G4VJM8_SCHMA Loading...

Putative pre-mRNA splicing factor

AlphaFold DB , UniProt , Accession G4VJM8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 187 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44Very low60.8Low228 Ų228151.6 Ų151.6100%1.12381%0.806SS**  095.80-72.7173.310900105.9
2T52.1Low60.8Low125 Ų125151.7 Ų151.777%0.76780%0.798SS**  75.1126.7110.8560000112.3
3T55Low59.8Low115 Ų115153.6 Ų153.671%0.70680%0.8SS**  cis178.1170.60.732.20000107.1
4L64Low59Low151 Ų151148.1 Ų148.179%0.79180%0.799SS**  trans82.4107.1172.7-69.577.5000114.3
5D55.5Low58.5Low141 Ų141145.6 Ų145.675%0.75480%0.797SS**  cis53.69128.9-98.38.1000113.4
6N68.8Low58Low148 Ų148146.9 Ų146.979%0.79180%0.803SS**  trans-149.5105.8147.5-111.331.8000109.5
7I56Low57.7Low136 Ų136148.3 Ų148.370%0.69780%0.803SS**  trans-85.3116169.3-79.5153.9000106.6
8D67.4Low57.4Low143 Ų143149.3 Ų149.377%0.76581%0.807SS**  trans-123.391.4160.6-80.3-34.4000104.8
9Q63Low57.2Low173 Ų173147.6 Ų147.681%0.80880%0.802SS**  47.284.592.7-77.2-167.4-6.700114.2
10E71.6Confident56.7Low182 Ų182148.4 Ų148.485%0.8580%0.804SS**  trans-74136.6152.6-67.1-125.5153.200109.5E12E10-E12 PolarHBondContact O-N 3.28Å
11P70.9Confident56.5Low126 Ų126146.3 Ų146.382%0.81880%0.801SS**  trans-78.8115.4172.130.1-29.9000110.8
12E61.3Low56.4Low152 Ų152143.4 Ų143.471%0.7179%0.785SS**  trans-55.2146.5161.2-72.1-78.4178.800113.1E10E10-E12 PolarHBondContact O-N 3.28Å
13H48.4Very low56.4Low177 Ų177145.3 Ų145.382%0.81979%0.79SS**  trans75.6110144.7-70.312.8000119.6
14G48.1Very low56.4Low76 Ų76147.9 Ų147.978%0.78479%0.791SS**  trans-159.788161.700000110.5
15S50.9Low55.4Low111 Ų111148.8 Ų148.878%0.77679%0.791SS**  trans-45.3123.8177.350.70000115.1
16D51.2Low54.9Low167 Ų167149.5 Ų149.589%0.89380%0.795SS**  trans-12963.7152.1-86.8-23000108.4L18D16-L18 PolarHBondContact O-N 3.41Å
17E52.8Low53.8Low170 Ų170152.2 Ų152.279%0.79480%0.8SS**  trans-81.4106.2160.9-172.4174.6-175.700106.8V19E17-V19 PolarHBondContact O-N 3.48Å
18L52Low53.5Low167 Ų167151.8 Ų151.887%0.87480%0.804SS**  trans-67.490.1169.8-84.9166.5000108.5D16 L20D16-L18 PolarHBondContact O-N 3.41Å; L18-L20 PolarHBondContact O-N 3.2Å
19V53.7Low52.3Low117 Ų117150.1 Ų150.171%0.70980%0.804SS**  trans-54.5115.7170.6176.90000108.8E17 S21E17-V19 PolarHBondContact O-N 3.48Å; V19-S21 PolarHBondContact O-N 3.47Å
20L47.1Very low51.4Low162 Ų162149 Ų14985%0.84880%0.803SS**  trans-57.5109.3161.7-79.1106.7000107.8L18 E22L18-L20 PolarHBondContact O-N 3.2Å; L20-E22 PolarHBondContact O-N 3Å; L20-E22 VanDerWaalsContact O-N 3.13Å
21S51.7Low50Low105 Ų105147.4 Ų147.473%0.73480%0.8SS**  trans-68111.7170.245.90000109.3V19 N23V19-S21 PolarHBondContact O-N 3.47Å; S21-N23 PolarHBondContact O-N 2.92Å
22E43.9Very low48.7Very low168 Ų168149.1 Ų149.179%0.78580%0.797SS**  trans-53.7114.5166.5-69.5173.3135.400110L20 K24L20-E22 PolarHBondContact O-N 3Å; L20-E22 VanDerWaalsContact O-N 3.13Å; E22-K24 VanDerWaalsContact C-N 3.33Å; E22-K24 PolarHBondContact O-N 3.06Å
23N52Low48Very low165 Ų165146.7 Ų146.788%0.88279%0.793SS**  trans-70.596.5161.4-77.9-34.7000108S21 E25S21-N23 PolarHBondContact O-N 2.92Å; N23-E25 PolarHBondContact O-N 3.07Å
24K54.7Low47.7Very low168 Ų168145.3 Ų145.373%0.7379%0.791SS**  trans-60.1124.6167.3-79.3176.8175.21730110.4E22E22-K24 VanDerWaalsContact C-N 3.33Å; E22-K24 PolarHBondContact O-N 3.06Å
25E43.1Very low47.5Very low170 Ų170146.2 Ų146.279%0.79478%0.778SS**  trans39.194.9133.4-60.3-178156.600116.4N23N23-E25 PolarHBondContact O-N 3.07Å
26N44.1Very low47.6Very low157 Ų157150.6 Ų150.684%0.8479%0.786SS**  trans-129.186.3142.2-82.8-33000107.3T28N26-T28 PolarHBondContact O-N 3.11Å
27K46.5Very low47.6Very low204 Ų204147.8 Ų147.889%0.88778%0.776SS**  trans-91.480.9167.3-159.1174.1-171.7178.80106.7S29K27-S29 PolarHBondContact O-N 2.81Å
28T49Very low47.7Very low127 Ų127144.6 Ų144.678%0.77976%0.764SS**  trans-82.295.1169.552.40000107.9N26N26-T28 PolarHBondContact O-N 3.11Å
29S42.7Very low47.7Very low109 Ų109143.3 Ų143.376%0.76275%0.753SS**  trans-68.6116152.151.80000107.8K27K27-S29 PolarHBondContact O-N 2.81Å
30D43.8Very low47.6Very low148 Ų148142 Ų14279%0.79175%0.75SS**  -168.1150.3125.7-136.1-22.3000111.1
31N42.8Very low48Very low149 Ų149140.6 Ų140.680%0.79774%0.741SS**  trans-67.1127.3-174.3-59.3-80.4000112.5
32H42.1Very low48.6Very low163 Ų163137.7 Ų137.776%0.75573%0.728SS**  trans-159.498.4153-15265.4000108.6
33V46.8Very low50.2Low101 Ų101135.3 Ų135.361%0.61272%0.717SS**  54.6102.199-174.30000112.4
34D42.4Very low51.6Low148 Ų148134.3 Ų134.379%0.79171%0.709SS**  trans26.3100.4149.5-55.4-27.3000118.1
35N44.6Very low53Low95 Ų95136.1 Ų136.151%0.50871%0.711SS.*  trans-155.168.8159.1-98.6-30.2000111.9T37N35-T37 VanDerWaalsContact C-N 3.31Å
36E52Low55Low202 Ų202132.6 Ų132.694%0.94470%0.697SS**SBendtrans-79.6-2.4173.5-84.8-100.9145.200113.7
37T52.4Low57.1Low109 Ų109130.6 Ų130.667%0.66968%0.683SS**SBendtrans-116.7-11.3-175.552.90000115.5N35N35-T37 VanDerWaalsContact C-N 3.31Å
38D53.9Low59.4Low102 Ų102123.6 Ų123.655%0.54566%0.663SS.*SBendtrans-105-9.5-171.3-75.30.1000114.8S40D38-S40 VanDerWaalsContact C-N 3.34Å
39Q52.6Low61.4Low140 Ų140122.4 Ų122.465%0.65465%0.651SS**THydrogen-bonded Turntrans-78.5-16.4175.4-64.7-174.5500113.4I41 H43Q39-I41 VanDerWaalsContact C-N 3.31Å; Q39-I41 PolarHBondContact O-N 3.45Å; Q39-H43 PolarHBondContact O-CD2 3.28Å; Q39-H43 PolarHBondContact O-NE2 3.05Å
40S51.9Low63.7Low91 Ų91125.6 Ų125.664%0.63665%0.647SS**Hα-helixtrans-68.2-27.2-178-166.10000113.7D38D38-S40 VanDerWaalsContact C-N 3.34Å
41I55.8Low66Low131 Ų131126.5 Ų126.567%0.67264%0.639SS**Hα-helixtrans-85.1-17.6-167-58161.7000112.3Q39Q39-I41 VanDerWaalsContact C-N 3.31Å; Q39-I41 PolarHBondContact O-N 3.45Å
42G63.8Low68.5Low44 Ų44126.6 Ų126.645%0.45463%0.632SS.*Hα-helixtrans-87.6-36.517900000115.2M44 R45G42-M44 VanDerWaalsContact C-N 3.31Å; G42-M44 PolarHBondContact O-N 2.78Å; G42-R45 PolarHBondContact O-N 3.47Å
43H77.7Confident71Confident119 Ų119124.6 Ų124.655%0.55162%0.623SS**Hα-helixtrans-70.4-22.5-172.6-62.1-52.1000114.5Q39 R45 E47Q39-H43 PolarHBondContact O-CD2 3.28Å; Q39-H43 PolarHBondContact O-NE2 3.05Å; H43-R45 VanDerWaalsContact C-N 3.33Å; H43-R45 PolarHBondContact O-N 2.98Å; H43-E47 WeakPolarHBondContact O-CB 3.43Å; H43-E47 PolarHBondContact O-N 2.91Å
44M80.4Confident73.2Confident144 Ų144128.5 Ų128.571%0.70963%0.627SS**Hα-helixtrans-65.8-36.6-179.7-165.6-171.3-44.800112.3G42 A48G42-M44 VanDerWaalsContact C-N 3.31Å; G42-M44 PolarHBondContact O-N 2.78Å; M44-A48 WeakPolarHBondContact O-CB 3.35Å; M44-A48 PolarHBondContact O-N 2.92Å
45R84.5Confident75.7Confident206 Ų206125.2 Ų125.278%0.77761%0.609SS**Hα-helixtrans-71.6-43.1-178.3-147.1-178.1-166.1116.8-1.2110.8G42 H43 A48 L49G42-R45 PolarHBondContact O-N 3.47Å; H43-R45 VanDerWaalsContact C-N 3.33Å; H43-R45 PolarHBondContact O-N 2.98Å; R45-A48 PolarHBondContact O-N 3.25Å; R45-L49 WeakPolarHBondContact O-CG 3.35Å; R45-L49 PolarHBondContact O-N 2.85Å
46D85.2Confident78Confident96 Ų96127.2 Ų127.251%0.51361%0.613SS.*Hα-helixtrans-66.6-42.3177.3-70-19.9000111.9A48 L49 R50D46-A48 PolarHBondContact O-N 3.08Å; D46-L49 PolarHBondContact O-N 3.31Å; D46-R50 PolarHBondContact O-N 3.24Å
47E89.2Confident79.9Confident115 Ų115122.7 Ų122.754%0.53759%0.592SS.*Hα-helixtrans-66.1-37.6176-170.856.3-146.300111.8H43 L49 R50 R51H43-E47 WeakPolarHBondContact O-CB 3.43Å; H43-E47 PolarHBondContact O-N 2.91Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 2.99Å; E47-R50 PolarHBondContact O-N 3.42Å; E47-R51 WeakPolarHBondContact O-CB 3.41Å; E47-R51 PolarHBondContact O-N 2.75Å
48A93.1Very high81.6Confident56 Ų56121.4 Ų121.446%0.46358%0.581SS.*Hα-helixtrans-63.8-37.6173.900000112.3M44 R45 D46 K52M44-A48 WeakPolarHBondContact O-CB 3.35Å; M44-A48 PolarHBondContact O-N 2.92Å; R45-A48 PolarHBondContact O-N 3.25Å; D46-A48 PolarHBondContact O-N 3.08Å; A48-K52 WeakPolarHBondContact O-CB 3.38Å; A48-K52 PolarHBondContact O-N 3.18Å
49L92Very high83.3Confident102 Ų102125.7 Ų125.753%0.53459%0.589SS.*Hα-helixtrans-67-45.8175-72.5174.2000111.7R45 D46 E47 R51 K52 E53R45-L49 WeakPolarHBondContact O-CG 3.35Å; R45-L49 PolarHBondContact O-N 2.85Å; D46-L49 PolarHBondContact O-N 3.31Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 2.99Å; L49-R51 VanDerWaalsContact C-N 3.33Å; L49-R51 PolarHBondContact O-N 2.67Å; L49-K52 WeakPolarHBondContact O-CB 3.36Å; L49-K52 PolarHBondContact O-N 3.01Å; L49-K52 VanDerWaalsContact O-N 3.17Å; L49-E53 PolarHBondContact O-N 3.11Å
50R90.9Very high84.9Confident176 Ų176124.6 Ų124.666%0.66459%0.585SS**Hα-helixtrans-57.8-43.3173.8-74.5178.8171.4174.6-1.3112.1D46 E47 E53 R54D46-R50 PolarHBondContact O-N 3.24Å; E47-R50 PolarHBondContact O-N 3.42Å; R50-E53 PolarHBondContact O-N 3.32Å; R50-R54 WeakPolarHBondContact O-CB 3.39Å; R50-R54 PolarHBondContact O-N 2.89Å
51R92.2Very high86.6Confident167 Ų167127.1 Ų127.163%0.6359%0.585SS**Hα-helixtrans-63.6-43.3175.1-175.3178.7179.987.2-1.2112E47 L49 E53 R54 L55E47-R51 WeakPolarHBondContact O-CB 3.41Å; E47-R51 PolarHBondContact O-N 2.75Å; L49-R51 VanDerWaalsContact C-N 3.33Å; L49-R51 PolarHBondContact O-N 2.67Å; R51-E53 VanDerWaalsContact C-N 3.33Å; R51-E53 PolarHBondContact O-N 3.11Å; R51-R54 PolarHBondContact O-N 3.36Å; R51-L55 HydrophobicContact CG-CD1 3.99Å; R51-L55 HydrophobicContact CG-CG 4.41Å; R51-L55 WeakPolarHBondContact O-CB 2.84Å; R51-L55 WeakPolarHBondContact O-CG 3.16Å; R51-L55 PolarHBondContact O-N 2.91Å
52K96.2Very high87.9Confident152 Ų152125.2 Ų125.266%0.66158%0.576SS**Hα-helixtrans-60.6-43.4177.7-178.1-178.8178-1780111.1A48 L49 L55 K56A48-K52 WeakPolarHBondContact O-CB 3.38Å; A48-K52 PolarHBondContact O-N 3.18Å; L49-K52 WeakPolarHBondContact O-CB 3.36Å; L49-K52 PolarHBondContact O-N 3.01Å; L49-K52 VanDerWaalsContact O-N 3.17Å; K52-L55 PolarHBondContact O-N 2.91Å; K52-K56 WeakPolarHBondContact O-CB 3.49Å; K52-K56 PolarHBondContact O-N 3.07Å
53E93.2Very high88.6Confident121 Ų121126 Ų12657%0.56558%0.578SS**Hα-helixtrans-66.5-46.8177.2-171.5170.6-162.200112L49 R50 R51 L55 K56 Q57L49-E53 PolarHBondContact O-N 3.11Å; R50-E53 PolarHBondContact O-N 3.32Å; R51-E53 VanDerWaalsContact C-N 3.33Å; R51-E53 PolarHBondContact O-N 3.11Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 3.46Å; E53-K56 WeakPolarHBondContact O-CB 3.43Å; E53-K56 PolarHBondContact O-N 3.49Å; E53-K56 VanDerWaalsContact O-N 3.08Å; E53-Q57 WeakPolarHBondContact O-CG 3.32Å; E53-Q57 PolarHBondContact O-N 2.92Å
54R93.2Very high88.3Confident183 Ų183123.8 Ų123.869%0.69158%0.576SS**Hα-helixtrans-56.5-45.6173.8-177.4178.9178.1143.10.6112R50 R51 K56 Q57 L58R50-R54 WeakPolarHBondContact O-CB 3.39Å; R50-R54 PolarHBondContact O-N 2.89Å; R51-R54 PolarHBondContact O-N 3.36Å; R54-K56 VanDerWaalsContact C-N 3.34Å; R54-Q57 PolarHBondContact O-N 2.89Å; R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 PolarHBondContact O-N 2.96Å
55L94.5Very high87.5Confident79 Ų79122.4 Ų122.441%0.41457%0.568SS.*Hα-helixtrans-65.2-36.3176.5-76.3171.4000112R51 K52 E53 L58 R59R51-L55 HydrophobicContact CG-CD1 3.99Å; R51-L55 HydrophobicContact CG-CG 4.41Å; R51-L55 WeakPolarHBondContact O-CB 2.84Å; R51-L55 WeakPolarHBondContact O-CG 3.16Å; R51-L55 PolarHBondContact O-N 2.91Å; K52-L55 PolarHBondContact O-N 2.91Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 3.46Å; L55-L58 PolarHBondContact O-N 3Å; L55-R59 VanDerWaalsContact O-CB 3.31Å; L55-R59 WeakPolarHBondContact O-CB 3.3Å; L55-R59 VanDerWaalsContact O-CG 3.28Å; L55-R59 WeakPolarHBondContact O-CG 3.41Å; L55-R59 PolarHBondContact O-N 3.3Å
56K93.3Very high86.4Confident137 Ų137119.2 Ų119.260%0.59656%0.56SS**Hα-helixtrans-63.8-45.7174.1-171.5-177.9177.8-173.50110.8K52 E53 R54 L58 R59 M60K52-K56 WeakPolarHBondContact O-CB 3.49Å; K52-K56 PolarHBondContact O-N 3.07Å; E53-K56 WeakPolarHBondContact O-CB 3.43Å; E53-K56 PolarHBondContact O-N 3.49Å; E53-K56 VanDerWaalsContact O-N 3.08Å; R54-K56 VanDerWaalsContact C-N 3.34Å; K56-L58 PolarHBondContact O-N 2.92Å; K56-R59 PolarHBondContact O-N 3.3Å; K56-M60 VanDerWaalsContact O-CG 3.25Å; K56-M60 WeakPolarHBondContact O-CG 3.34Å; K56-M60 PolarHBondContact O-N 2.86Å
57Q91Very high84.9Confident107 Ų107116.6 Ų116.650%0.555%0.549SS..Hα-helixtrans-62-42.4175.7-68.3176.21.800112.1E53 R54 M60 K61E53-Q57 WeakPolarHBondContact O-CG 3.32Å; E53-Q57 PolarHBondContact O-N 2.92Å; R54-Q57 PolarHBondContact O-N 2.89Å; Q57-M60 PolarHBondContact O-N 3.09Å; Q57-K61 WeakPolarHBondContact O-CG 3.34Å; Q57-K61 PolarHBondContact O-N 2.98Å
58L89.1Confident83.3Confident82 Ų82116.5 Ų116.543%0.42955%0.551SS.*Hα-helixtrans-67.8-38.6178-149.5155.8000111.2R54 L55 K56 K61 N62R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 PolarHBondContact O-N 2.96Å; L55-L58 PolarHBondContact O-N 3Å; K56-L58 PolarHBondContact O-N 2.92Å; L58-K61 PolarHBondContact O-N 3.3Å; L58-N62 VanDerWaalsContact CD2-ND2 3.33Å; L58-N62 WeakPolarHBondContact CD2-ND2 3.49Å; L58-N62 VanDerWaalsContact O-CB 3.27Å; L58-N62 WeakPolarHBondContact O-CB 3.41Å; L58-N62 PolarHBondContact O-N 3.4Å
59R90.1Very high81.6Confident191 Ų191120.1 Ų120.172%0.72156%0.561SS**Hα-helixtrans-62.2-41.4171.2-79.8176.5170.3174.2-2.7112.2L55 K56 A63L55-R59 VanDerWaalsContact O-CB 3.31Å; L55-R59 WeakPolarHBondContact O-CB 3.3Å; L55-R59 VanDerWaalsContact O-CG 3.28Å; L55-R59 WeakPolarHBondContact O-CG 3.41Å; L55-R59 PolarHBondContact O-N 3.3Å; K56-R59 PolarHBondContact O-N 3.3Å; R59-A63 VanDerWaalsContact O-CB 3.25Å; R59-A63 WeakPolarHBondContact O-CB 3.21Å; R59-A63 PolarHBondContact O-N 3.21Å
60M86.3Confident79.7Confident117 Ų117120.9 Ų120.958%0.57656%0.562SS**Hα-helixtrans-65.6-47.4176.2-68.7-67.4149.100111.3K56 Q57 N62 A63 S64K56-M60 VanDerWaalsContact O-CG 3.25Å; K56-M60 WeakPolarHBondContact O-CG 3.34Å; K56-M60 PolarHBondContact O-N 2.86Å; Q57-M60 PolarHBondContact O-N 3.09Å; M60-N62 PolarHBondContact O-N 3.13Å; M60-A63 PolarHBondContact O-N 3.45Å; M60-S64 PolarHBondContact O-N 2.85Å; M60-S64 PolarHBondContact O-OG 3.48Å
61K85.9Confident77.9Confident144 Ų144117.5 Ų117.563%0.62656%0.556SS**Hα-helixtrans-60.4-43.2175.6-73.2179.9176.4-177.50112.2Q57 L58 S64 H65Q57-K61 WeakPolarHBondContact O-CG 3.34Å; Q57-K61 PolarHBondContact O-N 2.98Å; L58-K61 PolarHBondContact O-N 3.3Å; K61-S64 PolarHBondContact O-N 3.26Å; K61-H65 WeakPolarHBondContact O-CB 3.36Å; K61-H65 PolarHBondContact O-N 3.23Å
62N84.6Confident76Confident91 Ų91114.1 Ų114.149%0.48755%0.551SS.*Hα-helixtrans-73.4-27.9177.7-74.46.4000112.6L58 M60 S64 H65 K66L58-N62 VanDerWaalsContact CD2-ND2 3.33Å; L58-N62 WeakPolarHBondContact CD2-ND2 3.49Å; L58-N62 VanDerWaalsContact O-CB 3.27Å; L58-N62 WeakPolarHBondContact O-CB 3.41Å; L58-N62 PolarHBondContact O-N 3.4Å; M60-N62 PolarHBondContact O-N 3.13Å; N62-S64 VanDerWaalsContact C-N 3.35Å; N62-H65 PolarHBondContact O-N 2.97Å; N62-K66 WeakPolarHBondContact O-CA 3.47Å; N62-K66 WeakPolarHBondContact O-CB 3.32Å; N62-K66 PolarHBondContact O-N 3.43Å
63A77.6Confident73.7Confident60 Ų60113 Ų11350%0.49655%0.552SS.*Hα-helixtrans-65.7-41.3170.700000110.5R59 M60 S67R59-A63 VanDerWaalsContact O-CB 3.25Å; R59-A63 WeakPolarHBondContact O-CB 3.21Å; R59-A63 PolarHBondContact O-N 3.21Å; M60-A63 PolarHBondContact O-N 3.45Å; A63-S67 WeakPolarHBondContact O-CB 3.41Å; A63-S67 PolarHBondContact O-N 2.85Å; A63-S67 PolarHBondContact O-OG 2.83Å
64S70.8Confident71.6Confident73 Ų73109.7 Ų109.751%0.5155%0.55SS.*Hα-helixtrans-69.8-32.5172.5-610000113.7M60 K61 N62 S67 I68M60-S64 PolarHBondContact O-N 2.85Å; M60-S64 PolarHBondContact O-OG 3.48Å; K61-S64 PolarHBondContact O-N 3.26Å; N62-S64 VanDerWaalsContact C-N 3.35Å; S64-S67 VanDerWaalsContact C-OG 3.31Å; S64-S67 WeakPolarHBondContact CA-OG 3.23Å; S64-S67 PolarHBondContact O-OG 3.39Å; S64-I68 WeakPolarHBondContact O-CG1 3.33Å; S64-I68 PolarHBondContact O-N 3.25Å
65H63.8Low69.5Low116 Ų116108.7 Ų108.754%0.53756%0.559SS.*Hα-helixtrans-81.7-32.6176.7-109.1-73.9000113K61 N62 S67 I68 I69K61-H65 WeakPolarHBondContact O-CB 3.36Å; K61-H65 PolarHBondContact O-N 3.23Å; N62-H65 PolarHBondContact O-N 2.97Å; H65-S67 VanDerWaalsContact C-N 3.28Å; H65-I68 WeakPolarHBondContact O-CA 3.48Å; H65-I68 PolarHBondContact O-N 2.84Å; H65-I69 PolarHBondContact O-N 3.24Å
66K61.4Low67.4Low138 Ų138111.9 Ų111.960%0.658%0.576SS**Hα-helixtrans-70.3-31.7171.6-169.1170.9-173.5179.70110.2N62 I69 H70N62-K66 WeakPolarHBondContact O-CA 3.47Å; N62-K66 WeakPolarHBondContact O-CB 3.32Å; N62-K66 PolarHBondContact O-N 3.43Å; K66-I69 PolarHBondContact O-N 3.36Å; K66-H70 WeakPolarHBondContact O-CB 3.47Å; K66-H70 PolarHBondContact O-CD2 3.16Å; K66-H70 PolarHBondContact O-N 3.41Å
67S54.8Low65.8Low42 Ų42109.6 Ų109.629%0.29459%0.591SS.*Hα-helixtrans-62.4-47.9163.578.50000108.8A63 S64 H65 I69 H70 L71A63-S67 WeakPolarHBondContact O-CB 3.41Å; A63-S67 PolarHBondContact O-N 2.85Å; A63-S67 PolarHBondContact O-OG 2.83Å; S64-S67 VanDerWaalsContact C-OG 3.31Å; S64-S67 WeakPolarHBondContact CA-OG 3.23Å; S64-S67 PolarHBondContact O-OG 3.39Å; H65-S67 VanDerWaalsContact C-N 3.28Å; S67-I69 PolarHBondContact O-N 3.44Å; S67-H70 CarbonylContact O-C 3.54Å; S67-H70 VanDerWaalsContact O-C 3.29Å; S67-H70 PolarHBondContact O-N 3Å; S67-L71 VanDerWaalsContact O-CA 3.26Å; S67-L71 WeakPolarHBondContact O-CA 3.36Å; S67-L71 WeakPolarHBondContact O-CB 3.48Å; S67-L71 VanDerWaalsContact O-CD1 3.3Å; S67-L71 WeakPolarHBondContact O-CD1 3.41Å; S67-L71 WeakPolarHBondContact O-CG 3.36Å; S67-L71 PolarHBondContact O-N 2.81Å; S67-L71 VanDerWaalsContact OG-CD1 3.29Å; S67-L71 WeakPolarHBondContact OG-CD1 3.5Å
68I55.4Low64.3Low112 Ų112112.1 Ų112.157%0.57460%0.603SS**Hα-helixtrans-58.8-28.1178.6-71.1163.7000114.8S64 H65 L71S64-I68 WeakPolarHBondContact O-CG1 3.33Å; S64-I68 PolarHBondContact O-N 3.25Å; H65-I68 WeakPolarHBondContact O-CA 3.48Å; H65-I68 PolarHBondContact O-N 2.84Å; I68-L71 HydrophobicContact CG1-CD1 4.17Å
69I57.2Low63.4Low133 Ų133115.5 Ų115.568%0.68262%0.621SS**Hα-helixtrans-88.2-16.9175.9-60.4170.7000112.5H65 K66 S67H65-I69 PolarHBondContact O-N 3.24Å; K66-I69 PolarHBondContact O-N 3.36Å; S67-I69 PolarHBondContact O-N 3.44Å
70H52.9Low62.5Low117 Ų117109.1 Ų109.154%0.54260%0.604SS.*Hα-helixtrans-127.415.8179.7-66-72.1000114.6K66 S67 N72K66-H70 WeakPolarHBondContact O-CB 3.47Å; K66-H70 PolarHBondContact O-CD2 3.16Å; K66-H70 PolarHBondContact O-N 3.41Å; S67-H70 CarbonylContact O-C 3.54Å; S67-H70 VanDerWaalsContact O-C 3.29Å; S67-H70 PolarHBondContact O-N 3Å; H70-N72 VanDerWaalsContact C-N 3.31Å; H70-N72 PolarHBondContact O-N 3.46Å; H70-N72 VanDerWaalsContact O-N 3.13Å
71L52.1Low62.1Low105 Ų105111.5 Ų111.555%0.5561%0.611SS.*THydrogen-bonded Turntrans-89.477.6179.3-88.8161.9000106.4S67 I68S67-L71 VanDerWaalsContact O-CA 3.26Å; S67-L71 WeakPolarHBondContact O-CA 3.36Å; S67-L71 WeakPolarHBondContact O-CB 3.48Å; S67-L71 VanDerWaalsContact O-CD1 3.3Å; S67-L71 WeakPolarHBondContact O-CD1 3.41Å; S67-L71 WeakPolarHBondContact O-CG 3.36Å; S67-L71 PolarHBondContact O-N 2.81Å; S67-L71 VanDerWaalsContact OG-CD1 3.29Å; S67-L71 WeakPolarHBondContact OG-CD1 3.5Å; I68-L71 HydrophobicContact CG1-CD1 4.17Å
72N52.7Low61.7Low96 Ų96108 Ų10851%0.51360%0.604SS.*THydrogen-bonded Turntrans-176.126.1147.9-85.9-17.8000110.9H70 G74 P80H70-N72 VanDerWaalsContact C-N 3.31Å; H70-N72 PolarHBondContact O-N 3.46Å; H70-N72 VanDerWaalsContact O-N 3.13Å; N72-G74 PolarHBondContact O-N 3.04Å; N72-G74 VanDerWaalsContact O-N 3.08Å; N72-P80 HydrophobicContact CB-CB 3.33Å; N72-P80 HydrophobicContact CB-CG 3.42Å; N72-P80 VanDerWaalsContact CB-CG 3.42Å
73N47.6Very low61.7Low130 Ų130109.1 Ų109.170%0.69561%0.608SS**  trans-8276.2159.7-79.113.2000107.3
74G48.3Very low62Low51 Ų51106.7 Ų106.753%0.52659%0.586SS.*  trans-68.2135.6162.400000108.7N72 N76N72-G74 PolarHBondContact O-N 3.04Å; N72-G74 VanDerWaalsContact O-N 3.08Å; G74-N76 PolarHBondContact O-N 3.2Å
75D50.8Low62.7Low162 Ų162112.7 Ų112.787%0.86660%0.598SS**SBendtrans-66.650.5-174.1-71.3-46.3000114.5
76N50.3Low63.7Low145 Ų145114.7 Ų114.778%0.77561%0.613SS**SBendtrans-150.742.5175-75.6-46.4000112.4G74 E78G74-N76 PolarHBondContact O-N 3.2Å; N76-E78 PolarHBondContact O-N 2.9Å
77G58.5Low65Low89 Ų89115.1 Ų115.192%0.91861%0.612SS**SBendtrans57.28169.700000117.4
78E60.2Low66.3Low161 Ų161120.5 Ų120.575%0.75263%0.629SS**PPolyproline II helixtrans-103.7119.3-172-132.3161.9-164.600108.4N76N76-E78 PolarHBondContact O-N 2.9Å
79L69.5Low67.8Low153 Ų153115.8 Ų115.880%0.80161%0.606SS**PPolyproline II helixtrans-62.5149-177.2-69.5162.9000110.4K81L79-K81 PolarHBondContact O-N 2.76Å
80P72.2Confident69Low57 Ų57119 Ų11937%0.3762%0.618SS.*PPolyproline II helixtrans-48.7126.8171.5-22.929.2000111.3N72 P82N72-P80 HydrophobicContact CB-CB 3.33Å; N72-P80 HydrophobicContact CB-CG 3.42Å; N72-P80 VanDerWaalsContact CB-CG 3.42Å; P80-P82 WeakPolarHBondContact O-CD 3.4Å
81K76.9Confident70.4Confident167 Ų167116 Ų11673%0.72661%0.611SS**PPolyproline II helixtrans-60.4124.4174.3-69-171.5179-171.20109.6L79L79-K81 PolarHBondContact O-N 2.76Å
82P78.3Confident71.7Confident71 Ų71118.1 Ų118.146%0.46162%0.618SS.*PPolyproline II helixtrans-68.2140.6-176.826.8-34.6000111.6P80 F84P80-P82 WeakPolarHBondContact O-CD 3.4Å; P82-F84 HydrophobicContact CB-CE1 4.04Å; P82-F84 HydrophobicContact CB-CE2 4.38Å; P82-F84 HydrophobicContact CB-CZ 3.77Å; P82-F84 HydrophobicContact CG-CE1 4.2Å; P82-F84 HydrophobicContact CG-CE2 4.04Å; P82-F84 HydrophobicContact CG-CZ 3.47Å; P82-F84 VanDerWaalsContact CG-CZ 3.47Å
83I83.8Confident73Confident114 Ų114121.8 Ų121.859%0.58563%0.632SS**  trans-105.3120.8177.4-58173.8000109.2G97 L99I83-G97 CarbonylContact C-O 3.59Å; I83-G97 WeakPolarHBondContact CA-O 3.5Å; I83-L99 HydrophobicContact CG2-CD1 3.31Å; I83-L99 HydrophobicContact CG2-CD2 4.5Å; I83-L99 HydrophobicContact CG2-CG 3.63Å
84F84.2Confident74.4Confident8 Ų8118.6 Ų118.64%0.03562%0.615CS.*BIsolated β-bridgetrans-96.7107.6-174.7-52.9-69.9000110.9P82 Y87 P89 L94 G97 L99P82-F84 HydrophobicContact CB-CE1 4.04Å; P82-F84 HydrophobicContact CB-CE2 4.38Å; P82-F84 HydrophobicContact CB-CZ 3.77Å; P82-F84 HydrophobicContact CG-CE1 4.2Å; P82-F84 HydrophobicContact CG-CE2 4.04Å; P82-F84 HydrophobicContact CG-CZ 3.47Å; P82-F84 VanDerWaalsContact CG-CZ 3.47Å; F84-Y87 WeakPolarHBondContact CB-O 3.21Å; F84-Y87 HydrophobicContact CD1-CD2 4.13Å; F84-Y87 AromaticContact CD1-CE1 3.91Å; F84-Y87 HydrophobicContact CD1-CE1 3.91Å; F84-Y87 AromaticContact CD1-CE2 3.28Å; F84-Y87 HydrophobicContact CD1-CE2 3.28Å; F84-Y87 AromaticContact CD1-CZ 3.19Å; F84-Y87 WeakPolarHBondContact CD1-OH 3.38Å; F84-Y87 AromaticContact CE1-CE2 3.63Å; F84-Y87 HydrophobicContact CE1-CE2 3.63Å; F84-Y87 AromaticContact CE1-CZ 3.55Å; F84-Y87 WeakPolarHBondContact CE1-OH 3.29Å; F84-Y87 HydrophobicContact CG-CE2 4.17Å; F84-P89 HydrophobicContact CD2-CB 4.25Å; F84-P89 HydrophobicContact CD2-CG 3.69Å; F84-P89 HydrophobicContact CE2-CB 4.17Å; F84-P89 HydrophobicContact CE2-CG 3.98Å; F84-P89 HydrophobicContact CG-CG 4.21Å; F84-P89 HydrophobicContact CZ-CB 4.41Å; F84-L94 WeakPolarHBondContact CD2-O 3.35Å; F84-L94 HydrophobicContact CE1-CD2 4.27Å; F84-L94 HydrophobicContact CE2-CB 3.61Å; F84-L94 HydrophobicContact CE2-CD2 4.12Å; F84-L94 HydrophobicContact CE2-CG 3.9Å; F84-L94 WeakPolarHBondContact CE2-O 3.36Å; F84-L94 HydrophobicContact CZ-CB 3.86Å; F84-L94 HydrophobicContact CZ-CD2 3.45Å; F84-L94 VanDerWaalsContact CZ-CD2 3.45Å; F84-L94 HydrophobicContact CZ-CG 3.69Å; F84-G97 PolarHBondContact N-O 3.33Å; F84-L99 PolarHBondContact O-N 2.86Å; F84-L99 VanDerWaalsContact O-N 3.1Å
85R86.1Confident75.8Confident199 Ų199120.7 Ų120.775%0.75161%0.609SS**SBendtrans-90.4-46.2179.1-70173.9131.6117.1-0.8112.9L99R85-L99 HydrophobicContact CB-CD1 4.48Å; R85-L99 HydrophobicContact CG-CD1 3.48Å; R85-L99 VanDerWaalsContact CG-CD1 3.48Å
86N85.6Confident77.2Confident159 Ų159119.7 Ų119.785%0.8560%0.604SS**SBendtrans-107.3-8.3-163.5-62.1-7.8000113.6
87Y86.9Confident78.6Confident147 Ų147113.6 Ų113.658%0.57658%0.575SS**SBendtrans-145.8157.9-177.564.1-88.1000110.6F84F84-Y87 WeakPolarHBondContact CB-O 3.21Å; F84-Y87 HydrophobicContact CD1-CD2 4.13Å; F84-Y87 AromaticContact CD1-CE1 3.91Å; F84-Y87 HydrophobicContact CD1-CE1 3.91Å; F84-Y87 AromaticContact CD1-CE2 3.28Å; F84-Y87 HydrophobicContact CD1-CE2 3.28Å; F84-Y87 AromaticContact CD1-CZ 3.19Å; F84-Y87 WeakPolarHBondContact CD1-OH 3.38Å; F84-Y87 AromaticContact CE1-CE2 3.63Å; F84-Y87 HydrophobicContact CE1-CE2 3.63Å; F84-Y87 AromaticContact CE1-CZ 3.55Å; F84-Y87 WeakPolarHBondContact CE1-OH 3.29Å; F84-Y87 HydrophobicContact CG-CE2 4.17Å
88K83.6Confident79.6Confident154 Ų154112.6 Ų112.667%0.6755%0.547SS*.  trans-98120.1175.4-53.8-162.8173.2-168.80108.8E98K88-E98 WeakPolarHBondContact CD-OE1 3.2Å; K88-E98 WeakPolarHBondContact CE-OE1 3.22Å; K88-E98 VanDerWaalsContact CG-OE1 3.27Å; K88-E98 WeakPolarHBondContact CG-OE1 3.41Å; K88-E98 IonicContact NZ-OE1 2.81Å
89P85.7Confident80.3Confident13 Ų13108.8 Ų108.88%0.08453%0.531CS..  trans-64.9139.8177.126.6-32.3000110.4F84 L94F84-P89 HydrophobicContact CD2-CB 4.25Å; F84-P89 HydrophobicContact CD2-CG 3.69Å; F84-P89 HydrophobicContact CE2-CB 4.17Å; F84-P89 HydrophobicContact CE2-CG 3.98Å; F84-P89 HydrophobicContact CG-CG 4.21Å; F84-P89 HydrophobicContact CZ-CB 4.41Å; P89-L94 HydrophobicContact CB-CB 3.47Å; P89-L94 VanDerWaalsContact CB-CB 3.47Å; P89-L94 HydrophobicContact CB-CD2 4.31Å; P89-L94 HydrophobicContact CG-CB 3.87Å; P89-L94 WeakPolarHBondContact CG-O 3.44Å
90Q82.9Confident80.6Confident200 Ų200107 Ų10794%0.93553%0.528SS*.SBendtrans-78.6-30.3179.4-70.1-179.1-31.100112.6
91S83.3Confident80.9Confident55 Ų55108.7 Ų108.739%0.38555%0.548SS..SBendtrans-81.6143.2-179.550.50000111.8E93 L94S91-E93 VanDerWaalsContact C-N 3.32Å; S91-E93 PolarHBondContact O-N 3Å; S91-L94 PolarHBondContact O-N 3.21Å
92E79.5Confident80.9Confident149 Ų149104.1 Ų104.170%0.69655%0.548SS*.G310 helixtrans-64.4-36.7-177.7-57.6-134.8117.700112.7L94 K95E92-L94 PolarHBondContact O-N 3.13Å; E92-K95 WeakPolarHBondContact O-CB 3.31Å; E92-K95 PolarHBondContact O-N 3.01Å; E92-K95 IonicContact OE1-NZ 3.73Å; E92-K95 PolarHBondContact OE1-NZ 3.42Å
93E79.6Confident80.9Confident174 Ų174110.2 Ų110.281%0.81357%0.567SS**G310 helixtrans-63.8-22.1-179.3-61176.7-178.100113.9S91S91-E93 VanDerWaalsContact C-N 3.32Å; S91-E93 PolarHBondContact O-N 3Å
94L77.1Confident80.8Confident63 Ų63110.7 Ų110.733%0.3358%0.577SS.*G310 helixtrans-98.4-11.5-178.1-8664.7000112.3F84 P89 S91 E92 D96 G97F84-L94 WeakPolarHBondContact CD2-O 3.35Å; F84-L94 HydrophobicContact CE1-CD2 4.27Å; F84-L94 HydrophobicContact CE2-CB 3.61Å; F84-L94 HydrophobicContact CE2-CD2 4.12Å; F84-L94 HydrophobicContact CE2-CG 3.9Å; F84-L94 WeakPolarHBondContact CE2-O 3.36Å; F84-L94 HydrophobicContact CZ-CB 3.86Å; F84-L94 HydrophobicContact CZ-CD2 3.45Å; F84-L94 VanDerWaalsContact CZ-CD2 3.45Å; F84-L94 HydrophobicContact CZ-CG 3.69Å; P89-L94 HydrophobicContact CB-CB 3.47Å; P89-L94 VanDerWaalsContact CB-CB 3.47Å; P89-L94 HydrophobicContact CB-CD2 4.31Å; P89-L94 HydrophobicContact CG-CB 3.87Å; P89-L94 WeakPolarHBondContact CG-O 3.44Å; S91-L94 PolarHBondContact O-N 3.21Å; E92-L94 PolarHBondContact O-N 3.13Å; L94-D96 PolarHBondContact O-N 3.34Å; L94-G97 PolarHBondContact O-N 3.3Å
95K77.8Confident80.6Confident95 Ų95115.9 Ų115.941%0.41361%0.61SS.*G310 helixtrans-60.2-30.7179.6-70.2176.6-175.1170.20112.5E92 G97 E98E92-K95 WeakPolarHBondContact O-CB 3.31Å; E92-K95 PolarHBondContact O-N 3.01Å; E92-K95 IonicContact OE1-NZ 3.73Å; E92-K95 PolarHBondContact OE1-NZ 3.42Å; K95-G97 PolarHBondContact O-N 2.92Å; K95-G97 VanDerWaalsContact O-N 3.11Å; K95-E98 WeakPolarHBondContact O-CB 3.41Å; K95-E98 PolarHBondContact O-N 3.23Å
96D79Confident80.4Confident141 Ų141111 Ų11175%0.75460%0.599SS**G310 helixtrans-59.3-22176.7-70.1-9.4000113.4L94L94-D96 PolarHBondContact O-N 3.34Å
97G80.1Confident80.4Confident17 Ų17108.3 Ų108.318%0.17558%0.584CS.*G310 helixtrans-92.7-0.4177.300000114.9I83 F84 L94 K95 L99I83-G97 CarbonylContact C-O 3.59Å; I83-G97 WeakPolarHBondContact CA-O 3.5Å; F84-G97 PolarHBondContact N-O 3.33Å; L94-G97 PolarHBondContact O-N 3.3Å; K95-G97 PolarHBondContact O-N 2.92Å; K95-G97 VanDerWaalsContact O-N 3.11Å; G97-L99 PolarHBondContact O-N 2.82Å
98E78.6Confident80.4Confident68 Ų68106 Ų10632%0.31858%0.581SS.*BIsolated β-bridgetrans-73.5116.1-179.3-170.2176.7163.700110.3K88 K95K88-E98 WeakPolarHBondContact CD-OE1 3.2Å; K88-E98 WeakPolarHBondContact CE-OE1 3.22Å; K88-E98 VanDerWaalsContact CG-OE1 3.27Å; K88-E98 WeakPolarHBondContact CG-OE1 3.41Å; K88-E98 IonicContact NZ-OE1 2.81Å; K95-E98 WeakPolarHBondContact O-CB 3.41Å; K95-E98 PolarHBondContact O-N 3.23Å
99L75.5Confident80.4Confident81 Ų81106.4 Ų106.442%0.42458%0.583SS.*PPolyproline II helixtrans-69.3132.1172-84156.8000108.9I83 F84 R85 G97 A101I83-L99 HydrophobicContact CG2-CD1 3.31Å; I83-L99 HydrophobicContact CG2-CD2 4.5Å; I83-L99 HydrophobicContact CG2-CG 3.63Å; F84-L99 PolarHBondContact O-N 2.86Å; F84-L99 VanDerWaalsContact O-N 3.1Å; R85-L99 HydrophobicContact CB-CD1 4.48Å; R85-L99 HydrophobicContact CG-CD1 3.48Å; R85-L99 VanDerWaalsContact CG-CD1 3.48Å; G97-L99 PolarHBondContact O-N 2.82Å; L99-A101 PolarHBondContact O-N 3.07Å
100P76.9Confident80.3Confident114 Ų114111.7 Ų111.774%0.7461%0.606SS**PPolyproline II helixtrans-59.8134.3177.425.4-33.3000109.5G102P100-G102 PolarHBondContact O-N 2.86Å
101A77.4Confident80.4Confident94 Ų94106 Ų10678%0.77758%0.581SS**PPolyproline II helixtrans-56.1127.117600000109.5L99 K103L99-A101 PolarHBondContact O-N 3.07Å; A101-K103 PolarHBondContact O-N 3.2Å
102G76.6Confident80.6Confident71 Ų71108.2 Ų108.273%0.73259%0.588SS**PPolyproline II helixtrans-57.1134.117700000110.2P100P100-G102 PolarHBondContact O-N 2.86Å
103K79.6Confident80.8Confident198 Ų198103.8 Ų103.886%0.86158%0.577SS**PPolyproline II helixtrans-59.5133.9174.4-66.2-178.3-178.9179.90108.4A101 V105A101-K103 PolarHBondContact O-N 3.2Å; K103-V105 PolarHBondContact O-N 3.45Å
104P80.2Confident81.1Confident124 Ų124102.1 Ų102.181%0.80557%0.569SS**PPolyproline II helixtrans-59141.3177.125.1-32.8000109.6D106P104-D106 PolarHBondContact O-N 3.32Å
105V80.8Confident81.4Confident118 Ų118103.9 Ų103.972%0.71558%0.578SS**PPolyproline II helixtrans-63132175.5178.50000108.2K103 L107K103-V105 PolarHBondContact O-N 3.45Å; V105-L107 HydrophobicContact CG1-CD2 4.4Å; V105-L107 PolarHBondContact O-N 3.33Å
106D82.4Confident81.5Confident97 Ų97106.1 Ų106.152%0.51959%0.59SS.*  trans-71.8101.2178.8-172.57.6000110.5P104 N108P104-D106 PolarHBondContact O-N 3.32Å; D106-N108 VanDerWaalsContact C-N 3.28Å; D106-N108 PolarHBondContact O-N 2.89Å; D106-N108 VanDerWaalsContact OD1-CB 3.31Å; D106-N108 WeakPolarHBondContact OD1-CB 3.38Å; D106-N108 PolarHBondContact OD1-N 3.01Å; D106-N108 PolarHBondContact OD1-ND2 3.4Å
107L84.8Confident81.5Confident102 Ų102103 Ų10353%0.53458%0.584SS.*  trans-80.7-7.1-177.6-59.2-179.2000113V105 K109 H110 I111V105-L107 HydrophobicContact CG1-CD2 4.4Å; V105-L107 PolarHBondContact O-N 3.33Å; L107-K109 PolarHBondContact O-N 3.17Å; L107-K109 VanDerWaalsContact O-N 3.15Å; L107-H110 WeakPolarHBondContact O-CB 3.18Å; L107-H110 PolarHBondContact O-N 2.91Å; L107-I111 HydrophobicContact CB-CD1 4.32Å; L107-I111 PolarHBondContact O-N 3.2Å
108N86.8Confident81.2Confident97 Ų97105.6 Ų105.652%0.51960%0.604SS.*Hα-helixtrans-54.2-40.2-175.1-71.4-39.8000112.1D106 H110 I111 I112D106-N108 VanDerWaalsContact C-N 3.28Å; D106-N108 PolarHBondContact O-N 2.89Å; D106-N108 VanDerWaalsContact OD1-CB 3.31Å; D106-N108 WeakPolarHBondContact OD1-CB 3.38Å; D106-N108 PolarHBondContact OD1-N 3.01Å; D106-N108 PolarHBondContact OD1-ND2 3.4Å; N108-H110 VanDerWaalsContact C-N 3.32Å; N108-H110 PolarHBondContact O-N 3.4Å; N108-I111 PolarHBondContact O-N 3.38Å; N108-I112 WeakPolarHBondContact O-CB 3.32Å; N108-I112 WeakPolarHBondContact O-CD1 3.2Å; N108-I112 WeakPolarHBondContact O-CG1 3.47Å; N108-I112 PolarHBondContact O-N 3.4Å
109K84.3Confident81Confident163 Ų163108.9 Ų108.971%0.70962%0.623SS**Hα-helixtrans-61.1-38.3177.2-62.6-176.9-179.7-177.20113.2L107 A113L107-K109 PolarHBondContact O-N 3.17Å; L107-K109 VanDerWaalsContact O-N 3.15Å; K109-A113 PolarHBondContact O-N 3.43Å; K109-A113 VanDerWaalsContact O-N 3.15Å
110H82.6Confident80.7Confident124 Ų124107.3 Ų107.357%0.57462%0.622SS**Hα-helixtrans-73.7-39.3179.2-72.980000111.3L107 N108 I112 A113 Q114L107-H110 WeakPolarHBondContact O-CB 3.18Å; L107-H110 PolarHBondContact O-N 2.91Å; N108-H110 VanDerWaalsContact C-N 3.32Å; N108-H110 PolarHBondContact O-N 3.4Å; H110-I112 VanDerWaalsContact C-N 3.35Å; H110-A113 PolarHBondContact O-N 3.48Å; H110-Q114 WeakPolarHBondContact O-CG 3.46Å; H110-Q114 PolarHBondContact O-N 2.99Å
111I86.5Confident80.1Confident80 Ų80107.2 Ų107.241%0.4162%0.622SS.*Hα-helixtrans-63.9-44.3177-63.9167.5000109.9L107 N108 A113 Q114 L115L107-I111 HydrophobicContact CB-CD1 4.32Å; L107-I111 PolarHBondContact O-N 3.2Å; N108-I111 PolarHBondContact O-N 3.38Å; I111-A113 PolarHBondContact O-N 3.3Å; I111-Q114 PolarHBondContact O-N 3Å; I111-L115 HydrophobicContact CG2-CD1 3.83Å; I111-L115 HydrophobicContact CG2-CG 4.28Å; I111-L115 WeakPolarHBondContact O-CB 3.39Å; I111-L115 WeakPolarHBondContact O-CG 3.22Å; I111-L115 PolarHBondContact O-N 3.04Å
112I86.5Confident79.3Confident103 Ų103108.4 Ų108.453%0.52862%0.619SS.*Hα-helixtrans-60.5-47.6177.5-67.1161.4000110.6N108 H110 Q114 L115 E116N108-I112 WeakPolarHBondContact O-CB 3.32Å; N108-I112 WeakPolarHBondContact O-CD1 3.2Å; N108-I112 WeakPolarHBondContact O-CG1 3.47Å; N108-I112 PolarHBondContact O-N 3.4Å; H110-I112 VanDerWaalsContact C-N 3.35Å; I112-Q114 VanDerWaalsContact C-N 3.28Å; I112-Q114 PolarHBondContact O-N 3.3Å; I112-L115 PolarHBondContact O-N 3.31Å; I112-E116 WeakPolarHBondContact O-CB 3.4Å; I112-E116 PolarHBondContact O-N 3.44Å
113A84.8Confident78.4Confident56 Ų56112 Ų11246%0.46362%0.62SS.*Hα-helixtrans-61.2-36.217800000112.7K109 H110 I111 A117K109-A113 PolarHBondContact O-N 3.43Å; K109-A113 VanDerWaalsContact O-N 3.15Å; H110-A113 PolarHBondContact O-N 3.48Å; I111-A113 PolarHBondContact O-N 3.3Å; A113-A117 VanDerWaalsContact O-CB 3.3Å; A113-A117 WeakPolarHBondContact O-CB 3.35Å; A113-A117 PolarHBondContact O-N 2.97Å
114Q84.7Confident77.4Confident138 Ų138107 Ų10765%0.64561%0.606SS**Hα-helixtrans-72.2-39.8176.4-74.6178.8-15.600112.6H110 I111 I112 A117 A118H110-Q114 WeakPolarHBondContact O-CG 3.46Å; H110-Q114 PolarHBondContact O-N 2.99Å; I111-Q114 PolarHBondContact O-N 3Å; I112-Q114 VanDerWaalsContact C-N 3.28Å; I112-Q114 PolarHBondContact O-N 3.3Å; Q114-A117 PolarHBondContact O-N 2.92Å; Q114-A118 WeakPolarHBondContact O-CB 3.44Å; Q114-A118 PolarHBondContact O-N 2.92Å
115L82.8Confident76.5Confident101 Ų101107.3 Ų107.353%0.52960%0.601SS.*Hα-helixtrans-66.6-42.6175.5-72.7172.5000111I111 I112 A117 A118 D119I111-L115 HydrophobicContact CG2-CD1 3.83Å; I111-L115 HydrophobicContact CG2-CG 4.28Å; I111-L115 WeakPolarHBondContact O-CB 3.39Å; I111-L115 WeakPolarHBondContact O-CG 3.22Å; I111-L115 PolarHBondContact O-N 3.04Å; I112-L115 PolarHBondContact O-N 3.31Å; L115-A117 VanDerWaalsContact C-N 3.33Å; L115-A117 PolarHBondContact O-N 3.49Å; L115-A118 CarbonylContact O-C 3.29Å; L115-A118 PolarHBondContact O-N 3.39Å; L115-A118 VanDerWaalsContact O-N 3.09Å; L115-D119 WeakPolarHBondContact O-CB 3.41Å; L115-D119 PolarHBondContact O-N 2.82Å
116E80.8Confident75.4Confident141 Ų141110 Ų11066%0.65961%0.605SS**Hα-helixtrans-63.4-39175.4-172.2173.2-164.400111.8I112 A118 D119 A120I112-E116 WeakPolarHBondContact O-CB 3.4Å; I112-E116 PolarHBondContact O-N 3.44Å; E116-A118 VanDerWaalsContact C-N 3.28Å; E116-A118 PolarHBondContact O-N 2.94Å; E116-D119 PolarHBondContact O-N 3.25Å; E116-A120 WeakPolarHBondContact O-CB 3.29Å; E116-A120 PolarHBondContact O-N 3.46Å
117A79.5Confident74.3Confident75 Ų75109.4 Ų109.462%0.6261%0.605SS**Hα-helixtrans-67.8-26173.400000113.5A113 Q114 L115A113-A117 VanDerWaalsContact O-CB 3.3Å; A113-A117 WeakPolarHBondContact O-CB 3.35Å; A113-A117 PolarHBondContact O-N 2.97Å; Q114-A117 PolarHBondContact O-N 2.92Å; L115-A117 VanDerWaalsContact C-N 3.33Å; L115-A117 PolarHBondContact O-N 3.49Å
118A73.6Confident73.2Confident72 Ų72110.3 Ų110.360%0.59561%0.611SS**Hα-helixtrans-85.2-34.3176.700000112.8Q114 L115 E116Q114-A118 WeakPolarHBondContact O-CB 3.44Å; Q114-A118 PolarHBondContact O-N 2.92Å; L115-A118 CarbonylContact O-C 3.29Å; L115-A118 PolarHBondContact O-N 3.39Å; L115-A118 VanDerWaalsContact O-N 3.09Å; E116-A118 VanDerWaalsContact C-N 3.28Å; E116-A118 PolarHBondContact O-N 2.94Å
119D73.1Confident71.9Confident137 Ų137112.7 Ų112.773%0.73362%0.622SS**Hα-helixtrans-80.3-19.4175.9-82.2-12.6000112.5L115 E116 P121L115-D119 WeakPolarHBondContact O-CB 3.41Å; L115-D119 PolarHBondContact O-N 2.82Å; E116-D119 PolarHBondContact O-N 3.25Å; D119-P121 VanDerWaalsContact O-N 3.09Å
120A69.7Low71Confident49 Ų49109.1 Ų109.141%0.40562%0.624SS.*SBendtrans-50.1121.2168.600000107.8E116 V122E116-A120 WeakPolarHBondContact O-CB 3.29Å; E116-A120 PolarHBondContact O-N 3.46Å; A120-V122 PolarHBondContact O-N 3.17Å
121P63.8Low70.1Confident112 Ų112107.1 Ų107.173%0.72762%0.623SS**  trans-58.5114.4-175.724.3-32.5000105.8D119 I123D119-P121 VanDerWaalsContact O-N 3.09Å; P121-I123 PolarHBondContact O-N 3.4Å
122V61.9Low69Low119 Ų119109.5 Ų109.572%0.72164%0.636SS**  trans-55.3104.3169.6-178.60000103.6A120 V124A120-V122 PolarHBondContact O-N 3.17Å; V122-V124 HydrophobicContact CB-CG2 4.11Å; V122-V124 HydrophobicContact CG1-CG2 3.55Å; V122-V124 PolarHBondContact O-N 2.95Å
123I57.9Low68.4Low145 Ų145107 Ų10774%0.74463%0.631SS**  trans-68.581167.2-56.3169.3000102.4P121 D125P121-I123 PolarHBondContact O-N 3.4Å; I123-D125 PolarHBondContact O-N 3.42Å
124V57.9Low68Low94 Ų94110.6 Ų110.657%0.5765%0.65SS**  trans-66.889.6161.1-171.80000101.6V122 E126V122-V124 HydrophobicContact CB-CG2 4.11Å; V122-V124 HydrophobicContact CG1-CG2 3.55Å; V122-V124 PolarHBondContact O-N 2.95Å; V124-E126 VanDerWaalsContact C-N 3.26Å; V124-E126 PolarHBondContact O-N 2.94Å
125D61.1Low67.8Low130 Ų130110.5 Ų110.570%0.69564%0.644SS**  trans-46110.2152.6-84-14.9000103.9I123 V127I123-D125 PolarHBondContact O-N 3.42Å; D125-V127 VanDerWaalsContact C-N 3.26Å; D125-V127 VanDerWaalsContact O-CG2 3.29Å; D125-V127 WeakPolarHBondContact O-CG2 3.42Å; D125-V127 PolarHBondContact O-N 3.35Å
126E57.2Low67.9Low174 Ų174113.4 Ų113.481%0.81365%0.652SS**  trans-5296.6-172.3-67.4180174.600107.8V124 N128V124-E126 VanDerWaalsContact C-N 3.26Å; V124-E126 PolarHBondContact O-N 2.94Å; E126-N128 VanDerWaalsContact C-N 3.3Å; E126-N128 PolarHBondContact O-N 3.03Å
127V60.3Low68Low86 Ų86112.3 Ų112.352%0.52166%0.657SS.*  trans-68.4103.3179.6-167.70000103.2D125 L129 L132D125-V127 VanDerWaalsContact C-N 3.26Å; D125-V127 VanDerWaalsContact O-CG2 3.29Å; D125-V127 WeakPolarHBondContact O-CG2 3.42Å; D125-V127 PolarHBondContact O-N 3.35Å; V127-L129 PolarHBondContact O-N 2.82Å; V127-L132 HydrophobicContact CG1-CD1 4.08Å
128N61.6Low68.5Low120 Ų120113 Ų11364%0.64265%0.651SS**  trans-50.3100.2-178.7-98.2-58.3000108.9E126 A130 S131E126-N128 VanDerWaalsContact C-N 3.3Å; E126-N128 PolarHBondContact O-N 3.03Å; N128-A130 PolarHBondContact O-N 3.35Å; N128-S131 WeakPolarHBondContact O-CB 3.35Å; N128-S131 PolarHBondContact O-N 2.74Å; N128-S131 PolarHBondContact O-OG 3.33Å
129L59.1Low69.2Low147 Ų147114.3 Ų114.377%0.7764%0.64SS**Hα-helixtrans-59-23.2-174.3-65.2168.7000111.6V127 S131 L132 A133V127-L129 PolarHBondContact O-N 2.82Å; L129-S131 PolarHBondContact O-N 3.03Å; L129-L132 PolarHBondContact O-N 2.65Å; L129-A133 PolarHBondContact O-N 2.74Å
130A64.5Low69.9Low89 Ų89112.6 Ų112.674%0.73663%0.631SS**Hα-helixtrans-64.2-22.7172.700000114.1N128N128-A130 PolarHBondContact O-N 3.35Å
131S64.7Low70.9Confident81 Ų81115.8 Ų115.857%0.56664%0.64SS**Hα-helixtrans-87.2-26.2177.573.10000113.5N128 L129N128-S131 WeakPolarHBondContact O-CB 3.35Å; N128-S131 PolarHBondContact O-N 2.74Å; N128-S131 PolarHBondContact O-OG 3.33Å; L129-S131 PolarHBondContact O-N 3.03Å
132L63.6Low72.1Confident130 Ų130116.8 Ų116.868%0.68163%0.633SS**Hα-helixtrans-84.1-16.2175.8-115.782.6000113V127 L129V127-L132 HydrophobicContact CG1-CD1 4.08Å; L129-L132 PolarHBondContact O-N 2.65Å
133A72.9Confident73.4Confident50 Ų50118 Ų11841%0.41363%0.625SS.*SBendtrans-56.8140176.500000110.9L129 R135L129-A133 PolarHBondContact O-N 2.74Å; A133-R135 PolarHBondContact O-N 2.82Å
134P77.9Confident75Confident133 Ų133113.3 Ų113.386%0.86461%0.613SS**PPolyproline II helixtrans-52.9117.8175.5-24.432.6000110.3
135R80.7Confident76.6Confident136 Ų136111.4 Ų111.451%0.51360%0.601SS.*PPolyproline II helixtrans-74.3154.1178.8-61.1178.581156.913.5109.5A133 W139A133-R135 PolarHBondContact O-N 2.82Å; R135-W139 HydrophobicContact CB-CB 3.9Å; R135-W139 VanDerWaalsContact CB-CD1 3.5Å; R135-W139 HydrophobicContact CB-CD2 3.89Å; R135-W139 HydrophobicContact CB-CG 3.45Å; R135-W139 VanDerWaalsContact CB-CG 3.45Å; R135-W139 HydrophobicContact CG-CD2 4.33Å; R135-W139 HydrophobicContact CG-CG 4.34Å; R135-W139 VanDerWaalsContact NH1-CE3 3.27Å
136K83.7Confident78.2Confident161 Ų161110.5 Ų110.570%0.759%0.593SS**PPolyproline II helixtrans-52.2136.8173.8-65.7-172.5176.7-178.80109.5D138 W139K136-D138 PolarHBondContact O-N 2.87Å; K136-W139 WeakPolarHBondContact O-CB 3.47Å; K136-W139 PolarHBondContact O-N 3.49Å
137P83.5Confident79.8Confident119 Ų119109 Ų10977%0.77358%0.584SS**THydrogen-bonded Turntrans-52.5-29.1-175.220.6-33.3000114W139P137-W139 VanDerWaalsContact C-N 3.28Å; P137-W139 PolarHBondContact O-N 2.86Å
138D89.3Confident81.5Confident90 Ų90112.5 Ų112.548%0.48159%0.592SS.*THydrogen-bonded Turntrans-79.1-1.5178.1-48.1-30.7000114.7K136 D140 L141 K142K136-D138 PolarHBondContact O-N 2.87Å; D138-D140 VanDerWaalsContact C-N 3.26Å; D138-D140 PolarHBondContact O-N 2.92Å; D138-L141 PolarHBondContact O-N 3.49Å; D138-K142 WeakPolarHBondContact O-CG 3.28Å; D138-K142 PolarHBondContact O-N 2.87Å
139W89.6Confident83.1Confident99 Ų99110.9 Ų110.938%0.37558%0.583SS.*Hα-helixtrans-62.5-35.6-172.577.7-78.9000112.8R135 K136 P137 R143R135-W139 HydrophobicContact CB-CB 3.9Å; R135-W139 VanDerWaalsContact CB-CD1 3.5Å; R135-W139 HydrophobicContact CB-CD2 3.89Å; R135-W139 HydrophobicContact CB-CG 3.45Å; R135-W139 VanDerWaalsContact CB-CG 3.45Å; R135-W139 HydrophobicContact CG-CD2 4.33Å; R135-W139 HydrophobicContact CG-CG 4.34Å; R135-W139 VanDerWaalsContact NH1-CE3 3.27Å; K136-W139 WeakPolarHBondContact O-CB 3.47Å; K136-W139 PolarHBondContact O-N 3.49Å; P137-W139 VanDerWaalsContact C-N 3.28Å; P137-W139 PolarHBondContact O-N 2.86Å; W139-R143 PolarHBondContact O-N 3.42Å
140D88Confident84.7Confident101 Ų101110.1 Ų110.154%0.5457%0.57SS.*Hα-helixtrans-76.2-42180-170.249.9000110.8D138 K142 R143 G144D138-D140 VanDerWaalsContact C-N 3.26Å; D138-D140 PolarHBondContact O-N 2.92Å; D140-K142 VanDerWaalsContact C-N 3.34Å; D140-K142 PolarHBondContact O-N 3.38Å; D140-R143 WeakPolarHBondContact O-CB 3.41Å; D140-R143 PolarHBondContact O-N 2.91Å; D140-R143 VanDerWaalsContact O-N 3.17Å; D140-G144 PolarHBondContact O-N 2.74Å
141L90.2Very high86.1Confident115 Ų115112 Ų11260%0.60256%0.561SS**Hα-helixtrans-58.6-46.4174-174.762.7000111.1D138 R143 G144 V145D138-L141 PolarHBondContact O-N 3.49Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.25Å; L141-G144 PolarHBondContact O-N 2.7Å; L141-V145 HydrophobicContact CD1-CG2 3.75Å; L141-V145 HydrophobicContact CG-CG2 4.14Å; L141-V145 VanDerWaalsContact O-CB 3.22Å; L141-V145 WeakPolarHBondContact O-CB 3.31Å; L141-V145 WeakPolarHBondContact O-CG2 3.41Å; L141-V145 PolarHBondContact O-N 2.84Å
142K88.2Confident87.6Confident133 Ų133112.8 Ų112.858%0.57856%0.559SS**Hα-helixtrans-57.6-47.1175.9-74.4-178.4-179-172.20111.3D138 D140 G144 V145 E146D138-K142 WeakPolarHBondContact O-CG 3.28Å; D138-K142 PolarHBondContact O-N 2.87Å; D140-K142 VanDerWaalsContact C-N 3.34Å; D140-K142 PolarHBondContact O-N 3.38Å; K142-G144 PolarHBondContact O-N 3.08Å; K142-V145 PolarHBondContact O-N 3.45Å; K142-E146 WeakPolarHBondContact O-CB 3.33Å; K142-E146 PolarHBondContact O-N 2.93Å
143R89.3Confident89.2Confident144 Ų144111.7 Ų111.754%0.54355%0.55SS..Hα-helixtrans-59.2-45.2179.8-175.7-174-61.3-116.4-11.7112.5W139 D140 L141W139-R143 PolarHBondContact O-N 3.42Å; D140-R143 WeakPolarHBondContact O-CB 3.41Å; D140-R143 PolarHBondContact O-N 2.91Å; D140-R143 VanDerWaalsContact O-N 3.17Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.25Å
144G91Very high90.3Very high48 Ų48116 Ų11650%0.49556%0.556SS.*Hα-helixtrans-70.2-38.8178.700000113.4D140 L141 K142D140-G144 PolarHBondContact O-N 2.74Å; L141-G144 PolarHBondContact O-N 2.7Å; K142-G144 PolarHBondContact O-N 3.08Å
145V93.3Very high91.2Very high53 Ų53118 Ų11832%0.32155%0.546SS..Hα-helixtrans-80.6-29.8-175.8173.90000112.3L141 K142 K147 K148 L149L141-V145 HydrophobicContact CD1-CG2 3.75Å; L141-V145 HydrophobicContact CG-CG2 4.14Å; L141-V145 VanDerWaalsContact O-CB 3.22Å; L141-V145 WeakPolarHBondContact O-CB 3.31Å; L141-V145 WeakPolarHBondContact O-CG2 3.41Å; L141-V145 PolarHBondContact O-N 2.84Å; K142-V145 PolarHBondContact O-N 3.45Å; V145-K147 VanDerWaalsContact C-N 3.31Å; V145-K147 PolarHBondContact O-N 3.35Å; V145-K148 CarbonylContact O-C 3.59Å; V145-K148 WeakPolarHBondContact O-CA 3.4Å; V145-K148 WeakPolarHBondContact O-CB 3.3Å; V145-K148 PolarHBondContact O-N 3.33Å; V145-L149 HydrophobicContact CG1-CD1 3.66Å; V145-L149 HydrophobicContact CG1-CD2 4.47Å; V145-L149 HydrophobicContact CG1-CG 3.66Å; V145-L149 PolarHBondContact O-N 3.03Å
146E93.4Very high92Very high112 Ų112114.7 Ų114.752%0.52354%0.541SS..Hα-helixtrans-52.3-46-178.2-171.959.4-139.600112.5K142 K148 L149 R150K142-E146 WeakPolarHBondContact O-CB 3.33Å; K142-E146 PolarHBondContact O-N 2.93Å; E146-K148 VanDerWaalsContact C-N 3.27Å; E146-K148 PolarHBondContact O-N 3.5Å; E146-L149 PolarHBondContact O-N 3.03Å; E146-R150 WeakPolarHBondContact O-CB 3.25Å; E146-R150 PolarHBondContact O-N 3.42Å
147K92.3Very high92.6Very high143 Ų143112.2 Ų112.262%0.62253%0.532SS*.Hα-helixtrans-63.2-33.7179-173176.7-179178.40112.4V145V145-K147 VanDerWaalsContact C-N 3.31Å; V145-K147 PolarHBondContact O-N 3.35Å
148K94.6Very high93.3Very high158 Ų158114.2 Ų114.269%0.68752%0.524SS*.Hα-helixtrans-76.7-45.5177.7-64.8179.8-179.4176.50110.5V145 E146 R150 K151 L152V145-K148 CarbonylContact O-C 3.59Å; V145-K148 WeakPolarHBondContact O-CA 3.4Å; V145-K148 WeakPolarHBondContact O-CB 3.3Å; V145-K148 PolarHBondContact O-N 3.33Å; E146-K148 VanDerWaalsContact C-N 3.27Å; E146-K148 PolarHBondContact O-N 3.5Å; K148-R150 PolarHBondContact O-N 2.9Å; K148-K151 PolarHBondContact O-N 3.3Å; K148-K151 VanDerWaalsContact O-N 3.16Å; K148-L152 PolarHBondContact O-N 2.9Å
149L95Very high93.7Very high87 Ų87112 Ų11246%0.45552%0.518SS..Hα-helixtrans-58-46.1175.8-75.3176.5000111.6V145 E146 K151 L152 E153V145-L149 HydrophobicContact CG1-CD1 3.66Å; V145-L149 HydrophobicContact CG1-CD2 4.47Å; V145-L149 HydrophobicContact CG1-CG 3.66Å; V145-L149 PolarHBondContact O-N 3.03Å; E146-L149 PolarHBondContact O-N 3.03Å; L149-K151 VanDerWaalsContact C-N 3.25Å; L149-K151 PolarHBondContact O-N 3.46Å; L149-L152 CarbonylContact O-C 3.6Å; L149-L152 PolarHBondContact O-N 3.5Å; L149-E153 VanDerWaalsContact O-CB 3.31Å; L149-E153 WeakPolarHBondContact O-CB 3.45Å; L149-E153 PolarHBondContact O-N 3.09Å
150R93.4Very high94Very high130 Ų130111.6 Ų111.649%0.49152%0.522SS..Hα-helixtrans-57.2-36176.8-169.2-177.871.6168.92.3113.5E146 K148 R154E146-R150 WeakPolarHBondContact O-CB 3.25Å; E146-R150 PolarHBondContact O-N 3.42Å; K148-R150 PolarHBondContact O-N 2.9Å; R150-R154 WeakPolarHBondContact O-CG 3.33Å; R150-R154 PolarHBondContact O-N 3.45Å
151K94.5Very high94.5Very high128 Ų128108.4 Ų108.456%0.55751%0.51SS*.Hα-helixtrans-72.8-41.8175.8-73.3-178.1178.5-1740111.4K148 L149 R155K148-K151 PolarHBondContact O-N 3.3Å; K148-K151 VanDerWaalsContact O-N 3.16Å; L149-K151 VanDerWaalsContact C-N 3.25Å; L149-K151 PolarHBondContact O-N 3.46Å; K151-R155 PolarHBondContact O-N 2.86Å
152L96.4Very high94.7Very high99 Ų99108 Ų10852%0.51851%0.505SS..Hα-helixtrans-65-50.9179-174.360.2000110.2K148 L149 R154 R155 T156K148-L152 PolarHBondContact O-N 2.9Å; L149-L152 CarbonylContact O-C 3.6Å; L149-L152 PolarHBondContact O-N 3.5Å; L152-R154 VanDerWaalsContact C-N 3.29Å; L152-R154 PolarHBondContact O-N 2.9Å; L152-R155 CarbonylContact O-C 3.58Å; L152-R155 WeakPolarHBondContact O-CA 3.25Å; L152-R155 WeakPolarHBondContact O-CB 3.27Å; L152-R155 PolarHBondContact O-N 3.44Å; L152-T156 PolarHBondContact O-N 3.22Å; L152-T156 PolarHBondContact O-OG1 3.4Å
153E95.9Very high95.1Very high106 Ų106106.9 Ų106.950%0.49551%0.505SS..Hα-helixtrans-51.9-44.1177.7-174.4-178.2-169.200112.3L149 R155 T156 Q157L149-E153 VanDerWaalsContact O-CB 3.31Å; L149-E153 WeakPolarHBondContact O-CB 3.45Å; L149-E153 PolarHBondContact O-N 3.09Å; E153-R155 VanDerWaalsContact C-N 3.32Å; E153-R155 PolarHBondContact O-N 2.84Å; E153-T156 PolarHBondContact O-N 3.04Å; E153-Q157 WeakPolarHBondContact O-CB 3.34Å; E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.34Å; E153-Q157 PolarHBondContact O-N 2.82Å
154R96.3Very high95.4Very high142 Ų142105.1 Ų105.154%0.53651%0.505SS..Hα-helixtrans-61.7-36.2174.2-75178.2178-173.5-2.2113.4R150 L152 R158R150-R154 WeakPolarHBondContact O-CG 3.33Å; R150-R154 PolarHBondContact O-N 3.45Å; L152-R154 VanDerWaalsContact C-N 3.29Å; L152-R154 PolarHBondContact O-N 2.9Å; R154-R158 WeakPolarHBondContact O-CG 3.46Å; R154-R158 PolarHBondContact O-N 2.84Å
155R96.8Very high95.6Very high174 Ų174110.9 Ų110.966%0.65751%0.512SS*.Hα-helixtrans-73.2-40.2175.4-67.8176177.2176.5-3.6110.7K151 L152 E153 R158 A159K151-R155 PolarHBondContact O-N 2.86Å; L152-R155 CarbonylContact O-C 3.58Å; L152-R155 WeakPolarHBondContact O-CA 3.25Å; L152-R155 WeakPolarHBondContact O-CB 3.27Å; L152-R155 PolarHBondContact O-N 3.44Å; E153-R155 VanDerWaalsContact C-N 3.32Å; E153-R155 PolarHBondContact O-N 2.84Å; R155-R158 WeakPolarHBondContact O-CB 3.49Å; R155-R158 PolarHBondContact O-N 3.46Å; R155-A159 PolarHBondContact O-N 2.93Å
156T97.4Very high95.6Very high67 Ų67113.6 Ų113.641%0.41152%0.521SS..Hα-helixtrans-62.2-44.6176-31.90000110.9L152 E153 R158 A159 I160L152-T156 PolarHBondContact O-N 3.22Å; L152-T156 PolarHBondContact O-OG1 3.4Å; E153-T156 PolarHBondContact O-N 3.04Å; T156-R158 VanDerWaalsContact C-N 3.31Å; T156-R158 PolarHBondContact O-N 3.34Å; T156-A159 PolarHBondContact O-N 3.37Å; T156-I160 HydrophobicContact CG2-CD1 4.17Å; T156-I160 WeakPolarHBondContact O-CB 3.18Å; T156-I160 WeakPolarHBondContact O-CD1 3.34Å; T156-I160 WeakPolarHBondContact O-CG1 3.49Å; T156-I160 PolarHBondContact O-N 3.33Å
157Q97.4Very high95.6Very high109 Ų109117.1 Ų117.151%0.50953%0.53SS..Hα-helixtrans-60-39.2174.5-74.7173.9-1.600112.1E153 A161E153-Q157 WeakPolarHBondContact O-CB 3.34Å; E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.34Å; E153-Q157 PolarHBondContact O-N 2.82Å; Q157-A161 WeakPolarHBondContact O-CB 3.49Å; Q157-A161 PolarHBondContact O-N 2.86Å
158R97.2Very high95.6Very high160 Ų160115.9 Ų115.960%0.60453%0.529SS*.Hα-helixtrans-66-47.7174.6-75.1176.3-175.4139.5-2.3112.5R154 R155 T156 I160 A161 E162R154-R158 WeakPolarHBondContact O-CG 3.46Å; R154-R158 PolarHBondContact O-N 2.84Å; R155-R158 WeakPolarHBondContact O-CB 3.49Å; R155-R158 PolarHBondContact O-N 3.46Å; T156-R158 VanDerWaalsContact C-N 3.31Å; T156-R158 PolarHBondContact O-N 3.34Å; R158-I160 VanDerWaalsContact C-N 3.33Å; R158-I160 PolarHBondContact O-N 3.5Å; R158-A161 WeakPolarHBondContact O-CB 3.41Å; R158-A161 PolarHBondContact O-N 3.42Å; R158-A161 VanDerWaalsContact O-N 3.13Å; R158-E162 WeakPolarHBondContact O-CG 3.44Å; R158-E162 PolarHBondContact O-N 3.15Å
159A97.3Very high95.4Very high44 Ų44113.7 Ų113.736%0.36452%0.524SS..Hα-helixtrans-61.6-41.7177.600000111.6R155 T156 A161 E162 L163R155-A159 PolarHBondContact O-N 2.93Å; T156-A159 PolarHBondContact O-N 3.37Å; A159-A161 VanDerWaalsContact C-N 3.34Å; A159-A161 PolarHBondContact O-N 3.24Å; A159-E162 PolarHBondContact O-N 3.02Å; A159-L163 WeakPolarHBondContact O-CB 3.42Å; A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 2.9Å
160I96.8Very high95.1Very high90 Ų90115.3 Ų115.346%0.46253%0.53SS..Hα-helixtrans-60.5-44.6173.4-70.2165.3000110.4T156 R158 E162 L163 I164T156-I160 HydrophobicContact CG2-CD1 4.17Å; T156-I160 WeakPolarHBondContact O-CB 3.18Å; T156-I160 WeakPolarHBondContact O-CD1 3.34Å; T156-I160 WeakPolarHBondContact O-CG1 3.49Å; T156-I160 PolarHBondContact O-N 3.33Å; R158-I160 VanDerWaalsContact C-N 3.33Å; R158-I160 PolarHBondContact O-N 3.5Å; I160-E162 PolarHBondContact O-N 2.84Å; I160-L163 PolarHBondContact O-N 3.42Å; I160-I164 HydrophobicContact CG2-CD1 3.75Å; I160-I164 HydrophobicContact CG2-CG1 4.47Å; I160-I164 VanDerWaalsContact O-CG1 3.23Å; I160-I164 WeakPolarHBondContact O-CG1 3.38Å; I160-I164 PolarHBondContact O-N 3.43Å
161A97Very high94.7Very high34 Ų34112.3 Ų112.328%0.28153%0.526SS..Hα-helixtrans-65-37.1177.800000112.8Q157 R158 A159 R165Q157-A161 WeakPolarHBondContact O-CB 3.49Å; Q157-A161 PolarHBondContact O-N 2.86Å; R158-A161 WeakPolarHBondContact O-CB 3.41Å; R158-A161 PolarHBondContact O-N 3.42Å; R158-A161 VanDerWaalsContact O-N 3.13Å; A159-A161 VanDerWaalsContact C-N 3.34Å; A159-A161 PolarHBondContact O-N 3.24Å; A161-R165 WeakPolarHBondContact O-CG 3.29Å; A161-R165 PolarHBondContact O-N 3.23Å; A161-R165 VanDerWaalsContact O-N 3.09Å
162E96Very high93.9Very high108 Ų108108.7 Ų108.751%0.50552%0.517SS..Hα-helixtrans-65.2-49.6174.1-76.2166-17000111.4R158 A159 I160 I164 R165 E166R158-E162 WeakPolarHBondContact O-CG 3.44Å; R158-E162 PolarHBondContact O-N 3.15Å; A159-E162 PolarHBondContact O-N 3.02Å; I160-E162 PolarHBondContact O-N 2.84Å; E162-I164 VanDerWaalsContact C-N 3.29Å; E162-I164 PolarHBondContact O-N 2.92Å; E162-R165 WeakPolarHBondContact O-CA 3.02Å; E162-R165 WeakPolarHBondContact O-CB 3.34Å; E162-R165 PolarHBondContact O-N 2.8Å; E162-E166 PolarHBondContact O-N 3.03Å
163L96.6Very high92.8Very high109 Ų109106.3 Ų106.357%0.57151%0.506SS*.Hα-helixtrans-58.8-38.7176.5-72.2171.8000112.6A159 I160 R167A159-L163 WeakPolarHBondContact O-CB 3.42Å; A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 2.9Å; I160-L163 PolarHBondContact O-N 3.42Å; L163-R167 WeakPolarHBondContact O-CB 3.5Å; L163-R167 PolarHBondContact O-N 3.49Å
164I95.3Very high91.5Very high107 Ų107106 Ų10655%0.54951%0.508SS..Hα-helixtrans-65.9-39.9174.8-68.9166.8000110.9I160 E162 L168I160-I164 HydrophobicContact CG2-CD1 3.75Å; I160-I164 HydrophobicContact CG2-CG1 4.47Å; I160-I164 VanDerWaalsContact O-CG1 3.23Å; I160-I164 WeakPolarHBondContact O-CG1 3.38Å; I160-I164 PolarHBondContact O-N 3.43Å; E162-I164 VanDerWaalsContact C-N 3.29Å; E162-I164 PolarHBondContact O-N 2.92Å; I164-L168 WeakPolarHBondContact O-CB 3.34Å; I164-L168 PolarHBondContact O-N 3.15Å
165R94.1Very high89.9Confident169 Ų169102.1 Ų102.164%0.63850%0.502SS*.Hα-helixtrans-65.6-44.6177.3-76.6179.3-171.1121.8-0.7112A161 E162 L168 L169A161-R165 WeakPolarHBondContact O-CG 3.29Å; A161-R165 PolarHBondContact O-N 3.23Å; A161-R165 VanDerWaalsContact O-N 3.09Å; E162-R165 WeakPolarHBondContact O-CA 3.02Å; E162-R165 WeakPolarHBondContact O-CB 3.34Å; E162-R165 PolarHBondContact O-N 2.8Å; R165-L168 PolarHBondContact O-N 2.73Å; R165-L169 WeakPolarHBondContact O-CB 2.93Å; R165-L169 PolarHBondContact O-N 3.05Å
166E93.8Very high88.4Confident110 Ų11098.1 Ų98.151%0.51450%0.498SS..Hα-helixtrans-60.1-50176.3-72.3173.8175.800110.5E162 L168 L169 E170E162-E166 PolarHBondContact O-N 3.03Å; E166-L168 VanDerWaalsContact C-N 3.3Å; E166-L168 PolarHBondContact O-N 3.07Å; E166-L169 WeakPolarHBondContact O-CB 2.97Å; E166-L169 PolarHBondContact O-N 2.73Å; E166-L169 VanDerWaalsContact O-N 3.11Å; E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.03Å
167R93.5Very high86.7Confident186 Ų186100.1 Ų100.170%0.70250%0.502SS*.Hα-helixtrans-59.4-40.6177.6-170179.6-175.1-150.20.2112.4L163 T171L163-R167 WeakPolarHBondContact O-CB 3.5Å; L163-R167 PolarHBondContact O-N 3.49Å; R167-T171 WeakPolarHBondContact O-CG2 3.31Å; R167-T171 PolarHBondContact O-N 2.97Å; R167-T171 PolarHBondContact O-OG1 3.43Å; R167-T171 VanDerWaalsContact O-OG1 3.11Å
168L92.7Very high84.9Confident117 Ų11799.3 Ų99.361%0.61351%0.505SS*.Hα-helixtrans-67.9-39.5177.5-170.165.5000111.4I164 R165 E166 T171 S172I164-L168 WeakPolarHBondContact O-CB 3.34Å; I164-L168 PolarHBondContact O-N 3.15Å; R165-L168 PolarHBondContact O-N 2.73Å; E166-L168 VanDerWaalsContact C-N 3.3Å; E166-L168 PolarHBondContact O-N 3.07Å; L168-T171 WeakPolarHBondContact CA-OG1 3.49Å; L168-T171 PolarHBondContact O-OG1 3.45Å; L168-S172 WeakPolarHBondContact O-CB 3.47Å; L168-S172 PolarHBondContact O-N 2.91Å; L168-S172 PolarHBondContact O-OG 3.02Å
169L90.7Very high83.2Confident111 Ų111100.2 Ų100.258%0.58151%0.51SS*.Hα-helixtrans-63-50.8176.4-175.665.1000111R165 E166 T171 S172 V173R165-L169 WeakPolarHBondContact O-CB 2.93Å; R165-L169 PolarHBondContact O-N 3.05Å; E166-L169 WeakPolarHBondContact O-CB 2.97Å; E166-L169 PolarHBondContact O-N 2.73Å; E166-L169 VanDerWaalsContact O-N 3.11Å; L169-T171 PolarHBondContact O-N 3.05Å; L169-S172 WeakPolarHBondContact CA-OG 3.3Å; L169-S172 PolarHBondContact O-N 3.3Å; L169-S172 VanDerWaalsContact O-N 3.08Å; L169-S172 PolarHBondContact O-OG 2.72Å; L169-V173 HydrophobicContact CD1-CG2 4.12Å; L169-V173 HydrophobicContact CG-CG2 4.28Å; L169-V173 VanDerWaalsContact O-CG2 3.3Å; L169-V173 WeakPolarHBondContact O-CG2 3.44Å; L169-V173 PolarHBondContact O-N 2.59Å
170E87.6Confident81.7Confident121 Ų121100.6 Ų100.657%0.56551%0.512SS*.Hα-helixtrans-53.5-51.4175.6-71.1171.4175.600111E166 S172 V173 D174E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.03Å; E170-S172 VanDerWaalsContact C-N 3.27Å; E170-S172 PolarHBondContact O-N 3.24Å; E170-V173 PolarHBondContact O-N 3.47Å; E170-D174 WeakPolarHBondContact O-CB 3.26Å; E170-D174 VanDerWaalsContact O-CG 3.23Å; E170-D174 PolarHBondContact O-N 3.45Å
171T84.4Confident80.1Confident67 Ų67101.6 Ų101.641%0.41152%0.519SS..Hα-helixtrans-63.2-30.5178.859.90000113.6R167 L168 L169 S175R167-T171 WeakPolarHBondContact O-CG2 3.31Å; R167-T171 PolarHBondContact O-N 2.97Å; R167-T171 PolarHBondContact O-OG1 3.43Å; R167-T171 VanDerWaalsContact O-OG1 3.11Å; L168-T171 WeakPolarHBondContact CA-OG1 3.49Å; L168-T171 PolarHBondContact O-OG1 3.45Å; L169-T171 PolarHBondContact O-N 3.05Å; T171-S175 VanDerWaalsContact O-CB 3.32Å; T171-S175 WeakPolarHBondContact O-CB 3.2Å; T171-S175 PolarHBondContact O-N 3.39Å; T171-S175 PolarHBondContact O-OG 2.74Å
172S78.8Confident78.4Confident52 Ų52106.4 Ų106.436%0.36454%0.535SS..Hα-helixtrans-79.1-34.8177.773.90000113.1L168 L169 E170 T176L168-S172 WeakPolarHBondContact O-CB 3.47Å; L168-S172 PolarHBondContact O-N 2.91Å; L168-S172 PolarHBondContact O-OG 3.02Å; L169-S172 WeakPolarHBondContact CA-OG 3.3Å; L169-S172 PolarHBondContact O-N 3.3Å; L169-S172 VanDerWaalsContact O-N 3.08Å; L169-S172 PolarHBondContact O-OG 2.72Å; E170-S172 VanDerWaalsContact C-N 3.27Å; E170-S172 PolarHBondContact O-N 3.24Å; S172-T176 WeakPolarHBondContact O-CG2 3.39Å; S172-T176 PolarHBondContact O-N 3.08Å; S172-T176 PolarHBondContact O-OG1 2.82Å; S172-T176 VanDerWaalsContact O-OG1 3.06Å
173V74Confident77Confident50 Ų50105.3 Ų105.330%0.30354%0.539SS..Hα-helixtrans-71.7-46.7176.7174.70000109.3L169 E170 S175 T176 E177L169-V173 HydrophobicContact CD1-CG2 4.12Å; L169-V173 HydrophobicContact CG-CG2 4.28Å; L169-V173 VanDerWaalsContact O-CG2 3.3Å; L169-V173 WeakPolarHBondContact O-CG2 3.44Å; L169-V173 PolarHBondContact O-N 2.59Å; E170-V173 PolarHBondContact O-N 3.47Å; V173-S175 VanDerWaalsContact C-N 3.25Å; V173-S175 PolarHBondContact O-N 3.13Å; V173-T176 PolarHBondContact O-N 3.23Å; V173-T176 PolarHBondContact O-OG1 3.33Å; V173-T176 VanDerWaalsContact O-OG1 3.07Å; V173-E177 HydrophobicContact CG1-CG 4.08Å; V173-E177 WeakPolarHBondContact CG1-OE1 3.16Å; V173-E177 WeakPolarHBondContact O-CB 3.41Å; V173-E177 WeakPolarHBondContact O-CG 3.48Å; V173-E177 PolarHBondContact O-N 3.02Å
174D67.3Low75.3Confident99 Ų99108.8 Ų108.853%0.52955%0.55SS..Hα-helixtrans-58.7-39.7175-68.5-14.1000111.5E170 T178E170-D174 WeakPolarHBondContact O-CB 3.26Å; E170-D174 VanDerWaalsContact O-CG 3.23Å; E170-D174 PolarHBondContact O-N 3.45Å; D174-T178 WeakPolarHBondContact O-CB 3.22Å; D174-T178 WeakPolarHBondContact O-CG2 3.09Å; D174-T178 PolarHBondContact O-N 3.33Å; D174-T178 VanDerWaalsContact O-N 3.11Å; D174-T178 PolarHBondContact O-OG1 2.72Å
175S64.2Low73.8Confident60 Ų60108.4 Ų108.442%0.4256%0.557SS.*Hα-helixtrans-64.7-44.4174.8-620000111.6T171 V173 T178 Y179T171-S175 VanDerWaalsContact O-CB 3.32Å; T171-S175 WeakPolarHBondContact O-CB 3.2Å; T171-S175 PolarHBondContact O-N 3.39Å; T171-S175 PolarHBondContact O-OG 2.74Å; V173-S175 VanDerWaalsContact C-N 3.25Å; V173-S175 PolarHBondContact O-N 3.13Å; S175-T178 PolarHBondContact O-OG1 3.23Å; S175-Y179 WeakPolarHBondContact O-CD2 3.34Å; S175-Y179 WeakPolarHBondContact O-CE2 3.15Å; S175-Y179 PolarHBondContact O-N 3.07Å
176T64.2Low72.2Confident91 Ų91106.4 Ų106.456%0.55856%0.557SS**Hα-helixtrans-75.5-34.9-17853.70000113.4S172 V173 Y179 A180S172-T176 WeakPolarHBondContact O-CG2 3.39Å; S172-T176 PolarHBondContact O-N 3.08Å; S172-T176 PolarHBondContact O-OG1 2.82Å; S172-T176 VanDerWaalsContact O-OG1 3.06Å; V173-T176 PolarHBondContact O-N 3.23Å; V173-T176 PolarHBondContact O-OG1 3.33Å; V173-T176 VanDerWaalsContact O-OG1 3.07Å; T176-Y179 PolarHBondContact O-N 3.1Å; T176-A180 WeakPolarHBondContact O-CB 3.27Å; T176-A180 PolarHBondContact O-N 3.11Å
177E61Low70Confident109 Ų109113.4 Ų113.451%0.50959%0.59SS.*Hα-helixtrans-69.5-35.3176.6-72.6-175.3-179.900112.3V173 A180 N181V173-E177 HydrophobicContact CG1-CG 4.08Å; V173-E177 WeakPolarHBondContact CG1-OE1 3.16Å; V173-E177 WeakPolarHBondContact O-CB 3.41Å; V173-E177 WeakPolarHBondContact O-CG 3.48Å; V173-E177 PolarHBondContact O-N 3.02Å; E177-A180 PolarHBondContact O-N 3.23Å; E177-N181 PolarHBondContact O-N 3.2Å; E177-N181 PolarHBondContact O-ND2 3.18Å
178T60Low68.8Low91 Ų91109.8 Ų109.856%0.55859%0.585SS**Hα-helixtrans-66-37.5175.349.70000112.4D174 S175D174-T178 WeakPolarHBondContact O-CB 3.22Å; D174-T178 WeakPolarHBondContact O-CG2 3.09Å; D174-T178 PolarHBondContact O-N 3.33Å; D174-T178 VanDerWaalsContact O-N 3.11Å; D174-T178 PolarHBondContact O-OG1 2.72Å; S175-T178 PolarHBondContact O-OG1 3.23Å
179Y62.9Low67.6Low180 Ų180109.4 Ų109.471%0.70658%0.583SS**Hα-helixtrans-76.4-34.1175.2-64.7-62.3000113.6S175 T176 S183S175-Y179 WeakPolarHBondContact O-CD2 3.34Å; S175-Y179 WeakPolarHBondContact O-CE2 3.15Å; S175-Y179 PolarHBondContact O-N 3.07Å; T176-Y179 PolarHBondContact O-N 3.1Å; Y179-S183 PolarHBondContact O-N 3.33Å
180A65.4Low66.3Low51 Ų51109.3 Ų109.342%0.42158%0.583SS.*Hα-helixtrans-71.4-32.1-178.600000113.6T176 E177 S183T176-A180 WeakPolarHBondContact O-CB 3.27Å; T176-A180 PolarHBondContact O-N 3.11Å; E177-A180 PolarHBondContact O-N 3.23Å; A180-S183 PolarHBondContact O-OG 2.81Å
181N63Low65.1Low112 Ų112108.6 Ų108.660%0.59958%0.584SS**Hα-helixtrans-77.2-28.3177.9-71.2-45.9000112.6E177E177-N181 PolarHBondContact O-N 3.2Å; E177-N181 PolarHBondContact O-ND2 3.18Å
182H61.5Low63.9Low135 Ų135111.3 Ų111.363%0.62560%0.595SS**Hα-helixtrans-74.8-32179.3-166.962.1000113.2
183S65.4Low62.9Low84 Ų84115.2 Ų115.259%0.58761%0.61SS**Hα-helixtrans-76.2-23-17862.50000114.5Y179 A180 S185Y179-S183 PolarHBondContact O-N 3.33Å; A180-S183 PolarHBondContact O-OG 2.81Å; S183-S185 VanDerWaalsContact C-N 3.3Å; S183-S185 PolarHBondContact O-N 3.41Å
184K62.2Low62.1Low183 Ų183119.9 Ų119.980%0.79663%0.632SS**THydrogen-bonded Turntrans-80-2179.1-89.4175.4177.6174.70115.2
185S62.5Low61.7Low99 Ų99121.5 Ų121.569%0.69264%0.64SS**THydrogen-bonded Turntrans-112.912.1-178-57.20000114.3S183S183-S185 VanDerWaalsContact C-N 3.3Å; S183-S185 PolarHBondContact O-N 3.41Å
186I61.9Low61.4Low126 Ų126126.6 Ų126.665%0.64666%0.659SS**  trans-110.53.7-174-67.2176.3000113.6
187E47.4Very low61.2Low258 Ų258129.8 Ų129.8100%1.20667%0.668SS**  trans-113.70169.5-98.5171.316200111.4

Retrieved 187 of 187 residues in 88.6 ms (Link to these results)