.1-167.32.4109.3G16 S20G16-R18 PolarHBondContact O-N 2.91Å; G16-R18 VanDerWaalsContact O-N 3.1Å; R18-S20 VanDerWaalsContact C-N 3.33Å; R18-S20 PolarHBondContact O-N 2.73Å
19Q50.2Low48.8Very low193 Ų193136.5 Ų136.590%0.90271%0.711SS**  trans-73.883.4177-68-177.74.400110.8L17L17-Q19 PolarHBondContact O-N 2.74Å; L17-Q19 VanDerWaalsContact O-N 3.13Å
20S49.5Very low49.2Very low94 Ų94134.6 Ų134.666%0.65771%0.706SS**  trans-117.1100.9169.556.70000110R18R18-S20 VanDerWaalsContact C-N 3.33Å; R18-S20 PolarHBondContact O-N 2.73Å
21I56Low48.9Very low123 Ų123137.1 Ų137.163%0.63170%0.7SS**  trans-92.1107.6170.7-58.9175.2000107.5L23 V32I21-L23 HydrophobicContact CG2-CD2 4.05Å; I21-L23 HydrophobicContact CG2-CG 4.29Å; I21-L23 PolarHBondContact O-N 3.02Å; I21-V32 HydrophobicContact CD1-CG2 4.36Å
22L49.8Very low48.6Very low174 Ų174137.2 Ų137.291%0.91170%0.696SS**  trans-83.3103.8170.6-168.771.7000108.6
23L53.3Low48.2Very low77 Ų77136.5 Ų136.540%0.40369%0.694SS.*  trans-72.2129.8177-70.1171.2000110.2I21 C30I21-L23 HydrophobicContact CG2-CD2 4.05Å; I21-L23 HydrophobicContact CG2-CG 4.29Å; I21-L23 PolarHBondContact O-N 3.02Å; L23-C30 HydrophobicContact CD1-CB 4.15Å; L23-C30 WeakPolarHBondContact CD1-O 3.11Å; L23-C30 HydrophobicContact CD2-CB 3.72Å
24N43.6Very low48.1Very low94 Ų94135.4 Ų135.450%0.50369%0.688SS.*  trans-71.5129.9174.6-172.8-67.8000109.2R26 L27N24-R26 PolarHBondContact O-N 2.95Å; N24-R26 WeakPolarHBondContact OD1-CB 3.44Å; N24-R26 WeakPolarHBondContact OD1-CG 3.33Å; N24-R26 PolarHBondContact OD1-N 2.78Å; N24-L27 HydrophobicContact CB-CD1 4.27Å; N24-L27 HydrophobicContact CB-CG 4.35Å; N24-L27 WeakPolarHBondContact O-CB 3.4Å; N24-L27 PolarHBondContact O-N 3.33Å
25T51.7Low48.1Very low136 Ų136133.5 Ų133.583%0.83469%0.685SS**THydrogen-bonded Turntrans-62.6-11.2-175.652.60000115
26R47.3Very low48.2Very low225 Ų225127.4 Ų127.485%0.84968%0.676SS**THydrogen-bonded Turntrans-83-12171.8-58-178.1179.4-140.8-1.5113.6N24 Q28N24-R26 PolarHBondContact O-N 2.95Å; N24-R26 WeakPolarHBondContact OD1-CB 3.44Å; N24-R26 WeakPolarHBondContact OD1-CG 3.33Å; N24-R26 PolarHBondContact OD1-N 2.78Å; R26-Q28 PolarHBondContact O-N 3.43Å
27L47.7Very low48.3Very low105 Ų105129.9 Ų129.955%0.5567%0.672SS.*  trans-92.793.7174.6-61.4176.1000108.8N24N24-L27 HydrophobicContact CB-CD1 4.27Å; N24-L27 HydrophobicContact CB-CG 4.35Å; N24-L27 WeakPolarHBondContact O-CB 3.4Å; N24-L27 PolarHBondContact O-N 3.33Å
28Q48.5Very low48.3Very low164 Ų164125.3 Ų125.377%0.76665%0.651SS**THydrogen-bonded Turntrans-71.5158.4166-66.21724.100109.1R26 C30R26-Q28 PolarHBondContact O-N 3.43Å; Q28-C30 VanDerWaalsContact C-N 3.31Å; Q28-C30 PolarHBondContact O-N 2.84Å
29D46.9Very low48.7Very low158 Ų158120 Ų12085%0.84564%0.64SS**THydrogen-bonded Turntrans63.617.7176.5-47.9-36000117.8
30C50.5Low48.5Very low63 Ų63115.7 Ų115.743%0.42662%0.622SS.*  trans-95.3121170.6-67.40000111.5L23 Q28L23-C30 HydrophobicContact CD1-CB 4.15Å; L23-C30 WeakPolarHBondContact CD1-O 3.11Å; L23-C30 HydrophobicContact CD2-CB 3.72Å; Q28-C30 VanDerWaalsContact C-N 3.31Å; Q28-C30 PolarHBondContact O-N 2.84Å
31Y49.1Very low48Very low183 Ų183120.8 Ų120.872%0.71863%0.627SS**  trans-125.7152.9172.862.8-86.3000111.4D33Y31-D33 WeakPolarHBondContact CE2-OD1 3.48Å
32V46.1Very low47.5Very low84 Ų84119.8 Ų119.851%0.50962%0.621SS.*  trans-95.2117.1171.9179.40000108.1I21 S34I21-V32 HydrophobicContact CD1-CG2 4.36Å; V32-S34 VanDerWaalsContact C-N 3.3Å; V32-S34 PolarHBondContact O-N 3.04Å
33D45.3Very low47.2Very low103 Ų103114.6 Ų114.655%0.55160%0.603SS**  trans-62.587.6173.6-90.9-52.7000110.7Y31Y31-D33 WeakPolarHBondContact CE2-OD1 3.48Å
34S45.7Very low46.9Very low56 Ų56121 Ų12139%0.39262%0.621SS.*  trans-74.6124.1168.3-670000109.1V32 A36 L37V32-S34 VanDerWaalsContact C-N 3.3Å; V32-S34 PolarHBondContact O-N 3.04Å; S34-A36 PolarHBondContact O-N 3.49Å; S34-L37 PolarHBondContact O-N 3.05Å
35P51.4Low46.9Very low106 Ų106120.2 Ų120.269%0.68862%0.62SS**Hα-helixtrans-54.8-24-176.5-28.735.1000115.2
36A46.5Very low46.6Very low73 Ų73117.4 Ų117.460%0.60361%0.605SS**Hα-helixtrans-66.8-33176.600000113.9S34S34-A36 PolarHBondContact O-N 3.49Å
37L45.1Very low46.3Very low123 Ų123111 Ų11164%0.64460%0.601SS**Hα-helixtrans-81.8-33.5-176-87.6160.5000112.7S34 N39 I40S34-L37 PolarHBondContact O-N 3.05Å; L37-N39 VanDerWaalsContact C-N 3.27Å; L37-N39 PolarHBondContact O-N 3.42Å; L37-I40 PolarHBondContact O-N 3.41Å
38T48.8Very low46.4Very low69 Ų69115.2 Ų115.242%0.42362%0.615SS.*Hα-helixtrans-61-36.6-179.4-33.90000112I40 M42T38-I40 PolarHBondContact O-N 2.99Å; T38-M42 WeakPolarHBondContact O-CB 3.11Å; T38-M42 WeakPolarHBondContact O-CG 3.28Å; T38-M42 PolarHBondContact O-N 3.01Å
39N50.6Low46.2Very low118 Ų118115.7 Ų115.763%0.63162%0.617SS**Hα-helixtrans-64.7-36.5179.6-75.5-26.7000113.5L37 A43L37-N39 VanDerWaalsContact C-N 3.27Å; L37-N39 PolarHBondContact O-N 3.42Å; N39-A43 VanDerWaalsContact O-CB 3.28Å; N39-A43 WeakPolarHBondContact O-CB 3.46Å; N39-A43 PolarHBondContact O-N 3.3Å
40I44.9Very low46Very low101 Ų101115.6 Ų115.652%0.51862%0.616SS.*Hα-helixtrans-73-39.5-174.9-60.3172.6000111.1L37 T38L37-I40 PolarHBondContact O-N 3.41Å; T38-I40 PolarHBondContact O-N 2.99Å
41W39.7Very low45.6Very low202 Ų202119.9 Ų119.977%0.76563%0.633SS**Hα-helixtrans-67.1-48.1175-169.6-85.8000111.1A43 R44 T45W41-A43 PolarHBondContact O-N 3.49Å; W41-R44 PolarHBondContact O-N 3.46Å; W41-T45 PolarHBondContact O-N 2.97Å; W41-T45 PolarHBondContact O-OG1 3.01Å
42M45.7Very low45.5Very low102 Ų102118.4 Ų118.450%0.50264%0.638SS.*Hα-helixtrans-59.1-43.9179-71.7-71.1-70.900112.4T38 R44 T45 C46T38-M42 WeakPolarHBondContact O-CB 3.11Å; T38-M42 WeakPolarHBondContact O-CG 3.28Å; T38-M42 PolarHBondContact O-N 3.01Å; M42-R44 VanDerWaalsContact C-N 3.3Å; M42-R44 PolarHBondContact O-N 3.43Å; M42-T45 WeakPolarHBondContact CA-OG1 3.33Å; M42-T45 PolarHBondContact O-N 3.5Å; M42-T45 PolarHBondContact O-OG1 3.05Å; M42-C46 WeakPolarHBondContact O-CB 3.36Å; M42-C46 PolarHBondContact O-N 3.15Å; M42-C46 PolarHBondContact O-SG 3.44Å
43A43.6Very low44.9Very low65 Ų65120.6 Ų120.654%0.53765%0.651SS.*Hα-helixtrans-59.7-38.1179.600000113N39 W41 A47N39-A43 VanDerWaalsContact O-CB 3.28Å; N39-A43 WeakPolarHBondContact O-CB 3.46Å; N39-A43 PolarHBondContact O-N 3.3Å; W41-A43 PolarHBondContact O-N 3.49Å; A43-A47 PolarHBondContact O-N 3.42Å
44R47Very low44.8Very low210 Ų210122.2 Ų122.279%0.79267%0.665SS**Hα-helixtrans-72-32.8177.7-72-178.9174.6176.8-1.4112.8W41 M42W41-R44 PolarHBondContact O-N 3.46Å; M42-R44 VanDerWaalsContact C-N 3.3Å; M42-R44 PolarHBondContact O-N 3.43Å
45T43.4Very low44.3Very low79 Ų79123.6 Ų123.649%0.48568%0.68SS.*Hα-helixtrans-78.5-34.5175.345.80000113.4W41 M42W41-T45 PolarHBondContact O-N 2.97Å; W41-T45 PolarHBondContact O-OG1 3.01Å; M42-T45 WeakPolarHBondContact CA-OG1 3.33Å; M42-T45 PolarHBondContact O-N 3.5Å; M42-T45 PolarHBondContact O-OG1 3.05Å
46C44.7Very low43.8Very low77 Ų77123.8 Ų123.852%0.5268%0.681SS.*Hα-helixtrans-78.2-18-176.5-68.30000113.9M42 K48 Q49M42-C46 WeakPolarHBondContact O-CB 3.36Å; M42-C46 PolarHBondContact O-N 3.15Å; M42-C46 PolarHBondContact O-SG 3.44Å; C46-K48 PolarHBondContact O-N 3.33Å; C46-Q49 PolarHBondContact O-N 3.15Å
47A40.5Very low43.4Very low91 Ų91124.4 Ų124.475%0.75269%0.687SS**THydrogen-bonded Turntrans-61.8-8.1176.200000114.8A43A43-A47 PolarHBondContact O-N 3.42Å
48K50.4Low43.2Very low193 Ų193123.9 Ų123.984%0.83969%0.689SS**THydrogen-bonded Turntrans-109.94.5-178.3-156.3168.3-179.5177.60114.9C46C46-K48 PolarHBondContact O-N 3.33Å
49Q43.8Very low42.8Very low173 Ų173126.3 Ų126.381%0.80870%0.704SS**  trans-134.590.4176-69-170.1-2.400111.8C46 I51C46-Q49 PolarHBondContact O-N 3.15Å; Q49-I51 PolarHBondContact O-N 2.87Å
50N44.3Very low42.3Very low156 Ų156124 Ų12483%0.83470%0.697SS**  trans-88.786.1172.2178.414.2000110.6
51I41Very low42.2Very low153 Ų153122.3 Ų122.379%0.78569%0.694SS**  trans-150.2141.2155.8-11169.3000110.7Q49 T53Q49-I51 PolarHBondContact O-N 2.87Å; I51-T53 PolarHBondContact O-N 3.11Å
52N47.2Very low42.1Very low152 Ų152119.8 Ų119.881%0.81368%0.684SS**  trans-63.6121.2-172.2-57.1-62000113.4
53T34.3Very low41.9Very low130 Ų130119.7 Ų119.780%0.79868%0.683SS**  trans-154.4128.1158.3-61.50000110I51 A55I51-T53 PolarHBondContact O-N 3.11Å; T53-A55 PolarHBondContact O-N 3.12Å
54T41.7Very low42Very low137 Ų137120.3 Ų120.384%0.8468%0.68SS**  trans-59124.1176-54.40000110.4
55A35.4Very low41.9Very low86 Ų86113.1 Ų113.171%0.71166%0.659SS**  trans-60.9130.4-172.800000112.4T53 A57T53-A55 PolarHBondContact O-N 3.12Å; A55-A57 PolarHBondContact O-N 2.94Å; A55-A57 VanDerWaalsContact O-N 3.13Å
56P41.3Very low42Very low109 Ų109118.7 Ų118.771%0.70867%0.671SS**  trans-70.9109.9172.228.4-32.4000109.5T58P56-T58 VanDerWaalsContact C-N 3.33Å; P56-T58 PolarHBondContact O-N 3.02Å; P56-T58 PolarHBondContact O-OG1 3.47Å
57A37.4Very low42.2Very low87 Ų87121.8 Ų121.872%0.71968%0.683SS**  trans-61.592.3173.600000110.3A55 T59A55-A57 PolarHBondContact O-N 2.94Å; A55-A57 VanDerWaalsContact O-N 3.13Å; A57-T59 VanDerWaalsContact C-N 3.29Å; A57-T59 PolarHBondContact O-N 2.83Å
58T41.9Very low42.6Very low112 Ų112123 Ų12369%0.68768%0.683SS**  trans-76.983.6-177.9-59.10000108.7P56 S60P56-T58 VanDerWaalsContact C-N 3.33Å; P56-T58 PolarHBondContact O-N 3.02Å; P56-T58 PolarHBondContact O-OG1 3.47Å; T58-S60 PolarHBondContact O-N 2.96Å; T58-S60 VanDerWaalsContact O-N 3.16Å
59T39.2Very low42.4Very low119 Ų119121.9 Ų121.973%0.7369%0.685SS**  trans-78.895.7-178.938.10000110.2A57 S61A57-T59 VanDerWaalsContact C-N 3.29Å; A57-T59 PolarHBondContact O-N 2.83Å; T59-S61 PolarHBondContact O-N 3.31Å
60S41.8Very low42.7Very low69 Ų69119.3 Ų119.348%0.48368%0.675SS.*  trans-71.1104168.7450000109.8T58T58-S60 PolarHBondContact O-N 2.96Å; T58-S60 VanDerWaalsContact O-N 3.16Å
61S41.4Very low42.7Very low66 Ų66117.5 Ų117.546%0.46268%0.682SS.*EExtended strand (participates in β ladder)trans-87.1125.5174.263.40000110.8T59T59-S61 PolarHBondContact O-N 3.31Å
62W39.2Very low42.9Very low149 Ų149115.4 Ų115.456%0.56467%0.673SS**EExtended strand (participates in β ladder)trans-85.4124.1171.1-64.799000110.3L81 R83W62-L81 HydrophobicContact CB-CD2 4.27Å; W62-L81 HydrophobicContact CE3-CB 4.11Å; W62-L81 HydrophobicContact CZ3-CB 4.36Å; W62-R83 HydrophobicContact CE3-CB 4.28Å; W62-R83 HydrophobicContact CH2-CB 3.96Å; W62-R83 HydrophobicContact CH2-CG 3.97Å; W62-R83 HydrophobicContact CZ2-CG 4.45Å; W62-R83 HydrophobicContact CZ3-CB 3.63Å; W62-R83 HydrophobicContact CZ3-CG 4.07Å
63E41.3Very low42.9Very low100 Ų100113.4 Ų113.447%0.46767%0.67SS.*EExtended strand (participates in β ladder)trans-100.7126.6175-170.7174.8-170.200109.7V65 Q84E63-V65 HydrophobicContact CG-CG2 4.48Å; E63-V65 PolarHBondContact O-N 3.39Å; E63-Q84 PolarHBondContact OE2-NE2 3.49Å
64V44.8Very low43.3Very low79 Ų79115.3 Ų115.348%0.47967%0.668SS.*EExtended strand (participates in β ladder)trans-91.392.9179.1-178.40000108.8R66 L79 L81V64-R66 PolarHBondContact O-N 3.11Å; V64-R66 VanDerWaalsContact O-N 3.11Å; V64-L79 HydrophobicContact CG1-CD1 4.19Å; V64-L79 HydrophobicContact CG1-CD2 3.7Å; V64-L79 HydrophobicContact CG1-CG 4.36Å; V64-L81 HydrophobicContact CG2-CD2 4.12Å
65V45.5Very low43.4Very low58 Ų58114.5 Ų114.535%0.35267%0.668SS.*EExtended strand (participates in β ladder)trans-76.5100.5179.1-175.80000109.5E63E63-V65 HydrophobicContact CG-CG2 4.48Å; E63-V65 PolarHBondContact O-N 3.39Å
66R45.5Very low43.9Very low196 Ų196117.9 Ų117.974%0.7467%0.673SS**  trans-81.1119.1169-79.8-173.3171.9-169.3-1.2110V64 P68 L79V64-R66 PolarHBondContact O-N 3.11Å; V64-R66 VanDerWaalsContact O-N 3.11Å; R66-P68 WeakPolarHBondContact O-CD 3.35Å; R66-L79 HydrophobicContact CG-CD2 4.37Å
67N48.8Very low44.3Very low143 Ų143117.5 Ų117.577%0.76567%0.669SS**  trans-102105.3162.6-88.4-31.9000109.2L69N67-L69 PolarHBondContact O-N 3Å; N67-L69 VanDerWaalsContact O-N 3.13Å
68P47.8Very low45.1Very low117 Ų117121.5 Ų121.576%0.7667%0.67SS**  trans-88.668.5-176.736.4-34.9000111.5R66R66-P68 WeakPolarHBondContact O-CD 3.35Å
69L48Very low45.4Very low168 Ų168120.6 Ų120.688%0.8866%0.66SS**  trans-136.962.6170.7-72.4178.8000111.1N67N67-L69 PolarHBondContact O-N 3Å; N67-L69 VanDerWaalsContact O-N 3.13Å
70I48.2Very low46Very low119 Ų119118.9 Ų118.961%0.6165%0.65SS**  trans-13288.6163.1-53.8179.8000107.4N72I70-N72 HydrophobicContact CG2-CB 4.08Å; I70-N72 PolarHBondContact O-N 3.36Å
71A44.7Very low46.3Very low118 Ų118120.7 Ų120.798%0.97565%0.653SS**  trans-8061.817200000110.2
72N45.6Very low46.5Very low110 Ų110125 Ų12559%0.58866%0.659SS**SBendtrans-142.7129.2176-166.41.2000110I70 F74I70-N72 HydrophobicContact CG2-CB 4.08Å; I70-N72 PolarHBondContact O-N 3.36Å; N72-F74 PolarHBondContact O-N 3.48Å
73S47.5Very low47.1Very low109 Ų109126.1 Ų126.176%0.76266%0.663SS**SBendtrans-82.544.6-163.843.90000114.6
74F42.9Very low47.4Very low170 Ų170125 Ų12575%0.74666%0.659SS**SBendtrans-132.5116.4166.3-66.4-79.7000109.6N72 L76N72-F74 PolarHBondContact O-N 3.48Å; F74-L76 VanDerWaalsContact C-N 3.29Å; F74-L76 PolarHBondContact O-N 3.49Å
75S44.3Very low47.3Very low121 Ų121126.4 Ų126.485%0.84666%0.662SS**  trans-79.550.5-15549.70000116.2V77S75-V77 PolarHBondContact O-N 3.01Å
76L44.1Very low47.4Very low156 Ų156130.9 Ų130.982%0.81768%0.677SS**  trans-91.487.5171.3-68.2178.3000111.5F74 K78F74-L76 VanDerWaalsContact C-N 3.29Å; F74-L76 PolarHBondContact O-N 3.49Å; L76-K78 PolarHBondContact O-N 3.22Å; L76-K78 VanDerWaalsContact O-N 3.09Å
77V49.9Very low47.3Very low101 Ų101127.6 Ų127.661%0.61268%0.675SS**  trans-71.1102.5173.4-174.30000109.7S75 L79S75-V77 PolarHBondContact O-N 3.01Å; V77-L79 HydrophobicContact CG1-CD2 3.57Å; V77-L79 HydrophobicContact CG1-CG 4.16Å; V77-L79 PolarHBondContact O-N 3.4Å
78K54.9Low47.4Very low172 Ų172129.9 Ų129.975%0.74868%0.677SS**  trans-71.493.1173.9-174.6175.9179.8175.70110.7L76L76-K78 PolarHBondContact O-N 3.22Å; L76-K78 VanDerWaalsContact O-N 3.09Å
79L49Very low46.9Very low92 Ų92129.3 Ų129.348%0.48268%0.675SS.*  trans-79122.9173-59.6-178.2000110.4V64 R66 V77V64-L79 HydrophobicContact CG1-CD1 4.19Å; V64-L79 HydrophobicContact CG1-CD2 3.7Å; V64-L79 HydrophobicContact CG1-CG 4.36Å; R66-L79 HydrophobicContact CG-CD2 4.37Å; V77-L79 HydrophobicContact CG1-CD2 3.57Å; V77-L79 HydrophobicContact CG1-CG 4.16Å; V77-L79 PolarHBondContact O-N 3.4Å
80V51.9Low46.3Very low84 Ų84126.9 Ų126.951%0.50967%0.671SS.*EExtended strand (participates in β ladder)trans-101.9110171.7-179.40000108.1R82V80-R82 PolarHBondContact O-N 2.67Å
81L47.4Very low45.8Very low106 Ų106127.2 Ų127.256%0.55568%0.681SS**EExtended strand (participates in β ladder)trans-81.1113.4175.6-74166.5000109.7W62 V64W62-L81 HydrophobicContact CB-CD2 4.27Å; W62-L81 HydrophobicContact CE3-CB 4.11Å; W62-L81 HydrophobicContact CZ3-CB 4.36Å; V64-L81 HydrophobicContact CG2-CD2 4.12Å
82R44.6Very low45.3Very low157 Ų157125.6 Ų125.659%0.59267%0.668SS**EExtended strand (participates in β ladder)trans-98.7119.1174.4-170.7177.4-178.5177.50.5109.5V80 Q84V80-R82 PolarHBondContact O-N 2.67Å; R82-Q84 PolarHBondContact O-N 3.48Å
83R53Low45.1Very low172 Ų172126.7 Ų126.765%0.64968%0.681SS**EExtended strand (participates in β ladder)trans-75104175-167173.474.7-179.13.1110W62 L85W62-R83 HydrophobicContact CE3-CB 4.28Å; W62-R83 HydrophobicContact CH2-CB 3.96Å; W62-R83 HydrophobicContact CH2-CG 3.97Å; W62-R83 HydrophobicContact CZ2-CG 4.45Å; W62-R83 HydrophobicContact CZ3-CB 3.63Å; W62-R83 HydrophobicContact CZ3-CG 4.07Å; R83-L85 PolarHBondContact O-N 2.87Å
84Q46.3Very low44.4Very low78 Ų78133.4 Ų133.436%0.36469%0.689SS.*EExtended strand (participates in β ladder)trans-87.5102.9173-69.6-81.934.600109.5E63 R82 K86E63-Q84 PolarHBondContact OE2-NE2 3.49Å; R82-Q84 PolarHBondContact O-N 3.48Å; Q84-K86 PolarHBondContact O-N 3.49Å
85L43.8Very low44.5Very low107 Ų107135.2 Ų135.256%0.5670%0.697SS**  trans-80.495.7172.4-176.165.7000109.3R83 N87R83-L85 PolarHBondContact O-N 2.87Å; L85-N87 VanDerWaalsContact C-N 3.29Å; L85-N87 WeakPolarHBondContact CG-OD1 3.25Å; L85-N87 PolarHBondContact O-N 2.92Å
86K47Very low43.7Very low153 Ų153135.9 Ų135.967%0.66570%0.7SS**  trans-79.974.5-176.5-160.4169.3-167.7168.10111.2Q84 K88Q84-K86 PolarHBondContact O-N 3.49Å; K86-K88 PolarHBondContact O-N 2.85Å
87N43.6Very low43Very low127 Ų127131.7 Ų131.768%0.67969%0.694SS**  trans-62.793174.2-78.6-8000110.8L85 C89L85-N87 VanDerWaalsContact C-N 3.29Å; L85-N87 WeakPolarHBondContact CG-OD1 3.25Å; L85-N87 PolarHBondContact O-N 2.92Å; N87-C89 PolarHBondContact O-N 3.18Å
88K51.6Low41.9Very low190 Ų190136.1 Ų136.183%0.82671%0.708SS**  trans-74.656.1167.4-76.7-86-166.4166.10110.3K86K86-K88 PolarHBondContact O-N 2.85Å
89C36.8Very low40.7Very low106 Ų106131.9 Ų131.972%0.71671%0.705SS**  trans-148.998.5172.4-157.90000111N87N87-C89 PolarHBondContact O-N 3.18Å
90C35.1Very low40.1Very low117 Ų117136.4 Ų136.479%0.79172%0.721SS**  trans156.8142.2141.2-85.30000110.2
91P38.3Very low39.2Very low126 Ų126140.2 Ų140.282%0.81874%0.738SS**  trans-74.5161.8179.231.5-35000112.6
92A34.2Very low38.7Very low84 Ų84139.5 Ų139.569%0.69474%0.742SS**  trans-63.6151.6-17300000114.5R94A92-R94 PolarHBondContact O-N 3.38Å; A92-R94 VanDerWaalsContact O-N 3.1Å
93P40Very low38.3Very low133 Ų133141.6 Ų141.686%0.86476%0.755SS**  trans-72.5103.5175.430.3-33.8000110.7
94R33.6Very low37.2Very low250 Ų250144.6 Ų144.694%0.94377%0.767SS**  trans-73.4127171.1-73.8-173.5171.6-167-2.2110.3A92A92-R94 PolarHBondContact O-N 3.38Å; A92-R94 VanDerWaalsContact O-N 3.1Å
95K44.3Very low36.5Very low207 Ų207148.6 Ų148.690%0.979%0.789SS**  trans-97.3120.1160.9-73.3-161.6176.8-170.30109.9
96C29Very low36.1Very low136 Ų136152.3 Ų152.392%0.91980%0.801SS**  trans-170.9148.3154.6-103.80000105.2
97G28.1Very low35.2Very low67 Ų67152.9 Ų152.969%0.69181%0.806SS**  cis13678.213.300000109.2
98E28.1Very low34.7Very low195 Ų195153.8 Ų153.891%0.91180%0.804SS**  trans58.9149.5155.3-143.9167.8-168.500121.8
99A29.9Very low33.6Very low83 Ų83150.4 Ų150.469%0.68679%0.794SS**  trans72.1141.3165.300000118.9
100K34.8Very low33.6Very low187 Ų187152.1 Ų152.181%0.81380%0.797SS**  cis-166.4160-6.9-120.5167.5-169168.30112.3
101L33Very low33.7Very low163 Ų163152.4 Ų152.485%0.85380%0.8SS**  trans66.3161.5161-62.3165.3000116.9
102S38.3Very low33.6Very low92 Ų92152.7 Ų152.764%0.64380%0.799SS**  cis-162.7152.6-29.556.40000108.8
103K34.8Very low33.5Very low200 Ų200157.5 Ų157.587%0.8781%0.81SS**  -170166.576.4-89.1174.7179.2170.70111.1
104R29.9Very low33.2Very low236 Ų236160 Ų16089%0.89181%0.807SS**  trans-31.5150173.3-66.2176.3175.4-160.1-1.2115.8
105L32.9Very low33.1Very low161 Ų161152.4 Ų152.484%0.84380%0.797SS**  -156.8160.862.3-166.563000115
106K34.9Very low32.4Very low185 Ų185148.2 Ų148.280%0.80479%0.789SS**  trans-50.3170.1-176.2-57-77.2-173.4166.30115.7
107H27.3Very low32.6Very low165 Ų165150.1 Ų150.176%0.76479%0.785SS**  cis-155.9178.524.6-168.637.2000114
108K33.5Very low32.8Very low147 Ų147155.7 Ų155.764%0.63979%0.793SS**  trans-63.3168.7176.1-115.4174.3157.2-92.70111.9
109D29.8Very low32.9Very low118 Ų118150.4 Ų150.463%0.63178%0.782SS**  cis-151.8152.538.5-113.5-44.5000116.2
110D36.2Very low32.9Very low143 Ų143157.3 Ų157.377%0.76579%0.79SS**  trans-95.9154.1162.2-63.1-71.9000110.1
111S37.5Very low32.8Very low123 Ų123157.4 Ų157.486%0.8679%0.791SS**  -175.1147.712049.50000114.4
112V35.8Very low33Very low131 Ų131160.4 Ų160.479%0.79479%0.791SS**  trans-94.8137.6168.4165.50000109.1
113M32.7Very low32.8Very low186 Ų186162.8 Ų162.892%0.91680%0.796SS**  trans-140.9164.5153.4-96.1-160.370.700112.7
114K33.9Very low32.8Very low185 Ų185158.1 Ų158.180%0.80479%0.789SS**  trans-110.6176-158.9-82.1-116.9-174.5178.80113.8
115A30Very low33.2Very low90 Ų90154.7 Ų154.774%0.74479%0.787SS**  trans78.4150.7155.700000116.4
116T30.5Very low33.5Very low119 Ų119152.2 Ų152.273%0.7378%0.782SS**  cis-158.7156.1-0.5-103.60000111.4
117Q33.7Very low33.5Very low176 Ų176149.1 Ų149.182%0.82278%0.784SS**  trans7.8141.1162.3-57.817121.400122.5
118Q31.8Very low33.9Very low185 Ų185151.3 Ų151.386%0.86479%0.792SS**  -172.9155.3110.5-108.4-172.66.100116.5
119A29.6Very low34Very low83 Ų83149.8 Ų149.869%0.68680%0.799SS**  trans60.5115.5153.200000120.8
120R31Very low34.3Very low228 Ų228154.1 Ų154.186%0.8681%0.813SS**  66.2132.389-106-178.2175.7-1740.8113.3
121K31.9Very low34.2Very low189 Ų189159 Ų15982%0.82282%0.82SS**  cis-146.6172.227.2-99-179.9179.3177.10112.5
122R36.5Very low34.5Very low227 Ų227159.2 Ų159.286%0.85782%0.819SS**  trans-113.1158.6-178.6-139.6-174.7-170.6154.80.2110.5
123N33.9Very low34.5Very low141 Ų141158.1 Ų158.175%0.75482%0.824SS**  trans102.8138150.5-57.8-12.2000121.6
124S36.6Very low34.2Very low102 Ų102152.9 Ų152.971%0.71382%0.817SS**  trans-54.7168.4167.952.20000117.4
125I36.5Very low34.1Very low165 Ų165153.3 Ų153.385%0.84682%0.822SS**  -167.9159.6118.4-92.8148.6000111
126S39.1Very low34.2Very low108 Ų108161 Ų16176%0.75583%0.831SS**  trans-75.1166-171.958.60000117.7
127S35.2Very low34.5Very low121 Ų121166.7 Ų166.785%0.84684%0.84SS**  trans-152.1154.5136.162.40000113.1
128K36.3Very low35Very low210 Ų210164 Ų16491%0.91384%0.837SS**  trans-114142.3177.8-82.3179.2174173.50110.6
129S36Very low35Very low115 Ų115160.2 Ų160.280%0.80484%0.837SS**  trans-150109.8150.150.10000108.1
130K34.8Very low35Very low210 Ų210160.2 Ų160.291%0.91385%0.845SS**  56.4110.784-79.7-164.9173.9-175.60114.9
131R35Very low35Very low245 Ų245153 Ų15393%0.92584%0.842SS**  trans-74.7161164.9-63.1177.1173.5178.4-3.5111.5
132P43.6Very low35.4Very low127 Ų127151.4 Ų151.483%0.82584%0.841SS**  trans-113171.2142.135.1-25.3000112.2
133A35.4Very low35.5Very low109 Ų109151.7 Ų151.790%0.90184%0.842SS**  trans-108.2158.7-179.600000112.1
134G27.4Very low35.7Very low75 Ų75154 Ų15477%0.77385%0.848SS**  trans-171.9148.6176.700000113.1
135H31.4Very low36.1Very low194 Ų194154.1 Ų154.190%0.89885%0.849SS**  trans-93.2143.6-170.9-65.2-112.7000113.8
136R31Very low36.7Very low251 Ų251156.5 Ų156.595%0.94785%0.853SS**  168.4143.3125.6-96.2175.8170.6-179.8-3.4112.6
137R37.5Very low36.6Very low240 Ų240159.8 Ų159.891%0.90686%0.857SS**  trans-86.4165.7157.4-91-177.8-179.7174.90.7108.2
138P44.4Very low36.9Very low119 Ų119158.9 Ų158.977%0.77385%0.85SS**  cis-148.8-171.337.143.4-22.6000118
139A31.9Very low37.4Very low105 Ų105155.1 Ų155.187%0.86885%0.851SS**  trans74.5129.4154.800000120.2
140G29Very low38.1Very low83 Ų83159.1 Ų159.186%0.85685%0.853SS**  trans125.3134164.100000114.9
141G30.6Very low38.7Very low76 Ų76157.1 Ų157.178%0.78485%0.847SS**  trans105.178.2159.300000117.8
142I41.8Very low39.5Very low157 Ų157154.8 Ų154.881%0.80584%0.844SS**  trans33.9120.5132.7-60.7165000118E144I142-E144 PolarHBondContact O-N 3.26Å
143R38.3Very low39.7Very low233 Ų233157.1 Ų157.188%0.87984%0.841SS**PPolyproline II helixtrans-62120.6159.2-87.1-179.9161.1-147.40.3110.1
144E38.2Very low40.3Very low189 Ų189158 Ų15888%0.88383%0.83SS**PPolyproline II helixtrans-78.8121156.8-70.6-173.1159.400109.6I142 K146I142-E144 PolarHBondContact O-N 3.26Å; E144-K146 PolarHBondContact O-N 2.93Å
145S45.4Very low41.6Very low104 Ų104159.1 Ų159.173%0.72782%0.822SS**PPolyproline II helixtrans-76.8121.1176.4-68.30000110.6E147S145-E147 VanDerWaalsContact C-N 3.31Å; S145-E147 PolarHBondContact O-N 2.9Å
146K49.3Very low42.8Very low215 Ų215154.1 Ų154.194%0.93581%0.805SS**  trans-76.679.8172.2-172.4179.7-176.9174.90110E144E144-K146 PolarHBondContact O-N 2.93Å
147E35.1Very low44.2Very low178 Ų178150.6 Ų150.683%0.83279%0.792SS**  trans-82146.2-178.8-165163.4-168.800112.8S145S145-E147 VanDerWaalsContact C-N 3.31Å; S145-E147 PolarHBondContact O-N 2.9Å
148S43.2Very low45.4Very low102 Ų102144.4 Ų144.471%0.71377%0.773SS**  trans-92.9119.8-157.650.50000115.1K150S148-K150 PolarHBondContact O-N 3.45Å
149S46.2Very low46.6Very low131 Ų131142.6 Ų142.692%0.91676%0.757SS**  trans-8168.717149.10000113.1
150K50.4Low48.2Very low199 Ų199142.2 Ų142.287%0.86574%0.74SS**  trans-138.821.6-177.5-144.8-171.7175.4-175.80117.8S148S148-K150 PolarHBondContact O-N 3.45Å
151E48.1Very low50.2Low167 Ų167144.7 Ų144.778%0.7873%0.729SS**SBendtrans-108.5-30.6-175-159.5166.7-176.200115.2K153E151-K153 VanDerWaalsContact C-N 3.27Å; E151-K153 PolarHBondContact O-N 3.27Å
152K50.3Low52Low197 Ų197145.6 Ų145.686%0.85772%0.716SS**THydrogen-bonded Turntrans-79.818.9-167.9-61.5-171.2176.7-176.40116.9
153K49Very low53.2Low175 Ų175143.6 Ų143.676%0.76170%0.698SS**THydrogen-bonded Turntrans-119-7.3-176.9-149.6179.6-177.8-178.10114.8E151E151-K153 VanDerWaalsContact C-N 3.27Å; E151-K153 PolarHBondContact O-N 3.27Å
154L47.6Very low54.6Low128 Ų128140.8 Ų140.867%0.6769%0.689SS**THydrogen-bonded Turntrans-90.5-49.2-177.5-140.3159.8000110.9V156 R157 Q158L154-V156 VanDerWaalsContact C-N 3.34Å; L154-V156 PolarHBondContact O-N 3.05Å; L154-R157 PolarHBondContact O-N 2.77Å; L154-R157 VanDerWaalsContact O-N 3.13Å; L154-Q158 PolarHBondContact O-N 3.11Å
155T55.2Low56.1Low98 Ų98134.9 Ų134.960%0.60167%0.672SS**Hα-helixtrans-58.3-36.6177.927.10000114.6R157 Q158 D159T155-R157 VanDerWaalsContact C-N 3.28Å; T155-R157 PolarHBondContact O-N 2.77Å; T155-Q158 PolarHBondContact O-N 2.88Å; T155-D159 PolarHBondContact O-N 3.38Å; T155-D159 VanDerWaalsContact O-N 3.07Å
156V56.2Low56.9Low90 Ų90136.9 Ų136.955%0.54567%0.67SS.*Hα-helixtrans-69.8-24.1179.6178.80000112.7L154 L160L154-V156 VanDerWaalsContact C-N 3.34Å; L154-V156 PolarHBondContact O-N 3.05Å; V156-L160 WeakPolarHBondContact O-CD1 3.33Å
157R59.5Low57.5Low177 Ų177133.2 Ų133.267%0.66866%0.656SS**Hα-helixtrans-77.9-44.2172.5-79.5-174160.7-172.4-9.9111L154 T155 D159 L160 E161L154-R157 PolarHBondContact O-N 2.77Å; L154-R157 VanDerWaalsContact O-N 3.13Å; T155-R157 VanDerWaalsContact C-N 3.28Å; T155-R157 PolarHBondContact O-N 2.77Å; R157-D159 PolarHBondContact O-N 3.07Å; R157-L160 CarbonylContact O-C 3.59Å; R157-L160 WeakPolarHBondContact O-CA 3.45Å; R157-L160 WeakPolarHBondContact O-CB 3.49Å; R157-L160 PolarHBondContact O-N 2.78Å; R157-E161 PolarHBondContact O-N 3.17Å
158Q64.6Low58.5Low109 Ų109128.8 Ų128.851%0.50964%0.641SS.*Hα-helixtrans-60.1-46.2-179.2-149.5149.8700111.8L154 T155 L160 E161 D162L154-Q158 PolarHBondContact O-N 3.11Å; T155-Q158 PolarHBondContact O-N 2.88Å; Q158-L160 PolarHBondContact O-N 2.98Å; Q158-E161 PolarHBondContact O-N 3.07Å; Q158-E161 VanDerWaalsContact O-N 3.11Å; Q158-D162 WeakPolarHBondContact O-CB 3.22Å; Q158-D162 PolarHBondContact O-N 3.44Å
159D68.6Low58.8Low82 Ų82127.8 Ų127.844%0.43964%0.639SS.*Hα-helixtrans-58.9-26.7172.3169.590.5000114.5T155 R157 R163T155-D159 PolarHBondContact O-N 3.38Å; T155-D159 VanDerWaalsContact O-N 3.07Å; R157-D159 PolarHBondContact O-N 3.07Å; D159-R163 WeakPolarHBondContact O-CG 3.17Å; D159-R163 PolarHBondContact O-N 3.33Å; D159-R163 PolarHBondContact O-NE 3.13Å; D159-R163 IonicContact OD1-NE 2.68Å; D159-R163 IonicContact OD2-CZ 3.25Å; D159-R163 IonicContact OD2-NE 3.83Å; D159-R163 PolarHBondContact OD2-NE 2.84Å; D159-R163 IonicContact OD2-NH2 3.68Å; D159-R163 PolarHBondContact OD2-NH2 3.3Å
160L65.8Low59.1Low97 Ų97125.5 Ų125.551%0.50863%0.628SS.*Hα-helixtrans-83.4-38.3174.6-83.1166.8000112.2V156 R157 Q158 Y164V156-L160 WeakPolarHBondContact O-CD1 3.33Å; R157-L160 CarbonylContact O-C 3.59Å; R157-L160 WeakPolarHBondContact O-CA 3.45Å; R157-L160 WeakPolarHBondContact O-CB 3.49Å; R157-L160 PolarHBondContact O-N 2.78Å; Q158-L160 PolarHBondContact O-N 2.98Å; L160-Y164 PolarHBondContact O-N 3.46Å; L160-Y164 VanDerWaalsContact O-N 3.17Å
161E70.4Confident59.2Low134 Ų134122 Ų12263%0.62662%0.623SS**Hα-helixtrans-62.7-47.4173-112.797-139.800110.6R157 Q158 R163 Y164 A165R157-E161 PolarHBondContact O-N 3.17Å; Q158-E161 PolarHBondContact O-N 3.07Å; Q158-E161 VanDerWaalsContact O-N 3.11Å; E161-R163 PolarHBondContact O-N 3.3Å; E161-Y164 WeakPolarHBondContact O-CA 3.43Å; E161-Y164 WeakPolarHBondContact O-CB 3.43Å; E161-Y164 PolarHBondContact O-N 3.33Å; E161-A165 PolarHBondContact O-N 3.27Å
162D68.6Low59.5Low96 Ų96122.6 Ų122.651%0.51363%0.626SS.*Hα-helixtrans-62.7-44.8-177.9-65.5-27.3000111.4Q158 Y164 A165 E166Q158-D162 WeakPolarHBondContact O-CB 3.22Å; Q158-D162 PolarHBondContact O-N 3.44Å; D162-Y164 VanDerWaalsContact C-N 3.25Å; D162-Y164 PolarHBondContact O-N 3.39Å; D162-A165 WeakPolarHBondContact O-CB 2.99Å; D162-A165 PolarHBondContact O-N 3.36Å; D162-E166 PolarHBondContact O-N 3.28Å; D162-E166 VanDerWaalsContact O-N 3.08Å
163R68Low59.2Low114 Ų114117.9 Ų117.943%0.4362%0.624SS.*Hα-helixtrans-66.8-23.9173.7-74.1-173.9-70.8131-6.5113.5D159 E161 H167D159-R163 WeakPolarHBondContact O-CG 3.17Å; D159-R163 PolarHBondContact O-N 3.33Å; D159-R163 PolarHBondContact O-NE 3.13Å; D159-R163 IonicContact OD1-NE 2.68Å; D159-R163 IonicContact OD2-CZ 3.25Å; D159-R163 IonicContact OD2-NE 3.83Å; D159-R163 PolarHBondContact OD2-NE 2.84Å; D159-R163 IonicContact OD2-NH2 3.68Å; D159-R163 PolarHBondContact OD2-NH2 3.3Å; E161-R163 PolarHBondContact O-N 3.3Å; R163-H167 PolarHBondContact O-CD2 3.47Å
164Y67.4Low59Low174 Ų174117.3 Ų117.368%0.68263%0.628SS**Hα-helixtrans-76-39.2172.3-149.4-93.4000110.8L160 E161 D162 H167 V168L160-Y164 PolarHBondContact O-N 3.46Å; L160-Y164 VanDerWaalsContact O-N 3.17Å; E161-Y164 WeakPolarHBondContact O-CA 3.43Å; E161-Y164 WeakPolarHBondContact O-CB 3.43Å; E161-Y164 PolarHBondContact O-N 3.33Å; D162-Y164 VanDerWaalsContact C-N 3.25Å; D162-Y164 PolarHBondContact O-N 3.39Å; Y164-H167 PolarHBondContact O-N 3.06Å; Y164-V168 HydrophobicContact CD1-CG2 3.82Å; Y164-V168 HydrophobicContact CE1-CG2 3.88Å; Y164-V168 WeakPolarHBondContact O-CG2 3.37Å; Y164-V168 PolarHBondContact O-N 3.43Å; Y164-V168 VanDerWaalsContact O-N 3.13Å
165A70Confident58.9Low65 Ų65116.9 Ų116.954%0.53763%0.633SS.*Hα-helixtrans-61.7-44.5176.700000112.6E161 D162 H167 V168E161-A165 PolarHBondContact O-N 3.27Å; D162-A165 WeakPolarHBondContact O-CB 2.99Å; D162-A165 PolarHBondContact O-N 3.36Å; A165-H167 PolarHBondContact O-N 3.46Å; A165-V168 PolarHBondContact O-N 2.68Å
166E61.8Low58.3Low147 Ų147120.6 Ų120.669%0.68764%0.644SS**Hα-helixtrans-60-30.9176.4-75-169.1142.600113.3D162D162-E166 PolarHBondContact O-N 3.28Å; D162-E166 VanDerWaalsContact O-N 3.08Å
167H62.3Low57.7Low137 Ų137123.9 Ų123.963%0.63466%0.658SS**Hα-helixtrans-90.8-17.7-178.1-67.7-36.1000114.6R163 Y164 A165R163-H167 PolarHBondContact O-CD2 3.47Å; Y164-H167 PolarHBondContact O-N 3.06Å; A165-H167 PolarHBondContact O-N 3.46Å
168V54.7Low56.8Low86 Ų86119.2 Ų119.252%0.52165%0.653SS.*Hα-helixtrans-75.2-29.5177.11670000112.4Y164 A165 A170Y164-V168 HydrophobicContact CD1-CG2 3.82Å; Y164-V168 HydrophobicContact CE1-CG2 3.88Å; Y164-V168 WeakPolarHBondContact O-CG2 3.37Å; Y164-V168 PolarHBondContact O-N 3.43Å; Y164-V168 VanDerWaalsContact O-N 3.13Å; A165-V168 PolarHBondContact O-N 2.68Å; V168-A170 VanDerWaalsContact C-N 3.28Å; V168-A170 PolarHBondContact O-N 3.21Å
169A50.8Low55.5Low81 Ų81118 Ų11867%0.66967%0.67SS**G310 helixtrans-71.4-17.2-179.900000114.3T171A169-T171 VanDerWaalsContact C-N 3.34Å; A169-T171 PolarHBondContact O-N 3.35Å
170A52.6Low54.3Low83 Ų83120.9 Ų120.969%0.68669%0.69SS**G310 helixtrans-79.9-5-171.300000115.5V168V168-A170 VanDerWaalsContact C-N 3.28Å; V168-A170 PolarHBondContact O-N 3.21Å
171T51.2Low53.1Low125 Ų125120.7 Ų120.777%0.76770%0.703SS**G310 helixtrans-104.22.5-172.7-47.80000113.6A169A169-T171 VanDerWaalsContact C-N 3.34Å; A169-T171 PolarHBondContact O-N 3.35Å
172Q55.3Low51.6Low180 Ų180119.2 Ų119.284%0.84171%0.713SS**  trans-125.578.2179.3-70.7-173.377.800112.2
173A43.3Very low50.2Low98 Ų98126.6 Ų126.681%0.8173%0.734SS**  trans-146.266.5169.500000111.2
174L45Very low49.4Very low162 Ų162131.4 Ų131.485%0.84876%0.758SS**  trans-87.1131.2157.9-173.269.1000107.5Q176L174-Q176 PolarHBondContact O-N 2.92Å; L174-Q176 VanDerWaalsContact O-N 3.14Å
175P46.1Very low47.8Very low120 Ų120126.3 Ų126.378%0.77976%0.759SS**  trans-72.1110.9-175.3-13.728.4000111.1D177P175-D177 PolarHBondContact O-N 3.31Å
176Q42.2Very low46.9Very low175 Ų175129.7 Ų129.782%0.81878%0.776SS**  trans-91.271.8170-168.1172.24.600109.7L174 S178L174-Q176 PolarHBondContact O-N 2.92Å; L174-Q176 VanDerWaalsContact O-N 3.14Å; Q176-S178 PolarHBondContact O-N 3.41Å; Q176-S178 PolarHBondContact O-OG 2.97Å
177D43.7Very low45.9Very low159 Ų159128.6 Ų128.685%0.8578%0.779SS**  trans-65.5131.2169.5-166.72.4000109.5P175P175-D177 PolarHBondContact O-N 3.31Å
178S39.4Very low45Very low80 Ų80130 Ų13056%0.55979%0.79SS**  trans-124.479.5-160.4-650000110.1Q176 T180Q176-S178 PolarHBondContact O-N 3.41Å; Q176-S178 PolarHBondContact O-OG 2.97Å; S178-T180 PolarHBondContact O-N 3.49Å
179G38.9Very low44.6Very low83 Ų83133 Ų13386%0.85680%0.802SS**  trans-70.3106.7171.900000111.9
180T43.8Very low44.2Very low142 Ų142133.3 Ų133.387%0.87180%0.797SS**  trans-70.2130.6-17740.50000114.8S178S178-T180 PolarHBondContact O-N 3.49Å
181A38.7Very low43.5Very low94 Ų94136.9 Ų136.978%0.77780%0.8SS**  trans-154.5139.7154.100000113.7
182A40.7Very low43.3Very low102 Ų102136.4 Ų136.484%0.84380%0.797SS**  trans58.579.3157.800000120.1
183W39.4Very low42.6Very low251 Ų251136 Ų13695%0.95180%0.795SS**  trans-82.3114.5157.3-70.217.5000111.6
184K50Low42.5Very low215 Ų215140 Ų14094%0.93579%0.794SS**  trans-156.1134147.8-73.3-152.3-173.3-54.40111.7
185G34.7Very low42.3Very low68 Ų68144 Ų14470%0.70180%0.798SS**  trans129.793.2165.400000114.8V187G185-V187 PolarHBondContact O-N 2.99Å
186P50.1Low42.3Very low136 Ų136146.2 Ų146.288%0.88380%0.798SS**  trans-85.6104.9168.832.4-28.7000110.2
187V40.3Very low42.3Very low124 Ų124146.9 Ų146.975%0.75280%0.801SS**  trans-135.4106.5171.5-176.90000110.5G185G185-V187 PolarHBondContact O-N 2.99Å
188L44.8Very low42.2Very low165 Ų165146.8 Ų146.886%0.86480%0.799SS**  trans36.7105.7148.5-61.2165.4000119.1
189L46.3Very low42.7Very low151 Ų151147.5 Ų147.579%0.79181%0.805SS**  trans-58.1144.4155.7-161.7-82.4000109.1
190P42.2Very low43.3Very low87 Ų87151.5 Ų151.557%0.56580%0.801SS**  cis-125.1130.737.6159.6000117.1T192P190-T192 HydrophobicContact CB-CG2 3.72Å; P190-T192 PolarHBondContact O-N 3.32Å
191E37.9Very low44.1Very low157 Ų157152 Ų15273%0.73480%0.799SS**  trans-81.351.7160.4-160.2-176.7168.800111.3Q193E191-Q193 PolarHBondContact O-N 2.96Å; E191-Q193 VanDerWaalsContact O-N 3.11Å
192T45.4Very low45.6Very low115 Ų115151.8 Ų151.871%0.70679%0.787SS**THydrogen-bonded Turntrans-85.645.717851.30000112.1P190P190-T192 HydrophobicContact CB-CG2 3.72Å; P190-T192 PolarHBondContact O-N 3.32Å
193Q41.7Very low47.7Very low173 Ų173152.7 Ų152.781%0.80878%0.778SS**THydrogen-bonded Turntrans-154.928.4178.1-127.4170.318.300116.5E191E191-Q193 PolarHBondContact O-N 2.96Å; E191-Q193 VanDerWaalsContact O-N 3.11Å
194K41.2Very low50Low180 Ų180145.5 Ų145.578%0.78376%0.761SS**SBendtrans-136.422.2170.6-122.3177.9-175.5179.80116.2
195R40.9Very low51.7Low247 Ų247137.5 Ų137.593%0.93273%0.729SS**SBendtrans-111.711.4172.2-130177.6-165.8153.74.5113.9
196Q46.5Very low54.2Low167 Ų167140.6 Ų140.678%0.7872%0.724SS**SBendtrans-12155-178.1-69.5-177.5-40.800111.4
197Q42.6Very low55.9Low189 Ų189137.1 Ų137.188%0.88371%0.714SS**  trans-1639.4165.7-119.8168.717.900117S199Q197-S199 VanDerWaalsContact C-N 3.32Å; Q197-S199 PolarHBondContact O-N 3.37Å
198L41.4Very low58.1Low156 Ų156132.7 Ų132.782%0.81769%0.685SS**SBendtrans-75.9101.3139.6-148.881.5000104.5E200L198-E200 PolarHBondContact O-N 3.39Å
199S48.2Very low60.3Low96 Ų96127.6 Ų127.667%0.67166%0.662SS**  trans-58.1112.6156.348.90000104.9Q197 D201Q197-S199 VanDerWaalsContact C-N 3.32Å; Q197-S199 PolarHBondContact O-N 3.37Å; S199-D201 PolarHBondContact O-N 2.93Å
200E53.1Low62.4Low166 Ų166122.4 Ų122.478%0.77664%0.637SS**  trans-54.5108.2170.4-71.4177.1157.500106L198 T202L198-E200 PolarHBondContact O-N 3.39Å; E200-T202 VanDerWaalsContact C-N 3.3Å; E200-T202 WeakPolarHBondContact O-CA 3.41Å; E200-T202 PolarHBondContact O-N 2.99Å; E200-T202 PolarHBondContact O-OG1 2.78Å
201D59.9Low64.8Low154 Ų154124.3 Ų124.382%0.82464%0.638SS**  trans-62.595.7-167.7-164.721.5000106.7S199 L203S199-D201 PolarHBondContact O-N 2.93Å; D201-L203 WeakPolarHBondContact O-CA 3.31Å; D201-L203 PolarHBondContact O-N 3.3Å
202T70.2Confident67.4Low88 Ų88118.1 Ų118.154%0.5462%0.617SS.*  trans-72.2100-141.7-57.50000108.6E200 T204 P209E200-T202 VanDerWaalsContact C-N 3.3Å; E200-T202 WeakPolarHBondContact O-CA 3.41Å; E200-T202 PolarHBondContact O-N 2.99Å; E200-T202 PolarHBondContact O-OG1 2.78Å; T202-T204 VanDerWaalsContact O-CG2 3.23Å; T202-T204 WeakPolarHBondContact O-CG2 3.46Å; T202-T204 PolarHBondContact O-N 3.38Å; T202-P209 HydrophobicContact CG2-CB 4.3Å
203L84.4Confident69.6Low122 Ų122115.2 Ų115.264%0.63959%0.593SS**  trans-49.9106.4-155.5-171.1100000110.9D201 I205 T210D201-L203 WeakPolarHBondContact O-CA 3.31Å; D201-L203 PolarHBondContact O-N 3.3Å; L203-I205 HydrophobicContact CD2-CD1 4.29Å; L203-I205 HydrophobicContact CD2-CG1 4.15Å; L203-T210 PolarHBondContact O-N 3.35Å; L203-T210 PolarHBondContact O-OG1 3.41Å
204T89.1Confident72.1Confident99 Ų99112 Ų11261%0.60758%0.578SS**EExtended strand (participates in β ladder)trans-88.7121-176.1580000110.3T202 L208T202-T204 VanDerWaalsContact O-CG2 3.23Å; T202-T204 WeakPolarHBondContact O-CG2 3.46Å; T202-T204 PolarHBondContact O-N 3.38Å; T204-L208 CarbonylContact C-O 3.43Å; T204-L208 WeakPolarHBondContact CA-O 3.45Å
205I85.4Confident74.6Confident48 Ų48106.3 Ų106.325%0.24656%0.564CS.*EExtended strand (participates in β ladder)trans-105.1113.4175.8-55.4176.7000106.5L203 G207 L208 T210 Y213L203-I205 HydrophobicContact CD2-CD1 4.29Å; L203-I205 HydrophobicContact CD2-CG1 4.15Å; I205-G207 PolarHBondContact O-N 3.46Å; I205-L208 PolarHBondContact N-O 3.02Å; I205-L208 PolarHBondContact O-N 3.1Å; I205-L208 VanDerWaalsContact O-N 3.1Å; I205-T210 HydrophobicContact CD1-CG2 4.37Å; I205-Y213 HydrophobicContact CB-CD1 4.12Å; I205-Y213 HydrophobicContact CB-CD2 4.22Å; I205-Y213 HydrophobicContact CB-CG 3.82Å; I205-Y213 HydrophobicContact CD1-CD1 3.99Å; I205-Y213 HydrophobicContact CD1-CG 4.46Å; I205-Y213 HydrophobicContact CG2-CD1 3.72Å; I205-Y213 HydrophobicContact CG2-CD2 3.74Å; I205-Y213 HydrophobicContact CG2-CE1 3.91Å; I205-Y213 HydrophobicContact CG2-CE2 3.94Å; I205-Y213 HydrophobicContact CG2-CG 3.64Å
206H86.9Confident77.2Confident132 Ų13295.7 Ų95.761%0.61153%0.526SS*.THydrogen-bonded Turntrans54.534.5-175-58.6-65.9000114.5L208 Y213 L251H206-L208 VanDerWaalsContact C-N 3.29Å; H206-L208 PolarHBondContact O-N 3.26Å; H206-Y213 AromaticContact CD2-CE2 3.67Å; H206-L251 HydrophobicContact CB-CD1 4.36Å; H206-L251 HydrophobicContact CB-CD2 3.87Å
207G85.4Confident79.5Confident64 Ų6492.5 Ų92.566%0.6651%0.508SS*.THydrogen-bonded Turntrans79.64.8-179.400000114.9I205I205-G207 PolarHBondContact O-N 3.46Å
208L86.8Confident81.9Confident30 Ų3087.1 Ų87.116%0.15748%0.482CS..EExtended strand (participates in β ladder)trans-104.6145.5169.9-60.5176.5000109.7T204 I205 H206 L216 L251 Q254T204-L208 CarbonylContact C-O 3.43Å; T204-L208 WeakPolarHBondContact CA-O 3.45Å; I205-L208 PolarHBondContact N-O 3.02Å; I205-L208 PolarHBondContact O-N 3.1Å; I205-L208 VanDerWaalsContact O-N 3.1Å; H206-L208 VanDerWaalsContact C-N 3.29Å; H206-L208 PolarHBondContact O-N 3.26Å; L208-L216 HydrophobicContact CD1-CD2 4.21Å; L208-L251 HydrophobicContact CD1-CD2 4.03Å; L208-Q254 HydrophobicContact CD1-CG 4.47Å; L208-Q254 HydrophobicContact CD2-CG 3.86Å
209P91.4Very high84.5Confident59 Ų5983 Ų8338%0.38347%0.471SS..EExtended strand (participates in β ladder)trans-58.7155.5165.628.9-35.2000109.8T202 E211 G212 Y213T202-P209 HydrophobicContact CG2-CB 4.3Å; P209-E211 PolarHBondContact O-N 2.93Å; P209-G212 WeakPolarHBondContact O-CA 3.42Å; P209-G212 PolarHBondContact O-N 3.28Å; P209-Y213 PolarHBondContact O-N 2.94Å
210T91Very high86.7Confident42 Ų4279.8 Ų79.826%0.25845%0.447SS..Hα-helixtrans-55.3-39.1-173.5-72.80000112.6L203 I205 G212 Y213 Q214L203-T210 PolarHBondContact O-N 3.35Å; L203-T210 PolarHBondContact O-OG1 3.41Å; I205-T210 HydrophobicContact CD1-CG2 4.37Å; T210-G212 PolarHBondContact O-N 3.45Å; T210-Y213 PolarHBondContact O-N 2.92Å; T210-Q214 WeakPolarHBondContact O-CB 3.36Å; T210-Q214 PolarHBondContact O-N 3.48Å
211E92.5Very high88.7Confident127 Ų12772.1 Ų72.159%0.59341%0.412SS*.Hα-helixtrans-64.9-39.3176.2-58.468.4-150.100111.6P209 Q214 A215P209-E211 PolarHBondContact O-N 2.93Å; E211-Q214 PolarHBondContact O-N 3.27Å; E211-A215 WeakPolarHBondContact O-CB 3.38Å; E211-A215 PolarHBondContact O-N 2.89Å
212G90.8Very high90.3Very high27 Ų2769.1 Ų69.128%0.27839%0.393SS..Hα-helixtrans-68.2-41.2177.100000112.1P209 T210 L216P209-G212 WeakPolarHBondContact O-CA 3.42Å; P209-G212 PolarHBondContact O-N 3.28Å; T210-G212 PolarHBondContact O-N 3.45Å; G212-L216 WeakPolarHBondContact O-CB 3.42Å; G212-L216 PolarHBondContact O-N 3.31Å
213Y92.8Very high91.4Very high54 Ų5469 Ų6921%0.21239%0.393CS..Hα-helixtrans-65.9-41.1173-178.7-98.8000112I205 H206 P209 T210 L216 Y217 L251I205-Y213 HydrophobicContact CB-CD1 4.12Å; I205-Y213 HydrophobicContact CB-CD2 4.22Å; I205-Y213 HydrophobicContact CB-CG 3.82Å; I205-Y213 HydrophobicContact CD1-CD1 3.99Å; I205-Y213 HydrophobicContact CD1-CG 4.46Å; I205-Y213 HydrophobicContact CG2-CD1 3.72Å; I205-Y213 HydrophobicContact CG2-CD2 3.74Å; I205-Y213 HydrophobicContact CG2-CE1 3.91Å; I205-Y213 HydrophobicContact CG2-CE2 3.94Å; I205-Y213 HydrophobicContact CG2-CG 3.64Å; H206-Y213 AromaticContact CD2-CE2 3.67Å; P209-Y213 PolarHBondContact O-N 2.94Å; T210-Y213 PolarHBondContact O-N 2.92Å; Y213-L216 PolarHBondContact O-N 2.85Å; Y213-Y217 WeakPolarHBondContact O-CB 3.42Å; Y213-Y217 PolarHBondContact O-N 3.22Å; Y213-L251 HydrophobicContact CD2-CD2 4.18Å; Y213-L251 HydrophobicContact CE2-CD1 4.42Å; Y213-L251 HydrophobicContact CE2-CD2 4.26Å
214Q93.9Very high91.9Very high106 Ų10665 Ų6550%0.49537%0.372SS..Hα-helixtrans-62.4-48.6175.5178.7170.53.500111.2T210 E211 L216 Y217 H218T210-Q214 WeakPolarHBondContact O-CB 3.36Å; T210-Q214 PolarHBondContact O-N 3.48Å; E211-Q214 PolarHBondContact O-N 3.27Å; Q214-L216 VanDerWaalsContact C-N 3.33Å; Q214-L216 PolarHBondContact O-N 2.82Å; Q214-Y217 WeakPolarHBondContact O-CB 3.42Å; Q214-Y217 PolarHBondContact O-N 2.88Å; Q214-Y217 VanDerWaalsContact O-N 3.11Å; Q214-H218 VanDerWaalsContact CG-CD2 3.49Å; Q214-H218 WeakPolarHBondContact CG-CD2 3.39Å; Q214-H218 PolarHBondContact NE2-NE2 3.01Å; Q214-H218 PolarHBondContact O-CD2 3.23Å; Q214-H218 PolarHBondContact O-N 2.79Å
215A93.6Very high92.1Very high59 Ų5963.2 Ų63.249%0.48836%0.358SS..Hα-helixtrans-58.6-43.6176.900000112.1E211 Y217 H218 A219E211-A215 WeakPolarHBondContact O-CB 3.38Å; E211-A215 PolarHBondContact O-N 2.89Å; A215-Y217 VanDerWaalsContact C-N 3.35Å; A215-Y217 PolarHBondContact O-N 3.47Å; A215-H218 PolarHBondContact O-N 2.96Å; A215-A219 VanDerWaalsContact O-CB 3.28Å; A215-A219 WeakPolarHBondContact O-CB 3.34Å; A215-A219 PolarHBondContact O-N 3.36Å
216L94.6Very high92.6Very high25 Ų2566.8 Ų66.813%0.13137%0.369CS..Hα-helixtrans-59.2-45173.6-168.189.9000111.5L208 G212 Y213 Q214 A219 V220 A250 L251L208-L216 HydrophobicContact CD1-CD2 4.21Å; G212-L216 WeakPolarHBondContact O-CB 3.42Å; G212-L216 PolarHBondContact O-N 3.31Å; Y213-L216 PolarHBondContact O-N 2.85Å; Q214-L216 VanDerWaalsContact C-N 3.33Å; Q214-L216 PolarHBondContact O-N 2.82Å; L216-A219 PolarHBondContact O-N 3.17Å; L216-V220 WeakPolarHBondContact O-CB 3.32Å; L216-V220 WeakPolarHBondContact O-CG2 3.43Å; L216-V220 PolarHBondContact O-N 3.34Å; L216-A250 HydrophobicContact CD1-CB 4.08Å; L216-A250 HydrophobicContact CD2-CB 4.35Å; L216-A250 HydrophobicContact CG-CB 4.36Å; L216-L251 HydrophobicContact CD2-CD2 3.48Å; L216-L251 VanDerWaalsContact CD2-CD2 3.48Å; L216-L251 HydrophobicContact CD2-CG 3.74Å
217Y94.9Very high92.8Very high100 Ų10063.1 Ų63.139%0.39235%0.354SS..Hα-helixtrans-61.5-49.7179.2-172.2-85.7000111.5Y213 Q214 A215 A219 V220 V221 L247Y213-Y217 WeakPolarHBondContact O-CB 3.42Å; Y213-Y217 PolarHBondContact O-N 3.22Å; Q214-Y217 WeakPolarHBondContact O-CB 3.42Å; Q214-Y217 PolarHBondContact O-N 2.88Å; Q214-Y217 VanDerWaalsContact O-N 3.11Å; A215-Y217 VanDerWaalsContact C-N 3.35Å; A215-Y217 PolarHBondContact O-N 3.47Å; Y217-A219 PolarHBondContact O-N 3.04Å; Y217-V220 PolarHBondContact O-N 3.26Å; Y217-V221 HydrophobicContact CD1-CB 4.2Å; Y217-V221 HydrophobicContact CD1-CG2 4.07Å; Y217-V221 HydrophobicContact CD2-CG2 3.93Å; Y217-V221 HydrophobicContact CE1-CB 3.95Å; Y217-V221 HydrophobicContact CE1-CG1 4.01Å; Y217-V221 HydrophobicContact CE1-CG2 3.92Å; Y217-V221 HydrophobicContact CE2-CG2 3.79Å; Y217-V221 HydrophobicContact CG-CG2 4.07Å; Y217-V221 WeakPolarHBondContact O-CB 3.41Å; Y217-V221 VanDerWaalsContact O-CG2 3.22Å; Y217-V221 WeakPolarHBondContact O-CG2 3.14Å; Y217-V221 PolarHBondContact O-N 3.35Å; Y217-L247 HydrophobicContact CD2-CD1 3.99Å; Y217-L247 HydrophobicContact CD2-CD2 4.08Å; Y217-L247 HydrophobicContact CE2-CD1 3.92Å
218H94.8Very high93Very high75 Ų7566.9 Ų66.935%0.34737%0.366SS..Hα-helixtrans-60.9-47.4177.1-71.7-78.2000111.6Q214 A215 V220 V221 E222Q214-H218 VanDerWaalsContact CG-CD2 3.49Å; Q214-H218 WeakPolarHBondContact CG-CD2 3.39Å; Q214-H218 PolarHBondContact NE2-NE2 3.01Å; Q214-H218 PolarHBondContact O-CD2 3.23Å; Q214-H218 PolarHBondContact O-N 2.79Å; A215-H218 PolarHBondContact O-N 2.96Å; H218-V220 VanDerWaalsContact C-N 3.31Å; H218-V220 PolarHBondContact O-N 3.08Å; H218-V221 PolarHBondContact O-N 3.26Å; H218-E222 HydrophobicContact CB-CG 4.44Å; H218-E222 IonicContact CE1-OE1 2.67Å; H218-E222 IonicContact CG-OE1 2.74Å; H218-E222 IonicContact ND1-OE1 3.37Å; H218-E222 PolarHBondContact ND1-OE1 3.48Å; H218-E222 WeakPolarHBondContact O-CB 3.45Å; H218-E222 WeakPolarHBondContact O-CG 3.35Å; H218-E222 PolarHBondContact O-N 3.13Å
219A94.5Very high93.2Very high71 Ų7169.7 Ų69.759%0.58739%0.389SS*.Hα-helixtrans-60-36.2-179.200000113.7A215 L216 Y217 P223A215-A219 VanDerWaalsContact O-CB 3.28Å; A215-A219 WeakPolarHBondContact O-CB 3.34Å; A215-A219 PolarHBondContact O-N 3.36Å; L216-A219 PolarHBondContact O-N 3.17Å; Y217-A219 PolarHBondContact O-N 3.04Å; A219-P223 WeakPolarHBondContact O-CD 3.35Å; A219-P223 WeakPolarHBondContact O-CG 3.33Å
220V94.8Very high93.2Very high28 Ų2869.3 Ų69.317%0.1740%0.395CS..Hα-helixtrans-86.1-43.2179.3174.40000112.1L216 Y217 H218 M224 K246 L247 A250L216-V220 WeakPolarHBondContact O-CB 3.32Å; L216-V220 WeakPolarHBondContact O-CG2 3.43Å; L216-V220 PolarHBondContact O-N 3.34Å; Y217-V220 PolarHBondContact O-N 3.26Å; H218-V220 VanDerWaalsContact C-N 3.31Å; H218-V220 PolarHBondContact O-N 3.08Å; V220-M224 WeakPolarHBondContact O-CG 3.45Å; V220-K246 HydrophobicContact CG1-CB 3.67Å; V220-L247 HydrophobicContact CB-CD2 3.92Å; V220-L247 HydrophobicContact CB-CG 4.48Å; V220-L247 HydrophobicContact CG1-CD2 3.95Å; V220-L247 HydrophobicContact CG1-CG 3.97Å; V220-L247 HydrophobicContact CG2-CD2 4.43Å; V220-A250 HydrophobicContact CG2-CB 3.87Å
221V94.9Very high93.3Very high4 Ų470.4 Ų70.42%0.02440%0.402CS..Hα-helixtrans-86.7-38.1-167.1-178.30000112.4Y217 H218 M224 L225 I243 L247Y217-V221 HydrophobicContact CD1-CB 4.2Å; Y217-V221 HydrophobicContact CD1-CG2 4.07Å; Y217-V221 HydrophobicContact CD2-CG2 3.93Å; Y217-V221 HydrophobicContact CE1-CB 3.95Å; Y217-V221 HydrophobicContact CE1-CG1 4.01Å; Y217-V221 HydrophobicContact CE1-CG2 3.92Å; Y217-V221 HydrophobicContact CE2-CG2 3.79Å; Y217-V221 HydrophobicContact CG-CG2 4.07Å; Y217-V221 WeakPolarHBondContact O-CB 3.41Å; Y217-V221 VanDerWaalsContact O-CG2 3.22Å; Y217-V221 WeakPolarHBondContact O-CG2 3.14Å; Y217-V221 PolarHBondContact O-N 3.35Å; H218-V221 PolarHBondContact O-N 3.26Å; V221-M224 PolarHBondContact O-N 3.25Å; V221-M224 VanDerWaalsContact O-N 3.15Å; V221-L225 HydrophobicContact CG1-CD1 3.67Å; V221-L225 HydrophobicContact CG1-CG 3.89Å; V221-L225 WeakPolarHBondContact O-CG 3.48Å; V221-L225 PolarHBondContact O-N 3.17Å; V221-I243 HydrophobicContact CG1-CD1 4.33Å; V221-I243 HydrophobicContact CG1-CG2 4.36Å; V221-I243 HydrophobicContact CG2-CG2 3.94Å; V221-L247 HydrophobicContact CG2-CD1 3.83Å; V221-L247 HydrophobicContact CG2-CD2 4Å; V221-L247 HydrophobicContact CG2-CG 4.06Å
222E93.4Very high93.3Very high91 Ų9168.8 Ų68.843%0.42540%0.402SS..Hα-helixtrans-61.4-49.7-178-66.3-175.4174.600112.7H218 M224 L225 W226H218-E222 HydrophobicContact CB-CG 4.44Å; H218-E222 IonicContact CE1-OE1 2.67Å; H218-E222 IonicContact CG-OE1 2.74Å; H218-E222 IonicContact ND1-OE1 3.37Å; H218-E222 PolarHBondContact ND1-OE1 3.48Å; H218-E222 WeakPolarHBondContact O-CB 3.45Å; H218-E222 WeakPolarHBondContact O-CG 3.35Å; H218-E222 PolarHBondContact O-N 3.13Å; E222-M224 PolarHBondContact O-N 3.05Å; E222-L225 PolarHBondContact O-N 2.93Å; E222-W226 PolarHBondContact O-N 3.34Å
223P93.4Very high93.5Very high86 Ų8670.9 Ų70.956%0.55840%0.404SS*.Hα-helixtrans-59-26.3177.6-23.735.3000113.3A219 K233A219-P223 WeakPolarHBondContact O-CD 3.35Å; A219-P223 WeakPolarHBondContact O-CG 3.33Å; P223-K233 PolarHBondContact O-NZ 3.47Å
224M94.5Very high93.6Very high38 Ų3879.6 Ų79.619%0.18744%0.436CS..Hα-helixtrans-80.1-31.5176.3-62.3-170.17600112.8V220 V221 E222 K233 L239 A242 I243 K246V220-M224 WeakPolarHBondContact O-CG 3.45Å; V221-M224 PolarHBondContact O-N 3.25Å; V221-M224 VanDerWaalsContact O-N 3.15Å; E222-M224 PolarHBondContact O-N 3.05Å; M224-K233 WeakPolarHBondContact O-CD 3.3Å; M224-K233 PolarHBondContact O-NZ 3.02Å; M224-K233 VanDerWaalsContact O-NZ 3.15Å; M224-L239 HydrophobicContact CB-CD1 4.2Å; M224-L239 HydrophobicContact CE-CD1 4.49Å; M224-L239 WeakPolarHBondContact O-CD1 3.48Å; M224-A242 HydrophobicContact CE-CB 3.49Å; M224-A242 VanDerWaalsContact CE-CB 3.49Å; M224-I243 HydrophobicContact CB-CD1 4.45Å; M224-I243 HydrophobicContact CB-CG1 3.93Å; M224-I243 HydrophobicContact CE-CG1 4.12Å; M224-I243 HydrophobicContact SD-CG1 3.93Å; M224-K246 HydrophobicContact CE-CG 4.28Å; M224-K246 HydrophobicContact SD-CB 3.96Å; M224-K246 HydrophobicContact SD-CG 3.94Å
225L94.9Very high93.7Very high62 Ų6282.4 Ų82.433%0.32544%0.443SS..Hα-helixtrans-82.4-20.2177.2-69.5-178.4000114.4V221 E222 K233 L239 I243V221-L225 HydrophobicContact CG1-CD1 3.67Å; V221-L225 HydrophobicContact CG1-CG 3.89Å; V221-L225 WeakPolarHBondContact O-CG 3.48Å; V221-L225 PolarHBondContact O-N 3.17Å; E222-L225 PolarHBondContact O-N 2.93Å; L225-K233 WeakPolarHBondContact O-CB 3.47Å; L225-K233 PolarHBondContact O-N 3.36Å; L225-L239 HydrophobicContact CD2-CD2 4.28Å; L225-I243 HydrophobicContact CD2-CD1 3.91Å; L225-I243 HydrophobicContact CG-CD1 4.44Å
226W94.5Very high93.8Very high123 Ų12382 Ų8247%0.46644%0.437SS..BIsolated β-bridgetrans-105.3146.7178.6-63.1100.2000112.5E222 G230 P232 K233E222-W226 PolarHBondContact O-N 3.34Å; W226-G230 VanDerWaalsContact CE3-O 3.26Å; W226-G230 VanDerWaalsContact CZ3-O 3.25Å; W226-G230 WeakPolarHBondContact CZ3-O 3.23Å; W226-P232 HydrophobicContact CE3-CB 4.49Å; W226-P232 HydrophobicContact CE3-CG 4.05Å; W226-P232 HydrophobicContact CH2-CG 3.94Å; W226-P232 HydrophobicContact CZ3-CB 4.39Å; W226-P232 HydrophobicContact CZ3-CG 3.53Å; W226-K233 WeakPolarHBondContact O-CE 3.42Å; W226-K233 PolarHBondContact O-NZ 3.09Å
227N92.4Very high93.9Very high55 Ų5587 Ų8729%0.29446%0.463SS..  trans-80.6159.6166.8-70.8-51000110.7S229 G230 T231 K233N227-S229 WeakPolarHBondContact CB-OG 3.41Å; N227-S229 PolarHBondContact O-N 3.43Å; N227-G230 PolarHBondContact O-N 2.68Å; N227-T231 WeakPolarHBondContact CB-O 3.18Å; N227-T231 PolarHBondContact N-O 3.24Å; N227-T231 PolarHBondContact ND2-O 3.3Å; N227-T231 PolarHBondContact ND2-OG1 3.01Å; N227-K233 VanDerWaalsContact OD1-CE 3.25Å; N227-K233 WeakPolarHBondContact OD1-CE 3.41Å; N227-K233 WeakPolarHBondContact OD1-CG 3.43Å
228P89.3Confident94Very high142 Ų14289.6 Ų89.692%0.92248%0.479SS*.THydrogen-bonded Turntrans-56.7-22.1170.8-24.534.7000113.9G230P228-G230 PolarHBondContact O-N 3Å
229S90.1Very high94.1Very high90 Ų9087.2 Ų87.263%0.62947%0.469SS*.THydrogen-bonded Turntrans-80.68.4173.156.80000114.6N227 T231N227-S229 WeakPolarHBondContact CB-OG 3.41Å; N227-S229 PolarHBondContact O-N 3.43Å; S229-T231 PolarHBondContact O-N 3.14Å; S229-T231 PolarHBondContact OG-OG1 2.96Å; S229-T231 VanDerWaalsContact OG-OG1 3.09Å
230G91.1Very high94.2Very high50 Ų5084.1 Ų84.152%0.51544%0.444SS..SBendtrans68.912.9-178.400000114.6W226 N227 P228W226-G230 VanDerWaalsContact CE3-O 3.26Å; W226-G230 VanDerWaalsContact CZ3-O 3.25Å; W226-G230 WeakPolarHBondContact CZ3-O 3.23Å; N227-G230 PolarHBondContact O-N 2.68Å; P228-G230 PolarHBondContact O-N 3Å
231T92.9Very high94.3Very high66 Ų6689.3 Ų89.341%0.40546%0.464SS..PPolyproline II helixtrans-94.2141.4176.855.90000111.4N227 S229 K233N227-T231 WeakPolarHBondContact CB-O 3.18Å; N227-T231 PolarHBondContact N-O 3.24Å; N227-T231 PolarHBondContact ND2-O 3.3Å; N227-T231 PolarHBondContact ND2-OG1 3.01Å; S229-T231 PolarHBondContact O-N 3.14Å; S229-T231 PolarHBondContact OG-OG1 2.96Å; S229-T231 VanDerWaalsContact OG-OG1 3.09Å; T231-K233 PolarHBondContact O-N 2.86Å
232P94.3Very high94.4Very high92 Ų9291 Ų9160%0.59748%0.479SS*.BIsolated β-bridgetrans-62.1132.9173.9-19.630.6000111.1W226W226-P232 HydrophobicContact CE3-CB 4.49Å; W226-P232 HydrophobicContact CE3-CG 4.05Å; W226-P232 HydrophobicContact CH2-CG 3.94Å; W226-P232 HydrophobicContact CZ3-CB 4.39Å; W226-P232 HydrophobicContact CZ3-CG 3.53Å
233K94.4Very high94.5Very high71 Ų7187.4 Ų87.431%0.30946%0.462SS..PPolyproline II helixtrans-71.7144.4169.7-76.1158.6173.3156.70109.8P223 M224 L225 W226 N227 T231 Y235 L239P223-K233 PolarHBondContact O-NZ 3.47Å; M224-K233 WeakPolarHBondContact O-CD 3.3Å; M224-K233 PolarHBondContact O-NZ 3.02Å; M224-K233 VanDerWaalsContact O-NZ 3.15Å; L225-K233 WeakPolarHBondContact O-CB 3.47Å; L225-K233 PolarHBondContact O-N 3.36Å; W226-K233 WeakPolarHBondContact O-CE 3.42Å; W226-K233 PolarHBondContact O-NZ 3.09Å; N227-K233 VanDerWaalsContact OD1-CE 3.25Å; N227-K233 WeakPolarHBondContact OD1-CE 3.41Å; N227-K233 WeakPolarHBondContact OD1-CG 3.43Å; T231-K233 PolarHBondContact O-N 2.86Å; K233-Y235 PolarHBondContact O-N 3.49Å; K233-L239 HydrophobicContact CB-CD2 4.31Å
234R94.5Very high94.6Very high237 Ų23790.8 Ų90.889%0.89447%0.468SS*.PPolyproline II helixtrans-68.3132.4167.7-68.1-173.5178.8-1740.4108.9S236R234-S236 PolarHBondContact O-N 2.88Å
235Y95.1Very high94.7Very high165 Ų16593.9 Ų93.965%0.64748%0.482SS*.PPolyproline II helixtrans-64.7129.6175.5-171.2-97.3000110.6K233 G240K233-Y235 PolarHBondContact O-N 3.49Å; Y235-G240 WeakPolarHBondContact OH-CA 3.45Å
236S95.6Very high94.8Very high51 Ų5195.9 Ų95.936%0.35749%0.488SS..  trans-128.2161.1174.677.40000110R234 E238 L239 G240R234-S236 PolarHBondContact O-N 2.88Å; S236-E238 PolarHBondContact O-N 2.98Å; S236-L239 PolarHBondContact O-N 3.09Å; S236-L239 WeakPolarHBondContact OG-CB 3.37Å; S236-L239 PolarHBondContact OG-N 3.37Å; S236-G240 PolarHBondContact O-N 2.97Å
237L97.6Very high94.8Very high129 Ų12991 Ų9168%0.67547%0.471SS*.Hα-helixtrans-61.8-35.2176.8-178.461.6000111.9G240 K241L237-G240 PolarHBondContact O-N 3.11Å; L237-K241 WeakPolarHBondContact O-CG 3.36Å; L237-K241 PolarHBondContact O-N 3.48Å
238E96.9Very high94.9Very high156 Ų15696 Ų9673%0.72949%0.486SS*.Hα-helixtrans-67.1-44.4176.1-64.4175.7168.500111.4S236 G240 K241 A242S236-E238 PolarHBondContact O-N 2.98Å; E238-G240 VanDerWaalsContact C-N 3.33Å; E238-G240 PolarHBondContact O-N 3.13Å; E238-K241 PolarHBondContact O-N 3.36Å; E238-A242 WeakPolarHBondContact O-CB 3.34Å; E238-A242 PolarHBondContact O-N 3.2Å
239L96.6Very high95.2Very high24 Ų2492.7 Ų92.713%0.12646%0.458CS..Hα-helixtrans-60.5-43.5174.5-179.159.8000111.2M224 L225 K233 S236 K241 A242 I243M224-L239 HydrophobicContact CB-CD1 4.2Å; M224-L239 HydrophobicContact CE-CD1 4.49Å; M224-L239 WeakPolarHBondContact O-CD1 3.48Å; L225-L239 HydrophobicContact CD2-CD2 4.28Å; K233-L239 HydrophobicContact CB-CD2 4.31Å; S236-L239 PolarHBondContact O-N 3.09Å; S236-L239 WeakPolarHBondContact OG-CB 3.37Å; S236-L239 PolarHBondContact OG-N 3.37Å; L239-K241 PolarHBondContact O-N 3.23Å; L239-A242 PolarHBondContact O-N 3.1Å; L239-I243 HydrophobicContact CD1-CD1 4.04Å; L239-I243 HydrophobicContact CD1-CG1 4.25Å; L239-I243 HydrophobicContact CG-CD1 3.86Å; L239-I243 HydrophobicContact CG-CG1 4.49Å; L239-I243 WeakPolarHBondContact O-CB 3.39Å; L239-I243 VanDerWaalsContact O-CG1 3.32Å; L239-I243 WeakPolarHBondContact O-CG1 3.46Å; L239-I243 PolarHBondContact O-N 3.13Å
240G96.7Very high95.4Very high6 Ų689.4 Ų89.46%0.06244%0.436CS..Hα-helixtrans-61.8-38175.600000113.9Y235 S236 L237 E238 K244Y235-G240 WeakPolarHBondContact OH-CA 3.45Å; S236-G240 PolarHBondContact O-N 2.97Å; L237-G240 PolarHBondContact O-N 3.11Å; E238-G240 VanDerWaalsContact C-N 3.33Å; E238-G240 PolarHBondContact O-N 3.13Å; G240-K244 WeakPolarHBondContact O-CG 3.46Å; G240-K244 PolarHBondContact O-N 2.81Å
241K97.6Very high95.4Very high138 Ų13888.2 Ų88.260%0.642%0.418SS*.Hα-helixtrans-65.9-47.4172.4-74174179.6-178.90111.3L237 E238 L239 I243 K244 Q245L237-K241 WeakPolarHBondContact O-CG 3.36Å; L237-K241 PolarHBondContact O-N 3.48Å; E238-K241 PolarHBondContact O-N 3.36Å; L239-K241 PolarHBondContact O-N 3.23Å; K241-I243 PolarHBondContact O-N 2.93Å; K241-K244 PolarHBondContact O-N 3.39Å; K241-Q245 WeakPolarHBondContact O-CB 3.33Å; K241-Q245 PolarHBondContact O-N 3.39Å
242A96.6Very high95.2Very high40 Ų4088.2 Ų88.233%0.33142%0.42SS..Hα-helixtrans-63.2-41.1-178.800000112M224 E238 L239 Q245 K246M224-A242 HydrophobicContact CE-CB 3.49Å; M224-A242 VanDerWaalsContact CE-CB 3.49Å; E238-A242 WeakPolarHBondContact O-CB 3.34Å; E238-A242 PolarHBondContact O-N 3.2Å; L239-A242 PolarHBondContact O-N 3.1Å; A242-Q245 PolarHBondContact O-N 3.09Å; A242-K246 WeakPolarHBondContact O-CB 3.41Å; A242-K246 WeakPolarHBondContact O-CG 3.48Å; A242-K246 PolarHBondContact O-N 3.22Å
243I96.1Very high94.8Very high14 Ų1487.1 Ų87.17%0.07242%0.415CS..Hα-helixtrans-59-49.5173.8-75.7166.5000111V221 M224 L225 L239 K241 Q245 K246 L247V221-I243 HydrophobicContact CG1-CD1 4.33Å; V221-I243 HydrophobicContact CG1-CG2 4.36Å; V221-I243 HydrophobicContact CG2-CG2 3.94Å; M224-I243 HydrophobicContact CB-CD1 4.45Å; M224-I243 HydrophobicContact CB-CG1 3.93Å; M224-I243 HydrophobicContact CE-CG1 4.12Å; M224-I243 HydrophobicContact SD-CG1 3.93Å; L225-I243 HydrophobicContact CD2-CD1 3.91Å; L225-I243 HydrophobicContact CG-CD1 4.44Å; L239-I243 HydrophobicContact CD1-CD1 4.04Å; L239-I243 HydrophobicContact CD1-CG1 4.25Å; L239-I243 HydrophobicContact CG-CD1 3.86Å; L239-I243 HydrophobicContact CG-CG1 4.49Å; L239-I243 WeakPolarHBondContact O-CB 3.39Å; L239-I243 VanDerWaalsContact O-CG1 3.32Å; L239-I243 WeakPolarHBondContact O-CG1 3.46Å; L239-I243 PolarHBondContact O-N 3.13Å; K241-I243 PolarHBondContact O-N 2.93Å; I243-Q245 PolarHBondContact O-N 3.13Å; I243-K246 PolarHBondContact O-N 3.18Å; I243-L247 HydrophobicContact CG2-CD1 3.93Å; I243-L247 WeakPolarHBondContact O-CB 3.33Å; I243-L247 WeakPolarHBondContact O-CG 3.48Å; I243-L247 PolarHBondContact O-N 2.93Å
244K95.6Very high93.9Very high157 Ų15787.5 Ų87.568%0.68342%0.417SS*.Hα-helixtrans-62.6-42.6179.1-74.6-176.7176.2-168.30112.3G240 K241 W248G240-K244 WeakPolarHBondContact O-CG 3.46Å; G240-K244 PolarHBondContact O-N 2.81Å; K241-K244 PolarHBondContact O-N 3.39Å; K244-W248 WeakPolarHBondContact O-CB 3.4Å; K244-W248 PolarHBondContact O-N 2.96Å
245Q96.6Very high92.3Very high103 Ų10378.3 Ų78.348%0.48140%0.396SS..Hα-helixtrans-60.9-47.4176.6-17961.529.400111.2K241 A242 I243 W248 E249K241-Q245 WeakPolarHBondContact O-CB 3.33Å; K241-Q245 PolarHBondContact O-N 3.39Å; A242-Q245 PolarHBondContact O-N 3.09Å; I243-Q245 PolarHBondContact O-N 3.13Å; Q245-W248 PolarHBondContact O-N 3.14Å; Q245-E249 WeakPolarHBondContact CG-OE1 3.42Å; Q245-E249 PolarHBondContact NE2-OE1 3.01Å; Q245-E249 WeakPolarHBondContact O-CG 3.49Å; Q245-E249 PolarHBondContact O-N 3.49Å
246K95.8Very high90.4Very high105 Ų10573.7 Ų73.746%0.45739%0.393SS..Hα-helixtrans-67.8-37.5-179.8-76.6-74.7162.9-152.20113.4V220 M224 A242 I243 E249 A250V220-K246 HydrophobicContact CG1-CB 3.67Å; M224-K246 HydrophobicContact CE-CG 4.28Å; M224-K246 HydrophobicContact SD-CB 3.96Å; M224-K246 HydrophobicContact SD-CG 3.94Å; A242-K246 WeakPolarHBondContact O-CB 3.41Å; A242-K246 WeakPolarHBondContact O-CG 3.48Å; A242-K246 PolarHBondContact O-N 3.22Å; I243-K246 PolarHBondContact O-N 3.18Å; K246-E249 WeakPolarHBondContact CD-OE2 3.35Å; K246-E249 WeakPolarHBondContact CE-OE2 3.37Å; K246-E249 IonicContact NZ-OE2 3.66Å; K246-E249 PolarHBondContact NZ-OE2 3.49Å; K246-A250 VanDerWaalsContact O-CB 3.31Å; K246-A250 WeakPolarHBondContact O-CB 3.49Å; K246-A250 PolarHBondContact O-N 3.2Å
247L95.6Very high88.4Confident19 Ų1976.1 Ų76.110%0.09940%0.401CS..Hα-helixtrans-62.9-43.2172.6-78.1169.5000111.6Y217 V220 V221 I243 A250 L251Y217-L247 HydrophobicContact CD2-CD1 3.99Å; Y217-L247 HydrophobicContact CD2-CD2 4.08Å; Y217-L247 HydrophobicContact CE2-CD1 3.92Å; V220-L247 HydrophobicContact CB-CD2 3.92Å; V220-L247 HydrophobicContact CB-CG 4.48Å; V220-L247 HydrophobicContact CG1-CD2 3.95Å; V220-L247 HydrophobicContact CG1-CG 3.97Å; V220-L247 HydrophobicContact CG2-CD2 4.43Å; V221-L247 HydrophobicContact CG2-CD1 3.83Å; V221-L247 HydrophobicContact CG2-CD2 4Å; V221-L247 HydrophobicContact CG2-CG 4.06Å; I243-L247 HydrophobicContact CG2-CD1 3.93Å; I243-L247 WeakPolarHBondContact O-CB 3.33Å; I243-L247 WeakPolarHBondContact O-CG 3.48Å; I243-L247 PolarHBondContact O-N 2.93Å; L247-A250 PolarHBondContact O-N 3.16Å; L247-L251 WeakPolarHBondContact O-CB 3.19Å; L247-L251 VanDerWaalsContact O-CG 3.3Å; L247-L251 WeakPolarHBondContact O-CG 3.4Å; L247-L251 PolarHBondContact O-N 3.31Å
248W94.7Very high86Confident162 Ų16273.8 Ų73.861%0.61440%0.395SS*.Hα-helixtrans-63.6-47.7176.9-178.5-105.1000112.2K244 Q245 A250 L251 C252K244-W248 WeakPolarHBondContact O-CB 3.4Å; K244-W248 PolarHBondContact O-N 2.96Å; Q245-W248 PolarHBondContact O-N 3.14Å; W248-A250 VanDerWaalsContact C-N 3.3Å; W248-A250 PolarHBondContact O-N 2.93Å; W248-L251 PolarHBondContact O-N 3.46Å; W248-C252 VanDerWaalsContact CE2-SG 3.59Å; W248-C252 PolarHBondContact O-N 3.18Å; W248-C252 PolarHBondContact O-SG 2.57Å; W248-C252 VanDerWaalsContact O-SG 3.38Å
249E95.6Very high83.4Confident71 Ų7174.8 Ų74.833%0.33240%0.399SS..Hα-helixtrans-55.2-45.7174.3-74.5168.4-168.100111.7Q245 K246 C252 S253Q245-E249 WeakPolarHBondContact CG-OE1 3.42Å; Q245-E249 PolarHBondContact NE2-OE1 3.01Å; Q245-E249 WeakPolarHBondContact O-CG 3.49Å; Q245-E249 PolarHBondContact O-N 3.49Å; K246-E249 WeakPolarHBondContact CD-OE2 3.35Å; K246-E249 WeakPolarHBondContact CE-OE2 3.37Å; K246-E249 IonicContact NZ-OE2 3.66Å; K246-E249 PolarHBondContact NZ-OE2 3.49Å; E249-C252 PolarHBondContact O-N 3.26Å; E249-S253 WeakPolarHBondContact O-CB 3.28Å; E249-S253 PolarHBondContact O-N 3.26Å; E249-S253 PolarHBondContact O-OG 3.1Å
250A93.9Very high80.5Confident22 Ų2276.4 Ų76.418%0.18242%0.422CS..Hα-helixtrans-66-42.7-179.500000112.6L216 V220 K246 L247 W248 S253 Q254L216-A250 HydrophobicContact CD1-CB 4.08Å; L216-A250 HydrophobicContact CD2-CB 4.35Å; L216-A250 HydrophobicContact CG-CB 4.36Å; V220-A250 HydrophobicContact CG2-CB 3.87Å; K246-A250 VanDerWaalsContact O-CB 3.31Å; K246-A250 WeakPolarHBondContact O-CB 3.49Å; K246-A250 PolarHBondContact O-N 3.2Å; L247-A250 PolarHBondContact O-N 3.16Å; W248-A250 VanDerWaalsContact C-N 3.3Å; W248-A250 PolarHBondContact O-N 2.93Å; A250-S253 PolarHBondContact O-N 3.25Å; A250-Q254 WeakPolarHBondContact O-CB 3.44Å; A250-Q254 PolarHBondContact O-N 2.92Å
251L91.8Very high77.8Confident25 Ų2579.3 Ų79.313%0.13145%0.445CS..Hα-helixtrans-61.5-47.3175.2-74.2168.3000112H206 L208 Y213 L216 L247 W248 S253 Q254 G255H206-L251 HydrophobicContact CB-CD1 4.36Å; H206-L251 HydrophobicContact CB-CD2 3.87Å; L208-L251 HydrophobicContact CD1-CD2 4.03Å; Y213-L251 HydrophobicContact CD2-CD2 4.18Å; Y213-L251 HydrophobicContact CE2-CD1 4.42Å; Y213-L251 HydrophobicContact CE2-CD2 4.26Å; L216-L251 HydrophobicContact CD2-CD2 3.48Å; L216-L251 VanDerWaalsContact CD2-CD2 3.48Å; L216-L251 HydrophobicContact CD2-CG 3.74Å; L247-L251 WeakPolarHBondContact O-CB 3.19Å; L247-L251 VanDerWaalsContact O-CG 3.3Å; L247-L251 WeakPolarHBondContact O-CG 3.4Å; L247-L251 PolarHBondContact O-N 3.31Å; W248-L251 PolarHBondContact O-N 3.46Å; L251-S253 VanDerWaalsContact C-N 3.29Å; L251-S253 PolarHBondContact O-N 3.26Å; L251-Q254 PolarHBondContact O-N 2.94Å; L251-G255 PolarHBondContact O-N 2.89Å
252C88.3Confident75Confident66 Ų6680.7 Ų80.745%0.44645%0.454SS..Hα-helixtrans-62-38.2176.4-67.70000112.1W248 E249W248-C252 VanDerWaalsContact CE2-SG 3.59Å; W248-C252 PolarHBondContact O-N 3.18Å; W248-C252 PolarHBondContact O-SG 2.57Å; W248-C252 VanDerWaalsContact O-SG 3.38Å; E249-C252 PolarHBondContact O-N 3.26Å
253S84.6Confident72.3Confident69 Ų6987.8 Ų87.848%0.48348%0.477SS..Hα-helixtrans-69.5-39.1179.1-55.30000112E249 A250 L251 G255 A256 I257E249-S253 WeakPolarHBondContact O-CB 3.28Å; E249-S253 PolarHBondContact O-N 3.26Å; E249-S253 PolarHBondContact O-OG 3.1Å; A250-S253 PolarHBondContact O-N 3.25Å; L251-S253 VanDerWaalsContact C-N 3.29Å; L251-S253 PolarHBondContact O-N 3.26Å; S253-G255 VanDerWaalsContact C-N 3.33Å; S253-G255 PolarHBondContact O-N 3.42Å; S253-A256 PolarHBondContact O-N 2.84Å; S253-I257 PolarHBondContact O-N 3.23Å
254Q76.4Confident69.6Low78 Ų7894.7 Ų94.736%0.36451%0.514SS..Hα-helixtrans-67.5-33.6179.6-164.563.926.800112.4L208 A250 L251 A256 I257 S258L208-Q254 HydrophobicContact CD1-CG 4.47Å; L208-Q254 HydrophobicContact CD2-CG 3.86Å; A250-Q254 WeakPolarHBondContact O-CB 3.44Å; A250-Q254 PolarHBondContact O-N 2.92Å; L251-Q254 PolarHBondContact O-N 2.94Å; Q254-A256 VanDerWaalsContact C-N 3.33Å; Q254-A256 PolarHBondContact O-N 2.8Å; Q254-I257 PolarHBondContact O-N 2.96Å; Q254-S258 PolarHBondContact O-N 3.32Å
255G60.4Low66.8Low44 Ų4497.6 Ų97.645%0.45452%0.521SS..Hα-helixtrans-57.5-43.8172.400000112.7L251 S253 I257 S258 E259L251-G255 PolarHBondContact O-N 2.89Å; S253-G255 VanDerWaalsContact C-N 3.33Å; S253-G255 PolarHBondContact O-N 3.42Å; G255-I257 VanDerWaalsContact C-N 3.34Å; G255-I257 PolarHBondContact O-N 2.87Å; G255-S258 PolarHBondContact O-N 3.38Å; G255-E259 PolarHBondContact O-N 3.28Å
256A56.3Low64.1Low69 Ų69102.2 Ų102.257%0.5754%0.54SS*.Hα-helixtrans-67.4-30.3178.500000113.6S253 Q254S253-A256 PolarHBondContact O-N 2.84Å; Q254-A256 VanDerWaalsContact C-N 3.33Å; Q254-A256 PolarHBondContact O-N 2.8Å
257I53.6Low61.3Low102 Ų102103.5 Ų103.552%0.52356%0.559SS.*Hα-helixtrans-77.2-37.6177.5-61.6171.3000110.9S253 Q254 G255 E259 G260 A261S253-I257 PolarHBondContact O-N 3.23Å; Q254-I257 PolarHBondContact O-N 2.96Å; G255-I257 VanDerWaalsContact C-N 3.34Å; G255-I257 PolarHBondContact O-N 2.87Å; I257-E259 VanDerWaalsContact C-N 3.3Å; I257-E259 PolarHBondContact O-N 2.91Å; I257-G260 PolarHBondContact O-N 3.18Å; I257-A261 WeakPolarHBondContact O-CB 3.37Å; I257-A261 PolarHBondContact O-N 3.28Å
258S46Very low58.3Low79 Ų79106 Ų10655%0.55259%0.589SS**Hα-helixtrans-60.8-38.8177.5-164.20000112.3Q254 G255 G260 A261Q254-S258 PolarHBondContact O-N 3.32Å; G255-S258 PolarHBondContact O-N 3.38Å; S258-G260 VanDerWaalsContact C-N 3.33Å; S258-G260 PolarHBondContact O-N 3.13Å; S258-A261 PolarHBondContact O-N 3.3Å
259E41.9Very low55.4Low177 Ų177108.8 Ų108.883%0.82760%0.6SS**Hα-helixtrans-69.4-28.4178.9-151.6171.8-149.200112.8G255 I257G255-E259 PolarHBondContact O-N 3.28Å; I257-E259 VanDerWaalsContact C-N 3.3Å; I257-E259 PolarHBondContact O-N 2.91Å
260G37.3Very low52.6Low58 Ų58115.1 Ų115.160%0.59863%0.626SS**Hα-helixtrans-83.9-31.4174.900000114.9I257 S258 Q262I257-G260 PolarHBondContact O-N 3.18Å; S258-G260 VanDerWaalsContact C-N 3.33Å; S258-G260 PolarHBondContact O-N 3.13Å; G260-Q262 VanDerWaalsContact C-N 3.34Å; G260-Q262 PolarHBondContact O-N 3.13Å
261A38.4Very low49.8Very low67 Ų67124.7 Ų124.755%0.55466%0.657SS**THydrogen-bonded Turntrans-80.9-3.7-170.100000115.4I257 S258 K263I257-A261 WeakPolarHBondContact O-CB 3.37Å; I257-A261 PolarHBondContact O-N 3.28Å; S258-A261 PolarHBondContact O-N 3.3Å; A261-K263 VanDerWaalsContact C-N 3.35Å; A261-K263 PolarHBondContact O-N 2.98Å
262Q39.3Very low47.3Very low167 Ų167129.5 Ų129.578%0.7869%0.69SS**THydrogen-bonded Turntrans-78.7-7-179.9-86.8-73.3-28.600115.1G260G260-Q262 VanDerWaalsContact C-N 3.34Å; G260-Q262 PolarHBondContact O-N 3.13Å
263K41Very low44.6Very low189 Ų189129.9 Ų129.982%0.82271%0.705SS**SBendtrans-90.4-25.6-178.8-84.2-171.7172.7-179.30116.2A261A261-K263 VanDerWaalsContact C-N 3.35Å; A261-K263 PolarHBondContact O-N 2.98Å
264D39.4Very low42.1Very low159 Ų159133.6 Ų133.685%0.8573%0.725SS**  trans-11450.5-170.1-76.2-40.1000114.4
265R35.5Very low40.2Very low218 Ų218137.7 Ų137.782%0.82374%0.743SS**  trans-115.348.9170.1-151176.6-174176.82.1114.7
266F39.7Very low39Very low200 Ų200144.4 Ų144.488%0.87776%0.763SS**  trans-136.675.3163.9-70.5-72000113.5G268F266-G268 PolarHBondContact O-N 3.17Å
267P37.9Very low38.2Very low133 Ų133147.9 Ų147.986%0.86477%0.768SS**  trans-77.372.4167.132.9-32.9000110.2
268G32.9Very low37.8Very low70 Ų70148.5 Ų148.572%0.72278%0.778SS**  trans-106.829.6-162.300000117.5F266F266-G268 PolarHBondContact O-N 3.17Å
269R32.6Very low37.1Very low222 Ų222149 Ų14984%0.83878%0.778SS**  trans-157.7125.8164.2-132.6174.1-172.5-139.90.8115.2
270K37.9Very low36.9Very low203 Ų203148.4 Ų148.488%0.88378%0.779SS**  trans-77.8140165.3-62.5-176.4178.4-176.50110.6
271R33.7Very low37.1Very low223 Ų223152.4 Ų152.484%0.84279%0.787SS**  trans-136.7143.8141.4-81.2-163.3169.8-158.3-3.5108.8
272P41.1Very low37Very low127 Ų127158.1 Ų158.183%0.82580%0.799SS**  trans-94.5152.3-168.636.2-34.8000113.7
273G29.8Very low37Very low74 Ų74161.9 Ų161.976%0.76381%0.807SS**  trans79.1107.6149.100000117.9
274V32.6Very low37.4Very low147 Ų147159 Ų15989%0.89181%0.807SS**  -139.9143.4111.3175.20000107
275H35.9Very low37.5Very low163 Ų163161.1 Ų161.176%0.75581%0.809SS**  trans-87125.6178.3164.3-68.6000110.3
276E37.2Very low37.6Very low185 Ų185159.2 Ų159.286%0.86481%0.814SS**  trans-156.1120.1150.7-119167.1-141.300111.2
277E38.7Very low37.9Very low143 Ų143159.5 Ų159.567%0.66882%0.815SS**  trans-84.9149.5166.3-158.9-152.9127.700108.3V279E277-V279 PolarHBondContact OE1-N 3.3Å
278P44.2Very low37.8Very low114 Ų114159 Ų15974%0.7481%0.814SS**  -146128.1111.831.7-14.7000116.4
279V33Very low38.5Very low91 Ų91165.7 Ų165.755%0.55282%0.823SS**  59.1105126.9-171.70000118.7E277 N281E277-V279 PolarHBondContact OE1-N 3.3Å; V279-N281 PolarHBondContact O-N 3.38Å
280L37.1Very low39.2Very low164 Ų164168.1 Ų168.186%0.85984%0.84SS**  trans-60.9116.8164.3-77.2157.8000113.6K282L280-K282 PolarHBondContact O-N 3.4Å
281N40.8Very low39.3Very low142 Ų142166.4 Ų166.476%0.75984%0.838SS**  trans-93.581.3172.9-78.2-37.2000113.7V279V279-N281 PolarHBondContact O-N 3.38Å
282K37.4Very low39.6Very low187 Ų187163.4 Ų163.481%0.81384%0.838SS**  trans34.7116135.3-58.5175.9-173.9172.90119.5L280L280-K282 PolarHBondContact O-N 3.4Å
283W39.6Very low39.5Very low246 Ų246165.4 Ų165.493%0.93284%0.838SS**PPolyproline II helixtrans-76.1144.2160.9-75.949.2000112.2
284P47.5Very low40.1Very low127 Ų127170.8 Ų170.883%0.82584%0.843SS**PPolyproline II helixtrans-79.9129173.831.2-32.6000112.2
285K43.3Very low40.5Very low204 Ų204172.3 Ų172.389%0.88784%0.84SS**PPolyproline II helixtrans-84142.3173.7-74.7-176.1176.5179.90112
286L37.7Very low40.9Very low178 Ų178172.9 Ų172.993%0.93285%0.846SS**PPolyproline II helixtrans-56.9138.9170.8-70.1152.7000111.6
287K44.5Very low41.1Very low207 Ų207172 Ų17290%0.984%0.844SS**PPolyproline II helixtrans-96.6116.3163.4-71.9-163.9176.4-171.50109.8
288S37.3Very low41.3Very low122 Ų122174.2 Ų174.285%0.85386%0.858SS**PPolyproline II helixtrans-74.7134.1159.843.20000109.3
289K46.5Very low41.1Very low210 Ų210179.3 Ų179.391%0.91387%0.868SS**PPolyproline II helixtrans-96.8137.7172.4-166.4176.3-178.9-1770108
290K48Very low41.8Very low273 Ų273187.3 Ų187.3100%1.18790%0.896SS**  trans-120.50168.6-149.4-179.9-172.6-1760107.8

Retrieved 290 of 290 residues in 116.1 ms (Link to these results)