A0A077Z5N9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z5N9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 344 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
1M44.5Very low48.4Very low232 Ų232121.9 Ų121.9100%1.14362%0.622SS**  0138.50-79.3176.1168.200108.6P3M1-P3 WeakPolarHBondContact O-CD 2.9Å
2N41.5Very low48.5Very low116 Ų116125.3 Ų125.362%0.6262%0.623SS**  trans-84.4109.9-177.5-164.2-16.2000109.3R4 A5N2-R4 PolarHBondContact O-N 3.07Å; N2-R4 VanDerWaalsContact O-N 3.1Å; N2-A5 PolarHBondContact O-N 3.07Å; N2-A5 VanDerWaalsContact O-N 3.1Å
3P52.7Low48.6Very low93 Ų93125.5 Ų125.560%0.60462%0.621SS**Hα-helixtrans-60.3-25.4-172.922.3-32.2000112.9M1 A5 V6 I7M1-P3 WeakPolarHBondContact O-CD 2.9Å; P3-A5 PolarHBondContact O-N 3.26Å; P3-V6 PolarHBondContact O-N 2.9Å; P3-I7 WeakPolarHBondContact O-CG1 3.2Å; P3-I7 PolarHBondContact O-N 2.95Å
4R46.3Very low49.1Very low203 Ų203123.7 Ų123.777%0.76662%0.615SS**Hα-helixtrans-63.8-36.4176.8-114.5178.9163.9150.1-4113.8N2 M8N2-R4 PolarHBondContact O-N 3.07Å; N2-R4 VanDerWaalsContact O-N 3.1Å; R4-M8 PolarHBondContact O-N 3.35Å
5A48.2Very low48.9Very low41 Ų41118.6 Ų118.634%0.33961%0.607SS.*Hα-helixtrans-70.3-40.3179.700000111.1N2 P3 I7 M8 Y9N2-A5 PolarHBondContact O-N 3.07Å; N2-A5 VanDerWaalsContact O-N 3.1Å; P3-A5 PolarHBondContact O-N 3.26Å; A5-I7 VanDerWaalsContact C-N 3.33Å; A5-I7 PolarHBondContact O-N 3.29Å; A5-M8 PolarHBondContact O-N 2.8Å; A5-Y9 VanDerWaalsContact O-CD2 3.28Å; A5-Y9 WeakPolarHBondContact O-CD2 3.34Å; A5-Y9 PolarHBondContact O-N 3.16Å
6V47.5Very low49.4Very low94 Ų94116.3 Ų116.357%0.5760%0.596SS**Hα-helixtrans-62.8-39.7179.6-177.30000111.4P3 A10P3-V6 PolarHBondContact O-N 2.9Å; V6-A10 PolarHBondContact O-N 2.99Å; V6-A10 VanDerWaalsContact O-N 3.14Å
7I55.4Low49.9Very low103 Ų103115.1 Ų115.153%0.52859%0.59SS.*Hα-helixtrans-66.5-39.9177.6-63167000111.5P3 A5 A10 N11P3-I7 WeakPolarHBondContact O-CG1 3.2Å; P3-I7 PolarHBondContact O-N 2.95Å; A5-I7 VanDerWaalsContact C-N 3.33Å; A5-I7 PolarHBondContact O-N 3.29Å; I7-A10 PolarHBondContact O-N 3Å; I7-N11 PolarHBondContact O-N 3.29Å; I7-N11 VanDerWaalsContact O-N 3.08Å; I7-N11 PolarHBondContact O-ND2 2.92Å
8M52Low50.3Low137 Ų137113.5 Ų113.568%0.67559%0.587SS**Hα-helixtrans-64.8-42.1178.6-74.9-159.4-67.100112.5R4 A5 N11 Y12R4-M8 PolarHBondContact O-N 3.35Å; A5-M8 PolarHBondContact O-N 2.8Å; M8-N11 PolarHBondContact O-N 3.34Å; M8-Y12 PolarHBondContact O-N 3.36Å; M8-Y12 VanDerWaalsContact O-N 3.14Å
9Y49.5Very low50.4Low175 Ų175109.8 Ų109.869%0.68658%0.579SS**Hα-helixtrans-65.2-43.1176.9-82.4-78000112.2A5 N11 Y12 E13A5-Y9 VanDerWaalsContact O-CD2 3.28Å; A5-Y9 WeakPolarHBondContact O-CD2 3.34Å; A5-Y9 PolarHBondContact O-N 3.16Å; Y9-N11 VanDerWaalsContact C-N 3.28Å; Y9-N11 PolarHBondContact O-N 3.48Å; Y9-Y12 PolarHBondContact O-N 3.46Å; Y9-E13 PolarHBondContact O-N 3.11Å; Y9-E13 VanDerWaalsContact O-N 3.09Å
10A47Very low50.6Low43 Ų43113.5 Ų113.536%0.35559%0.585SS.*Hα-helixtrans-61.4-36.9177.300000112.5V6 I7 N14V6-A10 PolarHBondContact O-N 2.99Å; V6-A10 VanDerWaalsContact O-N 3.14Å; I7-A10 PolarHBondContact O-N 3Å; A10-N14 WeakPolarHBondContact O-CB 3.29Å; A10-N14 PolarHBondContact O-N 3.42Å; A10-N14 VanDerWaalsContact O-N 3.1Å; A10-N14 PolarHBondContact O-ND2 2.91Å
11N47.9Very low51Low104 Ų104113.2 Ų113.256%0.55658%0.581SS**Hα-helixtrans-70.3-36.3177.1-73-17000112.8I7 M8 Y9 G15I7-N11 PolarHBondContact O-N 3.29Å; I7-N11 VanDerWaalsContact O-N 3.08Å; I7-N11 PolarHBondContact O-ND2 2.92Å; M8-N11 PolarHBondContact O-N 3.34Å; Y9-N11 VanDerWaalsContact C-N 3.28Å; Y9-N11 PolarHBondContact O-N 3.48Å; N11-G15 PolarHBondContact O-N 2.78Å
12Y49.1Very low51.7Low162 Ų162111.5 Ų111.564%0.63556%0.562SS**Hα-helixtrans-69.6-44178.5-170.2-101.9000112M8 Y9 G15 L16M8-Y12 PolarHBondContact O-N 3.36Å; M8-Y12 VanDerWaalsContact O-N 3.14Å; Y9-Y12 PolarHBondContact O-N 3.46Å; Y12-G15 PolarHBondContact O-N 2.97Å; Y12-L16 HydrophobicContact CD1-CD1 3.77Å; Y12-L16 HydrophobicContact CD1-CG 4.42Å; Y12-L16 HydrophobicContact CE1-CD1 3.32Å; Y12-L16 HydrophobicContact CE1-CG 4.09Å; Y12-L16 PolarHBondContact O-N 3.08Å
13E50.2Low52.6Low128 Ų128111.9 Ų111.960%0.59856%0.558SS**Hα-helixtrans-63.5-41.7175.5-74.3-168.516200112Y9 G15 L16 N17Y9-E13 PolarHBondContact O-N 3.11Å; Y9-E13 VanDerWaalsContact O-N 3.09Å; E13-G15 PolarHBondContact O-N 2.75Å; E13-L16 PolarHBondContact O-N 3.25Å; E13-N17 WeakPolarHBondContact O-CB 3.49Å; E13-N17 PolarHBondContact O-N 3.08Å; E13-N17 PolarHBondContact O-ND2 3.39Å
14N55.8Low53Low101 Ų101111.2 Ų111.254%0.5455%0.552SS.*Hα-helixtrans-63-41.5174.8-80-19.3000112A10 N17 V18A10-N14 WeakPolarHBondContact O-CB 3.29Å; A10-N14 PolarHBondContact O-N 3.42Å; A10-N14 VanDerWaalsContact O-N 3.1Å; A10-N14 PolarHBondContact O-ND2 2.91Å; N14-N17 PolarHBondContact O-N 3.3Å; N14-V18 VanDerWaalsContact O-CG2 3.29Å; N14-V18 WeakPolarHBondContact O-CG2 3.21Å; N14-V18 PolarHBondContact O-N 3.47Å
15G45.7Very low53.4Low47 Ų47107.8 Ų107.849%0.48554%0.54SS..Hα-helixtrans-62.1-43.1176.900000113.2N11 Y12 E13 G19N11-G15 PolarHBondContact O-N 2.78Å; Y12-G15 PolarHBondContact O-N 2.97Å; E13-G15 PolarHBondContact O-N 2.75Å; G15-G19 PolarHBondContact O-N 3.18Å; G15-G19 VanDerWaalsContact O-N 3.08Å
16L56.5Low54Low82 Ų82112.3 Ų112.343%0.42955%0.554SS.*Hα-helixtrans-66-39.8177-77.2175.3000112.6Y12 E13 G19 R20Y12-L16 HydrophobicContact CD1-CD1 3.77Å; Y12-L16 HydrophobicContact CD1-CG 4.42Å; Y12-L16 HydrophobicContact CE1-CD1 3.32Å; Y12-L16 HydrophobicContact CE1-CG 4.09Å; Y12-L16 PolarHBondContact O-N 3.08Å; E13-L16 PolarHBondContact O-N 3.25Å; L16-G19 PolarHBondContact O-N 3.46Å; L16-R20 WeakPolarHBondContact O-CG 3.35Å; L16-R20 PolarHBondContact O-N 3.3Å
17N57.7Low54.3Low95 Ų95113.3 Ų113.351%0.50855%0.552SS.*Hα-helixtrans-66.8-41.3178.3-76.2-23.4000111.9E13 N14 G19 R20 E21E13-N17 WeakPolarHBondContact O-CB 3.49Å; E13-N17 PolarHBondContact O-N 3.08Å; E13-N17 PolarHBondContact O-ND2 3.39Å; N14-N17 PolarHBondContact O-N 3.3Å; N17-G19 VanDerWaalsContact C-N 3.33Å; N17-G19 PolarHBondContact O-N 3.31Å; N17-R20 PolarHBondContact O-N 3.12Å; N17-E21 WeakPolarHBondContact O-CB 3.27Å; N17-E21 PolarHBondContact O-N 3.36Å
18V58Low54.4Low87 Ų87114 Ų11453%0.52755%0.553SS.*Hα-helixtrans-63.2-39.6174.7174.40000111.4N14 R22N14-V18 VanDerWaalsContact O-CG2 3.29Å; N14-V18 WeakPolarHBondContact O-CG2 3.21Å; N14-V18 PolarHBondContact O-N 3.47Å; V18-R22 PolarHBondContact O-N 3.13Å; V18-R22 VanDerWaalsContact O-N 3.13Å
19G52Low54.1Low43 Ų43113.5 Ų113.544%0.44355%0.549SS..Hα-helixtrans-64.1-44.417600000113.1G15 L16 N17 R22 F23G15-G19 PolarHBondContact O-N 3.18Å; G15-G19 VanDerWaalsContact O-N 3.08Å; L16-G19 PolarHBondContact O-N 3.46Å; N17-G19 VanDerWaalsContact C-N 3.33Å; N17-G19 PolarHBondContact O-N 3.31Å; G19-R22 PolarHBondContact O-N 3.47Å; G19-F23 PolarHBondContact O-N 2.96Å; G19-F23 VanDerWaalsContact O-N 3.15Å
20R54.6Low54.1Low183 Ų183109 Ų10969%0.69154%0.543SS*.Hα-helixtrans-64.8-42.6177.1-77.8-178.7176.2-176.9-0.3112.3L16 N17 R22 F23 V24L16-R20 WeakPolarHBondContact O-CG 3.35Å; L16-R20 PolarHBondContact O-N 3.3Å; N17-R20 PolarHBondContact O-N 3.12Å; R20-R22 PolarHBondContact O-N 3.25Å; R20-F23 PolarHBondContact O-N 2.81Å; R20-V24 WeakPolarHBondContact O-CG2 3.47Å; R20-V24 PolarHBondContact O-N 3.04Å
21E59.9Low54.1Low109 Ų109113.5 Ų113.551%0.50956%0.557SS.*Hα-helixtrans-66.2-38.3-179.7-153.2-17417100111.8N17 V24 R25N17-E21 WeakPolarHBondContact O-CB 3.27Å; N17-E21 PolarHBondContact O-N 3.36Å; E21-V24 PolarHBondContact O-N 3.39Å; E21-R25 WeakPolarHBondContact O-CG 3.43Å; E21-R25 PolarHBondContact O-N 3.48Å; E21-R25 IonicContact OE1-CZ 3.86Å; E21-R25 IonicContact OE1-NE 3.59Å; E21-R25 IonicContact OE1-NH2 3.85Å; E21-R25 PolarHBondContact OE1-NH2 3.01Å
22R58.8Low53.9Low195 Ų195115 Ų11574%0.73656%0.564SS**Hα-helixtrans-60.1-45.4171.5-88.8-171.6177.6-172.5-0.2112.4V18 G19 R20 R25 Q26V18-R22 PolarHBondContact O-N 3.13Å; V18-R22 VanDerWaalsContact O-N 3.13Å; G19-R22 PolarHBondContact O-N 3.47Å; R20-R22 PolarHBondContact O-N 3.25Å; R22-R25 PolarHBondContact O-N 3.49Å; R22-Q26 WeakPolarHBondContact O-CB 3.44Å; R22-Q26 PolarHBondContact O-N 3.17Å
23F59.5Low53.5Low124 Ų124112.5 Ų112.554%0.54456%0.561SS.*Hα-helixtrans-63-43.1-179.8-175-99.5000112.1G19 R20 Q26 Q27G19-F23 PolarHBondContact O-N 2.96Å; G19-F23 VanDerWaalsContact O-N 3.15Å; R20-F23 PolarHBondContact O-N 2.81Å; F23-Q26 PolarHBondContact O-N 2.89Å; F23-Q27 HydrophobicContact CE1-CG 4.29Å; F23-Q27 HydrophobicContact CZ-CG 4.47Å; F23-Q27 PolarHBondContact O-N 2.97Å
24V62.2Low53.4Low79 Ų79114.6 Ų114.648%0.47957%0.569SS.*Hα-helixtrans-64.7-43.8177.7174.60000111.5R20 E21 Q26 Q27 Q28R20-V24 WeakPolarHBondContact O-CG2 3.47Å; R20-V24 PolarHBondContact O-N 3.04Å; E21-V24 PolarHBondContact O-N 3.39Å; V24-Q26 VanDerWaalsContact C-N 3.32Å; V24-Q26 PolarHBondContact O-N 3.05Å; V24-Q27 PolarHBondContact O-N 3.23Å; V24-Q28 WeakPolarHBondContact O-CG 3.47Å; V24-Q28 PolarHBondContact O-N 2.78Å
25R54.4Low52.7Low132 Ų132114.8 Ų114.850%0.49858%0.578SS.*Hα-helixtrans-63.4-38.4175.2-72.4-173.6-168.1168.86.6112E21 R22 Q27 Q28 H29E21-R25 WeakPolarHBondContact O-CG 3.43Å; E21-R25 PolarHBondContact O-N 3.48Å; E21-R25 IonicContact OE1-CZ 3.86Å; E21-R25 IonicContact OE1-NE 3.59Å; E21-R25 IonicContact OE1-NH2 3.85Å; E21-R25 PolarHBondContact OE1-NH2 3.01Å; R22-R25 PolarHBondContact O-N 3.49Å; R25-Q27 VanDerWaalsContact C-N 3.32Å; R25-Q27 PolarHBondContact O-N 2.75Å; R25-Q28 PolarHBondContact O-N 3.5Å; R25-H29 PolarHBondContact O-CD2 3.25Å; R25-H29 PolarHBondContact O-N 3.46Å
26Q60Low52.4Low135 Ų135119.6 Ų119.663%0.63159%0.586SS**Hα-helixtrans-66.1-35.4179.1-154.1169.328.800111.9R22 F23 V24 S30R22-Q26 WeakPolarHBondContact O-CB 3.44Å; R22-Q26 PolarHBondContact O-N 3.17Å; F23-Q26 PolarHBondContact O-N 2.89Å; V24-Q26 VanDerWaalsContact C-N 3.32Å; V24-Q26 PolarHBondContact O-N 3.05Å; Q26-S30 WeakPolarHBondContact O-CB 3.43Å; Q26-S30 PolarHBondContact O-N 3.03Å; Q26-S30 PolarHBondContact O-OG 3.14Å
27Q54.3Low51.4Low116 Ų116120 Ų12054%0.54260%0.595SS.*Hα-helixtrans-66.7-43.7171.2-72.6-148.3-0.100112.3F23 V24 R25 H29 S30 E31F23-Q27 HydrophobicContact CE1-CG 4.29Å; F23-Q27 HydrophobicContact CZ-CG 4.47Å; F23-Q27 PolarHBondContact O-N 2.97Å; V24-Q27 PolarHBondContact O-N 3.23Å; R25-Q27 VanDerWaalsContact C-N 3.32Å; R25-Q27 PolarHBondContact O-N 2.75Å; Q27-H29 PolarHBondContact O-N 3.22Å; Q27-S30 PolarHBondContact O-N 3.38Å; Q27-E31 PolarHBondContact O-N 3.48Å
28Q57.9Low50.5Low117 Ų117125.9 Ų125.955%0.54761%0.612SS.*Hα-helixtrans-64.4-37.4178.7-71.9178.7-10.800112.9V24 R25 E31V24-Q28 WeakPolarHBondContact O-CG 3.47Å; V24-Q28 PolarHBondContact O-N 2.78Å; R25-Q28 PolarHBondContact O-N 3.5Å; Q28-E31 PolarHBondContact O-N 3.34Å
29H45.1Very low49.6Very low126 Ų126129.4 Ų129.458%0.58362%0.622SS**Hα-helixtrans-74.1-30.2175.3-72.8-64.3000113.1R25 Q27 E31 L32R25-H29 PolarHBondContact O-CD2 3.25Å; R25-H29 PolarHBondContact O-N 3.46Å; Q27-H29 PolarHBondContact O-N 3.22Å; H29-E31 PolarHBondContact O-N 2.93Å; H29-L32 PolarHBondContact O-N 2.87Å
30S49.4Very low48.8Very low81 Ų81134.9 Ų134.957%0.56664%0.641SS**Hα-helixtrans-67.8-20.3175.6-57.80000112.8Q26 Q27Q26-S30 WeakPolarHBondContact O-CB 3.43Å; Q26-S30 PolarHBondContact O-N 3.03Å; Q26-S30 PolarHBondContact O-OG 3.14Å; Q27-S30 PolarHBondContact O-N 3.38Å
31E46.3Very low48Very low138 Ų138130.2 Ų130.265%0.64564%0.642SS**Hα-helixtrans-83-24.2174.1-70.1-173.1163.600113.4Q27 Q28 H29Q27-E31 PolarHBondContact O-N 3.48Å; Q28-E31 PolarHBondContact O-N 3.34Å; H29-E31 PolarHBondContact O-N 2.93Å
32L44.2Very low47Very low134 Ų134130.2 Ų130.270%0.70265%0.651SS**Hα-helixtrans-87.9-14.5-174-79.7168.5000115.4H29 K34H29-L32 PolarHBondContact O-N 2.87Å; L32-K34 VanDerWaalsContact C-N 3.35Å; L32-K34 PolarHBondContact O-N 3.1Å
33D40.6Very low46.1Very low110 Ų110126 Ų12659%0.58866%0.658SS**THydrogen-bonded Turntrans-93.915-179.1-138.32000113.9S35 K36D33-S35 VanDerWaalsContact C-N 3.26Å; D33-S35 PolarHBondContact O-N 3.05Å; D33-K36 IonicContact OD1-NZ 2.73Å
34K48.3Very low45.1Very low173 Ų173125.4 Ų125.475%0.75267%0.665SS**THydrogen-bonded Turntrans-78.50.1178.1-70.4-177.8-178.9173.10114.5L32L32-K34 VanDerWaalsContact C-N 3.35Å; L32-K34 PolarHBondContact O-N 3.1Å
35S42.3Very low44.1Very low105 Ų105125.6 Ų125.673%0.73467%0.669SS**THydrogen-bonded Turntrans-96.94.6-176.9660000115.3D33 S37D33-S35 VanDerWaalsContact C-N 3.26Å; D33-S35 PolarHBondContact O-N 3.05Å; S35-S37 VanDerWaalsContact C-N 3.33Å; S35-S37 PolarHBondContact O-N 3.42Å
36K38.4Very low43.3Very low148 Ų148121.5 Ų121.564%0.64367%0.668SS**SBendtrans-77.690.2169.7-78177.3-175.51570110D33 Y38D33-K36 IonicContact OD1-NZ 2.73Å; K36-Y38 WeakPolarHBondContact O-CD2 3.31Å; K36-Y38 PolarHBondContact O-N 3.33Å
37S36.6Very low42.7Very low89 Ų89121 Ų12162%0.62267%0.669SS**  trans-30.6112.3164.5177.10000112.9S35 H39S35-S37 VanDerWaalsContact C-N 3.33Å; S35-S37 PolarHBondContact O-N 3.42Å; S37-H39 PolarHBondContact O-N 3.31Å
38Y38.2Very low42.4Very low219 Ų219118.4 Ų118.486%0.85967%0.667SS**THydrogen-bonded Turntrans-83.939.4173.3-85.4-87.8000112.3K36K36-Y38 WeakPolarHBondContact O-CD2 3.31Å; K36-Y38 PolarHBondContact O-N 3.33Å
39H38.3Very low42Very low162 Ų162117.7 Ų117.775%0.7567%0.667SS**THydrogen-bonded Turntrans-101-7.4-178.5-78.3-55.2000116.5S37S37-H39 PolarHBondContact O-N 3.31Å
40D36.1Very low42.2Very low157 Ų157118.1 Ų118.184%0.8467%0.669SS**  trans-129.340.7-177-70.6-39.3000114.5P42D40-P42 VanDerWaalsContact O-CD 3.27Å; D40-P42 WeakPolarHBondContact O-CD 3.44Å
41A37.6Very low42.3Very low86 Ų86121.1 Ų121.171%0.71167%0.674SS**  trans-91.8107.5165.900000109.3
42P37.7Very low42.7Very low108 Ų108120.2 Ų120.270%0.70167%0.67SS**  trans-60.5141.2175.623.7-31.5000109.8D40 V44D40-P42 VanDerWaalsContact O-CD 3.27Å; D40-P42 WeakPolarHBondContact O-CD 3.44Å; P42-V44 VanDerWaalsContact C-N 3.28Å; P42-V44 PolarHBondContact O-N 3.19Å
43A41.5Very low43.1Very low107 Ų107117.7 Ų117.788%0.88466%0.663SS**  trans-61.186.1178.100000110.6S45A43-S45 PolarHBondContact O-N 3.49Å
44V37.3Very low43.6Very low112 Ų112117.1 Ų117.168%0.67966%0.66SS**  trans-68.4115.6172-177.90000106.9P42 G46P42-V44 VanDerWaalsContact C-N 3.28Å; P42-V44 PolarHBondContact O-N 3.19Å; V44-G46 PolarHBondContact O-N 3.13Å
45S40.8Very low43.9Very low83 Ų83115.9 Ų115.958%0.5865%0.654SS**  trans-57.1121.9-176.965.10000110.8A43 I47A43-S45 PolarHBondContact O-N 3.49Å; S45-I47 PolarHBondContact O-N 3.45Å
46G39Very low44.4Very low46 Ų46114.8 Ų114.847%0.47464%0.64SS.*THydrogen-bonded Turntrans-63.715.7-172.600000117.5V44 Q50V44-G46 PolarHBondContact O-N 3.13Å; G46-Q50 PolarHBondContact O-N 3.21Å
47I45.9Very low44.8Very low124 Ų124113.4 Ų113.464%0.63664%0.636SS**Hα-helixtrans-74.6-35.3176.5-56.9176.6000110.7S45S45-I47 PolarHBondContact O-N 3.45Å
48A48.5Very low45.1Very low62 Ų62112.2 Ų112.251%0.51263%0.628SS.*Hα-helixtrans-69.4-42.3178.400000112.1Q50 Q51 Q52A48-Q50 VanDerWaalsContact C-N 3.31Å; A48-Q50 PolarHBondContact O-N 3.42Å; A48-Q51 PolarHBondContact O-N 2.96Å; A48-Q52 PolarHBondContact O-N 3.06Å
49D49.1Very low45.6Very low101 Ų101106.5 Ų106.554%0.5461%0.612SS.*Hα-helixtrans-66.5-32.9-178.4-69.2-27.3000112.6Q52 C53D49-Q52 PolarHBondContact O-N 3.19Å; D49-C53 PolarHBondContact O-N 3.37Å
50Q49.9Very low46.1Very low135 Ų135108.2 Ų108.263%0.63161%0.612SS**Hα-helixtrans-73.1-34.9179.3-162.2148.82100112.6G46 A48 Q52 N54G46-Q50 PolarHBondContact O-N 3.21Å; A48-Q50 VanDerWaalsContact C-N 3.31Å; A48-Q50 PolarHBondContact O-N 3.42Å; Q50-Q52 VanDerWaalsContact C-N 3.35Å; Q50-N54 PolarHBondContact O-N 2.95Å; Q50-N54 VanDerWaalsContact O-N 3.14Å; Q50-N54 PolarHBondContact O-ND2 3.26Å
51Q51.9Low46.7Very low144 Ų144107.6 Ų107.667%0.67360%0.602SS**Hα-helixtrans-67-36.9172.2-71.4-1701.900111.9A48 N54 K55A48-Q51 PolarHBondContact O-N 2.96Å; Q51-N54 PolarHBondContact O-N 3.38Å; Q51-K55 PolarHBondContact O-N 3.34Å; Q51-K55 VanDerWaalsContact O-N 3.11Å
52Q54.4Low47.3Very low120 Ų120106.6 Ų106.656%0.56159%0.593SS**Hα-helixtrans-70.5-37.3177.3-167156.6-14.900112.3A48 D49 Q50 K55 N56A48-Q52 PolarHBondContact O-N 3.06Å; D49-Q52 PolarHBondContact O-N 3.19Å; Q50-Q52 VanDerWaalsContact C-N 3.35Å; Q52-K55 PolarHBondContact O-N 3.49Å; Q52-N56 WeakPolarHBondContact O-CB 3.37Å; Q52-N56 VanDerWaalsContact O-CG 3.27Å; Q52-N56 PolarHBondContact O-N 3.22Å; Q52-N56 PolarHBondContact O-ND2 3.39Å
53C51.9Low48Very low81 Ų81105.2 Ų105.255%0.54759%0.587SS.*Hα-helixtrans-60.5-45.8171.9-81.50000112.4D49 K55 N56 Q57D49-C53 PolarHBondContact O-N 3.37Å; C53-K55 VanDerWaalsContact C-N 3.31Å; C53-K55 PolarHBondContact O-N 2.96Å; C53-N56 PolarHBondContact O-N 3.35Å; C53-Q57 PolarHBondContact O-N 2.9Å
54N52.4Low48.1Very low98 Ų98102.5 Ų102.552%0.52456%0.564SS.*Hα-helixtrans-63.3-37.9178.7-72.9-17.9000112.1Q50 Q51 Q57 S58Q50-N54 PolarHBondContact O-N 2.95Å; Q50-N54 VanDerWaalsContact O-N 3.14Å; Q50-N54 PolarHBondContact O-ND2 3.26Å; Q51-N54 PolarHBondContact O-N 3.38Å; N54-Q57 PolarHBondContact O-N 3.47Å; N54-S58 PolarHBondContact O-N 3.18Å
55K54.6Low48.4Very low146 Ų146102.6 Ų102.664%0.63556%0.561SS**Hα-helixtrans-69.5-34.4176.1-159.3174.3-175.7179.20112.7Q51 Q52 C53 S58 N59Q51-K55 PolarHBondContact O-N 3.34Å; Q51-K55 VanDerWaalsContact O-N 3.11Å; Q52-K55 PolarHBondContact O-N 3.49Å; C53-K55 VanDerWaalsContact C-N 3.31Å; C53-K55 PolarHBondContact O-N 2.96Å; K55-S58 PolarHBondContact O-OG 3.21Å; K55-N59 PolarHBondContact O-N 2.87Å
56N51.8Low48.3Very low82 Ų82100.4 Ų100.444%0.43955%0.551SS.*Hα-helixtrans-72-34.1175.2-72.3-21.1000112.1Q52 C53 N59 R60Q52-N56 WeakPolarHBondContact O-CB 3.37Å; Q52-N56 VanDerWaalsContact O-CG 3.27Å; Q52-N56 PolarHBondContact O-N 3.22Å; Q52-N56 PolarHBondContact O-ND2 3.39Å; C53-N56 PolarHBondContact O-N 3.35Å; N56-N59 PolarHBondContact O-N 3.21Å; N56-R60 WeakPolarHBondContact O-CG 3.28Å; N56-R60 PolarHBondContact O-N 3.28Å
57Q48.2Very low48.5Very low119 Ų119106.6 Ų106.656%0.55656%0.56SS**Hα-helixtrans-69.8-37.2177.5-152.2-177.827.400112.2C53 N54 R60 K61C53-Q57 PolarHBondContact O-N 2.9Å; N54-Q57 PolarHBondContact O-N 3.47Å; Q57-R60 PolarHBondContact O-N 3.15Å; Q57-K61 PolarHBondContact O-N 3.25Å
58S43Very low48.5Very low65 Ų65105.8 Ų105.846%0.45556%0.556SS.*Hα-helixtrans-66.2-40.4174.362.10000112.2N54 K55 R60 K61 A62N54-S58 PolarHBondContact O-N 3.18Å; K55-S58 PolarHBondContact O-OG 3.21Å; S58-R60 PolarHBondContact O-N 3.4Å; S58-K61 PolarHBondContact O-N 3.49Å; S58-A62 PolarHBondContact O-N 3.11Å; S58-A62 VanDerWaalsContact O-N 3.15Å
59N48.2Very low48.3Very low99 Ų99112.6 Ų112.653%0.52957%0.568SS.*Hα-helixtrans-64-37.3174.4-74.8-14.1000112.8K55 N56 A62 S63K55-N59 PolarHBondContact O-N 2.87Å; N56-N59 PolarHBondContact O-N 3.21Å; N59-A62 PolarHBondContact O-N 3.15Å; N59-S63 WeakPolarHBondContact O-CB 3.49Å; N59-S63 PolarHBondContact O-N 2.83Å
60R49Very low48Very low197 Ų197114.5 Ų114.574%0.74357%0.574SS**Hα-helixtrans-64.4-40.5175.6-76.6-176.8-174.8-173.82.7112.5N56 Q57 S58 S63 A64N56-R60 WeakPolarHBondContact O-CG 3.28Å; N56-R60 PolarHBondContact O-N 3.28Å; Q57-R60 PolarHBondContact O-N 3.15Å; S58-R60 PolarHBondContact O-N 3.4Å; R60-S63 PolarHBondContact O-N 3.38Å; R60-A64 PolarHBondContact O-N 3.46Å
61K48.2Very low47.7Very low145 Ų145116.4 Ų116.463%0.6358%0.575SS**Hα-helixtrans-66.1-39176.3-73-175.3178.8-179.80112.2Q57 S58 N65Q57-K61 PolarHBondContact O-N 3.25Å; S58-K61 PolarHBondContact O-N 3.49Å; K61-N65 PolarHBondContact O-N 3.48Å
62A49.1Very low47.2Very low64 Ų64112.6 Ų112.653%0.52957%0.565SS.*Hα-helixtrans-66.2-41.6175.400000112.3S58 N59 N65 G66S58-A62 PolarHBondContact O-N 3.11Å; S58-A62 VanDerWaalsContact O-N 3.15Å; N59-A62 PolarHBondContact O-N 3.15Å; A62-N65 PolarHBondContact O-N 3.28Å; A62-G66 PolarHBondContact O-N 3.44Å; A62-G66 VanDerWaalsContact O-N 3.08Å
63S53.1Low46.6Very low80 Ų80110.1 Ų110.156%0.55956%0.561SS**Hα-helixtrans-65.2-41.4177.5179.60000112.7N59 R60 N65 G66 R67N59-S63 WeakPolarHBondContact O-CB 3.49Å; N59-S63 PolarHBondContact O-N 2.83Å; R60-S63 PolarHBondContact O-N 3.38Å; S63-N65 PolarHBondContact O-N 3.16Å; S63-G66 PolarHBondContact O-N 3.2Å; S63-R67 WeakPolarHBondContact O-CB 3.46Å; S63-R67 PolarHBondContact O-N 2.91Å
64A44Very low46.1Very low49 Ų49109.3 Ų109.341%0.40556%0.56SS.*Hα-helixtrans-62-42.8176.700000112.2R60 G66 R67 I68R60-A64 PolarHBondContact O-N 3.46Å; A64-G66 VanDerWaalsContact C-N 3.35Å; A64-G66 PolarHBondContact O-N 2.97Å; A64-R67 PolarHBondContact O-N 3.1Å; A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 3.37Å
65N43.3Very low45.6Very low115 Ų115109.6 Ų109.662%0.61556%0.56SS**Hα-helixtrans-66.9-34.6176.4-73.7-14.6000112.6K61 A62 S63 R69K61-N65 PolarHBondContact O-N 3.48Å; A62-N65 PolarHBondContact O-N 3.28Å; S63-N65 PolarHBondContact O-N 3.16Å; N65-R69 PolarHBondContact O-N 3.01Å
66G39.5Very low44.8Very low37 Ų37109.9 Ų109.938%0.38156%0.561SS.*Hα-helixtrans-63.4-44.1171.800000112.5A62 S63 A64 I68 R69 E70A62-G66 PolarHBondContact O-N 3.44Å; A62-G66 VanDerWaalsContact O-N 3.08Å; S63-G66 PolarHBondContact O-N 3.2Å; A64-G66 VanDerWaalsContact C-N 3.35Å; A64-G66 PolarHBondContact O-N 2.97Å; G66-I68 PolarHBondContact O-N 3.27Å; G66-R69 WeakPolarHBondContact O-CB 3.13Å; G66-R69 PolarHBondContact O-N 3.42Å; G66-R69 VanDerWaalsContact O-N 3.12Å; G66-E70 PolarHBondContact O-N 3.26Å; G66-E70 VanDerWaalsContact O-N 3.16Å
67R43.6Very low44.5Very low176 Ų176110.3 Ų110.366%0.66457%0.567SS**Hα-helixtrans-69.1-33-178.7-155.5173.5-171.1170.40.6113.1S63 A64 R69 R71S63-R67 WeakPolarHBondContact O-CB 3.46Å; S63-R67 PolarHBondContact O-N 2.91Å; A64-R67 PolarHBondContact O-N 3.1Å; R67-R69 VanDerWaalsContact C-N 3.32Å; R67-R71 PolarHBondContact O-N 3.03Å; R67-R71 VanDerWaalsContact O-N 3.1Å
68I46Very low44.5Very low107 Ų107112.5 Ų112.555%0.54957%0.574SS.*Hα-helixtrans-64.6-40.1171.3-66.5164000110.1A64 G66 E70 R71 S72A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 3.37Å; G66-I68 PolarHBondContact O-N 3.27Å; I68-E70 PolarHBondContact O-N 3.01Å; I68-R71 PolarHBondContact O-N 3.44Å; I68-S72 PolarHBondContact O-N 2.96Å; I68-S72 PolarHBondContact O-OG 3.23Å; I68-S72 VanDerWaalsContact O-OG 3.05Å
69R42.9Very low44.4Very low204 Ų204113.7 Ų113.777%0.7758%0.576SS**Hα-helixtrans-62.7-41.3178.7-153.6176.1-172.5-176.31.3112N65 G66 R67 S72 S73N65-R69 PolarHBondContact O-N 3.01Å; G66-R69 WeakPolarHBondContact O-CB 3.13Å; G66-R69 PolarHBondContact O-N 3.42Å; G66-R69 VanDerWaalsContact O-N 3.12Å; R67-R69 VanDerWaalsContact C-N 3.32Å; R69-S72 WeakPolarHBondContact CA-OG 3.5Å; R69-S72 PolarHBondContact O-N 3.48Å; R69-S72 PolarHBondContact O-OG 3.48Å; R69-S73 PolarHBondContact O-N 3.25Å; R69-S73 PolarHBondContact O-OG 3.12Å
70E43.9Very low44Very low141 Ų141114.5 Ų114.566%0.65958%0.58SS**Hα-helixtrans-66.3-37.9174.4-71.9-177.1172.900113G66 I68 S72 S73 A74G66-E70 PolarHBondContact O-N 3.26Å; G66-E70 VanDerWaalsContact O-N 3.16Å; I68-E70 PolarHBondContact O-N 3.01Å; E70-S72 PolarHBondContact O-N 3.01Å; E70-S73 WeakPolarHBondContact CA-OG 3.38Å; E70-S73 PolarHBondContact O-N 3.08Å; E70-S73 PolarHBondContact O-OG 3.22Å; E70-A74 PolarHBondContact O-N 3.45Å; E70-A74 VanDerWaalsContact O-N 3.17Å
71R42Very low43.9Very low175 Ų175109.4 Ų109.466%0.6657%0.571SS**Hα-helixtrans-63.7-39.6175.1-80.1-176.8163.8-173.5-4.3112.3R67 I68 S73 A74 I75R67-R71 PolarHBondContact O-N 3.03Å; R67-R71 VanDerWaalsContact O-N 3.1Å; I68-R71 PolarHBondContact O-N 3.44Å; R71-S73 VanDerWaalsContact C-N 3.29Å; R71-S73 PolarHBondContact O-N 3.05Å; R71-A74 PolarHBondContact O-N 3.05Å; R71-A74 VanDerWaalsContact O-N 3.16Å; R71-I75 WeakPolarHBondContact O-CG1 3.4Å; R71-I75 PolarHBondContact O-N 3.28Å
72S42.7Very low43.8Very low65 Ų65106.1 Ų106.146%0.45557%0.571SS.*Hα-helixtrans-65.5-28.4175.933.80000113.8I68 R69 E70 K76I68-S72 PolarHBondContact O-N 2.96Å; I68-S72 PolarHBondContact O-OG 3.23Å; I68-S72 VanDerWaalsContact O-OG 3.05Å; R69-S72 WeakPolarHBondContact CA-OG 3.5Å; R69-S72 PolarHBondContact O-N 3.48Å; R69-S72 PolarHBondContact O-OG 3.48Å; E70-S72 PolarHBondContact O-N 3.01Å; S72-K76 PolarHBondContact O-N 2.98Å
73S42Very low43.5Very low68 Ų68108.5 Ų108.548%0.47658%0.575SS.*Hα-helixtrans-72.1-37.2169.831.20000112.9R69 E70 R71 K76 V77R69-S73 PolarHBondContact O-N 3.25Å; R69-S73 PolarHBondContact O-OG 3.12Å; E70-S73 WeakPolarHBondContact CA-OG 3.38Å; E70-S73 PolarHBondContact O-N 3.08Å; E70-S73 PolarHBondContact O-OG 3.22Å; R71-S73 VanDerWaalsContact C-N 3.29Å; R71-S73 PolarHBondContact O-N 3.05Å; S73-K76 PolarHBondContact O-N 3.4Å; S73-V77 PolarHBondContact O-N 2.97Å
74A40.3Very low42.8Very low63 Ų63106.2 Ų106.252%0.52156%0.563SS.*Hα-helixtrans-68.9-34.9177.900000112.7E70 R71 K76 V77 K78E70-A74 PolarHBondContact O-N 3.45Å; E70-A74 VanDerWaalsContact O-N 3.17Å; R71-A74 PolarHBondContact O-N 3.05Å; R71-A74 VanDerWaalsContact O-N 3.16Å; A74-K76 VanDerWaalsContact C-N 3.33Å; A74-K76 PolarHBondContact O-N 3.47Å; A74-V77 WeakPolarHBondContact O-CB 3.45Å; A74-V77 PolarHBondContact O-N 3.44Å; A74-V77 VanDerWaalsContact O-N 3.14Å; A74-K78 PolarHBondContact O-N 3.05Å
75I42Very low42.7Very low105 Ų105111.9 Ų111.954%0.53858%0.575SS.*Hα-helixtrans-64.6-38.1175.4-65.2165.3000110.9R71 V77 K78 D79R71-I75 WeakPolarHBondContact O-CG1 3.4Å; R71-I75 PolarHBondContact O-N 3.28Å; I75-V77 PolarHBondContact O-N 2.96Å; I75-K78 WeakPolarHBondContact O-CB 3.5Å; I75-K78 PolarHBondContact O-N 3.34Å; I75-D79 PolarHBondContact O-N 3.48Å; I75-D79 VanDerWaalsContact O-N 3.08Å
76K37.4Very low43.1Very low151 Ų151110.3 Ų110.366%0.65758%0.578SS**Hα-helixtrans-60.4-31.5172.8-89.5-173.2174.9-176.10113.5S72 S73 A74 N80S72-K76 PolarHBondContact O-N 2.98Å; S73-K76 PolarHBondContact O-N 3.4Å; A74-K76 VanDerWaalsContact C-N 3.33Å; A74-K76 PolarHBondContact O-N 3.47Å; K76-N80 WeakPolarHBondContact O-CB 3.48Å; K76-N80 PolarHBondContact O-N 3.33Å
77V45.8Very low43.5Very low91 Ų91112.5 Ų112.555%0.55258%0.584SS**Hα-helixtrans-69.5-37.6175.1-177.90000110.4S73 A74 I75 N80 V81S73-V77 PolarHBondContact O-N 2.97Å; A74-V77 WeakPolarHBondContact O-CB 3.45Å; A74-V77 PolarHBondContact O-N 3.44Å; A74-V77 VanDerWaalsContact O-N 3.14Å; I75-V77 PolarHBondContact O-N 2.96Å; V77-N80 PolarHBondContact O-N 2.87Å; V77-V81 HydrophobicContact CG1-CG2 4.22Å; V77-V81 WeakPolarHBondContact O-CB 3.35Å; V77-V81 VanDerWaalsContact O-CG2 3.23Å; V77-V81 WeakPolarHBondContact O-CG2 3.48Å; V77-V81 PolarHBondContact O-N 2.9Å
78K48Very low44.4Very low165 Ų165109.4 Ų109.472%0.71758%0.578SS**Hα-helixtrans-65.1-41.4176.4-162.6175-179.2179.20112A74 I75 V81 A82A74-K78 PolarHBondContact O-N 3.05Å; I75-K78 WeakPolarHBondContact O-CB 3.5Å; I75-K78 PolarHBondContact O-N 3.34Å; K78-V81 PolarHBondContact O-N 2.98Å; K78-A82 PolarHBondContact O-N 3.33Å
79D41.7Very low45.1Very low91 Ų91110.4 Ų110.449%0.48758%0.584SS.*Hα-helixtrans-68.2-35.6176.4-67.2-21000112.1I75 N83I75-D79 PolarHBondContact O-N 3.48Å; I75-D79 VanDerWaalsContact O-N 3.08Å; D79-N83 WeakPolarHBondContact O-CB 3.41Å; D79-N83 PolarHBondContact O-N 3.19Å; D79-N83 VanDerWaalsContact O-N 3.07Å
80N40.4Very low46Very low116 Ų116101.8 Ų101.862%0.6256%0.555SS**Hα-helixtrans-74.1-26.1174.1-77.4-7.5000113.3K76 V77 G84K76-N80 WeakPolarHBondContact O-CB 3.48Å; K76-N80 PolarHBondContact O-N 3.33Å; V77-N80 PolarHBondContact O-N 2.87Å; N80-G84 WeakPolarHBondContact O-CA 3.22Å; N80-G84 PolarHBondContact O-N 3.1Å
81V45.1Very low46.6Very low89 Ų89100.8 Ų100.854%0.53955%0.545SS..Hα-helixtrans-78.5-36.4174.9171.20000110.8V77 K78V77-V81 HydrophobicContact CG1-CG2 4.22Å; V77-V81 WeakPolarHBondContact O-CB 3.35Å; V77-V81 VanDerWaalsContact O-CG2 3.23Å; V77-V81 WeakPolarHBondContact O-CG2 3.48Å; V77-V81 PolarHBondContact O-N 2.9Å; K78-V81 PolarHBondContact O-N 2.98Å
82A46.5Very low47.5Very low76 Ų7696 Ų9663%0.62853%0.53SS*.Hα-helixtrans-68.7-36.8174.900000112.5K78K78-A82 PolarHBondContact O-N 3.33Å
83N42.9Very low48.5Very low115 Ų11599.4 Ų99.462%0.61554%0.539SS*.Hα-helixtrans-97.2-15.3179.2-69.3-27.8000114.3D79 Y85 A86D79-N83 WeakPolarHBondContact O-CB 3.41Å; D79-N83 PolarHBondContact O-N 3.19Å; D79-N83 VanDerWaalsContact O-N 3.07Å; N83-Y85 PolarHBondContact O-N 3.38Å; N83-A86 WeakPolarHBondContact O-CB 3.41Å; N83-A86 PolarHBondContact O-N 3.42Å
84G38.3Very low49Very low31 Ų3198.8 Ų98.832%0.3253%0.532SS..THydrogen-bonded Turntrans-79.10.6-176.400000114.7N80 S90N80-G84 WeakPolarHBondContact O-CA 3.22Å; N80-G84 PolarHBondContact O-N 3.1Å; G84-S90 WeakPolarHBondContact O-CB 3.46Å; G84-S90 PolarHBondContact O-OG 3.5Å
85Y42.6Very low49.7Very low169 Ų16997.7 Ų97.766%0.66352%0.516SS*.THydrogen-bonded Turntrans-96.6-0.6163.1-78-80.5000112.6N83N83-Y85 PolarHBondContact O-N 3.38Å
86A52.4Low50.3Low81 Ų81102.4 Ų102.467%0.66953%0.527SS*.SBendtrans-84.5-12.5-173.200000114.4N83N83-A86 WeakPolarHBondContact O-CB 3.41Å; N83-A86 PolarHBondContact O-N 3.42Å
87T47.3Very low51Low84 Ų84102.9 Ų102.952%0.51553%0.532SS..SBendtrans-120.1132.6-178.662.90000112.3N89 S90 R91T87-N89 PolarHBondContact O-N 3.09Å; T87-S90 PolarHBondContact O-N 3.44Å; T87-S90 PolarHBondContact O-OG 3.25Å; T87-S90 PolarHBondContact OG1-OG 3.36Å; T87-R91 PolarHBondContact O-N 3.47Å
88E62.3Low51.4Low111 Ų111105.8 Ų105.852%0.51954%0.537SS..Hα-helixtrans-50.3-33.6-179.5-172.662-157.100112.9R91 Q92E88-R91 PolarHBondContact O-N 3.19Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.49Å
89N61.5Low50.8Low127 Ų127100.7 Ų100.768%0.67953%0.531SS*.Hα-helixtrans-62.7-45.3176.5-71.5-9.9000112.8T87 R91 Q92 E93T87-N89 PolarHBondContact O-N 3.09Å; N89-R91 VanDerWaalsContact C-N 3.3Å; N89-R91 PolarHBondContact O-N 3.01Å; N89-Q92 PolarHBondContact O-N 2.97Å; N89-E93 PolarHBondContact O-N 3.16Å
90S60.8Low50.8Low23 Ų23104.6 Ų104.616%0.16154%0.541CS..Hα-helixtrans-65.4-35.5178.156.20000112.2G84 T87 E93 V94G84-S90 WeakPolarHBondContact O-CB 3.46Å; G84-S90 PolarHBondContact O-OG 3.5Å; T87-S90 PolarHBondContact O-N 3.44Å; T87-S90 PolarHBondContact O-OG 3.25Å; T87-S90 PolarHBondContact OG1-OG 3.36Å; S90-E93 PolarHBondContact O-N 2.73Å; S90-V94 WeakPolarHBondContact O-CG2 3.23Å; S90-V94 PolarHBondContact O-N 3.02Å; S90-V94 VanDerWaalsContact O-N 3.09Å
91R57.4Low50.8Low121 Ų121103.6 Ų103.646%0.45754%0.542SS..Hα-helixtrans-64.8-45173.9-171.7-170.4142158.9-2.6111.5T87 E88 N89 E93 V94 E95T87-R91 PolarHBondContact O-N 3.47Å; E88-R91 PolarHBondContact O-N 3.19Å; N89-R91 VanDerWaalsContact C-N 3.3Å; N89-R91 PolarHBondContact O-N 3.01Å; R91-E93 VanDerWaalsContact C-N 3.32Å; R91-E93 PolarHBondContact O-N 3.38Å; R91-V94 PolarHBondContact O-N 3.49Å; R91-E95 IonicContact CZ-OE1 3.19Å; R91-E95 IonicContact NE-OE1 2.77Å; R91-E95 PolarHBondContact NE-OE1 3.49Å; R91-E95 IonicContact NH2-OE1 2.77Å; R91-E95 PolarHBondContact NH2-OE1 3.42Å; R91-E95 WeakPolarHBondContact O-CB 3.48Å; R91-E95 WeakPolarHBondContact O-CG 3.38Å; R91-E95 PolarHBondContact O-N 3.26Å
92Q60.7Low50.4Low75 Ų75107 Ų10735%0.3555%0.553SS.*Hα-helixtrans-65.9-33.5177.3-72.2-179.817.700112.8E88 N89 E95 R96E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.49Å; N89-Q92 PolarHBondContact O-N 2.97Å; Q92-E95 PolarHBondContact O-N 3.4Å; Q92-R96 WeakPolarHBondContact O-CB 3.47Å; Q92-R96 VanDerWaalsContact O-CG 3.31Å; Q92-R96 WeakPolarHBondContact O-CG 3.38Å; Q92-R96 PolarHBondContact O-N 3.03Å
93E62.7Low50Low135 Ų135108.3 Ų108.363%0.63156%0.557SS**Hα-helixtrans-66.7-43.8176.1-167.8166.6-164.400111.2N89 S90 R91 R96 H97N89-E93 PolarHBondContact O-N 3.16Å; S90-E93 PolarHBondContact O-N 2.73Å; R91-E93 VanDerWaalsContact C-N 3.32Å; R91-E93 PolarHBondContact O-N 3.38Å; E93-R96 PolarHBondContact O-N 3.1Å; E93-H97 WeakPolarHBondContact O-CB 3.48Å; E93-H97 PolarHBondContact O-N 3.37Å
94V53.8Low49.5Very low56 Ų56114.1 Ų114.134%0.33957%0.57SS.*Hα-helixtrans-62.8-47.4172.2172.60000111S90 R91 R96 H97 F98S90-V94 WeakPolarHBondContact O-CG2 3.23Å; S90-V94 PolarHBondContact O-N 3.02Å; S90-V94 VanDerWaalsContact O-N 3.09Å; R91-V94 PolarHBondContact O-N 3.49Å; V94-R96 VanDerWaalsContact C-N 3.32Å; V94-R96 PolarHBondContact O-N 3.17Å; V94-H97 WeakPolarHBondContact O-CB 3.46Å; V94-H97 PolarHBondContact O-N 2.69Å; V94-F98 HydrophobicContact CG1-CD2 3.53Å; V94-F98 HydrophobicContact CG1-CE2 3.69Å; V94-F98 VanDerWaalsContact O-CD2 3.24Å; V94-F98 WeakPolarHBondContact O-CD2 3.42Å; V94-F98 PolarHBondContact O-N 3.16Å
95E54.8Low49.2Very low39 Ų39124.4 Ų124.418%0.18260%0.599CS.*Hα-helixtrans-61-37.4178.1-76.5179.1-176.200112.8R91 Q92 G99 Y100R91-E95 IonicContact CZ-OE1 3.19Å; R91-E95 IonicContact NE-OE1 2.77Å; R91-E95 PolarHBondContact NE-OE1 3.49Å; R91-E95 IonicContact NH2-OE1 2.77Å; R91-E95 PolarHBondContact NH2-OE1 3.42Å; R91-E95 WeakPolarHBondContact O-CB 3.48Å; R91-E95 WeakPolarHBondContact O-CG 3.38Å; R91-E95 PolarHBondContact O-N 3.26Å; Q92-E95 PolarHBondContact O-N 3.4Å; E95-G99 PolarHBondContact O-N 2.81Å; E95-G99 VanDerWaalsContact O-N 3.15Å; E95-Y100 PolarHBondContact O-N 3.38Å
96R54.7Low48.9Very low204 Ų204127.4 Ų127.477%0.7761%0.609SS**Hα-helixtrans-65.1-41.8171-76.5-177.8-158.3-171.88.3111.6Q92 E93 V94 F98 G99Q92-R96 WeakPolarHBondContact O-CB 3.47Å; Q92-R96 VanDerWaalsContact O-CG 3.31Å; Q92-R96 WeakPolarHBondContact O-CG 3.38Å; Q92-R96 PolarHBondContact O-N 3.03Å; E93-R96 PolarHBondContact O-N 3.1Å; V94-R96 VanDerWaalsContact C-N 3.32Å; V94-R96 PolarHBondContact O-N 3.17Å; R96-F98 VanDerWaalsContact C-N 3.35Å; R96-G99 PolarHBondContact O-N 3.38Å
97H50.5Low48.1Very low162 Ų162131 Ų13175%0.7562%0.617SS**Hα-helixtrans-66.5-35.9-179.3-126.4-53.4000112.9E93 V94E93-H97 WeakPolarHBondContact O-CB 3.48Å; E93-H97 PolarHBondContact O-N 3.37Å; V94-H97 WeakPolarHBondContact O-CB 3.46Å; V94-H97 PolarHBondContact O-N 2.69Å
98F54.6Low47.7Very low152 Ų152131 Ų13167%0.66763%0.634SS**THydrogen-bonded Turntrans-903178.3-74.2-75.5000113.9V94 R96 Y100V94-F98 HydrophobicContact CG1-CD2 3.53Å; V94-F98 HydrophobicContact CG1-CE2 3.69Å; V94-F98 VanDerWaalsContact O-CD2 3.24Å; V94-F98 WeakPolarHBondContact O-CD2 3.42Å; V94-F98 PolarHBondContact O-N 3.16Å; R96-F98 VanDerWaalsContact C-N 3.35Å; F98-Y100 VanDerWaalsContact C-N 3.26Å; F98-Y100 HydrophobicContact CB-CD2 3.83Å; F98-Y100 HydrophobicContact CB-CE2 3.87Å; F98-Y100 PolarHBondContact O-N 3.23Å
99G36.5Very low46.4Very low58 Ų58132.1 Ų132.160%0.59865%0.648SS**THydrogen-bonded Turntrans6821.6174.400000114.5E95 R96 S101E95-G99 PolarHBondContact O-N 2.81Å; E95-G99 VanDerWaalsContact O-N 3.15Å; R96-G99 PolarHBondContact O-N 3.38Å; G99-S101 PolarHBondContact O-N 2.95Å
100Y41.6Very low45.3Very low173 Ų173135.3 Ų135.368%0.67866%0.656SS**  trans-71.274.5168-70.1-70.6000108.6E95 F98 Q102E95-Y100 PolarHBondContact O-N 3.38Å; F98-Y100 VanDerWaalsContact C-N 3.26Å; F98-Y100 HydrophobicContact CB-CD2 3.83Å; F98-Y100 HydrophobicContact CB-CE2 3.87Å; F98-Y100 PolarHBondContact O-N 3.23Å; Y100-Q102 PolarHBondContact O-N 3.24Å; Y100-Q102 VanDerWaalsContact O-N 3.1Å
101S40.2Very low44.3Very low94 Ų94142.2 Ų142.266%0.65769%0.686SS**  trans-63116.416794.40000105.9G99 S103G99-S101 PolarHBondContact O-N 2.95Å; S101-S103 PolarHBondContact O-N 3.07Å
102Q36.4Very low43.5Very low162 Ų162143.2 Ų143.276%0.75771%0.706SS**  trans-63.587.6162.1-69.4-164.99.200106.5Y100 R104Y100-Q102 PolarHBondContact O-N 3.24Å; Y100-Q102 VanDerWaalsContact O-N 3.1Å; Q102-R104 VanDerWaalsContact C-N 3.32Å; Q102-R104 PolarHBondContact O-N 3.34Å
103S38.8Very low42.5Very low102 Ų102144.8 Ų144.871%0.71372%0.72SS**  trans-65100.5176.965.30000106.7S101 R105S101-S103 PolarHBondContact O-N 3.07Å; S103-R105 PolarHBondContact O-N 3.44Å
104R32.5Very low41.5Very low238 Ų238142.7 Ų142.790%0.89873%0.726SS**  trans-52.9108.5172.4-90.8-179.3168.3-177-2.8108.4Q102 R106Q102-R104 VanDerWaalsContact C-N 3.32Å; Q102-R104 PolarHBondContact O-N 3.34Å; R104-R106 PolarHBondContact O-N 3.45Å; R104-R106 VanDerWaalsContact O-N 3.1Å
105R32.1Very low40.6Very low246 Ų246143.2 Ų143.293%0.92873%0.732SS**  trans14.585.8149.9-65.8-172.4174.5-172-1.2114.3S103S103-R105 PolarHBondContact O-N 3.44Å
106R35.3Very low39.9Very low232 Ų232145.9 Ų145.988%0.87575%0.753SS**  trans-139.2103.9148.8-86.2-167.2176.1-179.1-1.3109.2R104R104-R106 PolarHBondContact O-N 3.45Å; R104-R106 VanDerWaalsContact O-N 3.1Å
107N36.4Very low39.1Very low156 Ų156140 Ų14083%0.83474%0.743SS**SBendtrans58.498.3153.1-59.7-5.5000117.4
108G37.1Very low38.7Very low84 Ų84140.1 Ų140.187%0.86674%0.742SS**  95.35.7125.100000119
109V36.4Very low38.1Very low136 Ų136136.5 Ų136.582%0.82474%0.735SS**  trans-96.7110.7170.1-173.70000108.5E111V109-E111 PolarHBondContact O-N 3.31Å
110K38Very low38.4Very low194 Ų194139.2 Ų139.284%0.84374%0.735SS**  trans-52.8123.2173.8-70-180177.3179.80108.4T112K110-T112 PolarHBondContact O-N 3.06Å
111E40.4Very low38.8Very low167 Ų167140.2 Ų140.278%0.7874%0.738SS**  trans-50.7106171.7-67.2172.2170.400109V109 T113V109-E111 PolarHBondContact O-N 3.31Å; E111-T113 HydrophobicContact CB-CG2 4.37Å; E111-T113 PolarHBondContact O-N 3.19Å
112T39.5Very low39.3Very low143 Ų143138.2 Ų138.288%0.87773%0.727SS**  trans-69.676.9151.436.30000106.3K110 A114K110-T112 PolarHBondContact O-N 3.06Å; T112-A114 PolarHBondContact O-N 3.47Å
113T39.1Very low39.9Very low107 Ų107134.6 Ų134.666%0.65671%0.713SS**  trans-55112.4158.6300000105.6E111 S115E111-T113 HydrophobicContact CB-CG2 4.37Å; E111-T113 PolarHBondContact O-N 3.19Å; T113-S115 PolarHBondContact O-N 3.29Å
114A41.6Very low40.5Very low91 Ų91138.1 Ų138.175%0.75271%0.711SS**  trans-50.7116.2173.400000106.9T112T112-A114 PolarHBondContact O-N 3.47Å
115S35.4Very low41.5Very low67 Ų67131 Ų13147%0.46969%0.693SS.*  trans-47.7129-174.9174.50000109.4T113 S117 F118T113-S115 PolarHBondContact O-N 3.29Å; S115-S117 PolarHBondContact O-N 2.95Å; S115-S117 PolarHBondContact OG-OG 3.47Å; S115-F118 PolarHBondContact O-N 2.9Å
116P41.3Very low42.8Very low96 Ų96122.9 Ų122.962%0.62367%0.671SS**Hα-helixtrans-50.6-24.8-178.4-18.818.8000113.7F118 S119 L120P116-F118 VanDerWaalsContact C-N 3.31Å; P116-F118 PolarHBondContact O-N 3.23Å; P116-S119 PolarHBondContact O-N 3.06Å; P116-L120 PolarHBondContact O-N 3.48Å
117S37.4Very low43.8Very low79 Ų79117.5 Ų117.555%0.55266%0.656SS**Hα-helixtrans-61.8-30.1175.454.10000114.6S115 R121S115-S117 PolarHBondContact O-N 2.95Å; S115-S117 PolarHBondContact OG-OG 3.47Å; S117-R121 PolarHBondContact O-N 3.05Å
118F41Very low45.2Very low165 Ų165115.1 Ų115.172%0.72464%0.643SS**Hα-helixtrans-76-36.6178.1-153.4-92.1000111.5S115 P116 R121 A122S115-F118 PolarHBondContact O-N 2.9Å; P116-F118 VanDerWaalsContact C-N 3.31Å; P116-F118 PolarHBondContact O-N 3.23Å; F118-R121 PolarHBondContact O-N 2.95Å; F118-A122 PolarHBondContact O-N 3.41Å
119S43.4Very low46.4Very low76 Ų76114.1 Ų114.153%0.53162%0.623SS.*Hα-helixtrans-67.7-39.2177.8-171.50000112.1P116 R121 A122 N123P116-S119 PolarHBondContact O-N 3.06Å; S119-R121 VanDerWaalsContact C-N 3.33Å; S119-R121 PolarHBondContact O-N 3.41Å; S119-A122 PolarHBondContact O-N 3.25Å; S119-N123 PolarHBondContact O-N 3.46Å
120L41.8Very low47.9Very low115 Ų115114.1 Ų114.160%0.60261%0.612SS**Hα-helixtrans-65.9-33175.7-76.2164.3000113.2P116 R124P116-L120 PolarHBondContact O-N 3.48Å; L120-R124 PolarHBondContact O-N 2.71Å
121R49.6Very low49.3Very low195 Ų195109.9 Ų109.974%0.73660%0.598SS**Hα-helixtrans-74.6-37.3-179.3-154.1176.9-169.8177.22.9112.1S117 F118 S119 R124 V125S117-R121 PolarHBondContact O-N 3.05Å; F118-R121 PolarHBondContact O-N 2.95Å; S119-R121 VanDerWaalsContact C-N 3.33Å; S119-R121 PolarHBondContact O-N 3.41Å; R121-R124 PolarHBondContact O-N 3.08Å; R121-V125 WeakPolarHBondContact O-CG2 3.07Å; R121-V125 PolarHBondContact O-N 3.08Å
122A51.2Low50.8Low51 Ų51108.8 Ų108.842%0.42159%0.588SS.*Hα-helixtrans-64.4-41.417400000111.6F118 S119 R124 V125 V126F118-A122 PolarHBondContact O-N 3.41Å; S119-A122 PolarHBondContact O-N 3.25Å; A122-R124 PolarHBondContact O-N 3.31Å; A122-V125 PolarHBondContact O-N 3.3Å; A122-V126 WeakPolarHBondContact O-CG2 3.44Å; A122-V126 PolarHBondContact O-N 3Å
123N48.7Very low52.2Low87 Ų87106.2 Ų106.247%0.46557%0.569SS.*Hα-helixtrans-62.7-41.2177.8-72.7-13.1000112.4S119 V125 V126 E127S119-N123 PolarHBondContact O-N 3.46Å; N123-V125 PolarHBondContact O-N 3.04Å; N123-V126 PolarHBondContact O-N 3.13Å; N123-E127 WeakPolarHBondContact O-CG 3.42Å; N123-E127 PolarHBondContact O-N 3.28Å
124R51.6Low54.1Low175 Ų175104.9 Ų104.966%0.6656%0.558SS**Hα-helixtrans-62.9-41.2176.6-75.7-174.1-178.1179.90.2113.4L120 R121 A122 V126 E127 D128L120-R124 PolarHBondContact O-N 2.71Å; R121-R124 PolarHBondContact O-N 3.08Å; A122-R124 PolarHBondContact O-N 3.31Å; R124-V126 VanDerWaalsContact C-N 3.28Å; R124-V126 PolarHBondContact O-N 3.07Å; R124-E127 PolarHBondContact O-N 3.02Å; R124-D128 WeakPolarHBondContact O-CB 3.32Å; R124-D128 VanDerWaalsContact O-CG 3.24Å; R124-D128 PolarHBondContact O-N 2.86Å
125V54.8Low55.5Low89 Ų89103.3 Ų103.354%0.53955%0.545SS..Hα-helixtrans-64.2-37178.3175.20000111.2R121 A122 N123 S129R121-V125 WeakPolarHBondContact O-CG2 3.07Å; R121-V125 PolarHBondContact O-N 3.08Å; A122-V125 PolarHBondContact O-N 3.3Å; N123-V125 PolarHBondContact O-N 3.04Å; V125-S129 WeakPolarHBondContact O-CB 3.47Å; V125-S129 PolarHBondContact O-N 3.14Å; V125-S129 VanDerWaalsContact O-N 3.08Å; V125-S129 PolarHBondContact O-OG 3.43Å
126V58.3Low57.1Low76 Ų76103.8 Ų103.846%0.46154%0.539SS..Hα-helixtrans-68.3-45.4176.2174.70000110.7A122 N123 R124 S129 F130A122-V126 WeakPolarHBondContact O-CG2 3.44Å; A122-V126 PolarHBondContact O-N 3Å; N123-V126 PolarHBondContact O-N 3.13Å; R124-V126 VanDerWaalsContact C-N 3.28Å; R124-V126 PolarHBondContact O-N 3.07Å; V126-S129 PolarHBondContact O-N 3.47Å; V126-F130 HydrophobicContact CG1-CD2 3.63Å; V126-F130 HydrophobicContact CG1-CE2 3.38Å; V126-F130 WeakPolarHBondContact O-CD2 3.13Å; V126-F130 PolarHBondContact O-N 3.15Å
127E56.8Low58.6Low118 Ų118104.2 Ų104.255%0.55154%0.536SS*.Hα-helixtrans-60.6-45.5175.7-74.5175.6178.400112.2N123 R124 S129 F130 N131N123-E127 WeakPolarHBondContact O-CG 3.42Å; N123-E127 PolarHBondContact O-N 3.28Å; R124-E127 PolarHBondContact O-N 3.02Å; E127-S129 VanDerWaalsContact C-N 3.3Å; E127-S129 PolarHBondContact O-N 3.01Å; E127-F130 PolarHBondContact O-N 3.05Å; E127-N131 WeakPolarHBondContact O-CB 3.39Å; E127-N131 VanDerWaalsContact O-CG 3.24Å; E127-N131 PolarHBondContact O-N 3.25Å; E127-N131 PolarHBondContact O-ND2 2.93Å
128D64.7Low60.3Low106 Ų106106 Ų10657%0.56753%0.534SS*.Hα-helixtrans-62-38.5177.7-71-19.2000111.7R124 N131 Y132R124-D128 WeakPolarHBondContact O-CB 3.32Å; R124-D128 VanDerWaalsContact O-CG 3.24Å; R124-D128 PolarHBondContact O-N 2.86Å; D128-N131 PolarHBondContact O-N 3.33Å; D128-Y132 WeakPolarHBondContact O-CB 3.26Å; D128-Y132 PolarHBondContact O-N 3.27Å
129S63.7Low61.9Low63 Ų63102.6 Ų102.644%0.44152%0.52SS..Hα-helixtrans-67.5-39.5177.1-57.20000112V125 V126 E127 L133V125-S129 WeakPolarHBondContact O-CB 3.47Å; V125-S129 PolarHBondContact O-N 3.14Å; V125-S129 VanDerWaalsContact O-N 3.08Å; V125-S129 PolarHBondContact O-OG 3.43Å; V126-S129 PolarHBondContact O-N 3.47Å; E127-S129 VanDerWaalsContact C-N 3.3Å; E127-S129 PolarHBondContact O-N 3.01Å; S129-L133 WeakPolarHBondContact O-CG 3.49Å; S129-L133 PolarHBondContact O-N 3.03Å; S129-L133 VanDerWaalsContact O-N 3.08Å
130F66.7Low62.9Low137 Ų137105.2 Ų105.260%0.60152%0.522SS*.Hα-helixtrans-68.5-38.9175.3-80.3-63.3000112.2V126 E127 Y132 L133 D134V126-F130 HydrophobicContact CG1-CD2 3.63Å; V126-F130 HydrophobicContact CG1-CE2 3.38Å; V126-F130 WeakPolarHBondContact O-CD2 3.13Å; V126-F130 PolarHBondContact O-N 3.15Å; E127-F130 PolarHBondContact O-N 3.05Å; F130-Y132 VanDerWaalsContact C-N 3.35Å; F130-L133 PolarHBondContact O-N 3.47Å; F130-D134 WeakPolarHBondContact O-CB 3.49Å; F130-D134 PolarHBondContact O-N 3.3Å
131N67.3Low64.2Low104 Ų104104.4 Ų104.456%0.55652%0.518SS*.Hα-helixtrans-64.9-39.1176-70-28.1000111.9E127 D128 D134 A135E127-N131 WeakPolarHBondContact O-CB 3.39Å; E127-N131 VanDerWaalsContact O-CG 3.24Å; E127-N131 PolarHBondContact O-N 3.25Å; E127-N131 PolarHBondContact O-ND2 2.93Å; D128-N131 PolarHBondContact O-N 3.33Å; N131-D134 PolarHBondContact O-N 3.15Å; N131-A135 WeakPolarHBondContact O-CB 3.17Å; N131-A135 PolarHBondContact O-N 3.44Å
132Y72.8Confident65.3Low145 Ų145100.9 Ų100.957%0.56951%0.51SS*.Hα-helixtrans-64.3-46.3175.3-176.5-94.6000111.9D128 F130 D134 A135 E136D128-Y132 WeakPolarHBondContact O-CB 3.26Å; D128-Y132 PolarHBondContact O-N 3.27Å; F130-Y132 VanDerWaalsContact C-N 3.35Å; Y132-D134 PolarHBondContact O-N 3.08Å; Y132-A135 PolarHBondContact O-N 3.41Å; Y132-E136 HydrophobicContact CD1-CG 4.3Å; Y132-E136 HydrophobicContact CE1-CG 3.77Å; Y132-E136 WeakPolarHBondContact CE1-OE1 3.4Å; Y132-E136 PolarHBondContact O-N 2.87Å; Y132-E136 PolarHBondContact OH-OE1 2.94Å
133L68.2Low66.1Low89 Ų89103.5 Ų103.547%0.46651%0.512SS..Hα-helixtrans-63.7-38.5177.1-74.4169000112.4S129 F130 A135 E136 L137S129-L133 WeakPolarHBondContact O-CG 3.49Å; S129-L133 PolarHBondContact O-N 3.03Å; S129-L133 VanDerWaalsContact O-N 3.08Å; F130-L133 PolarHBondContact O-N 3.47Å; L133-A135 VanDerWaalsContact C-N 3.34Å; L133-E136 PolarHBondContact O-N 2.58Å; L133-L137 WeakPolarHBondContact O-CB 3.41Å; L133-L137 VanDerWaalsContact O-CG 3.22Å; L133-L137 WeakPolarHBondContact O-CG 3.03Å; L133-L137 PolarHBondContact O-N 2.91Å
134D79Confident66.8Low79 Ų79105.2 Ų105.242%0.42252%0.517SS..Hα-helixtrans-64.8-38.7175.6-168.760000111.9F130 N131 Y132 K138F130-D134 WeakPolarHBondContact O-CB 3.49Å; F130-D134 PolarHBondContact O-N 3.3Å; N131-D134 PolarHBondContact O-N 3.15Å; Y132-D134 PolarHBondContact O-N 3.08Å; D134-K138 WeakPolarHBondContact O-CG 3.34Å; D134-K138 PolarHBondContact O-N 3.23Å; D134-K138 WeakPolarHBondContact OD2-CE 3.42Å; D134-K138 IonicContact OD2-NZ 2.73Å; D134-K138 PolarHBondContact OD2-NZ 3.3Å
135A72Confident67.3Low58 Ų58103 Ų10348%0.47951%0.512SS..Hα-helixtrans-67.8-43.5176.200000112.4N131 Y132 L133 K138 H139N131-A135 WeakPolarHBondContact O-CB 3.17Å; N131-A135 PolarHBondContact O-N 3.44Å; Y132-A135 PolarHBondContact O-N 3.41Å; L133-A135 VanDerWaalsContact C-N 3.34Å; A135-K138 PolarHBondContact O-N 3.43Å; A135-H139 PolarHBondContact O-N 2.98Å; A135-H139 VanDerWaalsContact O-N 3.09Å
136E69.3Low67.7Low76 Ų76104.8 Ų104.836%0.35552%0.515SS..Hα-helixtrans-62.3-43.1174.8-77.3-165.615700111.5Y132 L133 K138 H139 F140Y132-E136 HydrophobicContact CD1-CG 4.3Å; Y132-E136 HydrophobicContact CE1-CG 3.77Å; Y132-E136 WeakPolarHBondContact CE1-OE1 3.4Å; Y132-E136 PolarHBondContact O-N 2.87Å; Y132-E136 PolarHBondContact OH-OE1 2.94Å; L133-E136 PolarHBondContact O-N 2.58Å; E136-K138 PolarHBondContact O-N 3.01Å; E136-H139 PolarHBondContact O-N 3.08Å; E136-F140 WeakPolarHBondContact O-CD2 3.47Å; E136-F140 PolarHBondContact O-N 2.96Å
137L71.2Confident67.6Low106 Ų106106.7 Ų106.756%0.55552%0.522SS*.Hα-helixtrans-62.7-42.3178-74.1170.5000112.3L133 H139 F140 D141L133-L137 WeakPolarHBondContact O-CB 3.41Å; L133-L137 VanDerWaalsContact O-CG 3.22Å; L133-L137 WeakPolarHBondContact O-CG 3.03Å; L133-L137 PolarHBondContact O-N 2.91Å; L137-H139 VanDerWaalsContact C-N 3.33Å; L137-H139 PolarHBondContact O-N 3.39Å; L137-F140 PolarHBondContact O-N 3.12Å; L137-D141 PolarHBondContact O-N 3.45Å
138K74.7Confident67.5Low116 Ų116105.8 Ų105.850%0.50452%0.519SS..Hα-helixtrans-60.5-41.4174.1-80.4171.8176.8149.90112.5D134 A135 E136 F140 D141 E142D134-K138 WeakPolarHBondContact O-CG 3.34Å; D134-K138 PolarHBondContact O-N 3.23Å; D134-K138 WeakPolarHBondContact OD2-CE 3.42Å; D134-K138 IonicContact OD2-NZ 2.73Å; D134-K138 PolarHBondContact OD2-NZ 3.3Å; A135-K138 PolarHBondContact O-N 3.43Å; E136-K138 PolarHBondContact O-N 3.01Å; K138-F140 VanDerWaalsContact C-N 3.31Å; K138-F140 PolarHBondContact O-N 3.38Å; K138-D141 PolarHBondContact O-N 3.49Å; K138-E142 WeakPolarHBondContact O-CG 3.33Å; K138-E142 PolarHBondContact O-N 2.96Å
139H73.7Confident67.2Low93 Ų93107.7 Ų107.743%0.43152%0.524SS..Hα-helixtrans-67-31.4177.2176.8-98.4000112.5A135 E136 L137 K143A135-H139 PolarHBondContact O-N 2.98Å; A135-H139 VanDerWaalsContact O-N 3.09Å; E136-H139 PolarHBondContact O-N 3.08Å; L137-H139 VanDerWaalsContact C-N 3.33Å; L137-H139 PolarHBondContact O-N 3.39Å; H139-K143 WeakPolarHBondContact CE1-CE 3.23Å; H139-K143 PolarHBondContact CE1-NZ 2.98Å; H139-K143 PolarHBondContact O-N 3.27Å; H139-K143 VanDerWaalsContact O-N 3.16Å
140F64.6Low66.7Low132 Ų132110.2 Ų110.258%0.57953%0.529SS*.Hα-helixtrans-68.5-43.2170.9-81.2-70.1000112.5E136 L137 K138 E142 K143 E144E136-F140 WeakPolarHBondContact O-CD2 3.47Å; E136-F140 PolarHBondContact O-N 2.96Å; L137-F140 PolarHBondContact O-N 3.12Å; K138-F140 VanDerWaalsContact C-N 3.31Å; K138-F140 PolarHBondContact O-N 3.38Å; F140-E142 VanDerWaalsContact C-N 3.27Å; F140-E142 PolarHBondContact O-N 3.3Å; F140-K143 PolarHBondContact O-N 2.73Å; F140-E144 PolarHBondContact O-N 3.36Å
141D70Confident65.9Low97 Ų97110.1 Ų110.152%0.51953%0.53SS..Hα-helixtrans-61.7-35.5176.9-76.6-9.5000112L137 K138 K145L137-D141 PolarHBondContact O-N 3.45Å; K138-D141 PolarHBondContact O-N 3.49Å; D141-K145 WeakPolarHBondContact O-CG 3.32Å; D141-K145 PolarHBondContact O-N 3.46Å
142E71.2Confident65Low121 Ų121110.9 Ų110.957%0.56554%0.535SS*.Hα-helixtrans-68.3-45.5175.6-73.8174.218000112K138 F140 E144 K145 E146K138-E142 WeakPolarHBondContact O-CG 3.33Å; K138-E142 PolarHBondContact O-N 2.96Å; F140-E142 VanDerWaalsContact C-N 3.27Å; F140-E142 PolarHBondContact O-N 3.3Å; E142-E144 VanDerWaalsContact C-N 3.34Å; E142-E144 PolarHBondContact O-N 3.03Å; E142-K145 WeakPolarHBondContact O-CB 3.39Å; E142-K145 PolarHBondContact O-N 3.3Å; E142-E146 PolarHBondContact O-N 3.13Å
143K69.5Low63.7Low107 Ų107113.3 Ų113.347%0.46554%0.543SS..Hα-helixtrans-64.1-36.6176.1-79-172.6172.8-1760113.3H139 F140 K145 E146 L147H139-K143 WeakPolarHBondContact CE1-CE 3.23Å; H139-K143 PolarHBondContact CE1-NZ 2.98Å; H139-K143 PolarHBondContact O-N 3.27Å; H139-K143 VanDerWaalsContact O-N 3.16Å; F140-K143 PolarHBondContact O-N 2.73Å; K143-K145 VanDerWaalsContact C-N 3.32Å; K143-E146 PolarHBondContact O-N 2.98Å; K143-L147 PolarHBondContact O-N 3.47Å
144E61.8Low62.5Low122 Ų122114.9 Ų114.957%0.5755%0.546SS*.Hα-helixtrans-66.3-36.8175.8-168.2173.1-171.100111.2F140 E142 L147 M148F140-E144 PolarHBondContact O-N 3.36Å; E142-E144 VanDerWaalsContact C-N 3.34Å; E142-E144 PolarHBondContact O-N 3.03Å; E144-L147 PolarHBondContact O-N 3.37Å; E144-M148 PolarHBondContact O-N 3.08Å; E144-M148 VanDerWaalsContact O-N 3.13Å
145K62.3Low60.6Low128 Ų128114.9 Ų114.956%0.55755%0.552SS**Hα-helixtrans-65.7-40.3173.7-75.4173.5-176.8171.90113.1D141 E142 K143 L147 M148 Q149D141-K145 WeakPolarHBondContact O-CG 3.32Å; D141-K145 PolarHBondContact O-N 3.46Å; E142-K145 WeakPolarHBondContact O-CB 3.39Å; E142-K145 PolarHBondContact O-N 3.3Å; K143-K145 VanDerWaalsContact C-N 3.32Å; K145-L147 VanDerWaalsContact C-N 3.33Å; K145-L147 PolarHBondContact O-N 3.49Å; K145-M148 PolarHBondContact O-N 3.49Å; K145-Q149 PolarHBondContact O-N 3.33Å
146E63.7Low59.1Low128 Ų128115.9 Ų115.960%0.59856%0.555SS**Hα-helixtrans-60.7-42.9176-73.5-177.8170.300111.8E142 K143 Q149 Q150E142-E146 PolarHBondContact O-N 3.13Å; K143-E146 PolarHBondContact O-N 2.98Å; E146-Q149 PolarHBondContact O-N 3.3Å; E146-Q150 PolarHBondContact O-N 3.45Å
147L57.5Low57.9Low115 Ų115116.6 Ų116.660%0.60257%0.565SS**Hα-helixtrans-63.7-40.6176.6-82.7163.6000112.3K143 E144 K145 Q150 Q151K143-L147 PolarHBondContact O-N 3.47Å; E144-L147 PolarHBondContact O-N 3.37Å; K145-L147 VanDerWaalsContact C-N 3.33Å; K145-L147 PolarHBondContact O-N 3.49Å; L147-Q150 PolarHBondContact O-N 3.28Å; L147-Q151 WeakPolarHBondContact O-CB 3.3Å; L147-Q151 PolarHBondContact O-N 2.73Å
148M54.3Low56.4Low99 Ų99120.2 Ų120.249%0.48857%0.573SS.*Hα-helixtrans-65.1-40.2176-72.8-165.4-73.600112.2E144 K145 Q150 Q151 D152E144-M148 PolarHBondContact O-N 3.08Å; E144-M148 VanDerWaalsContact O-N 3.13Å; K145-M148 PolarHBondContact O-N 3.49Å; M148-Q150 PolarHBondContact O-N 3.18Å; M148-Q151 PolarHBondContact O-N 3.21Å; M148-Q151 VanDerWaalsContact O-N 3.17Å; M148-D152 PolarHBondContact O-N 3.48Å
149Q56.9Low54.6Low146 Ų146121.3 Ų121.368%0.68258%0.584SS**Hα-helixtrans-65.2-37.5175.9-74.1-175.812.400112.7K145 E146 Q151 W153K145-Q149 PolarHBondContact O-N 3.33Å; E146-Q149 PolarHBondContact O-N 3.3Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 3.31Å; Q149-W153 PolarHBondContact O-N 3.41Å
150Q53.6Low52.8Low117 Ų117122.3 Ų122.355%0.54760%0.597SS.*Hα-helixtrans-64.4-37.5172.7-76.1-171.9-1300111.9E146 L147 M148 W153 F154E146-Q150 PolarHBondContact O-N 3.45Å; L147-Q150 PolarHBondContact O-N 3.28Å; M148-Q150 PolarHBondContact O-N 3.18Å; Q150-W153 WeakPolarHBondContact O-CB 3.33Å; Q150-W153 PolarHBondContact O-N 2.65Å; Q150-F154 WeakPolarHBondContact O-CD2 3.35Å; Q150-F154 PolarHBondContact O-N 3.47Å; Q150-F154 VanDerWaalsContact O-N 3.13Å
151Q50Low51.6Low134 Ų134122.9 Ų122.963%0.62660%0.604SS**Hα-helixtrans-71.3-34.5-178.6-146.3166.62800113L147 M148 Q149 W153 F154 S155L147-Q151 WeakPolarHBondContact O-CB 3.3Å; L147-Q151 PolarHBondContact O-N 2.73Å; M148-Q151 PolarHBondContact O-N 3.21Å; M148-Q151 VanDerWaalsContact O-N 3.17Å; Q149-Q151 VanDerWaalsContact C-N 3.31Å; Q149-Q151 PolarHBondContact O-N 3.31Å; Q151-W153 VanDerWaalsContact C-N 3.27Å; Q151-W153 PolarHBondContact O-N 3.07Å; Q151-F154 PolarHBondContact O-N 2.76Å; Q151-S155 PolarHBondContact O-N 3.32Å; Q151-S155 VanDerWaalsContact O-N 3.12Å; Q151-S155 PolarHBondContact O-OG 3.38Å
152D49.1Very low50.3Low121 Ų121122.3 Ų122.365%0.64761%0.606SS**Hα-helixtrans-63-36.1169.4-78-19.1000111.3M148 S155 S156M148-D152 PolarHBondContact O-N 3.48Å; D152-S155 PolarHBondContact O-N 2.96Å; D152-S156 PolarHBondContact O-N 3.19Å
153W45Very low48.6Very low196 Ų196120.2 Ų120.274%0.74260%0.604SS**Hα-helixtrans-64.1-44.7176.1-147.6-10.1000111.8Q149 Q150 Q151 S155 S156 T157Q149-W153 PolarHBondContact O-N 3.41Å; Q150-W153 WeakPolarHBondContact O-CB 3.33Å; Q150-W153 PolarHBondContact O-N 2.65Å; Q151-W153 VanDerWaalsContact C-N 3.27Å; Q151-W153 PolarHBondContact O-N 3.07Å; W153-S155 VanDerWaalsContact C-N 3.3Å; W153-S155 PolarHBondContact O-N 2.8Å; W153-S156 PolarHBondContact O-N 3.23Å; W153-S156 PolarHBondContact O-OG 2.87Å; W153-T157 PolarHBondContact O-OG1 2.63Å; W153-T157 VanDerWaalsContact O-OG1 3.08Å
154F42.8Very low47.2Very low122 Ų122123.5 Ų123.554%0.53562%0.622SS.*Hα-helixtrans-61.3-36.6175.8-82.1-74.2000112.8Q150 Q151 S156 T157 Y158Q150-F154 WeakPolarHBondContact O-CD2 3.35Å; Q150-F154 PolarHBondContact O-N 3.47Å; Q150-F154 VanDerWaalsContact O-N 3.13Å; Q151-F154 PolarHBondContact O-N 2.76Å; F154-S156 PolarHBondContact O-N 3Å; F154-T157 PolarHBondContact O-N 3.43Å; F154-Y158 HydrophobicContact CD1-CE2 4.09Å; F154-Y158 VanDerWaalsContact O-CD2 3.29Å; F154-Y158 WeakPolarHBondContact O-CD2 3.3Å
155S39.1Very low46.2Very low79 Ų79122.2 Ų122.255%0.55263%0.626SS**Hα-helixtrans-67.1-25.4-178-57.60000112.9Q151 D152 W153Q151-S155 PolarHBondContact O-N 3.32Å; Q151-S155 VanDerWaalsContact O-N 3.12Å; Q151-S155 PolarHBondContact O-OG 3.38Å; D152-S155 PolarHBondContact O-N 2.96Å; W153-S155 VanDerWaalsContact C-N 3.3Å; W153-S155 PolarHBondContact O-N 2.8Å
156S41.6Very low45Very low78 Ų78119.8 Ų119.855%0.54563%0.63SS.*Hα-helixtrans-78.2-28.4177.2770000113.8D152 W153 F154D152-S156 PolarHBondContact O-N 3.19Å; W153-S156 PolarHBondContact O-N 3.23Å; W153-S156 PolarHBondContact O-OG 2.87Å; F154-S156 PolarHBondContact O-N 3Å
157T43Very low43.7Very low91 Ų91122.5 Ų122.556%0.55864%0.636SS**Hα-helixtrans-85.9-25.7-171.9-12.70000113.5W153 F154 N159W153-T157 PolarHBondContact O-OG1 2.63Å; W153-T157 VanDerWaalsContact O-OG1 3.08Å; F154-T157 PolarHBondContact O-N 3.43Å; T157-N159 VanDerWaalsContact C-N 3.35Å; T157-N159 PolarHBondContact O-N 2.84Å
158Y39.5Very low42.4Very low183 Ų183127.4 Ų127.472%0.71865%0.646SS**THydrogen-bonded Turntrans-80.2-8.3-177.4-80.6-73.5000115.2F154 V160F154-Y158 HydrophobicContact CD1-CE2 4.09Å; F154-Y158 VanDerWaalsContact O-CD2 3.29Å; F154-Y158 WeakPolarHBondContact O-CD2 3.3Å; Y158-V160 VanDerWaalsContact C-N 3.29Å; Y158-V160 PolarHBondContact O-N 3.29Å
159N37.5Very low41.7Very low139 Ų139128.8 Ų128.874%0.74366%0.663SS**THydrogen-bonded Turntrans-85.84.6175.2-79-17.8000114.1T157 I161T157-N159 VanDerWaalsContact C-N 3.35Å; T157-N159 PolarHBondContact O-N 2.84Å; N159-I161 PolarHBondContact O-N 3.02Å
160V36.6Very low40.6Very low114 Ų114126.1 Ų126.169%0.69166%0.66SS**  trans-78.980.3163.8-170.10000107.8Y158 P162Y158-V160 VanDerWaalsContact C-N 3.29Å; Y158-V160 PolarHBondContact O-N 3.29Å; V160-P162 WeakPolarHBondContact O-CD 3.13Å; V160-P162 VanDerWaalsContact O-N 3.15Å
161I39.5Very low39.6Very low143 Ų143130.3 Ų130.373%0.73367%0.673SS**  trans-59.7114.6162.2-61.7170.4000105.5N159 S163N159-I161 PolarHBondContact O-N 3.02Å; I161-S163 PolarHBondContact O-N 2.57Å
162P40.9Very low38.6Very low85 Ų85132.8 Ų132.855%0.55268%0.681SS**  trans-61.4114.9175.923.8-30.1000107.5V160 E164V160-P162 WeakPolarHBondContact O-CD 3.13Å; V160-P162 VanDerWaalsContact O-N 3.15Å; P162-E164 PolarHBondContact O-N 2.95Å
163S37Very low37.8Very low77 Ų77135.4 Ų135.454%0.53869%0.692SS.*  trans-57.8132.7177.556.40000109I161 S165 A166I161-S163 PolarHBondContact O-N 2.57Å; S163-S165 PolarHBondContact O-N 3.46Å; S163-S165 PolarHBondContact OG-OG 2.73Å; S163-A166 PolarHBondContact O-N 3.09Å
164E38.8Very low37Very low177 Ų177136.1 Ų136.183%0.82770%0.696SS**G310 helixtrans-52.4-13.6-178.1-69.4-178.8152.100114.5P162 A166 Y167P162-E164 PolarHBondContact O-N 2.95Å; E164-A166 PolarHBondContact O-N 3.4Å; E164-Y167 PolarHBondContact O-N 3.35Å; E164-Y167 VanDerWaalsContact O-N 3.16Å
165S41.8Very low36.3Very low94 Ų94133.8 Ų133.866%0.65771%0.706SS**G310 helixtrans-61.2-22.8170.456.10000114.2S163 Y167S163-S165 PolarHBondContact O-N 3.46Å; S163-S165 PolarHBondContact OG-OG 2.73Å; S165-Y167 PolarHBondContact O-N 3.35Å
166A37.7Very low35.9Very low78 Ų78137.2 Ų137.265%0.64572%0.718SS**G310 helixtrans-69.9-17.6175.300000113.1S163 E164S163-A166 PolarHBondContact O-N 3.09Å; E164-A166 PolarHBondContact O-N 3.4Å
167Y34.7Very low35.4Very low185 Ų185140.1 Ų140.173%0.72573%0.733SS**G310 helixtrans-97.817.1-175.6-79-80.8000114.7E164 S165 P169E164-Y167 PolarHBondContact O-N 3.35Å; E164-Y167 VanDerWaalsContact O-N 3.16Å; S165-Y167 PolarHBondContact O-N 3.35Å; Y167-P169 VanDerWaalsContact C-CD 3.44Å; Y167-P169 WeakPolarHBondContact O-CD 3.48Å
168R31.8Very low34.8Very low217 Ų217139.1 Ų139.182%0.81974%0.74SS**  trans-9493.8166.4-88.9-169173-165.8-0.1110.8S170R168-S170 VanDerWaalsContact C-N 3.26Å; R168-S170 PolarHBondContact O-N 3.39Å
169P38.3Very low34.4Very low128 Ų128136.4 Ų136.483%0.83175%0.748SS**  trans-71.985.2165.829.8-32.9000108.8Y167 Y171Y167-P169 VanDerWaalsContact C-CD 3.44Å; Y167-P169 WeakPolarHBondContact O-CD 3.48Å; P169-Y171 VanDerWaalsContact C-N 3.32Å; P169-Y171 PolarHBondContact O-N 3.06Å
170S33.7Very low34.2Very low90 Ų90134.2 Ų134.263%0.62975%0.749SS**  trans-88.760.9173.664.80000111.2R168R168-S170 VanDerWaalsContact C-N 3.26Å; R168-S170 PolarHBondContact O-N 3.39Å
171Y33.7Very low33.8Very low206 Ų206133.7 Ų133.781%0.80876%0.757SS**  trans-143.6100.2165-80.2-75.4000111.7P169 M173P169-Y171 VanDerWaalsContact C-N 3.32Å; P169-Y171 PolarHBondContact O-N 3.06Å; Y171-M173 PolarHBondContact O-N 3.33Å; Y171-M173 VanDerWaalsContact O-N 3.07Å
172K28.3Very low33.5Very low185 Ų185132.9 Ų132.980%0.80476%0.758SS**  trans-61.296.1155.6-80.2177.5171.8-179.70108Y174K172-Y174 HydrophobicContact CD-CE2 4.38Å
173M33Very low33Very low177 Ų177133.3 Ų133.387%0.87277%0.769SS**  trans-96.194.4163.5-75.5-134.3-89.100109.5Y171Y171-M173 PolarHBondContact O-N 3.33Å; Y171-M173 VanDerWaalsContact O-N 3.07Å
174Y28.2Very low32.8Very low210 Ų210136.7 Ų136.782%0.82478%0.776SS**  trans-62.8122.2152.3-75-94.9000107.7K172K172-Y174 HydrophobicContact CD-CE2 4.38Å
175G27.6Very low32.3Very low73 Ų73132 Ų13275%0.75376%0.763SS**  trans167.149.4178.200000116.6
176N30.8Very low32.3Very low152 Ų152132.7 Ų132.781%0.81377%0.765SS**  trans14.7119.9146.2-99.2-1.2000120.7
177V31.4Very low32Very low139 Ų139137 Ų13784%0.84277%0.771SS**  trans59.8118.5138.7-100.60000120.6
178G30.2Very low31.8Very low70 Ų70132.1 Ų132.172%0.72277%0.765SS**  trans115.670.6131.600000116
179S31.3Very low31.8Very low125 Ų125130 Ų13087%0.87476%0.758SS**SBendtrans-164.2141.4144-85.30000109.7
180A32.8Very low31.5Very low93 Ų93135.7 Ų135.777%0.76976%0.763SS**  trans-39.4133.6-17100000113.4V182A180-V182 VanDerWaalsContact C-N 3.27Å; A180-V182 PolarHBondContact O-N 3.16Å
181A28.5Very low31.4Very low103 Ų103139.2 Ų139.285%0.85177%0.774SS**  trans-57.392.1173.300000109.4A183A181-A183 VanDerWaalsContact C-N 3.27Å; A181-A183 PolarHBondContact O-N 3.01Å
182V32.8Very low31.1Very low127 Ų127139 Ų13977%0.7778%0.78SS**  trans-60.8102.2156.4176.60000103.9A180 Q184A180-V182 VanDerWaalsContact C-N 3.27Å; A180-V182 PolarHBondContact O-N 3.16Å; V182-Q184 PolarHBondContact O-N 3.41Å
183A30.8Very low31.1Very low94 Ų94134.2 Ų134.278%0.77778%0.775SS**  trans-57.595.2166.400000106.3A181 S185A181-A183 VanDerWaalsContact C-N 3.27Å; A181-A183 PolarHBondContact O-N 3.01Å; A183-S185 VanDerWaalsContact C-N 3.31Å; A183-S185 PolarHBondContact O-N 3.29Å
184Q31.9Very low30.8Very low147 Ų147131.1 Ų131.169%0.68777%0.771SS**  trans-63.5100.3172.4-75.5-178.8-15.800106.2V182V182-Q184 PolarHBondContact O-N 3.41Å
185S29.5Very low30.9Very low78 Ų78126.3 Ų126.355%0.54577%0.768SS.*  trans-52.3125.5165.8169.70000107.8A183 H187 S188A183-S185 VanDerWaalsContact C-N 3.31Å; A183-S185 PolarHBondContact O-N 3.29Å; S185-H187 PolarHBondContact O-N 3.05Å; S185-S188 PolarHBondContact O-OG 3.39Å
186P40.8Very low30.8Very low109 Ų109128.1 Ų128.171%0.70876%0.764SS**THydrogen-bonded Turntrans-69.218.4-174.726.6-33.4000114.1
187H32Very low30.8Very low168 Ų168125.4 Ų125.478%0.77876%0.762SS**THydrogen-bonded Turntrans-114.215.4-179.9-71.519.8000113.5S185S185-H187 PolarHBondContact O-N 3.05Å
188S31Very low30.7Very low84 Ų84127.3 Ų127.359%0.58776%0.762SS**  trans-103.853.1174.148.70000112.1S185S185-S188 PolarHBondContact O-OG 3.39Å
189Y32.1Very low30.6Very low173 Ų173129.7 Ų129.768%0.67876%0.763SS**  trans-124.5155.2159.4-65.8-79.3000107.1
190W32.2Very low30.4Very low247 Ų247129.7 Ų129.794%0.93676%0.758SS**  trans90.954.8-175.3-52.888.9000116.6
191L30.2Very low30Very low164 Ų164132 Ų13286%0.85976%0.757SS**  trans-152.686.4136.9-77.1-172.4000109.5
192H28.4Very low29.9Very low201 Ų201135.8 Ų135.893%0.93176%0.758SS**  trans-131.286.8149.2-92.5-77.5000107.6
193A27.3Very low29.6Very low84 Ų84132.9 Ų132.969%0.69475%0.753SS**  trans-68.8130.4159.700000108.4
194S26.6Very low29.5Very low113 Ų113136.5 Ų136.579%0.7976%0.758SS**  trans47.3111.9149.457.10000119.1
195S30.2Very low29.3Very low109 Ų109134 Ų13476%0.76276%0.756SS**  179.8109.4129.5172.60000111.6
196V26.6Very low29.8Very low110 Ų110136.1 Ų136.167%0.66777%0.768SS**  trans59.1106.2137.7-170.70000117.9Q198V196-Q198 HydrophobicContact CG1-CG 4.19Å; V196-Q198 PolarHBondContact O-N 3.02Å
197A30.7Very low29.1Very low95 Ų95140 Ų14079%0.78577%0.774SS**  trans-49.2106.3150.100000110.7
198Q28Very low28.9Very low179 Ų179137 Ų13784%0.83677%0.772SS**  trans-117.788.4155.1-92.4-179.5-7.500108.2V196V196-Q198 HydrophobicContact CG1-CG 4.19Å; V196-Q198 PolarHBondContact O-N 3.02Å
199T29.3Very low28.7Very low121 Ų121144.6 Ų144.674%0.74279%0.788SS**  trans-54.813015448.60000109.9
200T26.3Very low28.4Very low124 Ų124141.7 Ų141.776%0.76179%0.793SS**  trans164.1101.5137.839.70000106.2
201N25.7Very low28.1Very low142 Ų142141.5 Ų141.576%0.75979%0.792SS**  66.312394.5-84.4-8.4000113.5
202E26.7Very low28.2Very low183 Ų183139.5 Ų139.586%0.85579%0.787SS**  trans77.5107.8151.1-62.6177-168.800117.8
203G26Very low28.5Very low66 Ų66136 Ų13668%0.6878%0.78SS**  112.2111.9113.100000117.1
204I27.4Very low28.9Very low170 Ų170137.1 Ų137.187%0.87278%0.779SS**  trans81.7104.3131.4-54.5168.4000117.5
205S28Very low29.1Very low94 Ų94140.1 Ų140.166%0.65778%0.781SS**  trans84.7120.4131.7-160.30000119.9
206P40.1Very low29.1Very low123 Ų123143.6 Ų143.680%0.79979%0.785SS**  trans-88.8115.3-178.934.5-29000110.6
207K25.9Very low29.5Very low190 Ų190144.2 Ų144.283%0.82679%0.789SS**  trans-140.3139.9159.3-80.4-170179.2174.40111.6
208S28.1Very low29.4Very low105 Ų105143 Ų14373%0.73478%0.779SS**  trans69.9106.8153.845.90000118.7
209R26.4Very low29.4Very low244 Ų244140.6 Ų140.692%0.92178%0.777SS**  39.3110122.2-66.1178.6174.7-179.9-2.1116.3
210S26.5Very low29.4Very low111 Ų111143.3 Ų143.378%0.77678%0.778SS**  -177.6126.4107.860.10000111T212S210-T212 PolarHBondContact O-N 3.41Å
211R26.8Very low29.5Very low244 Ų244142.2 Ų142.292%0.92178%0.776SS**  trans-47113.8161.4179.7-173.1-166.3-178.53.7112
212T31.6Very low29.7Very low122 Ų122142.8 Ų142.875%0.74878%0.778SS**  trans-150.7109.514747.20000109.3S210S210-T212 PolarHBondContact O-N 3.41Å
213T33.9Very low30Very low128 Ų128139 Ų13979%0.78577%0.771SS**  trans-62.214016336.80000111
214P36.3Very low30.5Very low106 Ų106140.6 Ų140.669%0.68877%0.772SS**  trans-127.5109.8131.130.2-16.4000107.7Q216P214-Q216 VanDerWaalsContact C-N 3.31Å; P214-Q216 PolarHBondContact O-N 3.49Å
215E29.9Very low30.7Very low176 Ų176136 Ų13682%0.82275%0.747SS**  27.867.876.7-73.2-157.9174.100113.2
216Q31.6Very low31.3Very low182 Ų182135.6 Ų135.685%0.8574%0.741SS**  trans-130.474147.6-73.8-167.9-1.900108.5P214 A218P214-Q216 VanDerWaalsContact C-N 3.31Å; P214-Q216 PolarHBondContact O-N 3.49Å; Q216-A218 VanDerWaalsContact C-N 3.34Å; Q216-A218 PolarHBondContact O-N 2.73Å; Q216-A218 VanDerWaalsContact O-N 3.11Å
217T35Very low31.5Very low123 Ų123133.5 Ų133.576%0.75573%0.733SS**  trans-73.593.9164-36.20000106.5V219T217-V219 PolarHBondContact O-N 2.97Å
218A27.9Very low32.1Very low69 Ų69132.5 Ų132.557%0.5773%0.729SS**  trans-67.798.7172.300000108.5Q216 F220Q216-A218 VanDerWaalsContact C-N 3.34Å; Q216-A218 PolarHBondContact O-N 2.73Å; Q216-A218 VanDerWaalsContact O-N 3.11Å; A218-F220 HydrophobicContact CB-CD2 3.97Å; A218-F220 HydrophobicContact CB-CE2 3.47Å; A218-F220 VanDerWaalsContact CB-CE2 3.47Å; A218-F220 HydrophobicContact CB-CZ 4.23Å; A218-F220 PolarHBondContact O-N 3.44Å; A218-F220 VanDerWaalsContact O-N 3.08Å
219V28.6Very low32.5Very low130 Ų130132.8 Ų132.879%0.78872%0.719SS**  trans-74.493.7174.6-176.40000107.7T217 S221T217-V219 PolarHBondContact O-N 2.97Å; V219-S221 PolarHBondContact O-N 3.42Å
220F29.1Very low33.2Very low177 Ų177126.8 Ų126.878%0.77670%0.702SS**  trans-87102.5167.4-69.4-79.5000108.5A218 I222A218-F220 HydrophobicContact CB-CD2 3.97Å; A218-F220 HydrophobicContact CB-CE2 3.47Å; A218-F220 VanDerWaalsContact CB-CE2 3.47Å; A218-F220 HydrophobicContact CB-CZ 4.23Å; A218-F220 PolarHBondContact O-N 3.44Å; A218-F220 VanDerWaalsContact O-N 3.08Å; F220-I222 PolarHBondContact O-N 3.36Å
221S28.4Very low33.9Very low102 Ų102127.7 Ų127.771%0.71370%0.697SS**  trans-75.4107170.674.20000108.9V219 S223V219-S221 PolarHBondContact O-N 3.42Å; S221-S223 VanDerWaalsContact C-N 3.33Å; S221-S223 PolarHBondContact O-N 3.25Å; S221-S223 VanDerWaalsContact O-N 3.1Å
222I30.2Very low34.5Very low154 Ų154126.3 Ų126.379%0.7969%0.692SS**  trans-79.491.9166.5-53.7173.6000105.7F220 S224F220-I222 PolarHBondContact O-N 3.36Å; I222-S224 PolarHBondContact O-N 3.17Å
223S33.3Very low35Very low103 Ų103129.8 Ų129.872%0.7269%0.691SS**  trans-66.689.616450.70000107.4S221 E225S221-S223 VanDerWaalsContact C-N 3.33Å; S221-S223 PolarHBondContact O-N 3.25Å; S221-S223 VanDerWaalsContact O-N 3.1Å; S223-E225 PolarHBondContact O-N 3.48Å
224S36.5Very low35.1Very low100 Ų100127.9 Ų127.970%0.69968%0.683SS**  trans-74.471.617162.30000108.8I222 T226I222-S224 PolarHBondContact O-N 3.17Å; S224-T226 PolarHBondContact O-N 3.35Å; S224-T226 VanDerWaalsContact O-N 3.1Å
225E31Very low35Very low72 Ų72125.6 Ų125.634%0.33667%0.669SS.*  trans-64.7106.9167.8-163.1169.1-14600106S223 E229 Q230 R233S223-E225 PolarHBondContact O-N 3.48Å; E225-E229 HydrophobicContact CG-CB 3.53Å; E225-Q230 HydrophobicContact CG-CG 4.49Å; E225-R233 IonicContact OE1-CZ 3.73Å; E225-R233 IonicContact OE1-NH1 2.87Å; E225-R233 PolarHBondContact OE1-NH1 3.02Å; E225-R233 IonicContact OE2-NH1 3.98Å
226T41.4Very low35.3Very low87 Ų87123.9 Ų123.953%0.53467%0.671SS.*  trans-62.7152.8-18059.70000109.9S224 F228 E229 Q230S224-T226 PolarHBondContact O-N 3.35Å; S224-T226 VanDerWaalsContact O-N 3.1Å; T226-F228 PolarHBondContact O-N 3.38Å; T226-E229 PolarHBondContact O-N 3.21Å; T226-Q230 PolarHBondContact O-N 3.26Å
227A43.2Very low35.7Very low78 Ų78124.7 Ų124.765%0.64567%0.672SS**Hα-helixtrans-52.3-25.8-179.400000113.5Q230 L231A227-Q230 PolarHBondContact O-N 3.23Å; A227-L231 PolarHBondContact O-N 3.23Å; A227-L231 VanDerWaalsContact O-N 3.15Å
228F38.7Very low35.7Very low170 Ų170122.8 Ų122.875%0.74667%0.669SS**Hα-helixtrans-65.8-34.7174.6-166.9-97.9000113.6T226T226-F228 PolarHBondContact O-N 3.38Å
229E35.9Very low36Very low110 Ų110124 Ų12451%0.51467%0.673SS.*Hα-helixtrans-76.2-34.5176.8-69.9-158.2152.200112.3E225 T226 R232E225-E229 HydrophobicContact CG-CB 3.53Å; T226-E229 PolarHBondContact O-N 3.21Å; E229-R232 PolarHBondContact O-N 3.49Å
230Q42.4Very low36Very low119 Ų119126 Ų12656%0.55668%0.679SS**Hα-helixtrans-63.6-42.4173.1-72.2-174.8-9.500112E225 T226 A227 R232 R233 S234E225-Q230 HydrophobicContact CG-CG 4.49Å; T226-Q230 PolarHBondContact O-N 3.26Å; A227-Q230 PolarHBondContact O-N 3.23Å; Q230-R232 PolarHBondContact O-N 3.45Å; Q230-R233 PolarHBondContact O-N 3.33Å; Q230-R233 VanDerWaalsContact O-N 3.1Å; Q230-S234 PolarHBondContact O-N 2.81Å; Q230-S234 PolarHBondContact O-OG 3.2Å
231L40.3Very low36Very low129 Ų129125.9 Ų125.968%0.67568%0.681SS**Hα-helixtrans-65.4-26-178.4-149.4128.3000112.7A227 R233 S234A227-L231 PolarHBondContact O-N 3.23Å; A227-L231 VanDerWaalsContact O-N 3.15Å; L231-R233 VanDerWaalsContact C-N 3.34Å; L231-S234 PolarHBondContact O-OG 3.35Å
232R38.6Very low36.2Very low215 Ų215127.4 Ų127.481%0.81169%0.69SS**Hα-helixtrans-71.7-27.7176.4-155.1-177.8-177.3-168.71112.7E229 Q230E229-R232 PolarHBondContact O-N 3.49Å; Q230-R232 PolarHBondContact O-N 3.45Å
233R42.5Very low36.3Very low195 Ų195126.3 Ų126.374%0.73669%0.691SS**Hα-helixtrans-90-28178-76.2-176171.7147.30.8113.6E225 Q230 L231 S235E225-R233 IonicContact OE1-CZ 3.73Å; E225-R233 IonicContact OE1-NH1 2.87Å; E225-R233 PolarHBondContact OE1-NH1 3.02Å; E225-R233 IonicContact OE2-NH1 3.98Å; Q230-R233 PolarHBondContact O-N 3.33Å; Q230-R233 VanDerWaalsContact O-N 3.1Å; L231-R233 VanDerWaalsContact C-N 3.34Å; R233-S235 PolarHBondContact O-N 2.86Å
234S36.4Very low36.1Very low89 Ų89124.6 Ų124.662%0.62269%0.69SS**SBendtrans-79.52.1178.659.90000114Q230 L231 T236Q230-S234 PolarHBondContact O-N 2.81Å; Q230-S234 PolarHBondContact O-OG 3.2Å; L231-S234 PolarHBondContact O-OG 3.35Å; S234-T236 PolarHBondContact O-N 3.5Å
235S33.7Very low35.7Very low57 Ų57129 Ų12940%0.39970%0.699SS.*  trans-75.7111.7174.2177.50000110.6R233 F237R233-S235 PolarHBondContact O-N 2.86Å; S235-F237 PolarHBondContact O-N 2.89Å; S235-F237 PolarHBondContact OG-N 2.89Å
236T37.3Very low35.6Very low140 Ų140134.9 Ų134.986%0.85973%0.727SS**THydrogen-bonded Turntrans-65.45.9173.9-6.30000114.2S234 A238S234-T236 PolarHBondContact O-N 3.5Å; T236-A238 PolarHBondContact O-N 3.29Å
237F39.2Very low35Very low200 Ų200137.3 Ų137.388%0.87774%0.736SS**THydrogen-bonded Turntrans-79.96174.1-84.7-83.6000114.2S235S235-F237 PolarHBondContact O-N 2.89Å; S235-F237 PolarHBondContact OG-N 2.89Å
238A35.5Very low34.5Very low83 Ų83144.6 Ų144.669%0.68675%0.747SS**SBendtrans-107.575.8174.100000111.1T236T236-A238 PolarHBondContact O-N 3.29Å
239S33Very low34.2Very low93 Ų93142.1 Ų142.165%0.6575%0.751SS**  trans16383.7143.247.90000112.2
240D30.5Very low34Very low172 Ų172145 Ų14592%0.9276%0.764SS**  trans-115.884.2147.3-85.9-32.2000107.2C242D240-C242 PolarHBondContact O-N 2.77Å
241H27.5Very low33.4Very low176 Ų176150.3 Ų150.382%0.81578%0.779SS**  trans-70.4109.7160-85.4-73.4000107.8
242C33.4Very low33Very low133 Ų133149.7 Ų149.790%0.89979%0.785SS**  trans-135.4111.3154.2-99.50000109.9D240D240-C242 PolarHBondContact O-N 2.77Å
243T31.6Very low32.8Very low132 Ų132145 Ų14581%0.8179%0.786SS**  trans-69.8149.2173.941.50000112.8
244G28.9Very low32.3Very low67 Ų67143.2 Ų143.269%0.69179%0.786SS**  trans86.7108.6154.100000113.7
245E28.9Very low32.2Very low192 Ų192147.1 Ų147.190%0.89779%0.792SS**  63.1101.194.7-70.6-142.7147.300112.5
246E29.1Very low32.2Very low196 Ų196152.9 Ų152.992%0.91681%0.812SS**  -170.3115.3120.6-102.4174-166.600112.1
247D29.5Very low32.1Very low137 Ų137151.4 Ų151.473%0.73381%0.808SS**  trans53.3138.3138.3-125.8-8000125.2
248R31.1Very low31.9Very low231 Ų231147.9 Ų147.987%0.87281%0.808SS**  trans-51.8131.4174.7-64.5164.1161.4107.8-1.1112.7
249S33Very low31.6Very low118 Ų118147.1 Ų147.183%0.82581%0.808SS**  trans-141.1131.5137.2-176.90000111.3
250Q31.6Very low31.6Very low172 Ų172148.2 Ų148.280%0.80482%0.815SS**  trans-60142177.4-57.7178.2-18.600111.6
251R29.2Very low31.5Very low230 Ų230145.8 Ų145.887%0.86881%0.806SS**  150.6111.1125.6-79175.6101.3-173.74.8111.4
252S32.7Very low31.7Very low115 Ų115143.7 Ų143.780%0.80481%0.805SS**  trans38.795.8143.557.60000118.4
253S34.6Very low31.4Very low118 Ų118143.1 Ų143.183%0.82580%0.798SS**  trans-148.7118.4131.6-1750000109.2
254Q31.3Very low31.4Very low157 Ų157142.2 Ų142.273%0.73480%0.797SS**  trans-87.8140.2-178.6-164.3172.5-15.600107.2
255F34.1Very low31.5Very low170 Ų170144.5 Ų144.575%0.74680%0.802SS**  trans89.274.5174.4-52.3-74.2000118.1
256H34.6Very low31.7Very low179 Ų179140.7 Ų140.783%0.82979%0.794SS**  trans-133.8124.2140-75.2-60.8000111.3
257S34.4Very low31.7Very low109 Ų109140 Ų14076%0.76279%0.791SS**  trans28.3114.6154.353.70000118.4G259S257-G259 PolarHBondContact O-N 2.77Å
258S35.6Very low32.1Very low125 Ų125141.8 Ų141.887%0.87480%0.799SS**  trans-54.888.6167.251.80000112.4C260S258-C260 PolarHBondContact O-N 2.77Å
259G29.5Very low32.2Very low68 Ų68136.1 Ų136.170%0.70179%0.792SS**  trans-67.1103.5158.100000108.5S257 T261S257-G259 PolarHBondContact O-N 2.77Å; G259-T261 PolarHBondContact O-N 2.99Å; G259-T261 VanDerWaalsContact O-N 3.16Å
260C31.8Very low32.2Very low116 Ų116136.7 Ų136.778%0.78480%0.797SS**  trans-76.693.6168.3-1730000107.7S258 V262S258-C260 PolarHBondContact O-N 2.77Å; C260-V262 PolarHBondContact O-N 3.5Å
261T28.9Very low32.2Very low121 Ų121131.4 Ų131.474%0.74279%0.788SS**  trans-77.2104.2164.8430000108.2G259 T263G259-T261 PolarHBondContact O-N 2.99Å; G259-T261 VanDerWaalsContact O-N 3.16Å; T261-T263 PolarHBondContact O-N 2.87Å
262V32Very low32.5Very low131 Ų131126 Ų12679%0.79478%0.783SS**  trans-68.998.8166.2-178.80000106.9C260 S264C260-V262 PolarHBondContact O-N 3.5Å; V262-S264 PolarHBondContact O-N 3.38Å
263T27.7Very low32.3Very low121 Ų121127.9 Ų127.974%0.74278%0.784SS**PPolyproline II helixtrans-72.2117.5169.146.80000108.2T261 S265T261-T263 PolarHBondContact O-N 2.87Å; T263-S265 PolarHBondContact O-N 3.46Å
264S30.4Very low32Very low113 Ų113131.2 Ų131.279%0.7979%0.786SS**PPolyproline II helixtrans-63.9123.5167.237.50000108.8V262V262-S264 PolarHBondContact O-N 3.38Å
265S31Very low31.9Very low115 Ų115129.3 Ų129.380%0.80479%0.785SS**PPolyproline II helixtrans-56148173.1-78.50000112T263T263-S265 PolarHBondContact O-N 3.46Å
266P34.7Very low31.9Very low112 Ų112126.1 Ų126.173%0.72778%0.781SS**PPolyproline II helixtrans-81.3148.5-166.633.3-35000113.4
267H29Very low31.8Very low183 Ų183124.3 Ų124.385%0.84778%0.776SS**  trans45.7105.5150.2-67.4-37.6000119.8
268L36.4Very low31.8Very low173 Ų173126.7 Ų126.791%0.90678%0.779SS**  trans-96.7128.1136.9-85.4154.3000107.6
269P33.9Very low31.5Very low112 Ų112127.5 Ų127.573%0.72777%0.774SS**  trans-69.1138.1-170.127-32.6000111.6G271P269-G271 PolarHBondContact O-N 2.98Å; P269-G271 VanDerWaalsContact O-N 3.15Å
270S33.9Very low31.6Very low131 Ų131128.7 Ų128.792%0.91678%0.777SS**  trans-49.4107.8161.844.50000111.4
271G30Very low31.6Very low60 Ų60129 Ų12962%0.61978%0.776SS**  trans-135.7135.6163.500000108.9P269P269-G271 PolarHBondContact O-N 2.98Å; P269-G271 VanDerWaalsContact O-N 3.15Å
272P35.6Very low31.6Very low118 Ų118130.3 Ų130.377%0.76678%0.778SS**  trans-78.9140.4-169.131.7-33000112
273N28.8Very low31.5Very low154 Ų154131.9 Ų131.982%0.82478%0.782SS**  trans35.190.4153.8-65.9-27.5000117.4
274H27.9Very low31.6Very low187 Ų187134.5 Ų134.587%0.86679%0.786SS**  trans-124.285.1150.2-97-62.2000109.5
275V30Very low31.6Very low117 Ų117136 Ų13671%0.70979%0.785SS**  trans-64.9122.3148.4177.90000105.4I277V275-I277 PolarHBondContact O-N 2.91Å
276P34.8Very low31.6Very low104 Ų104140.4 Ų140.468%0.67579%0.79SS**  trans-64.4107.1176.123.9-29.9000108.5L278P276-L278 VanDerWaalsContact C-N 3.33Å; P276-L278 PolarHBondContact O-N 3.28Å
277I31.4Very low31.4Very low141 Ų141141.7 Ų141.772%0.72380%0.796SS**  trans-65.7100.2165.7-61.2173.7000105.6V275 N279V275-I277 PolarHBondContact O-N 2.91Å; I277-N279 WeakPolarHBondContact CG2-OD1 3.29Å; I277-N279 PolarHBondContact O-N 2.97Å
278L35.5Very low31.5Very low158 Ų158137.2 Ų137.283%0.82779%0.79SS**  trans-67.184.9165.6-75.4158.9000107.3P276 A280P276-L278 VanDerWaalsContact C-N 3.33Å; P276-L278 PolarHBondContact O-N 3.28Å; L278-A280 PolarHBondContact O-N 3.43Å
279N27.9Very low31.3Very low142 Ų142136 Ų13676%0.75979%0.785SS**  trans-65.689.1164.7-87.4-9.9000108I277 T281I277-N279 WeakPolarHBondContact CG2-OD1 3.29Å; I277-N279 PolarHBondContact O-N 2.97Å; N279-T281 PolarHBondContact O-N 3.12Å
280A32.2Very low31.2Very low94 Ų94137.1 Ų137.178%0.77779%0.785SS**  trans-79.554.4170.900000110.4L278L278-A280 PolarHBondContact O-N 3.43Å
281T32Very low31.3Very low123 Ų123138.5 Ų138.576%0.75578%0.782SS**  trans-160.572.9168.9-29.70000109.7N279N279-T281 PolarHBondContact O-N 3.12Å
282D28.3Very low31.5Very low148 Ų148140.6 Ų140.679%0.79178%0.783SS**  trans173.193.3147.9-90.3-20.4000108.8
283N30.6Very low31.6Very low164 Ų164146.4 Ų146.488%0.87779%0.789SS**  trans-176.979.9137.4-89.3-29.1000108.2
284Q28.6Very low31.8Very low176 Ų176147.1 Ų147.182%0.82279%0.787SS**  trans-59.9145.1146.1-68.8-165.8-10.100108.7
285N30.7Very low32.4Very low144 Ų144146.3 Ų146.377%0.7779%0.788SS**  trans6696.1165.9-71.9-25.4000117.4
286K32.2Very low32.6Very low207 Ų207152.1 Ų152.190%0.980%0.797SS**  -178.6134.6101.9-96.2168.7-176.11790111.7
287T30.6Very low32.7Very low140 Ų140155.7 Ų155.786%0.85981%0.805SS**  trans-58.1163.4169.8-17.20000113.1
288A31Very low33.2Very low88 Ų88154.8 Ų154.873%0.72781%0.808SS**  trans87.496.9162.300000117.2
289N31.7Very low33.3Very low149 Ų149158.7 Ų158.780%0.79781%0.812SS**  46.1102.3111.6-145.324.5000115.5
290D31.2Very low33.8Very low134 Ų134159.1 Ų159.172%0.71781%0.814SS**  trans166.4109133.1-83.5-20.2000110.1
291N35.6Very low33.8Very low160 Ų160159.4 Ų159.486%0.85682%0.817SS**  trans16680.9131.5-81.5-37.7000112
292V33.9Very low33.8Very low105 Ų105159.4 Ų159.464%0.63682%0.816SS**  trans-4.1126.6134.5-178.90000115.8H294V292-H294 WeakPolarHBondContact CG1-CD2 3.46Å
293R38.8Very low34.2Very low240 Ų240157.3 Ų157.391%0.90681%0.811SS**  trans-143.3101.9133.6-104.6-179.7-175.6-167.11.3109.2L295R293-L295 PolarHBondContact O-N 2.85Å; R293-L295 VanDerWaalsContact O-N 3.12Å
294H33.5Very low34.5Very low169 Ų169155.6 Ų155.678%0.78281%0.808SS**  trans-55.5110.5169.9-63.5-79.6000109.9V292 R296V292-H294 WeakPolarHBondContact CG1-CD2 3.46Å; H294-R296 PolarHBondContact O-N 3.14Å; H294-R296 VanDerWaalsContact O-N 3.14Å
295L39.4Very low34.8Very low169 Ų169155 Ų15589%0.88581%0.808SS**  trans-66.6108.6159.7-104109000107R293 E297R293-L295 PolarHBondContact O-N 2.85Å; R293-L295 VanDerWaalsContact O-N 3.12Å; L295-E297 PolarHBondContact O-N 3.19Å
296R34.3Very low34.8Very low240 Ų240156.6 Ų156.691%0.90681%0.811SS**  trans-61116168.4-93178166.3142.9-3.6108.4H294H294-R296 PolarHBondContact O-N 3.14Å; H294-R296 VanDerWaalsContact O-N 3.14Å
297E36.9Very low35.1Very low179 Ų179153 Ų15384%0.83681%0.805SS**  trans-63.6131.7167.6-68.6-177.116700109.8L295 R299L295-E297 PolarHBondContact O-N 3.19Å; E297-R299 PolarHBondContact O-N 3.19Å; E297-R299 VanDerWaalsContact O-N 3.14Å
298P41.4Very low35.1Very low121 Ų121152.8 Ų152.879%0.78680%0.798SS**  trans-66.8114.9177.624.1-29.6000110.2N300P298-N300 VanDerWaalsContact C-N 3.26Å; P298-N300 PolarHBondContact O-N 3.22Å
299R37.7Very low35.1Very low241 Ų241157 Ų15791%0.90980%0.802SS**SBendtrans-60.488.8161.5-82.3-179.4171.1178.4-3.7108.8E297E297-R299 PolarHBondContact O-N 3.19Å; E297-R299 VanDerWaalsContact O-N 3.14Å
300N38.7Very low35.2Very low150 Ų150155.4 Ų155.480%0.80280%0.798SS**  trans-162.766.1153.9-85.5-26.2000106.6P298 V302P298-N300 VanDerWaalsContact C-N 3.26Å; P298-N300 PolarHBondContact O-N 3.22Å; N300-V302 VanDerWaalsContact C-N 3.32Å; N300-V302 PolarHBondContact O-N 3.14Å
301A32.8Very low35.3Very low101 Ų101156 Ų15684%0.83580%0.802SS**  trans-68.394.8170.300000108
302V31.4Very low35.3Very low123 Ų123153.4 Ų153.475%0.74580%0.796SS**PPolyproline II helixtrans-60.2128.6160.5178.50000106.3N300N300-V302 VanDerWaalsContact C-N 3.32Å; N300-V302 PolarHBondContact O-N 3.14Å
303P36.5Very low35.3Very low103 Ų103154.8 Ų154.867%0.66980%0.804SS**PPolyproline II helixtrans-59.4145.6-17822.1-31.4000110.9M305P303-M305 PolarHBondContact O-N 3.09Å
304P36.6Very low35.2Very low128 Ų128146.8 Ų146.883%0.83179%0.785SS**PPolyproline II helixtrans-60.3123.4-17924.8-32.8000109.9E306P304-E306 PolarHBondContact O-N 3.39Å
305M36Very low35.2Very low165 Ų165142.1 Ų142.181%0.81377%0.77SS**PPolyproline II helixtrans-76.5119.9178.3-164.6179-51.300108.7P303 V307P303-M305 PolarHBondContact O-N 3.09Å; M305-V307 PolarHBondContact O-N 3.21Å; M305-V307 VanDerWaalsContact O-N 3.17Å
306E30.4Very low35.1Very low177 Ų177141.2 Ų141.283%0.82776%0.761SS**PPolyproline II helixtrans-56.3118.3173.8-72.2-177.9166.100109.7P304 I308P304-E306 PolarHBondContact O-N 3.39Å; E306-I308 PolarHBondContact O-N 3.08Å
307V38.4Very low35.2Very low130 Ų130136.3 Ų136.379%0.78875%0.752SS**  trans-80.599.5176.6-178.80000107.4M305 E309M305-V307 PolarHBondContact O-N 3.21Å; M305-V307 VanDerWaalsContact O-N 3.17Å; V307-E309 PolarHBondContact O-N 3.35Å
308I31.7Very low35.1Very low137 Ų137134.2 Ų134.270%0.70374%0.743SS**  trans-75.8104.5168.1-58.4173.7000107E306 T310E306-I308 PolarHBondContact O-N 3.08Å; I308-T310 HydrophobicContact CG2-CG2 4.31Å; I308-T310 PolarHBondContact O-N 3.4Å
309E31Very low34.9Very low176 Ų176133.8 Ų133.882%0.82273%0.731SS**  trans-60.6101.9170.6-66.2-177.117400109.1V307V307-E309 PolarHBondContact O-N 3.35Å
310T33.9Very low35Very low115 Ų115128.1 Ų128.171%0.70672%0.719SS**  trans-94.5115.917042.40000108.5I308 S312I308-T310 HydrophobicContact CG2-CG2 4.31Å; I308-T310 PolarHBondContact O-N 3.4Å; T310-S312 PolarHBondContact O-N 3.1Å; T310-S312 VanDerWaalsContact O-N 3.13Å
311N32.5Very low35Very low148 Ų148124.9 Ų124.979%0.79171%0.707SS**  trans-49.5118.5177.2-74.9-42000110.6V313N311-V313 PolarHBondContact O-N 3.45Å
312S36.6Very low35.1Very low105 Ų105123.1 Ų123.173%0.73469%0.688SS**THydrogen-bonded Turntrans-73.910.6-160.851.90000116.4T310T310-S312 PolarHBondContact O-N 3.1Å; T310-S312 VanDerWaalsContact O-N 3.13Å
313V33.4Very low35.6Very low134 Ų134121.2 Ų121.281%0.81268%0.677SS**THydrogen-bonded Turntrans-87.2-18.3-178.2-160.60000112.5N311N311-V313 PolarHBondContact O-N 3.45Å
314S36Very low35.9Very low72 Ų72121 Ų12150%0.50367%0.674SS.*SBendtrans-98.5-13.2-177.2-45.60000114.5H316 L317 E318S314-H316 PolarHBondContact O-N 2.74Å; S314-L317 PolarHBondContact O-N 2.87Å; S314-E318 PolarHBondContact O-N 3.22Å
315C34.4Very low36.1Very low70 Ų70118.2 Ų118.247%0.47365%0.654SS.*Hα-helixtrans-73.2-28.4-167.1-160.30000114L317 M319C315-L317 VanDerWaalsContact C-N 3.32Å; C315-L317 PolarHBondContact O-N 3.14Å; C315-M319 PolarHBondContact O-N 3.02Å; C315-M319 VanDerWaalsContact O-N 3.12Å
316H36.3Very low36.4Very low150 Ų150114.2 Ų114.269%0.69464%0.639SS**Hα-helixtrans-69.4-29.1175.9-84.6-56.3000113.3S314S314-H316 PolarHBondContact O-N 2.74Å
317L37.4Very low36.9Very low137 Ų137108.9 Ų108.972%0.71762%0.621SS**Hα-helixtrans-80.5-38.5177.1-84.6161000111.8S314 C315 C321S314-L317 PolarHBondContact O-N 2.87Å; C315-L317 VanDerWaalsContact C-N 3.32Å; C315-L317 PolarHBondContact O-N 3.14Å; L317-C321 WeakPolarHBondContact O-CB 3.28Å; L317-C321 PolarHBondContact O-N 2.97Å
318E33.8Very low37.1Very low136 Ų136104.7 Ų104.764%0.63660%0.599SS**Hα-helixtrans-69.9-34.2177.7-73-173.3175.500113.1S314 C321 S322S314-E318 PolarHBondContact O-N 3.22Å; E318-C321 PolarHBondContact O-N 3.47Å; E318-S322 VanDerWaalsContact O-CB 3.23Å; E318-S322 WeakPolarHBondContact O-CB 3.24Å; E318-S322 PolarHBondContact O-N 2.88Å
319M38.1Very low37.6Very low111 Ų111105.6 Ų105.655%0.54760%0.595SS.*Hα-helixtrans-66.5-41.1176.7-156.4-168.6-47.200111.7C315 S322 V323C315-M319 PolarHBondContact O-N 3.02Å; C315-M319 VanDerWaalsContact O-N 3.12Å; M319-S322 PolarHBondContact O-N 3Å; M319-V323 WeakPolarHBondContact O-CG2 3.38Å; M319-V323 PolarHBondContact O-N 3.4Å
320L40.1Very low38.3Very low123 Ų123100.4 Ų100.464%0.64458%0.578SS**Hα-helixtrans-66.5-40.5173.5-77167.9000111.5S322 V324L320-S322 VanDerWaalsContact C-N 3.34Å; L320-S322 PolarHBondContact O-N 3.33Å; L320-V324 WeakPolarHBondContact O-CB 3.24Å; L320-V324 VanDerWaalsContact O-CG2 3.26Å; L320-V324 WeakPolarHBondContact O-CG2 3.4Å; L320-V324 PolarHBondContact O-N 2.81Å; L320-V324 VanDerWaalsContact O-N 3.07Å
321C37.8Very low39Very low82 Ų82101.1 Ų101.155%0.55457%0.573SS**Hα-helixtrans-65.9-37.4175.8-132.20000111.7L317 E318 T325L317-C321 WeakPolarHBondContact O-CB 3.28Å; L317-C321 PolarHBondContact O-N 2.97Å; E318-C321 PolarHBondContact O-N 3.47Å; C321-T325 VanDerWaalsContact O-CB 3.3Å; C321-T325 WeakPolarHBondContact O-CB 3.31Å; C321-T325 WeakPolarHBondContact O-CG2 3.44Å; C321-T325 PolarHBondContact O-N 2.84Å; C321-T325 PolarHBondContact O-OG1 3.35Å
322S34.6Very low40Very low64 Ų6498.2 Ų98.245%0.44856%0.557SS.*Hα-helixtrans-70-41.6178.2-177.20000112.4E318 M319 L320 T325 T326E318-S322 VanDerWaalsContact O-CB 3.23Å; E318-S322 WeakPolarHBondContact O-CB 3.24Å; E318-S322 PolarHBondContact O-N 2.88Å; M319-S322 PolarHBondContact O-N 3Å; L320-S322 VanDerWaalsContact C-N 3.34Å; L320-S322 PolarHBondContact O-N 3.33Å; S322-T325 WeakPolarHBondContact CA-OG1 3.45Å; S322-T325 PolarHBondContact O-N 3.39Å; S322-T325 PolarHBondContact O-OG1 3.21Å; S322-T326 WeakPolarHBondContact O-CB 3.4Å; S322-T326 WeakPolarHBondContact O-CG2 3.3Å; S322-T326 PolarHBondContact O-N 2.79Å; S322-T326 PolarHBondContact O-OG1 3.15Å
323V41.1Very low40.4Very low82 Ų8298.2 Ų98.250%0.49755%0.548SS..Hα-helixtrans-67.2-40.3176.4174.10000111.1M319 T326 C327M319-V323 WeakPolarHBondContact O-CG2 3.38Å; M319-V323 PolarHBondContact O-N 3.4Å; V323-T326 WeakPolarHBondContact CA-OG1 3.46Å; V323-T326 PolarHBondContact O-OG1 3.34Å; V323-C327 WeakPolarHBondContact O-CB 3.46Å; V323-C327 PolarHBondContact O-N 2.9Å; V323-C327 PolarHBondContact O-SG 3.14Å; V323-C327 VanDerWaalsContact O-SG 3.38Å
324V43.9Very low41.2Very low100 Ų10098.7 Ų98.761%0.60654%0.539SS*.Hα-helixtrans-69.5-41.9176.2175.80000111.2L320 C327 A328L320-V324 WeakPolarHBondContact O-CB 3.24Å; L320-V324 VanDerWaalsContact O-CG2 3.26Å; L320-V324 WeakPolarHBondContact O-CG2 3.4Å; L320-V324 PolarHBondContact O-N 2.81Å; L320-V324 VanDerWaalsContact O-N 3.07Å; V324-C327 PolarHBondContact O-N 3.03Å; V324-A328 VanDerWaalsContact O-CB 3.3Å; V324-A328 WeakPolarHBondContact O-CB 3.29Å; V324-A328 PolarHBondContact O-N 2.96Å
325T40.6Very low42Very low69 Ų69100.5 Ų100.542%0.42354%0.543SS..Hα-helixtrans-71-34.8177.647.40000112.9C321 S322 A328 Y329C321-T325 VanDerWaalsContact O-CB 3.3Å; C321-T325 WeakPolarHBondContact O-CB 3.31Å; C321-T325 WeakPolarHBondContact O-CG2 3.44Å; C321-T325 PolarHBondContact O-N 2.84Å; C321-T325 PolarHBondContact O-OG1 3.35Å; S322-T325 WeakPolarHBondContact CA-OG1 3.45Å; S322-T325 PolarHBondContact O-N 3.39Å; S322-T325 PolarHBondContact O-OG1 3.21Å; T325-A328 PolarHBondContact O-N 3.1Å; T325-Y329 VanDerWaalsContact O-CB 3.3Å; T325-Y329 WeakPolarHBondContact O-CB 3.28Å; T325-Y329 PolarHBondContact O-N 3.45Å
326T41.5Very low42.5Very low80 Ų80103 Ų10349%0.49155%0.548SS..Hα-helixtrans-70.8-37.4173.246.70000112.1S322 V323 S330S322-T326 WeakPolarHBondContact O-CB 3.4Å; S322-T326 WeakPolarHBondContact O-CG2 3.3Å; S322-T326 PolarHBondContact O-N 2.79Å; S322-T326 PolarHBondContact O-OG1 3.15Å; V323-T326 WeakPolarHBondContact CA-OG1 3.46Å; V323-T326 PolarHBondContact O-OG1 3.34Å; T326-S330 VanDerWaalsContact O-CB 3.28Å; T326-S330 WeakPolarHBondContact O-CB 3.36Å; T326-S330 PolarHBondContact O-N 3.25Å; T326-S330 PolarHBondContact O-OG 3.41Å
327C42.6Very low42.5Very low66 Ų6697.7 Ų97.745%0.44653%0.533SS..Hα-helixtrans-61.6-47.6169.5-78.30000111V323 V324 Y329 S330 Q331V323-C327 WeakPolarHBondContact O-CB 3.46Å; V323-C327 PolarHBondContact O-N 2.9Å; V323-C327 PolarHBondContact O-SG 3.14Å; V323-C327 VanDerWaalsContact O-SG 3.38Å; V324-C327 PolarHBondContact O-N 3.03Å; C327-Y329 PolarHBondContact O-N 2.87Å; C327-S330 PolarHBondContact O-N 3.33Å; C327-S330 PolarHBondContact O-OG 3.31Å; C327-Q331 WeakPolarHBondContact O-CG 3.48Å; C327-Q331 PolarHBondContact O-N 3.42Å
328A42.5Very low43.1Very low41 Ų4196 Ų9634%0.33952%0.524SS..Hα-helixtrans-63-42.9177.800000112.3V324 T325 Q331 I332V324-A328 VanDerWaalsContact O-CB 3.3Å; V324-A328 WeakPolarHBondContact O-CB 3.29Å; V324-A328 PolarHBondContact O-N 2.96Å; T325-A328 PolarHBondContact O-N 3.1Å; A328-Q331 PolarHBondContact O-N 3.45Å; A328-I332 VanDerWaalsContact O-CG1 3.24Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; A328-I332 PolarHBondContact O-N 2.88Å
329Y40.5Very low43.8Very low157 Ų15794.5 Ų94.562%0.61652%0.52SS*.Hα-helixtrans-66.4-39.7176.4-104.7-85.4000112.3T325 C327 Q331 I332 I333T325-Y329 VanDerWaalsContact O-CB 3.3Å; T325-Y329 WeakPolarHBondContact O-CB 3.28Å; T325-Y329 PolarHBondContact O-N 3.45Å; C327-Y329 PolarHBondContact O-N 2.87Å; Y329-Q331 VanDerWaalsContact C-N 3.29Å; Y329-Q331 PolarHBondContact O-N 2.97Å; Y329-I332 PolarHBondContact O-N 3.05Å; Y329-I333 HydrophobicContact CD1-CD1 4.41Å; Y329-I333 WeakPolarHBondContact O-CB 3.47Å; Y329-I333 VanDerWaalsContact O-CG1 3.28Å; Y329-I333 WeakPolarHBondContact O-CG1 3.28Å; Y329-I333 PolarHBondContact O-N 2.74Å
330S45.6Very low44.1Very low67 Ų6792.3 Ų92.347%0.46952%0.519SS..Hα-helixtrans-64.2-36.8176.270.90000111.7T326 C327 F334T326-S330 VanDerWaalsContact O-CB 3.28Å; T326-S330 WeakPolarHBondContact O-CB 3.36Å; T326-S330 PolarHBondContact O-N 3.25Å; T326-S330 PolarHBondContact O-OG 3.41Å; C327-S330 PolarHBondContact O-N 3.33Å; C327-S330 PolarHBondContact O-OG 3.31Å; S330-F334 VanDerWaalsContact O-CB 3.26Å; S330-F334 WeakPolarHBondContact O-CB 3.38Å; S330-F334 PolarHBondContact O-N 3.41Å
331Q50.6Low44.5Very low129 Ų12991.1 Ų91.160%0.60352%0.52SS*.Hα-helixtrans-69.3-41.9173.5-71.1179.30.600111.8C327 A328 Y329 F334 L335C327-Q331 WeakPolarHBondContact O-CG 3.48Å; C327-Q331 PolarHBondContact O-N 3.42Å; A328-Q331 PolarHBondContact O-N 3.45Å; Y329-Q331 VanDerWaalsContact C-N 3.29Å; Y329-Q331 PolarHBondContact O-N 2.97Å; Q331-F334 PolarHBondContact O-N 2.83Å; Q331-L335 WeakPolarHBondContact O-CB 3.33Å; Q331-L335 WeakPolarHBondContact O-CD1 3.49Å; Q331-L335 PolarHBondContact O-N 3.05Å
332I51.6Low44.8Very low87 Ų8791.2 Ų91.245%0.44652%0.522SS..Hα-helixtrans-64.3-46.3176.7-67.9164.1000111A328 Y329 F334 L335 E336A328-I332 VanDerWaalsContact O-CG1 3.24Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; A328-I332 PolarHBondContact O-N 2.88Å; Y329-I332 PolarHBondContact O-N 3.05Å; I332-F334 VanDerWaalsContact C-N 3.29Å; I332-F334 PolarHBondContact O-N 3.29Å; I332-L335 PolarHBondContact O-N 3.06Å; I332-E336 HydrophobicContact CG2-CG 4.37Å; I332-E336 WeakPolarHBondContact O-CB 3.26Å; I332-E336 PolarHBondContact O-N 2.84Å
333I46Very low45.3Very low105 Ų10595.4 Ų95.454%0.53854%0.538SS..Hα-helixtrans-63.6-37.1176.8-66.6168.2000110.7Y329 G337Y329-I333 HydrophobicContact CD1-CD1 4.41Å; Y329-I333 WeakPolarHBondContact O-CB 3.47Å; Y329-I333 VanDerWaalsContact O-CG1 3.28Å; Y329-I333 WeakPolarHBondContact O-CG1 3.28Å; Y329-I333 PolarHBondContact O-N 2.74Å; I333-G337 PolarHBondContact O-N 3.17Å
334F49.4Very low45.3Very low144 Ų144102.7 Ų102.763%0.63257%0.567SS**Hα-helixtrans-66.8-40.3175.9-163.7-97.7000111.8S330 Q331 I332 L338S330-F334 VanDerWaalsContact O-CB 3.26Å; S330-F334 WeakPolarHBondContact O-CB 3.38Å; S330-F334 PolarHBondContact O-N 3.41Å; Q331-F334 PolarHBondContact O-N 2.83Å; I332-F334 VanDerWaalsContact C-N 3.29Å; I332-F334 PolarHBondContact O-N 3.29Å; F334-L338 HydrophobicContact CD1-CD1 3.74Å; F334-L338 HydrophobicContact CD1-CG 4.46Å; F334-L338 HydrophobicContact CE1-CD1 3.61Å; F334-L338 HydrophobicContact CE1-CG 4.35Å; F334-L338 WeakPolarHBondContact O-CB 3.47Å; F334-L338 WeakPolarHBondContact O-CG 3.33Å; F334-L338 PolarHBondContact O-N 2.75Å
335L54Low45.4Very low110 Ų110102.8 Ų102.858%0.57657%0.565SS**Hα-helixtrans-67.1-43.2174.2-93.8140000112.5Q331 I332 L338 L339Q331-L335 WeakPolarHBondContact O-CB 3.33Å; Q331-L335 WeakPolarHBondContact O-CD1 3.49Å; Q331-L335 PolarHBondContact O-N 3.05Å; I332-L335 PolarHBondContact O-N 3.06Å; L335-L338 PolarHBondContact O-N 3.28Å; L335-L339 PolarHBondContact O-N 2.76Å
336E44.7Very low45.6Very low124 Ų124104.6 Ų104.658%0.57957%0.572SS**Hα-helixtrans-67.4-37.7175.2-76-171.1164.100112I332 L339 A340I332-E336 HydrophobicContact CG2-CG 4.37Å; I332-E336 WeakPolarHBondContact O-CB 3.26Å; I332-E336 PolarHBondContact O-N 2.84Å; E336-L339 PolarHBondContact O-N 2.94Å; E336-A340 WeakPolarHBondContact O-CB 3.38Å; E336-A340 PolarHBondContact O-N 3.44Å
337G36.8Very low45.9Very low37 Ų37105.9 Ų105.938%0.38158%0.577SS.*Hα-helixtrans-63.5-40174.200000112.5I333 C341I333-G337 PolarHBondContact O-N 3.17Å; G337-C341 WeakPolarHBondContact O-CB 3.43Å; G337-C341 PolarHBondContact O-N 3.1Å
338L49.4Very low46Very low101 Ų101108.3 Ų108.353%0.52959%0.585SS.*Hα-helixtrans-66-41.1173-76.9168.6000112.1F334 L335 C341 S342F334-L338 HydrophobicContact CD1-CD1 3.74Å; F334-L338 HydrophobicContact CD1-CG 4.46Å; F334-L338 HydrophobicContact CE1-CD1 3.61Å; F334-L338 HydrophobicContact CE1-CG 4.35Å; F334-L338 WeakPolarHBondContact O-CB 3.47Å; F334-L338 WeakPolarHBondContact O-CG 3.33Å; F334-L338 PolarHBondContact O-N 2.75Å; L335-L338 PolarHBondContact O-N 3.28Å; L338-C341 PolarHBondContact O-N 3.1Å; L338-S342 PolarHBondContact O-N 3.22Å; L338-S342 VanDerWaalsContact O-N 3.17Å
339L47.6Very low46.3Very low106 Ų106112.5 Ų112.556%0.55560%0.6SS**Hα-helixtrans-63.7-44175.1-83.7158.5000112.1L335 E336 C341 S342 L343L335-L339 PolarHBondContact O-N 2.76Å; E336-L339 PolarHBondContact O-N 2.94Å; L339-C341 VanDerWaalsContact C-N 3.33Å; L339-C341 PolarHBondContact O-N 3.46Å; L339-S342 PolarHBondContact O-N 3.11Å; L339-S342 VanDerWaalsContact O-N 3.11Å; L339-S342 PolarHBondContact O-OG 2.93Å; L339-L343 PolarHBondContact O-N 3.1Å
340A45.5Very low46.7Very low65 Ų65109.5 Ų109.554%0.53760%0.599SS.*Hα-helixtrans-64.4-35.9177.300000112.4E336 S342E336-A340 WeakPolarHBondContact O-CB 3.38Å; E336-A340 PolarHBondContact O-N 3.44Å; A340-S342 VanDerWaalsContact C-N 3.29Å; A340-S342 PolarHBondContact O-N 3.44Å
341C47.5Very low46.7Very low98 Ų98112.6 Ų112.666%0.66261%0.608SS**Hα-helixtrans-72.2-18.3173.9-80.20000114.1G337 L338 L339G337-C341 WeakPolarHBondContact O-CB 3.43Å; G337-C341 PolarHBondContact O-N 3.1Å; L338-C341 PolarHBondContact O-N 3.1Å; L339-C341 VanDerWaalsContact C-N 3.33Å; L339-C341 PolarHBondContact O-N 3.46Å
342S44.8Very low46.4Very low83 Ų83111.3 Ų111.358%0.5861%0.609SS**Hα-helixtrans-87.8-12177.869.90000114.3L338 L339 A340L338-S342 PolarHBondContact O-N 3.22Å; L338-S342 VanDerWaalsContact O-N 3.17Å; L339-S342 PolarHBondContact O-N 3.11Å; L339-S342 VanDerWaalsContact O-N 3.11Å; L339-S342 PolarHBondContact O-OG 2.93Å; A340-S342 VanDerWaalsContact C-N 3.29Å; A340-S342 PolarHBondContact O-N 3.44Å
343L45.3Very low46Very low153 Ų153113.3 Ų113.380%0.80162%0.622SS**  trans-1031-179.5-85159.1000114.1L339L339-L343 PolarHBondContact O-N 3.1Å
344Q41Very low46Very low234 Ų234114.1 Ų114.1100%1.09363%0.63SS**  trans-98.30162.7-82.8-174.7-19.800109.7

Retrieved 344 of 344 residues in 290.9 ms (Link to these results)