A0A5K4F931_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F931, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 116 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
1M68.2Low62.6Low240 Ų240143.9 Ų143.9100%1.18285%0.853SS**  0111.60-69.1176.289.600108
2Y65.1Low62.1Low230 Ų230142.1 Ų142.190%0.90285%0.853SS**  trans-133.9146.1166.1-81.7-82.3000106.6
3P70.2Confident61.3Low123 Ų123139.6 Ų139.680%0.79985%0.847SS**  trans-74.6130.7-175.129.6-31.7000110.9
4S71.2Confident60.4Low104 Ų104137.6 Ų137.673%0.72784%0.842SS**  trans-70.4127.3168.348.50000110.4S6S4-S6 PolarHBondContact O-N 3.35Å
5L67.7Low60Low176 Ų176136.5 Ų136.592%0.92184%0.842SS**  trans-78.4105.9166.5-79.1158.8000108.7
6S61.4Low59.3Low102 Ų102135.4 Ų135.471%0.71384%0.841SS**  trans-75.8126172.8-55.60000110.4S4 S8S4-S6 PolarHBondContact O-N 3.35Å; S6-S8 PolarHBondContact O-N 3.49Å
7T56.7Low58.6Low133 Ų133134.2 Ų134.282%0.81684%0.836SS**  trans-75.3113.9170.747.80000110S9T7-S9 PolarHBondContact O-N 3.27Å
8S56Low57.8Low121 Ų121132.7 Ų132.785%0.84683%0.831SS**  trans-81.698.5169.6-47.80000109.5S6S6-S8 PolarHBondContact O-N 3.49Å
9S57.1Low56.8Low114 Ų114131.2 Ų131.280%0.79783%0.826SS**  trans-74.9118.9165.246.50000109.9T7T7-S9 PolarHBondContact O-N 3.27Å
10S59.1Low56.4Low119 Ų119132.3 Ų132.383%0.83283%0.831SS**  trans-117.9100.1162.655.60000109.1
11S56.2Low55.6Low121 Ų121131.1 Ų131.185%0.84683%0.827SS**  trans-68.9128.516546.80000110.5
12S56.1Low54.2Low122 Ų122125 Ų12585%0.85381%0.808SS**  trans-129.4116.3158.454.90000108.7
13S51.8Low53.3Low110 Ų110119.5 Ų119.577%0.76980%0.803SS**  trans-83.7138.4-172.846.70000113.4
14S48.5Very low52.2Low111 Ų111118.6 Ų118.678%0.77680%0.8SS**  trans52.8111.9139.863.60000121
15S54.4Low51.1Low122 Ų122119.7 Ų119.785%0.85381%0.807SS**  trans-157.7103.7133.659.80000110.9
16S49.7Very low50.2Low118 Ų118115.6 Ų115.683%0.82580%0.799SS**  trans-109.5167.7156.1-530000106.8
17P47.5Very low49.8Very low116 Ų116116.2 Ų116.275%0.75380%0.803SS**  cis-141.4-176.37.438.7-17.7000115.3
18S43.9Very low49.7Very low107 Ų107117.5 Ų117.575%0.74880%0.804SS**  trans124.9117.9138.472.20000118.7
19S39.5Very low49.7Very low104 Ų104117.3 Ų117.373%0.72780%0.8SS**  trans54.2105.5148.559.90000120.6
20V48.4Very low49.5Very low153 Ų153121.1 Ų121.193%0.92780%0.802SS**  trans-139.6127.2137.5-80.70000110.5
21S39.3Very low49.3Very low107 Ų107121.8 Ų121.875%0.74880%0.801SS**  trans-77158.8-173-48.30000112.8
22S39.5Very low49.3Very low111 Ų111123.8 Ų123.878%0.77680%0.802SS**  trans62.8106.5148.254.90000119
23S46Very low49Very low115 Ų115123.2 Ų123.280%0.80480%0.798SS**  -172.2134122.239.50000113.1
24S47.6Very low49.5Very low105 Ų105123 Ų12373%0.73480%0.796SS**  trans60.693.4154.8580000119.1A26S24-A26 VanDerWaalsContact C-N 3.31Å; S24-A26 PolarHBondContact O-N 3.25Å
25S46.1Very low49.8Very low126 Ų126123.5 Ų123.588%0.88180%0.797SS**  trans-58.593.8145.852.50000109.3S27S25-S27 PolarHBondContact O-N 3.27Å; S25-S27 VanDerWaalsContact O-N 3.15Å
26A50.1Low50Low91 Ų91123 Ų12375%0.75279%0.793SS**  trans-63.8110.5170.600000108.9S24 L28S24-A26 VanDerWaalsContact C-N 3.31Å; S24-A26 PolarHBondContact O-N 3.25Å; A26-L28 PolarHBondContact O-N 3.01Å
27S52.3Low50.4Low114 Ų114124.8 Ų124.880%0.79779%0.793SS**PPolyproline II helixtrans-60.8129.9173.539.80000110.2S25S25-S27 PolarHBondContact O-N 3.27Å; S25-S27 VanDerWaalsContact O-N 3.15Å
28L55.3Low50.8Low161 Ų161124.5 Ų124.584%0.84379%0.791SS**PPolyproline II helixtrans-58.4140.8178.1-67.9167.4000110.6A26 K30A26-L28 PolarHBondContact O-N 3.01Å; L28-K30 PolarHBondContact O-N 3.29Å
29P54.6Low51.3Low117 Ų117129.7 Ų129.776%0.7680%0.8SS**PPolyproline II helixtrans-64.6128.1175.926.1-30.5000109.5V31P29-V31 PolarHBondContact O-N 2.84Å
30K54.8Low52.1Low193 Ų193129 Ų12984%0.83980%0.795SS**PPolyproline II helixtrans-52.6116.6176.4-159.1168.6-176.9175.70108.9L28 L32L28-K30 PolarHBondContact O-N 3.29Å; K30-L32 PolarHBondContact O-N 3Å
31V54.2Low52.6Low134 Ų134131.1 Ų131.181%0.81280%0.795SS**  trans-52.9104.9174.7174.90000108.3P29 S33P29-V31 PolarHBondContact O-N 2.84Å; V31-S33 PolarHBondContact O-N 2.85Å; V31-S33 VanDerWaalsContact O-N 3.08Å
32L55.7Low53.8Low163 Ų163130.2 Ų130.285%0.85378%0.781SS**  trans-67.6104.6166.1-100.381.2000106.6K30 S34K30-L32 PolarHBondContact O-N 3Å; L32-S34 PolarHBondContact O-N 3.36Å; L32-S34 VanDerWaalsContact O-N 3.17Å
33S50.8Low55.4Low110 Ų110127.8 Ų127.877%0.76976%0.764SS**PPolyproline II helixtrans-51.4117.7166.5460000109.2V31V31-S33 PolarHBondContact O-N 2.85Å; V31-S33 VanDerWaalsContact O-N 3.08Å
34S61.1Low56.5Low104 Ų104128.3 Ų128.373%0.72776%0.757SS**PPolyproline II helixtrans-61.4147.4173.535.80000110.7L32 S36L32-S34 PolarHBondContact O-N 3.36Å; L32-S34 VanDerWaalsContact O-N 3.17Å; S34-S36 PolarHBondContact O-N 2.95Å
35P55.9Low57.4Low123 Ų123128.7 Ų128.780%0.79975%0.75SS**PPolyproline II helixtrans-62.7126.8177.126-31.7000108.9L37P35-L37 PolarHBondContact O-N 3.35Å
36S58.5Low58.4Low112 Ų112127.5 Ų127.578%0.78373%0.731SS**PPolyproline II helixtrans-58.3124.1173.954.30000109.5S34S34-S36 PolarHBondContact O-N 2.95Å
37L56.9Low59.1Low155 Ų155130.2 Ų130.281%0.81272%0.723SS**PPolyproline II helixtrans-52140.3169.5-76.4124000109.6P35 K39P35-L37 PolarHBondContact O-N 3.35Å; L37-K39 PolarHBondContact O-N 3.03Å
38P56.7Low59.7Low110 Ų110129 Ų12971%0.71471%0.707SS**PPolyproline II helixtrans-59.3118.5175.223.8-30.7000108.9S40P38-S40 PolarHBondContact O-N 3.25Å
39K54.3Low60.3Low216 Ų216125 Ų12594%0.93969%0.689SS**  trans-7181169.2-70.5175.4178.7175.20108.2L37L37-K39 PolarHBondContact O-N 3.03Å
40S56.1Low60.8Low90 Ų90123.9 Ų123.963%0.62968%0.676SS**  trans-14165.2164.965.40000108.9P38 L42P38-S40 PolarHBondContact O-N 3.25Å; S40-L42 VanDerWaalsContact C-N 3.26Å; S40-L42 PolarHBondContact O-N 3.15Å; S40-L42 VanDerWaalsContact O-N 3.08Å
41Q59.6Low61.1Low197 Ų197118.1 Ų118.192%0.92166%0.655SS**  trans-68.895.8155.3-86.6175.5-16.200106S43Q41-S43 PolarHBondContact O-N 3.5Å
42L63.4Low61.4Low87 Ų87116.8 Ų116.846%0.45564%0.643SS.*  trans-49.4135.3156.8-77.6154.8000106.8S40 E46 L50S40-L42 VanDerWaalsContact C-N 3.26Å; S40-L42 PolarHBondContact O-N 3.15Å; S40-L42 VanDerWaalsContact O-N 3.08Å; L42-E46 HydrophobicContact CB-CB 4.22Å; L42-E46 HydrophobicContact CD2-CB 3.9Å; L42-E46 VanDerWaalsContact CD2-CD 3.48Å; L42-E46 HydrophobicContact CD2-CG 3.98Å; L42-E46 WeakPolarHBondContact CD2-OE2 3.36Å; L42-L50 HydrophobicContact CD1-CD1 4.43Å
43S72.7Confident61.4Low60 Ų60115.9 Ų115.942%0.4263%0.632SS.*  trans-58.3149.5172.962.30000109.2Q41 D45 E46 Y47Q41-S43 PolarHBondContact O-N 3.5Å; S43-D45 PolarHBondContact O-N 3.48Å; S43-D45 VanDerWaalsContact O-N 3.08Å; S43-E46 PolarHBondContact N-OE2 3.43Å; S43-E46 WeakPolarHBondContact O-CB 3.31Å; S43-E46 PolarHBondContact O-N 3.48Å; S43-E46 WeakPolarHBondContact OG-CB 3.24Å; S43-E46 PolarHBondContact OG-N 3.02Å; S43-Y47 PolarHBondContact O-N 2.87Å
44I69.2Low61.7Low127 Ų127118.6 Ų118.665%0.65163%0.63SS**Hα-helixtrans-51.2-35.8177.7-106.475.6000110.5Y47 L48I44-Y47 PolarHBondContact O-N 2.77Å; I44-L48 HydrophobicContact CG2-CD1 3.83Å; I44-L48 WeakPolarHBondContact O-CB 3.17Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 3.15Å
45D66.6Low61.3Low112 Ų112120.1 Ų120.160%0.59963%0.63SS**Hα-helixtrans-68.8-38.5179.7-56.9-30.5000112.3S43 L48 T49S43-D45 PolarHBondContact O-N 3.48Å; S43-D45 VanDerWaalsContact O-N 3.08Å; D45-L48 PolarHBondContact O-N 3.07Å; D45-T49 WeakPolarHBondContact O-CB 3.5Å; D45-T49 PolarHBondContact O-N 3.46Å; D45-T49 PolarHBondContact O-OG1 3.24Å
46E67.1Low61.3Low102 Ų102120.6 Ų120.648%0.47763%0.626SS.*Hα-helixtrans-65.1-41.9173-118.3171.5162.400111.3L42 S43 T49 L50L42-E46 HydrophobicContact CB-CB 4.22Å; L42-E46 HydrophobicContact CD2-CB 3.9Å; L42-E46 VanDerWaalsContact CD2-CD 3.48Å; L42-E46 HydrophobicContact CD2-CG 3.98Å; L42-E46 WeakPolarHBondContact CD2-OE2 3.36Å; S43-E46 PolarHBondContact N-OE2 3.43Å; S43-E46 WeakPolarHBondContact O-CB 3.31Å; S43-E46 PolarHBondContact O-N 3.48Å; S43-E46 WeakPolarHBondContact OG-CB 3.24Å; S43-E46 PolarHBondContact OG-N 3.02Å; E46-T49 PolarHBondContact O-N 3.5Å; E46-L50 VanDerWaalsContact O-CG 3.27Å; E46-L50 WeakPolarHBondContact O-CG 3.14Å; E46-L50 PolarHBondContact O-N 3.46Å
47Y65.1Low61.1Low148 Ų148121.7 Ų121.758%0.5862%0.624SS**Hα-helixtrans-64.2-42.4176.5-176.3-96.8000111.8S43 I44 N51S43-Y47 PolarHBondContact O-N 2.87Å; I44-Y47 PolarHBondContact O-N 2.77Å; Y47-N51 WeakPolarHBondContact CD1-ND2 3.36Å; Y47-N51 WeakPolarHBondContact CE1-ND2 3.29Å; Y47-N51 WeakPolarHBondContact CE2-ND2 3.49Å; Y47-N51 PolarHBondContact O-N 3.28Å; Y47-N51 VanDerWaalsContact O-N 3.12Å; Y47-N51 PolarHBondContact O-ND2 3.02Å
48L64.6Low61Low88 Ų88119.5 Ų119.546%0.46161%0.612SS.*Hα-helixtrans-67.6-39.9176.8-77.8161.1000112.1I44 D45 L50 N51 N52I44-L48 HydrophobicContact CG2-CD1 3.83Å; I44-L48 WeakPolarHBondContact O-CB 3.17Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 3.15Å; D45-L48 PolarHBondContact O-N 3.07Å; L48-L50 VanDerWaalsContact C-N 3.33Å; L48-L50 PolarHBondContact O-N 3.03Å; L48-N51 PolarHBondContact O-N 2.93Å; L48-N52 WeakPolarHBondContact O-CB 3.32Å; L48-N52 PolarHBondContact O-N 2.85Å
49T69Low61.1Low77 Ų77119.9 Ų119.947%0.47262%0.615SS.*Hα-helixtrans-63.9-39.6177.6-58.40000111.7D45 E46 K53D45-T49 WeakPolarHBondContact O-CB 3.5Å; D45-T49 PolarHBondContact O-N 3.46Å; D45-T49 PolarHBondContact O-OG1 3.24Å; E46-T49 PolarHBondContact O-N 3.5Å; T49-K53 WeakPolarHBondContact O-CG 3.4Å
50L65.6Low61.1Low93 Ų93117.9 Ų117.949%0.48761%0.606SS.*Hα-helixtrans-68.4-38176.7-71169.8000112.1L42 E46 L48L42-L50 HydrophobicContact CD1-CD1 4.43Å; E46-L50 VanDerWaalsContact O-CG 3.27Å; E46-L50 WeakPolarHBondContact O-CG 3.14Å; E46-L50 PolarHBondContact O-N 3.46Å; L48-L50 VanDerWaalsContact C-N 3.33Å; L48-L50 PolarHBondContact O-N 3.03Å
51N60.5Low60.9Low73 Ų73118 Ų11839%0.3960%0.6SS.*Hα-helixtrans-80.6-27.1-178.5-74.4-60.3000113.9Y47 L48Y47-N51 WeakPolarHBondContact CD1-ND2 3.36Å; Y47-N51 WeakPolarHBondContact CE1-ND2 3.29Å; Y47-N51 WeakPolarHBondContact CE2-ND2 3.49Å; Y47-N51 PolarHBondContact O-N 3.28Å; Y47-N51 VanDerWaalsContact O-N 3.12Å; Y47-N51 PolarHBondContact O-ND2 3.02Å; L48-N51 PolarHBondContact O-N 2.93Å
52N59.4Low60.7Low106 Ų106113.5 Ų113.557%0.56759%0.588SS**Hα-helixtrans-76.5-23.4176.3-81.70.4000113.2L48 F54 N55L48-N52 WeakPolarHBondContact O-CB 3.32Å; L48-N52 PolarHBondContact O-N 2.85Å; N52-F54 PolarHBondContact O-N 2.92Å; N52-N55 PolarHBondContact O-N 2.96Å
53K57.3Low60.1Low143 Ų143118.9 Ų118.962%0.62260%0.604SS**THydrogen-bonded Turntrans-71.9-10177.9-77.4171.3177.5-82.30114.7T49T49-K53 WeakPolarHBondContact O-CG 3.4Å
54F55.2Low59Low167 Ų167120.8 Ų120.873%0.73262%0.617SS**THydrogen-bonded Turntrans-92.9-4.8178.5-86.8-83.9000114N52N52-F54 PolarHBondContact O-N 2.92Å
55N53.9Low57.9Low136 Ų136120.9 Ų120.973%0.72762%0.619SS**SBendtrans-105.70.2-178.2-78.3-29.9000114.1N52N52-N55 PolarHBondContact O-N 2.96Å
56D55Low57.1Low133 Ų133126.4 Ų126.471%0.71163%0.633SS**  trans-92.30.8177.6-67.6-32.7000113.2D58D56-D58 PolarHBondContact O-N 3.25Å; D56-D58 VanDerWaalsContact O-N 3.13Å
57D55Low56.2Low136 Ų136132.6 Ų132.673%0.72765%0.652SS**SBendtrans-87.183.1174.7-70.4-39.9000110.5
58D54.6Low55.3Low108 Ų108130.9 Ų130.958%0.57866%0.661SS**  trans-36.8119.2169.3-170.6-6.1000113.6D56 F60D56-D58 PolarHBondContact O-N 3.25Å; D56-D58 VanDerWaalsContact O-N 3.13Å; D58-F60 PolarHBondContact O-N 3.39Å; D58-F60 PolarHBondContact OD1-N 3.28Å
59P58.2Low54.6Low118 Ų118131.2 Ų131.277%0.76666%0.664SS**THydrogen-bonded Turntrans-70.61.9-179.126.8-32.4000114.6
60F55.8Low53.9Low174 Ų174138 Ų13876%0.76368%0.682SS**THydrogen-bonded Turntrans-112.224.8-176.5-78.9-82.4000115.5D58 P62D58-F60 PolarHBondContact O-N 3.39Å; D58-F60 PolarHBondContact OD1-N 3.28Å; F60-P62 WeakPolarHBondContact O-CD 3.24Å
61N50.7Low53.3Low94 Ų94144 Ų14450%0.50370%0.7SS.*  trans-97.893.7173.5-169.33000112.9Y63N61-Y63 PolarHBondContact O-N 3.31Å; N61-Y63 VanDerWaalsContact O-N 3.13Å; N61-Y63 PolarHBondContact OD1-N 3.07Å
62P56.1Low53Low102 Ų102148 Ų14866%0.66271%0.714SS**THydrogen-bonded Turntrans-76.715.2177.132.8-37.8000114.4F60F60-P62 WeakPolarHBondContact O-CD 3.24Å
63Y49.9Very low52.7Low200 Ų200147.4 Ų147.478%0.78471%0.711SS**THydrogen-bonded Turntrans-117.316.1-175.6-67.4-77000115.3N61N61-Y63 PolarHBondContact O-N 3.31Å; N61-Y63 VanDerWaalsContact O-N 3.13Å; N61-Y63 PolarHBondContact OD1-N 3.07Å
64S50.1Low52.6Low99 Ų99149.5 Ų149.569%0.69272%0.716SS**  trans-87.5-3178.561.10000114.8
65D46.6Very low52.6Low130 Ų130150 Ų15070%0.69571%0.714SS**  trans-73.7137.1166.7-70.6-33.2000109.4
66Y50.2Low52.7Low227 Ų227150.8 Ų150.889%0.8971%0.708SS**SBendtrans86.367.5-179.4-61.9-93.5000117.2
67R46.5Very low52.8Low233 Ų233153.5 Ų153.588%0.87971%0.71SS**SBendtrans-170.3109.4134.7-110.4161.5168.8-149-3.1113.3
68S47Very low53Low111 Ų111153 Ų15378%0.77671%0.707SS**  trans60.782.4137.4177.40000117.8
69N49.9Very low53.2Low96 Ų96154.8 Ų154.851%0.51371%0.712SS.*  trans-139.313.1164.2-85.8-38.3000116.9Y71 K72N69-Y71 PolarHBondContact O-N 3.39Å; N69-K72 PolarHBondContact O-N 3.33Å
70Y53.9Low53.2Low219 Ų219154.1 Ų154.186%0.85970%0.698SS**THydrogen-bonded Turntrans-63.9-9.7179.3-84.7-79.9000115.8
71Y53.8Low53.5Low219 Ų219151.3 Ų151.386%0.85970%0.697SS**THydrogen-bonded Turntrans-105-13.8-179.3-99.4-85.2000115.5N69N69-Y71 PolarHBondContact O-N 3.39Å
72K54.3Low54.3Low158 Ų158156.6 Ų156.669%0.68772%0.715SS**THydrogen-bonded Turntrans-96.4-19.2-178.5-79.2-172.2176.3-178.70114N69 Y74N69-K72 PolarHBondContact O-N 3.33Å; K72-Y74 VanDerWaalsContact C-N 3.32Å; K72-Y74 PolarHBondContact O-N 3.45Å
73D53.3Low54.4Low93 Ų93160.4 Ų160.450%0.49773%0.727SS.*Hα-helixtrans-72.4-25.1-177-63.7-20000113.2Y75 Y76D73-Y75 VanDerWaalsContact C-N 3.34Å; D73-Y75 PolarHBondContact O-N 3.07Å; D73-Y76 PolarHBondContact O-N 2.92Å
74Y54.1Low54.7Low186 Ų186156.1 Ų156.173%0.72973%0.726SS**Hα-helixtrans-69.9-26.9-178.3-110.2-86.5000114.3K72 N78K72-Y74 VanDerWaalsContact C-N 3.32Å; K72-Y74 PolarHBondContact O-N 3.45Å; Y74-N78 PolarHBondContact O-ND2 3.46Å
75Y56.8Low55.5Low179 Ų179160.8 Ų160.870%0.70273%0.734SS**Hα-helixtrans-92.1-26.1178.6-81.8-84000113D73D73-Y75 VanDerWaalsContact C-N 3.34Å; D73-Y75 PolarHBondContact O-N 3.07Å
76Y55.5Low56.3Low152 Ų152166 Ų16660%0.59674%0.744SS**Hα-helixtrans-70.9-43-178.7-164.6-104.4000111.5D73 N78 H80D73-Y76 PolarHBondContact O-N 2.92Å; Y76-N78 VanDerWaalsContact C-N 3.35Å; Y76-N78 PolarHBondContact O-N 3.3Å; Y76-H80 AromaticContact CD1-NE2 3.84Å; Y76-H80 AromaticContact CE1-NE2 3.44Å; Y76-H80 WeakPolarHBondContact CE1-NE2 3.42Å; Y76-H80 AromaticContact CE2-NE2 3.68Å; Y76-H80 AromaticContact CZ-CE1 3.99Å; Y76-H80 AromaticContact CZ-NE2 3.34Å; Y76-H80 VanDerWaalsContact CZ-NE2 3.34Å; Y76-H80 PolarHBondContact O-CD2 2.94Å
77Y57.2Low57.1Low190 Ų190159 Ų15975%0.74573%0.733SS**THydrogen-bonded Turntrans-75.2-14.3-174.6-90-83.5000116
78N58.5Low58Low125 Ų125152.3 Ų152.367%0.66872%0.715SS**THydrogen-bonded Turntrans-98.5-10.6-175.3-79.9-40.9000115.1Y74 Y76Y74-N78 PolarHBondContact O-ND2 3.46Å; Y76-N78 VanDerWaalsContact C-N 3.35Å; Y76-N78 PolarHBondContact O-N 3.3Å
79H59.9Low58.7Low146 Ų146153.3 Ų153.368%0.67671%0.711SS**SBendtrans-109.6-2-175.9-75.9-61.9000115P81H79-P81 VanDerWaalsContact O-CD 3.27Å; H79-P81 WeakPolarHBondContact O-CD 3.36Å
80H56.3Low59.4Low104 Ų104159.1 Ų159.148%0.48173%0.725SS.*SBendtrans-74120.5170.4-71.2-72.5000109.3Y76 K82Y76-H80 AromaticContact CD1-NE2 3.84Å; Y76-H80 AromaticContact CE1-NE2 3.44Å; Y76-H80 WeakPolarHBondContact CE1-NE2 3.42Å; Y76-H80 AromaticContact CE2-NE2 3.68Å; Y76-H80 AromaticContact CZ-CE1 3.99Å; Y76-H80 AromaticContact CZ-NE2 3.34Å; Y76-H80 VanDerWaalsContact CZ-NE2 3.34Å; Y76-H80 PolarHBondContact O-CD2 2.94Å; H80-K82 PolarHBondContact O-N 3.47Å
81P63.1Low59.6Low114 Ų114155.5 Ų155.574%0.7472%0.721SS**  trans-56.6114.5164.921.1-25.9000106.3H79 M83H79-P81 VanDerWaalsContact O-CD 3.27Å; H79-P81 WeakPolarHBondContact O-CD 3.36Å; P81-M83 PolarHBondContact O-N 3.34Å
82K66.6Low59.8Low205 Ų205148.8 Ų148.889%0.89170%0.699SS**  trans-43.7117.3177-69.7-179.9179.2178.60107H80 S84H80-K82 PolarHBondContact O-N 3.47Å; K82-S84 PolarHBondContact O-N 3.12Å; K82-S84 VanDerWaalsContact O-N 3.14Å
83M58.4Low60.1Low182 Ų182144.1 Ų144.190%0.89769%0.687SS**  trans-41.1122.4-168.2-74.7170.764.500110.6P81 K85P81-M83 PolarHBondContact O-N 3.34Å; M83-K85 PolarHBondContact O-N 2.73Å
84S57.3Low60.4Low110 Ų110145.8 Ų145.877%0.76969%0.694SS**  trans-0.3106.5157.7-170.70000112.8K82 R86K82-S84 PolarHBondContact O-N 3.12Å; K82-S84 VanDerWaalsContact O-N 3.14Å; S84-R86 PolarHBondContact O-N 2.91Å
85K66Low60.5Low198 Ų198143.6 Ų143.686%0.86169%0.69SS**  trans-48.1114.1166.1-79.4-175.8175.3-176.10106.6M83 A87M83-K85 PolarHBondContact O-N 2.73Å; K85-A87 PolarHBondContact O-N 3.33Å
86R63.5Low60.6Low239 Ų239137.9 Ų137.990%0.90268%0.677SS**  trans-53.5118.9163.8-80.3179141.6154.3-4.6105.4S84 D88S84-R86 PolarHBondContact O-N 2.91Å; R86-D88 PolarHBondContact O-N 2.97Å
87A66.6Low61.1Low80 Ų80134 Ų13466%0.66167%0.666SS**  trans-54.4116.2171.600000106.5K85 L89K85-A87 PolarHBondContact O-N 3.33Å; A87-L89 PolarHBondContact O-N 3.45Å; A87-L89 VanDerWaalsContact O-N 3.09Å
88D65.1Low61.5Low93 Ų93129 Ų12950%0.49765%0.65SS.*  trans-71.7107.5177.6-159.7-15.7000106.3R86 R90 D91R86-D88 PolarHBondContact O-N 2.97Å; D88-R90 PolarHBondContact O-N 3.34Å; D88-R90 WeakPolarHBondContact OD1-CB 3.49Å; D88-R90 WeakPolarHBondContact OD1-CG 3.15Å; D88-R90 PolarHBondContact OD1-N 3.08Å; D88-D91 PolarHBondContact O-N 2.87Å
89L63.4Low62.1Low132 Ų132125.9 Ų125.969%0.69164%0.643SS**THydrogen-bonded Turntrans-64.2-7.1179.7-64174.6000111.8A87 D91 L92A87-L89 PolarHBondContact O-N 3.45Å; A87-L89 VanDerWaalsContact O-N 3.09Å; L89-D91 VanDerWaalsContact C-N 3.33Å; L89-L92 HydrophobicContact CD2-CD1 4.25Å; L89-L92 HydrophobicContact CD2-CD2 4.49Å; L89-L92 PolarHBondContact O-N 3.43Å
90R63.8Low62.6Low218 Ų218125.1 Ų125.182%0.82364%0.637SS**THydrogen-bonded Turntrans-72.3-24.6171.4-64.6-177.5173.5-169.7-0.4113.4D88 L92D88-R90 PolarHBondContact O-N 3.34Å; D88-R90 WeakPolarHBondContact OD1-CB 3.49Å; D88-R90 WeakPolarHBondContact OD1-CG 3.15Å; D88-R90 PolarHBondContact OD1-N 3.08Å; R90-L92 VanDerWaalsContact C-N 3.34Å
91D59Low63.4Low142 Ų142124 Ų12476%0.75963%0.634SS**SBendtrans-84.8-11.1173.8-72.9-15000112.2D88 L89 S93D88-D91 PolarHBondContact O-N 2.87Å; L89-D91 VanDerWaalsContact C-N 3.33Å; D91-S93 VanDerWaalsContact C-N 3.35Å; D91-S93 PolarHBondContact O-N 2.84Å
92L58.1Low63.8Low79 Ų79126.5 Ų126.541%0.41463%0.629SS.*SBendtrans-73.893.5164.4-93.181.7000108.3L89 R90 I94L89-L92 HydrophobicContact CD2-CD1 4.25Å; L89-L92 HydrophobicContact CD2-CD2 4.49Å; L89-L92 PolarHBondContact O-N 3.43Å; R90-L92 VanDerWaalsContact C-N 3.34Å; L92-I94 PolarHBondContact O-N 3.27Å
93S60.3Low64.2Low60 Ų60122.9 Ų122.942%0.4261%0.613SS.*  trans-54130.7170.3173.80000110D91 H95 S96D91-S93 VanDerWaalsContact C-N 3.35Å; D91-S93 PolarHBondContact O-N 2.84Å; S93-H95 PolarHBondContact O-N 2.83Å; S93-H95 WeakPolarHBondContact OG-CB 3.39Å; S93-H95 PolarHBondContact OG-N 3.21Å; S93-H95 PolarHBondContact OG-ND1 3.06Å; S93-S96 PolarHBondContact O-N 3.02Å; S93-S96 PolarHBondContact O-OG 3.41Å
94I59.3Low64.9Low127 Ų127117.7 Ų117.765%0.65159%0.589SS**Hα-helixtrans-48-24.3172-61.9165.8000111.9L92 M98L92-I94 PolarHBondContact O-N 3.27Å; I94-M98 HydrophobicContact CG2-CE 4.43Å; I94-M98 PolarHBondContact O-N 3.39Å
95H56.5Low65.7Low140 Ų140118.7 Ų118.765%0.64858%0.579SS**Hα-helixtrans-77.6-27.9179.1-59.572.7000113.8S93 A99S93-H95 PolarHBondContact O-N 2.83Å; S93-H95 WeakPolarHBondContact OG-CB 3.39Å; S93-H95 PolarHBondContact OG-N 3.21Å; S93-H95 PolarHBondContact OG-ND1 3.06Å; H95-A99 PolarHBondContact O-N 3.45Å
96S59.3Low66Low60 Ų60113.8 Ų113.842%0.4256%0.562SS.*Hα-helixtrans-72.7-37172.760.10000111.6S93 A99 F100S93-S96 PolarHBondContact O-N 3.02Å; S93-S96 PolarHBondContact O-OG 3.41Å; S96-A99 PolarHBondContact O-N 2.81Å; S96-F100 PolarHBondContact O-N 3.02Å; S96-F100 VanDerWaalsContact O-N 3.07Å
97D64.2Low66Low71 Ų71107.7 Ų107.738%0.3854%0.544SS..Hα-helixtrans-68-41.4179.6-754.5000111.4A99 F100 I101D97-A99 VanDerWaalsContact C-N 3.33Å; D97-A99 PolarHBondContact O-N 3.29Å; D97-F100 PolarHBondContact O-N 3.42Å; D97-I101 VanDerWaalsContact O-CB 3.32Å; D97-I101 WeakPolarHBondContact O-CB 3.34Å; D97-I101 WeakPolarHBondContact O-CD1 3.46Å; D97-I101 WeakPolarHBondContact O-CG1 3.38Å; D97-I101 PolarHBondContact O-N 3.33Å
98M66Low65.9Low83 Ų83110.1 Ų110.141%0.40954%0.54SS..Hα-helixtrans-62.9-37.1174.9-79.8-165.4-71.200113I94 R102I94-M98 HydrophobicContact CG2-CE 4.43Å; I94-M98 PolarHBondContact O-N 3.39Å; M98-R102 WeakPolarHBondContact O-CB 3.43Å; M98-R102 VanDerWaalsContact O-CG 3.24Å; M98-R102 WeakPolarHBondContact O-CG 3.41Å; M98-R102 PolarHBondContact O-N 3.13Å
99A70.5Confident65.7Low61 Ų61109.6 Ų109.650%0.50454%0.537SS..Hα-helixtrans-68.2-40.8177.300000111.9H95 S96 D97 K103H95-A99 PolarHBondContact O-N 3.45Å; S96-A99 PolarHBondContact O-N 2.81Å; D97-A99 VanDerWaalsContact C-N 3.33Å; D97-A99 PolarHBondContact O-N 3.29Å; A99-K103 WeakPolarHBondContact O-CB 3.49Å; A99-K103 PolarHBondContact O-N 3.04Å
100F72.2Confident65.6Low129 Ų129109.6 Ų109.657%0.56653%0.533SS*.Hα-helixtrans-64.6-45.1174.3178.9-106.2000111.9S96 D97 K103 L104S96-F100 PolarHBondContact O-N 3.02Å; S96-F100 VanDerWaalsContact O-N 3.07Å; D97-F100 PolarHBondContact O-N 3.42Å; F100-K103 PolarHBondContact O-N 3.08Å; F100-L104 HydrophobicContact CD1-CD1 3.92Å; F100-L104 HydrophobicContact CE1-CD1 3.38Å; F100-L104 HydrophobicContact CE1-CG 4.13Å; F100-L104 HydrophobicContact CZ-CD1 3.76Å; F100-L104 HydrophobicContact CZ-CD2 4.39Å; F100-L104 HydrophobicContact CZ-CG 4.12Å; F100-L104 PolarHBondContact O-N 2.91Å
101I71.8Confident65.5Low80 Ų80103 Ų10341%0.4151%0.512SS..Hα-helixtrans-62.2-44.1177.6-69.6165.7000110.9D97 K103 L104 F105D97-I101 VanDerWaalsContact O-CB 3.32Å; D97-I101 WeakPolarHBondContact O-CB 3.34Å; D97-I101 WeakPolarHBondContact O-CD1 3.46Å; D97-I101 WeakPolarHBondContact O-CG1 3.38Å; D97-I101 PolarHBondContact O-N 3.33Å; I101-K103 PolarHBondContact O-N 3.02Å; I101-L104 WeakPolarHBondContact O-CB 3.48Å; I101-L104 PolarHBondContact O-N 3.02Å; I101-F105 HydrophobicContact CG2-CD2 3.69Å; I101-F105 HydrophobicContact CG2-CE2 3.4Å; I101-F105 WeakPolarHBondContact O-CD2 3.27Å; I101-F105 PolarHBondContact O-N 3.09Å
102R71.9Confident65.5Low167 Ų167101.3 Ų101.363%0.6350%0.502SS*.Hα-helixtrans-59.5-44.7174.5-74.8175-168.6-170.84.1111.9M98 L104 F105 D106M98-R102 WeakPolarHBondContact O-CB 3.43Å; M98-R102 VanDerWaalsContact O-CG 3.24Å; M98-R102 WeakPolarHBondContact O-CG 3.41Å; M98-R102 PolarHBondContact O-N 3.13Å; R102-L104 VanDerWaalsContact C-N 3.31Å; R102-L104 PolarHBondContact O-N 3Å; R102-F105 PolarHBondContact O-N 2.92Å; R102-F105 VanDerWaalsContact O-N 3.15Å; R102-D106 PolarHBondContact O-N 3.48Å
103K75.4Confident65.6Low130 Ų130104.1 Ų104.157%0.56552%0.517SS*.Hα-helixtrans-62.1-37.4177.1-170.8177.2-179.1179.90112.6A99 F100 I101 D106 Q107A99-K103 WeakPolarHBondContact O-CB 3.49Å; A99-K103 PolarHBondContact O-N 3.04Å; F100-K103 PolarHBondContact O-N 3.08Å; I101-K103 PolarHBondContact O-N 3.02Å; K103-D106 PolarHBondContact O-N 3.15Å; K103-Q107 WeakPolarHBondContact O-CG 3.48Å; K103-Q107 PolarHBondContact O-N 3.19Å
104L72.7Confident66.2Low73 Ų73109.6 Ų109.638%0.38253%0.528SS..Hα-helixtrans-64.6-42.3173.8-78.2175.3000111.9F100 I101 R102 Q107 K108F100-L104 HydrophobicContact CD1-CD1 3.92Å; F100-L104 HydrophobicContact CE1-CD1 3.38Å; F100-L104 HydrophobicContact CE1-CG 4.13Å; F100-L104 HydrophobicContact CZ-CD1 3.76Å; F100-L104 HydrophobicContact CZ-CD2 4.39Å; F100-L104 HydrophobicContact CZ-CG 4.12Å; F100-L104 PolarHBondContact O-N 2.91Å; I101-L104 WeakPolarHBondContact O-CB 3.48Å; I101-L104 PolarHBondContact O-N 3.02Å; R102-L104 VanDerWaalsContact C-N 3.31Å; R102-L104 PolarHBondContact O-N 3Å; L104-Q107 PolarHBondContact O-N 3.28Å; L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.04Å
105F74Confident66.6Low130 Ų130110 Ų11057%0.5753%0.531SS*.Hα-helixtrans-66.3-40.9175.7-77.2-62.2000112.4I101 R102 Q107 K108 N109I101-F105 HydrophobicContact CG2-CD2 3.69Å; I101-F105 HydrophobicContact CG2-CE2 3.4Å; I101-F105 WeakPolarHBondContact O-CD2 3.27Å; I101-F105 PolarHBondContact O-N 3.09Å; R102-F105 PolarHBondContact O-N 2.92Å; R102-F105 VanDerWaalsContact O-N 3.15Å; F105-Q107 PolarHBondContact O-N 3.26Å; F105-K108 PolarHBondContact O-N 2.97Å; F105-N109 WeakPolarHBondContact O-CB 3.36Å; F105-N109 VanDerWaalsContact O-CG 3.32Å; F105-N109 PolarHBondContact O-N 3.27Å
106D71.5Confident66.6Low95 Ų95109.1 Ų109.151%0.50856%0.56SS.*Hα-helixtrans-62.3-43.5176.4-68.8-21.2000111.2R102 K103 K108 N109 H110R102-D106 PolarHBondContact O-N 3.48Å; K103-D106 PolarHBondContact O-N 3.15Å; D106-K108 PolarHBondContact O-N 3.17Å; D106-N109 PolarHBondContact O-N 3.06Å; D106-H110 PolarHBondContact O-CD2 2.92Å; D106-H110 PolarHBondContact O-N 3.08Å
107Q65.3Low67Low111 Ų111111.6 Ų111.652%0.51957%0.567SS.*Hα-helixtrans-62.1-41.9175.8-76.8-178.8-28.800112.6K103 L104 F105 H110 E111K103-Q107 WeakPolarHBondContact O-CG 3.48Å; K103-Q107 PolarHBondContact O-N 3.19Å; L104-Q107 PolarHBondContact O-N 3.28Å; F105-Q107 PolarHBondContact O-N 3.26Å; Q107-H110 PolarHBondContact O-N 3.26Å; Q107-E111 PolarHBondContact O-N 2.96Å; Q107-E111 VanDerWaalsContact O-N 3.15Å
108K62.8Low67.1Low131 Ų131113.7 Ų113.757%0.5758%0.577SS**Hα-helixtrans-70.6-36178-69.6-68.1177.5-173.50112.4L104 F105 D106 E111 L112L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.04Å; F105-K108 PolarHBondContact O-N 2.97Å; D106-K108 PolarHBondContact O-N 3.17Å; K108-E111 PolarHBondContact O-N 3.14Å; K108-L112 PolarHBondContact O-N 3.09Å
109N62.2Low67.2Low83 Ų83115.4 Ų115.444%0.44459%0.586SS.*Hα-helixtrans-66.4-37.1173.4-76.9-15.2000111.9F105 D106 E111 L112 L113F105-N109 WeakPolarHBondContact O-CB 3.36Å; F105-N109 VanDerWaalsContact O-CG 3.32Å; F105-N109 PolarHBondContact O-N 3.27Å; D106-N109 PolarHBondContact O-N 3.06Å; N109-E111 VanDerWaalsContact C-N 3.33Å; N109-E111 PolarHBondContact O-N 3.13Å; N109-L112 PolarHBondContact O-N 2.93Å; N109-L113 WeakPolarHBondContact O-CB 3.27Å; N109-L113 VanDerWaalsContact O-CG 3.31Å; N109-L113 WeakPolarHBondContact O-CG 3.44Å; N109-L113 PolarHBondContact O-N 2.97Å
110H60.4Low67Low131 Ų131118.6 Ų118.661%0.60659%0.591SS**Hα-helixtrans-65.6-34.4172.8-77.7-58.9000112.8D106 Q107 R114D106-H110 PolarHBondContact O-CD2 2.92Å; D106-H110 PolarHBondContact O-N 3.08Å; Q107-H110 PolarHBondContact O-N 3.26Å; H110-R114 VanDerWaalsContact O-CB 3.29Å; H110-R114 WeakPolarHBondContact O-CB 3.38Å; H110-R114 PolarHBondContact O-N 3.34Å
111E61.1Low66.7Low80 Ų80118 Ų11837%0.37459%0.592SS.*Hα-helixtrans-71.2-38.6172.7-69.7-140.3129.100112.7Q107 K108 N109 R114 L115Q107-E111 PolarHBondContact O-N 2.96Å; Q107-E111 VanDerWaalsContact O-N 3.15Å; K108-E111 PolarHBondContact O-N 3.14Å; N109-E111 VanDerWaalsContact C-N 3.33Å; N109-E111 PolarHBondContact O-N 3.13Å; E111-R114 WeakPolarHBondContact O-CB 3.43Å; E111-R114 PolarHBondContact O-N 3.5Å; E111-R114 IonicContact OE1-CZ 3.54Å; E111-R114 IonicContact OE1-NH1 3.71Å; E111-R114 IonicContact OE1-NH2 2.77Å; E111-R114 PolarHBondContact OE1-NH2 3.4Å; E111-L115 VanDerWaalsContact O-CG 3.24Å; E111-L115 WeakPolarHBondContact O-CG 2.93Å; E111-L115 PolarHBondContact O-N 3.19Å
112L59Low66.3Low107 Ų107120.5 Ų120.556%0.5661%0.605SS**Hα-helixtrans-62.5-48.3172.6-90.6146.3000111.6K108 N109 R114 L115 G116K108-L112 PolarHBondContact O-N 3.09Å; N109-L112 PolarHBondContact O-N 2.93Å; L112-R114 PolarHBondContact O-N 3.41Å; L112-L115 PolarHBondContact O-N 3.32Å; L112-G116 PolarHBondContact O-N 3.31Å
113L60.6Low65.9Low137 Ų137117.2 Ų117.272%0.71760%0.603SS**Hα-helixtrans-62.4-28.3175.1-73.5168.5000112.9N109N109-L113 WeakPolarHBondContact O-CB 3.27Å; N109-L113 VanDerWaalsContact O-CG 3.31Å; N109-L113 WeakPolarHBondContact O-CG 3.44Å; N109-L113 PolarHBondContact O-N 2.97Å
114R72.7Confident65.2Low176 Ų176116.2 Ų116.266%0.66461%0.606SS**Hα-helixtrans-73.9-30.2173.1-171.4-178.372.9-164.7-7.3112.2H110 E111 L112H110-R114 VanDerWaalsContact O-CB 3.29Å; H110-R114 WeakPolarHBondContact O-CB 3.38Å; H110-R114 PolarHBondContact O-N 3.34Å; E111-R114 WeakPolarHBondContact O-CB 3.43Å; E111-R114 PolarHBondContact O-N 3.5Å; E111-R114 IonicContact OE1-CZ 3.54Å; E111-R114 IonicContact OE1-NH1 3.71Å; E111-R114 IonicContact OE1-NH2 2.77Å; E111-R114 PolarHBondContact OE1-NH2 3.4Å; L112-R114 PolarHBondContact O-N 3.41Å
115L69.3Low64.6Low136 Ų136119.8 Ų119.871%0.71262%0.624SS**Hα-helixtrans-83.6-11.6-177.8-71.9168000113.5E111 L112E111-L115 VanDerWaalsContact O-CG 3.24Å; E111-L115 WeakPolarHBondContact O-CG 2.93Å; E111-L115 PolarHBondContact O-N 3.19Å; L112-L115 PolarHBondContact O-N 3.32Å
116G56.4Low63.7Low121 Ų121118.9 Ų118.9100%1.24763%0.629SS**  trans780178.200000112.2L112L112-G116 PolarHBondContact O-N 3.31Å

Retrieved 116 of 116 residues in 136.2 ms (Link to these results)