A0A077Z4H7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4H7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 128 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.3Very low46.6Very low247 Ų247135.1 Ų135.1100%1.21779%0.793SS**  098.30-78.4176.117000105.9
2E46.6Very low46.5Very low134 Ų134128.8 Ų128.863%0.62676%0.762SS**  trans-148.980.8-154.7-159.8155.7141.900105.4R5E2-R5 IonicContact OE1-CZ 2.8Å; E2-R5 IonicContact OE1-NH1 3.99Å; E2-R5 IonicContact OE1-NH2 3.98Å; E2-R5 PolarHBondContact OE1-NH2 2.88Å
3S51.2Low47.4Very low106 Ų106131.8 Ų131.874%0.74176%0.76SS**  trans-143.6-8.3-173.2-590000116.1
4D53.9Low48Very low170 Ų170129 Ų12991%0.90974%0.741SS**  trans-113.139.7179-59.9-35.3000112.5
5R46Very low48.9Very low175 Ų175126.7 Ų126.766%0.6672%0.721SS**  trans-71142.4157.2-75.1-173.4175.2144.810.2108.2E2E2-R5 IonicContact OE1-CZ 2.8Å; E2-R5 IonicContact OE1-NH1 3.99Å; E2-R5 IonicContact OE1-NH2 3.98Å; E2-R5 PolarHBondContact OE1-NH2 2.88Å
6I42.8Very low49.1Very low152 Ų152124.6 Ų124.678%0.77971%0.705SS**SBendtrans90.788.7153.7-51.5135.3000115.2
7A38.2Very low49.6Very low92 Ų92123.5 Ų123.576%0.7670%0.696SS**  56.992.7120.700000117.5
8S43Very low50.1Low119 Ų119126.6 Ų126.683%0.83270%0.695SS**  trans-167.9133.3147.9-144.30000113
9A51.6Low50.3Low91 Ų91124.7 Ų124.775%0.75268%0.679SS**  trans74.632.8134.600000120.4I11A9-I11 VanDerWaalsContact C-N 3.3Å; A9-I11 PolarHBondContact O-N 2.99Å
10G44.6Very low50.5Low81 Ų81122.2 Ų122.284%0.83566%0.664SS**  trans-83.921.4168.900000116.2S12G10-S12 PolarHBondContact O-N 3.31Å
11I49Very low51Low119 Ų119119.9 Ų119.961%0.6166%0.655SS**SBendtrans-79.3106172.6-60.2170.6000106.8A9 F13 M16A9-I11 VanDerWaalsContact C-N 3.3Å; A9-I11 PolarHBondContact O-N 2.99Å; I11-F13 PolarHBondContact O-N 3.2Å; I11-M16 HydrophobicContact CB-CE 4.16Å; I11-M16 HydrophobicContact CG2-CE 4.08Å
12S46.4Very low51.6Low60 Ų60113.4 Ų113.442%0.4262%0.622SS.*  trans-47.3126.6-174.548.40000112.3G10 D14 E15 M16G10-S12 PolarHBondContact O-N 3.31Å; S12-D14 PolarHBondContact O-N 2.62Å; S12-E15 PolarHBondContact O-N 3.13Å; S12-E15 WeakPolarHBondContact OG-CB 3.45Å; S12-M16 PolarHBondContact O-N 3.09Å
13F57.7Low51.8Low167 Ų167112.4 Ų112.473%0.73262%0.619SS**Hα-helixtrans-50.4-28.1170.4-102.3-95.5000112.3I11 M16 L17I11-F13 PolarHBondContact O-N 3.2Å; F13-M16 PolarHBondContact O-N 3.14Å; F13-L17 WeakPolarHBondContact O-CB 3.21Å; F13-L17 VanDerWaalsContact O-CG 3.31Å; F13-L17 WeakPolarHBondContact O-CG 2.93Å; F13-L17 PolarHBondContact O-N 2.95Å
14D55.8Low52.1Low93 Ų93114.1 Ų114.150%0.49761%0.613SS.*Hα-helixtrans-66.4-34.6174.9-158.769.9000113S12 R18S12-D14 PolarHBondContact O-N 2.62Å; D14-R18 WeakPolarHBondContact O-CB 3.29Å; D14-R18 PolarHBondContact O-N 3.09Å; D14-R18 IonicContact OD2-CZ 2.62Å; D14-R18 IonicContact OD2-NH1 3.59Å; D14-R18 PolarHBondContact OD2-NH1 2.8Å
15E61.4Low52Low95 Ų95113 Ų11344%0.44460%0.602SS.*Hα-helixtrans-78-31.2175.7-170.5139.217400112S12 K19S12-E15 PolarHBondContact O-N 3.13Å; S12-E15 WeakPolarHBondContact OG-CB 3.45Å; E15-K19 HydrophobicContact CG-CD 4.29Å; E15-K19 WeakPolarHBondContact O-CB 3.46Å; E15-K19 VanDerWaalsContact O-CG 3.32Å; E15-K19 WeakPolarHBondContact O-CG 3.41Å; E15-K19 PolarHBondContact O-N 3.02Å; E15-K19 IonicContact OE1-NZ 2.99Å; E15-K19 PolarHBondContact OE1-NZ 2.91Å
16M51.4Low52.5Low93 Ų93110.4 Ų110.446%0.45860%0.599SS.*Hα-helixtrans-69.8-39.2169.4-63.7-165-160.700112I11 S12 F13 K19 L20I11-M16 HydrophobicContact CB-CE 4.16Å; I11-M16 HydrophobicContact CG2-CE 4.08Å; S12-M16 PolarHBondContact O-N 3.09Å; F13-M16 PolarHBondContact O-N 3.14Å; M16-K19 CarbonylContact O-C 3.59Å; M16-K19 PolarHBondContact O-N 2.82Å; M16-L20 WeakPolarHBondContact O-CB 3.49Å; M16-L20 WeakPolarHBondContact O-CD1 3.26Å; M16-L20 VanDerWaalsContact O-CG 3.3Å; M16-L20 WeakPolarHBondContact O-CG 3.16Å; M16-L20 PolarHBondContact O-N 3.48Å
17L58.3Low53Low105 Ų105105.7 Ų105.755%0.5558%0.583SS.*Hα-helixtrans-68.8-34176-77.3166.1000112.8F13 L20 P21F13-L17 WeakPolarHBondContact O-CB 3.21Å; F13-L17 VanDerWaalsContact O-CG 3.31Å; F13-L17 WeakPolarHBondContact O-CG 2.93Å; F13-L17 PolarHBondContact O-N 2.95Å; L17-L20 HydrophobicContact CD2-CD1 3.84Å; L17-L20 HydrophobicContact CG-CD1 4.45Å; L17-P21 WeakPolarHBondContact O-CD 3.49Å
18R57.7Low53.8Low180 Ų180109.3 Ų109.368%0.67958%0.582SS**Hα-helixtrans-72.3-32170.3-87.4179.3160.8122.6-8.2113.6D14 P21D14-R18 WeakPolarHBondContact O-CB 3.29Å; D14-R18 PolarHBondContact O-N 3.09Å; D14-R18 IonicContact OD2-CZ 2.62Å; D14-R18 IonicContact OD2-NH1 3.59Å; D14-R18 PolarHBondContact OD2-NH1 2.8Å; R18-P21 WeakPolarHBondContact O-CD 3.19Å; R18-P21 WeakPolarHBondContact O-CG 3.34Å
19K54.7Low54.3Low91 Ų91109 Ų10940%0.39657%0.571SS.*Hα-helixtrans-83.8-17.6176.4-74.1177.5-177.8156.90113.8E15 M16 Q22 M23E15-K19 HydrophobicContact CG-CD 4.29Å; E15-K19 WeakPolarHBondContact O-CB 3.46Å; E15-K19 VanDerWaalsContact O-CG 3.32Å; E15-K19 WeakPolarHBondContact O-CG 3.41Å; E15-K19 PolarHBondContact O-N 3.02Å; E15-K19 IonicContact OE1-NZ 2.99Å; E15-K19 PolarHBondContact OE1-NZ 2.91Å; M16-K19 CarbonylContact O-C 3.59Å; M16-K19 PolarHBondContact O-N 2.82Å; K19-Q22 PolarHBondContact O-N 3.07Å; K19-M23 HydrophobicContact CB-CE 4.01Å; K19-M23 WeakPolarHBondContact O-CB 3.23Å; K19-M23 WeakPolarHBondContact O-CG 3.28Å; K19-M23 PolarHBondContact O-N 2.76Å
20L54.4Low54.4Low74 Ų74109.9 Ų109.939%0.38756%0.56SS.*Hα-helixtrans-56-51.3174.4-94157.2000113.5M16 L17 Q22 M23 F24M16-L20 WeakPolarHBondContact O-CB 3.49Å; M16-L20 WeakPolarHBondContact O-CD1 3.26Å; M16-L20 VanDerWaalsContact O-CG 3.3Å; M16-L20 WeakPolarHBondContact O-CG 3.16Å; M16-L20 PolarHBondContact O-N 3.48Å; L17-L20 HydrophobicContact CD2-CD1 3.84Å; L17-L20 HydrophobicContact CG-CD1 4.45Å; L20-Q22 VanDerWaalsContact C-N 3.31Å; L20-Q22 PolarHBondContact O-N 3.02Å; L20-M23 PolarHBondContact O-N 3.48Å; L20-F24 HydrophobicContact CD2-CD2 4.45Å; L20-F24 HydrophobicContact CD2-CE2 3.83Å; L20-F24 WeakPolarHBondContact O-CD2 3.24Å; L20-F24 PolarHBondContact O-N 2.7Å
21P60.8Low54.9Low73 Ų73111.6 Ų111.647%0.47455%0.547SS..Hα-helixtrans-66.6-32.217824.2-32.9000113L17 R18 F24 Q25L17-P21 WeakPolarHBondContact O-CD 3.49Å; R18-P21 WeakPolarHBondContact O-CD 3.19Å; R18-P21 WeakPolarHBondContact O-CG 3.34Å; P21-F24 PolarHBondContact O-N 2.96Å; P21-Q25 WeakPolarHBondContact O-CG 3.32Å; P21-Q25 PolarHBondContact O-N 3.45Å
22Q57.7Low55.1Low111 Ų111110.8 Ų110.852%0.51954%0.543SS..Hα-helixtrans-71.7-35.9176.3-160.817516.300111.7K19 L20 Q25 M26K19-Q22 PolarHBondContact O-N 3.07Å; L20-Q22 VanDerWaalsContact C-N 3.31Å; L20-Q22 PolarHBondContact O-N 3.02Å; Q22-Q25 PolarHBondContact O-N 2.8Å; Q22-M26 WeakPolarHBondContact O-CG 3.44Å; Q22-M26 PolarHBondContact O-N 3.48Å
23M51.2Low55.3Low114 Ų114112.8 Ų112.856%0.56255%0.549SS*.Hα-helixtrans-71.6-32.3171.7-75.5-160.6-105.300112.5K19 L20 A27K19-M23 HydrophobicContact CB-CE 4.01Å; K19-M23 WeakPolarHBondContact O-CB 3.23Å; K19-M23 WeakPolarHBondContact O-CG 3.28Å; K19-M23 PolarHBondContact O-N 2.76Å; L20-M23 PolarHBondContact O-N 3.48Å; M23-A27 WeakPolarHBondContact O-CB 3.31Å; M23-A27 PolarHBondContact O-N 2.83Å
24F56.9Low55.2Low141 Ų141108.1 Ų108.162%0.61853%0.534SS*.Hα-helixtrans-69-35.6171.6-83.8-67.6000112.6L20 P21 A27 K28L20-F24 HydrophobicContact CD2-CD2 4.45Å; L20-F24 HydrophobicContact CD2-CE2 3.83Å; L20-F24 WeakPolarHBondContact O-CD2 3.24Å; L20-F24 PolarHBondContact O-N 2.7Å; P21-F24 PolarHBondContact O-N 2.96Å; F24-A27 PolarHBondContact O-N 3.28Å; F24-K28 WeakPolarHBondContact O-CB 3.38Å; F24-K28 PolarHBondContact O-N 2.92Å
25Q52.8Low55.2Low146 Ų146108.1 Ų108.168%0.68253%0.531SS*.Hα-helixtrans-69.6-41.6173-75.7176.6-8.800111.8P21 Q22 K28 D29P21-Q25 WeakPolarHBondContact O-CG 3.32Å; P21-Q25 PolarHBondContact O-N 3.45Å; Q22-Q25 PolarHBondContact O-N 2.8Å; Q25-K28 PolarHBondContact O-N 2.85Å; Q25-D29 PolarHBondContact O-N 3.42Å; Q25-D29 VanDerWaalsContact O-N 3.1Å
26M55.3Low54.7Low121 Ų121110.8 Ų110.860%0.59654%0.538SS*.Hα-helixtrans-66.3-34.8171.2-74.2-176.7174.600112.7Q22 D29 M30Q22-M26 WeakPolarHBondContact O-CG 3.44Å; Q22-M26 PolarHBondContact O-N 3.48Å; M26-D29 PolarHBondContact O-N 2.83Å; M26-M30 VanDerWaalsContact O-CB 3.24Å; M26-M30 WeakPolarHBondContact O-CB 3.36Å; M26-M30 WeakPolarHBondContact O-CG 3.43Å; M26-M30 PolarHBondContact O-N 3.46Å
27A53.9Low55.1Low53 Ų53111.3 Ų111.344%0.43854%0.542SS..Hα-helixtrans-69.4-33.5175.600000112M23 F24 M30 H31M23-A27 WeakPolarHBondContact O-CB 3.31Å; M23-A27 PolarHBondContact O-N 2.83Å; F24-A27 PolarHBondContact O-N 3.28Å; A27-M30 PolarHBondContact O-N 3.45Å; A27-H31 WeakPolarHBondContact O-CB 3.19Å; A27-H31 PolarHBondContact O-N 2.82Å
28K54.8Low55.1Low168 Ų168108.9 Ų108.973%0.7353%0.534SS*.Hα-helixtrans-72.5-35.4176.4-160167.7-174.6172.70112F24 Q25F24-K28 WeakPolarHBondContact O-CB 3.38Å; F24-K28 PolarHBondContact O-N 2.92Å; Q25-K28 PolarHBondContact O-N 2.85Å
29D54Low55.4Low114 Ų114105.1 Ų105.161%0.6152%0.524SS*.Hα-helixtrans-72.3-36.8171.4-123.310.8000112Q25 M26 L33Q25-D29 PolarHBondContact O-N 3.42Å; Q25-D29 VanDerWaalsContact O-N 3.1Å; M26-D29 PolarHBondContact O-N 2.83Å; D29-L33 PolarHBondContact O-N 2.79Å
30M53.3Low56.1Low108 Ų108106.5 Ų106.553%0.53253%0.533SS..Hα-helixtrans-69.8-31.1173.3-74.3-74.5121.500112.5M26 A27 N32 L33 T34M26-M30 VanDerWaalsContact O-CB 3.24Å; M26-M30 WeakPolarHBondContact O-CB 3.36Å; M26-M30 WeakPolarHBondContact O-CG 3.43Å; M26-M30 PolarHBondContact O-N 3.46Å; A27-M30 PolarHBondContact O-N 3.45Å; M30-N32 VanDerWaalsContact C-N 3.34Å; M30-N32 PolarHBondContact O-N 2.83Å; M30-L33 HydrophobicContact CE-CD1 3.94Å; M30-L33 PolarHBondContact O-N 3.36Å; M30-T34 VanDerWaalsContact O-CB 3.28Å; M30-T34 WeakPolarHBondContact O-CB 3.33Å; M30-T34 VanDerWaalsContact O-CG2 3.31Å; M30-T34 WeakPolarHBondContact O-CG2 3.48Å; M30-T34 PolarHBondContact O-N 3.28Å; M30-T34 PolarHBondContact O-OG1 2.82Å
31H55Low57.3Low117 Ų117111.7 Ų111.754%0.54255%0.548SS..Hα-helixtrans-64.3-39.5176.9-170.1-77.3000111.6A27 T34 E35A27-H31 WeakPolarHBondContact O-CB 3.19Å; A27-H31 PolarHBondContact O-N 2.82Å; H31-T34 VanDerWaalsContact CA-OG1 3.31Å; H31-T34 WeakPolarHBondContact CA-OG1 3.31Å; H31-T34 PolarHBondContact O-N 2.83Å; H31-T34 PolarHBondContact O-OG1 3.47Å; H31-E35 IonicContact ND1-OE2 3.52Å; H31-E35 PolarHBondContact O-N 3.5Å
32N52.6Low58.3Low102 Ų102113.1 Ų113.155%0.54555%0.55SS.*Hα-helixtrans-75.9-30.3178.4-143.20.6000112.3M30M30-N32 VanDerWaalsContact C-N 3.34Å; M30-N32 PolarHBondContact O-N 2.83Å
33L51.3Low59.5Low102 Ų102112.6 Ų112.653%0.53455%0.55SS.*Hα-helixtrans-76.5-29.7171-85.9164.1000113.5D29 M30 Y36 I37D29-L33 PolarHBondContact O-N 2.79Å; M30-L33 HydrophobicContact CE-CD1 3.94Å; M30-L33 PolarHBondContact O-N 3.36Å; L33-Y36 PolarHBondContact O-N 2.9Å; L33-I37 PolarHBondContact O-N 3.44Å; L33-I37 VanDerWaalsContact O-N 3.09Å
34T55Low61Low69 Ų69114.2 Ų114.242%0.42356%0.555SS.*Hα-helixtrans-80.6-27.5177.546.30000113.2M30 H31 Y36 I37 S38M30-T34 VanDerWaalsContact O-CB 3.28Å; M30-T34 WeakPolarHBondContact O-CB 3.33Å; M30-T34 VanDerWaalsContact O-CG2 3.31Å; M30-T34 WeakPolarHBondContact O-CG2 3.48Å; M30-T34 PolarHBondContact O-N 3.28Å; M30-T34 PolarHBondContact O-OG1 2.82Å; H31-T34 VanDerWaalsContact CA-OG1 3.31Å; H31-T34 WeakPolarHBondContact CA-OG1 3.31Å; H31-T34 PolarHBondContact O-N 2.83Å; H31-T34 PolarHBondContact O-OG1 3.47Å; T34-Y36 VanDerWaalsContact C-N 3.31Å; T34-I37 PolarHBondContact O-N 3.36Å; T34-S38 WeakPolarHBondContact O-CB 3.43Å; T34-S38 PolarHBondContact O-N 2.93Å; T34-S38 PolarHBondContact O-OG 2.83Å
35E55.7Low62.4Low93 Ų93113.9 Ų113.944%0.43556%0.557SS.*Hα-helixtrans-60.9-41.5165.5-95.8-178.3143.800111.1H31 S38 Q39H31-E35 IonicContact ND1-OE2 3.52Å; H31-E35 PolarHBondContact O-N 3.5Å; E35-S38 PolarHBondContact O-OG 3.3Å; E35-S38 VanDerWaalsContact O-OG 3.14Å; E35-Q39 VanDerWaalsContact O-CB 3.3Å; E35-Q39 WeakPolarHBondContact O-CB 3.31Å; E35-Q39 VanDerWaalsContact O-CG 3.25Å; E35-Q39 WeakPolarHBondContact O-CG 3.23Å; E35-Q39 PolarHBondContact O-N 2.92Å
36Y53Low64.2Low152 Ų152111.7 Ų111.760%0.59655%0.549SS*.Hα-helixtrans-65.7-39.1173.5-98.9-87.2000112.8L33 T34 M40L33-Y36 PolarHBondContact O-N 2.9Å; T34-Y36 VanDerWaalsContact C-N 3.31Å; Y36-M40 WeakPolarHBondContact O-CB 3.45Å; Y36-M40 WeakPolarHBondContact O-CG 3.25Å; Y36-M40 PolarHBondContact O-N 3.47Å
37I58Low65.9Low103 Ų103110.7 Ų110.753%0.52855%0.549SS..Hα-helixtrans-70.2-36.3179.1-101.7161.8000113.1L33 T34 R41L33-I37 PolarHBondContact O-N 3.44Å; L33-I37 VanDerWaalsContact O-N 3.09Å; T34-I37 PolarHBondContact O-N 3.36Å; I37-R41 WeakPolarHBondContact O-CG 3.42Å; I37-R41 PolarHBondContact O-N 3.48Å
38S59.9Low67.8Low55 Ų55110.9 Ų110.939%0.38555%0.545SS..Hα-helixtrans-75.3-36.9176.460.80000111.6T34 E35 R41 I42T34-S38 WeakPolarHBondContact O-CB 3.43Å; T34-S38 PolarHBondContact O-N 2.93Å; T34-S38 PolarHBondContact O-OG 2.83Å; E35-S38 PolarHBondContact O-OG 3.3Å; E35-S38 VanDerWaalsContact O-OG 3.14Å; S38-R41 PolarHBondContact O-N 3.32Å; S38-I42 WeakPolarHBondContact O-CG1 3.33Å; S38-I42 PolarHBondContact O-N 2.92Å; S38-I42 VanDerWaalsContact O-N 3.16Å
39Q63.7Low69.7Low101 Ų101106.6 Ų106.647%0.47253%0.533SS..Hα-helixtrans-63.8-42.4172.9-77.1179.7-2.600112.3E35 R41 I42 L43E35-Q39 VanDerWaalsContact O-CB 3.3Å; E35-Q39 WeakPolarHBondContact O-CB 3.31Å; E35-Q39 VanDerWaalsContact O-CG 3.25Å; E35-Q39 WeakPolarHBondContact O-CG 3.23Å; E35-Q39 PolarHBondContact O-N 2.92Å; Q39-R41 VanDerWaalsContact C-N 3.29Å; Q39-R41 PolarHBondContact O-N 2.9Å; Q39-I42 PolarHBondContact O-N 3.48Å; Q39-L43 WeakPolarHBondContact O-CB 3.45Å; Q39-L43 PolarHBondContact O-N 2.85Å
40M68.5Low71.6Confident120 Ų120106.8 Ų106.859%0.59153%0.533SS*.Hα-helixtrans-61.9-36.2176.6-74.6-62.5-152.200112.6Y36 F44Y36-M40 WeakPolarHBondContact O-CB 3.45Å; Y36-M40 WeakPolarHBondContact O-CG 3.25Å; Y36-M40 PolarHBondContact O-N 3.47Å; M40-F44 WeakPolarHBondContact O-CB 3.45Å; M40-F44 PolarHBondContact O-N 2.7Å
41R79.8Confident73.6Confident182 Ų182104 Ų10469%0.68753%0.532SS*.Hα-helixtrans-66.2-42.3175.4-72.3174.1-178.9-137.41.3112I37 S38 Q39 F44 M45I37-R41 WeakPolarHBondContact O-CG 3.42Å; I37-R41 PolarHBondContact O-N 3.48Å; S38-R41 PolarHBondContact O-N 3.32Å; Q39-R41 VanDerWaalsContact C-N 3.29Å; Q39-R41 PolarHBondContact O-N 2.9Å; R41-F44 PolarHBondContact O-N 3.33Å; R41-M45 VanDerWaalsContact O-CG 3.31Å; R41-M45 WeakPolarHBondContact O-CG 3.3Å; R41-M45 PolarHBondContact O-N 3.35Å
42I81.5Confident75.5Confident103 Ų103103.1 Ų103.153%0.52853%0.531SS..Hα-helixtrans-66.7-44.7178.3-65.8162.1000110.6S38 Q39 F44 M45 L46S38-I42 WeakPolarHBondContact O-CG1 3.33Å; S38-I42 PolarHBondContact O-N 2.92Å; S38-I42 VanDerWaalsContact O-N 3.16Å; Q39-I42 PolarHBondContact O-N 3.48Å; I42-F44 VanDerWaalsContact C-N 3.33Å; I42-F44 PolarHBondContact O-N 3.33Å; I42-M45 PolarHBondContact O-N 3.36Å; I42-L46 HydrophobicContact CG2-CD1 4.09Å; I42-L46 HydrophobicContact CG2-CG 4.48Å; I42-L46 WeakPolarHBondContact O-CB 3.49Å; I42-L46 WeakPolarHBondContact O-CG 3.35Å; I42-L46 PolarHBondContact O-N 3.4Å
43L82.8Confident77.5Confident100 Ų100103.5 Ų103.552%0.52453%0.532SS..Hα-helixtrans-57.9-45.1174-87.5149.7000111.5Q39 L46 V47Q39-L43 WeakPolarHBondContact O-CB 3.45Å; Q39-L43 PolarHBondContact O-N 2.85Å; L43-L46 PolarHBondContact O-N 3.27Å; L43-V47 VanDerWaalsContact O-CG2 3.32Å; L43-V47 WeakPolarHBondContact O-CG2 3.42Å; L43-V47 PolarHBondContact O-N 2.9Å
44F84.4Confident79.5Confident149 Ų149100.8 Ų100.865%0.65453%0.529SS*.Hα-helixtrans-62.8-44.1177.4-166.9-92.3000112M40 R41 I42 V47 T48M40-F44 WeakPolarHBondContact O-CB 3.45Å; M40-F44 PolarHBondContact O-N 2.7Å; R41-F44 PolarHBondContact O-N 3.33Å; I42-F44 VanDerWaalsContact C-N 3.33Å; I42-F44 PolarHBondContact O-N 3.33Å; F44-V47 PolarHBondContact O-N 3.16Å; F44-T48 VanDerWaalsContact O-CB 3.31Å; F44-T48 WeakPolarHBondContact O-CB 3.47Å; F44-T48 PolarHBondContact O-N 2.87Å; F44-T48 PolarHBondContact O-OG1 2.92Å
45M85.5Confident81.3Confident134 Ų13499.3 Ų99.366%0.6653%0.527SS*.Hα-helixtrans-60.6-44.7174.9-74.1-67.2-162.100111.6R41 I42 T48 V49R41-M45 VanDerWaalsContact O-CG 3.31Å; R41-M45 WeakPolarHBondContact O-CG 3.3Å; R41-M45 PolarHBondContact O-N 3.35Å; I42-M45 PolarHBondContact O-N 3.36Å; M45-T48 PolarHBondContact O-N 2.91Å; M45-V49 WeakPolarHBondContact O-CB 3.13Å; M45-V49 VanDerWaalsContact O-CG2 3.23Å; M45-V49 WeakPolarHBondContact O-CG2 3.24Å; M45-V49 PolarHBondContact O-N 2.98Å
46L90.3Very high83.1Confident100 Ų10099.9 Ų99.952%0.52453%0.533SS..Hα-helixtrans-62.9-47.3178.1-77.2172000112.5I42 L43 T48 V49 L50I42-L46 HydrophobicContact CG2-CD1 4.09Å; I42-L46 HydrophobicContact CG2-CG 4.48Å; I42-L46 WeakPolarHBondContact O-CB 3.49Å; I42-L46 WeakPolarHBondContact O-CG 3.35Å; I42-L46 PolarHBondContact O-N 3.4Å; L43-L46 PolarHBondContact O-N 3.27Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.27Å; L46-V49 PolarHBondContact O-N 2.94Å; L46-L50 WeakPolarHBondContact O-CB 3.31Å; L46-L50 WeakPolarHBondContact O-CG 3.28Å; L46-L50 PolarHBondContact O-N 3.44Å
47V91.2Very high85.1Confident99 Ų9994.2 Ų94.260%0.652%0.521SS*.Hα-helixtrans-61.9-41.3177.2172.40000110.7L43 F44 L50 G51L43-V47 VanDerWaalsContact O-CG2 3.32Å; L43-V47 WeakPolarHBondContact O-CG2 3.42Å; L43-V47 PolarHBondContact O-N 2.9Å; F44-V47 PolarHBondContact O-N 3.16Å; V47-L50 PolarHBondContact O-N 3.21Å; V47-G51 PolarHBondContact O-N 2.95Å
48T93.3Very high86.6Confident57 Ų5796.4 Ų96.435%0.3553%0.527SS..Hα-helixtrans-62.9-46.4177.1-56.80000111.3F44 M45 L46 G51 I52F44-T48 VanDerWaalsContact O-CB 3.31Å; F44-T48 WeakPolarHBondContact O-CB 3.47Å; F44-T48 PolarHBondContact O-N 2.87Å; F44-T48 PolarHBondContact O-OG1 2.92Å; M45-T48 PolarHBondContact O-N 2.91Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.27Å; T48-G51 PolarHBondContact O-N 3.3Å; T48-I52 HydrophobicContact CG2-CD1 4Å; T48-I52 VanDerWaalsContact O-CG1 3.31Å; T48-I52 WeakPolarHBondContact O-CG1 3.35Å; T48-I52 PolarHBondContact O-N 3.48Å
49V94.5Very high88Confident78 Ų7899.2 Ų99.247%0.47354%0.537SS..Hα-helixtrans-64.1-44178.6170.10000111.3M45 L46 G51 I52 L53M45-V49 WeakPolarHBondContact O-CB 3.13Å; M45-V49 VanDerWaalsContact O-CG2 3.23Å; M45-V49 WeakPolarHBondContact O-CG2 3.24Å; M45-V49 PolarHBondContact O-N 2.98Å; L46-V49 PolarHBondContact O-N 2.94Å; V49-G51 VanDerWaalsContact C-N 3.33Å; V49-G51 PolarHBondContact O-N 2.79Å; V49-I52 PolarHBondContact O-N 3.46Å; V49-L53 HydrophobicContact CG1-CD1 3.74Å; V49-L53 WeakPolarHBondContact O-CB 3.35Å; V49-L53 WeakPolarHBondContact O-CG 3.35Å; V49-L53 PolarHBondContact O-N 3.09Å
50L94.6Very high89.3Confident118 Ų11899.8 Ų99.862%0.61854%0.538SS*.Hα-helixtrans-64-37.5174.9-72.9173.2000112.1L46 V47 G54L46-L50 WeakPolarHBondContact O-CB 3.31Å; L46-L50 WeakPolarHBondContact O-CG 3.28Å; L46-L50 PolarHBondContact O-N 3.44Å; V47-L50 PolarHBondContact O-N 3.21Å; L50-G54 WeakPolarHBondContact O-CA 3.11Å; L50-G54 PolarHBondContact O-N 2.89Å
51G94.7Very high90.3Very high50 Ų5097.8 Ų97.852%0.51553%0.532SS..Hα-helixtrans-64.1-44174.500000112.6V47 T48 V49 G55V47-G51 PolarHBondContact O-N 2.95Å; T48-G51 PolarHBondContact O-N 3.3Å; V49-G51 VanDerWaalsContact C-N 3.33Å; V49-G51 PolarHBondContact O-N 2.79Å; G51-G55 PolarHBondContact O-N 2.98Å
52I94.7Very high90.5Very high98 Ų9892.2 Ų92.250%0.50352%0.519SS..Hα-helixtrans-65.3-48176-66.6165.6000110.5T48 V49 G54 G55 L56T48-I52 HydrophobicContact CG2-CD1 4Å; T48-I52 VanDerWaalsContact O-CG1 3.31Å; T48-I52 WeakPolarHBondContact O-CG1 3.35Å; T48-I52 PolarHBondContact O-N 3.48Å; V49-I52 PolarHBondContact O-N 3.46Å; I52-G54 PolarHBondContact O-N 3.22Å; I52-G55 PolarHBondContact O-N 3.14Å; I52-L56 HydrophobicContact CG2-CD1 3.76Å; I52-L56 HydrophobicContact CG2-CG 4.3Å; I52-L56 WeakPolarHBondContact O-CB 3.31Å; I52-L56 VanDerWaalsContact O-CG 3.28Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 2.94Å
53L95.1Very high90.4Very high111 Ų11189.7 Ų89.758%0.58151%0.513SS*.Hα-helixtrans-61.9-43.7177.7-79.8162.2000111.9V49 G57V49-L53 HydrophobicContact CG1-CD1 3.74Å; V49-L53 WeakPolarHBondContact O-CB 3.35Å; V49-L53 WeakPolarHBondContact O-CG 3.35Å; V49-L53 PolarHBondContact O-N 3.09Å; L53-G57 PolarHBondContact O-N 3.48Å
54G94Very high90.3Very high44 Ų4493.2 Ų93.245%0.45452%0.52SS..Hα-helixtrans-64.2-44.217600000112.1L50 I52 G57 F58L50-G54 WeakPolarHBondContact O-CA 3.11Å; L50-G54 PolarHBondContact O-N 2.89Å; I52-G54 PolarHBondContact O-N 3.22Å; G54-G57 PolarHBondContact O-N 3.15Å; G54-F58 WeakPolarHBondContact O-CB 3.32Å; G54-F58 PolarHBondContact O-N 3.04Å
55G93Very high89.7Confident39 Ų3996.2 Ų96.240%0.40253%0.526SS..Hα-helixtrans-63.7-46.617600000112.7G51 I52 F58 L59G51-G55 PolarHBondContact O-N 2.98Å; I52-G55 PolarHBondContact O-N 3.14Å; G55-F58 PolarHBondContact O-N 3.01Å; G55-L59 VanDerWaalsContact O-CB 3.24Å; G55-L59 WeakPolarHBondContact O-CB 3.37Å; G55-L59 PolarHBondContact O-N 2.63Å
56L93.7Very high88.4Confident105 Ų10590.8 Ų90.855%0.5551%0.505SS..Hα-helixtrans-64.7-42.7175.6-72.8173.1000111.8I52 L59 F60I52-L56 HydrophobicContact CG2-CD1 3.76Å; I52-L56 HydrophobicContact CG2-CG 4.3Å; I52-L56 WeakPolarHBondContact O-CB 3.31Å; I52-L56 VanDerWaalsContact O-CG 3.28Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 2.94Å; L56-L59 PolarHBondContact O-N 3.1Å; L56-F60 VanDerWaalsContact O-CB 3.23Å; L56-F60 WeakPolarHBondContact O-CB 3.37Å; L56-F60 PolarHBondContact O-N 2.85Å
57G93.2Very high86.7Confident33 Ų3396.7 Ų96.734%0.3452%0.52SS..Hα-helixtrans-62.8-45.8175.800000112L53 G54 F60 V61L53-G57 PolarHBondContact O-N 3.48Å; G54-G57 PolarHBondContact O-N 3.15Å; G57-F60 PolarHBondContact O-N 2.75Å; G57-V61 WeakPolarHBondContact O-CG2 3.42Å; G57-V61 PolarHBondContact O-N 3.47Å
58F90.9Very high84.8Confident148 Ų148103.9 Ų103.965%0.64954%0.537SS*.Hα-helixtrans-63-43.5175.7-179.7-97.8000111.8G54 G55 F60 V61 T62G54-F58 WeakPolarHBondContact O-CB 3.32Å; G54-F58 PolarHBondContact O-N 3.04Å; G55-F58 PolarHBondContact O-N 3.01Å; F58-F60 VanDerWaalsContact C-N 3.33Å; F58-F60 PolarHBondContact O-N 3.49Å; F58-V61 PolarHBondContact O-N 3.38Å; F58-T62 WeakPolarHBondContact O-CB 3.43Å; F58-T62 PolarHBondContact O-N 3.49Å; F58-T62 PolarHBondContact O-OG1 3.29Å
59L89.3Confident82.8Confident114 Ų114104.3 Ų104.360%0.59755%0.553SS**Hα-helixtrans-63.2-40.3175.6-170.173000111G55 L56 T62 A63G55-L59 VanDerWaalsContact O-CB 3.24Å; G55-L59 WeakPolarHBondContact O-CB 3.37Å; G55-L59 PolarHBondContact O-N 2.63Å; L56-L59 PolarHBondContact O-N 3.1Å; L59-T62 PolarHBondContact O-N 3.34Å; L59-A63 WeakPolarHBondContact O-CB 3.49Å; L59-A63 PolarHBondContact O-N 3.45Å
60F91.5Very high80.6Confident113 Ų113104.3 Ų104.350%0.49656%0.556SS.*Hα-helixtrans-66.5-44.5178.2-173.7-101.8000112.3L56 G57 F58 A63 R64L56-F60 VanDerWaalsContact O-CB 3.23Å; L56-F60 WeakPolarHBondContact O-CB 3.37Å; L56-F60 PolarHBondContact O-N 2.85Å; G57-F60 PolarHBondContact O-N 2.75Å; F58-F60 VanDerWaalsContact C-N 3.33Å; F58-F60 PolarHBondContact O-N 3.49Å; F60-A63 PolarHBondContact O-N 3.33Å; F60-R64 VanDerWaalsContact CE1-NH1 3.34Å; F60-R64 WeakPolarHBondContact O-CB 3.41Å; F60-R64 PolarHBondContact O-N 3.4Å
61V87.7Confident78.4Confident78 Ų78111 Ų11147%0.47357%0.573SS.*Hα-helixtrans-63.5-45.9174.3171.80000110.4G57 F58 R64 R65G57-V61 WeakPolarHBondContact O-CG2 3.42Å; G57-V61 PolarHBondContact O-N 3.47Å; F58-V61 PolarHBondContact O-N 3.38Å; V61-R64 PolarHBondContact O-N 2.94Å; V61-R65 WeakPolarHBondContact O-CB 3.09Å; V61-R65 PolarHBondContact O-N 2.82Å
62T84.7Confident76.2Confident66 Ų66112.5 Ų112.541%0.40558%0.576SS.*Hα-helixtrans-65.4-39.1179-59.90000111.7F58 L59 G66F58-T62 WeakPolarHBondContact O-CB 3.43Å; F58-T62 PolarHBondContact O-N 3.49Å; F58-T62 PolarHBondContact O-OG1 3.29Å; L59-T62 PolarHBondContact O-N 3.34Å; T62-G66 VanDerWaalsContact O-CA 3.26Å; T62-G66 WeakPolarHBondContact O-CA 3.3Å; T62-G66 PolarHBondContact O-N 2.81Å
63A80.3Confident74.2Confident50 Ų50113.9 Ų113.941%0.41359%0.589SS.*Hα-helixtrans-67.3-40174.700000111.4L59 F60 R67L59-A63 WeakPolarHBondContact O-CB 3.49Å; L59-A63 PolarHBondContact O-N 3.45Å; F60-A63 PolarHBondContact O-N 3.33Å; A63-R67 VanDerWaalsContact O-CG 3.29Å; A63-R67 WeakPolarHBondContact O-CG 3.12Å; A63-R67 PolarHBondContact O-N 3.41Å
64R80.7Confident71.9Confident174 Ų174112 Ų11266%0.65760%0.596SS**Hα-helixtrans-68-41.9175.7-81.6-170.1167.8173-1.2112.7F60 V61F60-R64 VanDerWaalsContact CE1-NH1 3.34Å; F60-R64 WeakPolarHBondContact O-CB 3.41Å; F60-R64 PolarHBondContact O-N 3.4Å; V61-R64 PolarHBondContact O-N 2.94Å
65R70.6Confident69.9Low211 Ų211119.9 Ų119.980%0.79661%0.613SS**Hα-helixtrans-68-41.6172.9-106.6174.8169.7162.9-3111.8V61 R67V61-R65 WeakPolarHBondContact O-CB 3.09Å; V61-R65 PolarHBondContact O-N 2.82Å; R65-R67 PolarHBondContact O-N 3.01Å
66G57.6Low68Low21 Ų21129.2 Ų129.222%0.21664%0.637CS.*Hα-helixtrans-76.2-15.5-175.500000114.7T62 R68 G69 S70T62-G66 VanDerWaalsContact O-CA 3.26Å; T62-G66 WeakPolarHBondContact O-CA 3.3Å; T62-G66 PolarHBondContact O-N 2.81Å; G66-R68 PolarHBondContact O-N 2.9Å; G66-G69 PolarHBondContact O-N 2.8Å; G66-S70 WeakPolarHBondContact O-CB 3.35Å; G66-S70 PolarHBondContact O-N 3.01Å
67R55.3Low65.7Low223 Ų223135.3 Ų135.384%0.84265%0.653SS**THydrogen-bonded Turntrans-61.4-13.1171.9-88.4-179.7-167.1-146.35113.9A63 R65A63-R67 VanDerWaalsContact O-CG 3.29Å; A63-R67 WeakPolarHBondContact O-CG 3.12Å; A63-R67 PolarHBondContact O-N 3.41Å; R65-R67 PolarHBondContact O-N 3.01Å
68R51.5Low63.5Low250 Ų250144.7 Ų144.794%0.94368%0.678SS**THydrogen-bonded Turntrans-98.1-6.7169-70.4-171.4176.9-174.7-0.8114.9G66G66-R68 PolarHBondContact O-N 2.9Å
69G51.4Low61.6Low67 Ų67143.9 Ų143.969%0.69169%0.689SS**THydrogen-bonded Turntrans-141.6-6.2-171.500000117.8G66G66-G69 PolarHBondContact O-N 2.8Å
70S48.8Very low59.7Low78 Ų78145.4 Ų145.455%0.54570%0.698SS.*  trans-113.266.2-174.8-158.50000112.2G66G66-S70 WeakPolarHBondContact O-CB 3.35Å; G66-S70 PolarHBondContact O-N 3.01Å
71R47.8Very low57.6Low257 Ų257144.4 Ų144.497%0.9771%0.71SS**  trans-93.39.6164.6-85.5-174.8173169.6-2.4112.6
72S48.5Very low55.9Low82 Ų82149.6 Ų149.657%0.57373%0.729SS**SBendtrans-122.919.2-162.1-154.40000116.6
73T53.4Low54.3Low127 Ų127153.7 Ų153.778%0.77975%0.749SS**SBendtrans-127.331.5176.529.20000113.2
74G47.1Very low53Low71 Ų71155.8 Ų155.873%0.73276%0.761SS**  trans-99.913.3172.200000115.2
75R51.9Low51.6Low211 Ų211154.9 Ų154.980%0.79677%0.767SS**THydrogen-bonded Turntrans-93.811.1-170.2-88.3-163.8-81.1177.2-4.8116.9
76Y51.4Low50.7Low234 Ų234152.2 Ų152.292%0.91877%0.769SS**THydrogen-bonded Turntrans-122.218.1-179-78.7-79.5000115.2
77R45.3Very low50.6Low234 Ų234157 Ų15788%0.88380%0.799SS**  trans-133.697.1176.4-96.4-163.7-176.6-168.62112.2
78R47.4Very low50.6Low230 Ų230154 Ų15487%0.86880%0.799SS**  trans156.383.3142.9-93.3179.9176.6177.2-1.7108.2
79C51.1Low50.8Low130 Ų130146.8 Ų146.888%0.87879%0.794SS**  trans-109.375.4151.4-63.50000105
80D49.6Very low50.9Low147 Ų147149.6 Ų149.679%0.78680%0.801SS**  trans-136.7139.4172.9-92.1-45.6000106.5
81A47.8Very low51.1Low91 Ų91157.2 Ų157.275%0.75282%0.818SS**  trans82.291.5-16700000111.7
82E51.4Low51.3Low187 Ų187150.8 Ų150.887%0.87481%0.808SS**  37.668.358.3-54.9-138.7128.500110.8
83D52.2Low51.5Low153 Ų153153.6 Ų153.682%0.81882%0.821SS**  trans180132.4131.7-93.8-30000111.2
84S51.5Low51.6Low94 Ų94155.7 Ų155.766%0.65783%0.828SS**  trans51.4110.6152.264.70000119.4
85I53.2Low51.9Low154 Ų154160.6 Ų160.679%0.7983%0.832SS**  trans62.984.3138.1-47.1163.2000113.9
86D51.2Low51.9Low155 Ų155161.1 Ų161.183%0.82983%0.834SS**  trans-177.4102.9137.3-89.5-25.4000112.1N88D86-N88 VanDerWaalsContact C-N 3.34Å; D86-N88 PolarHBondContact O-N 3.3Å
87S54.7Low52Low122 Ų122158.3 Ų158.385%0.85384%0.835SS**THydrogen-bonded Turntrans-77.555.8-177.2-63.90000114.3
88N55.2Low52.3Low159 Ų159151.7 Ų151.785%0.8581%0.814SS**THydrogen-bonded Turntrans-147.83.5-178.2-101.2-26.6000120.6D86D86-N88 VanDerWaalsContact C-N 3.34Å; D86-N88 PolarHBondContact O-N 3.3Å
89A55.7Low52.8Low100 Ų100149 Ų14983%0.82681%0.808SS**SBendtrans-102.9-19.1-170.100000117.4
90C53.2Low53.1Low126 Ų126149.7 Ų149.785%0.85180%0.804SS**SBendtrans-10413.5-165-81.60000116.8
91R52.9Low53.4Low237 Ų237151.1 Ų151.189%0.89481%0.81SS**SBendtrans-139.335.2-161.4-122.9-178.9-177.6161.91.4117.6
92T53.1Low53.5Low123 Ų123152.4 Ų152.476%0.75581%0.811SS**  trans-168.297.7173143.50000111.3
93T53.3Low53.3Low140 Ų140154.7 Ų154.786%0.85981%0.811SS**  trans177.961144.7230000110.4
94D54.5Low52.9Low171 Ų171158.1 Ų158.191%0.91481%0.813SS**SBendtrans-132.520.5173.3-115.1-11.7000113.9
95Q54.4Low52.9Low174 Ų174158.8 Ų158.881%0.81381%0.813SS**SBendtrans-138.4-16.2-173.9-125.6-178.914.700118.3
96W51.8Low52.8Low223 Ų223159.2 Ų159.285%0.84581%0.811SS**  trans-116.8-9.2-165.6-167.7-94000117.5Q98W96-Q98 PolarHBondContact O-N 2.97Å
97N52.5Low53Low175 Ų175160.1 Ų160.194%0.93681%0.811SS**  trans-8036.2175.4-117.6-28.6000113.8
98Q52.2Low52.6Low95 Ų95158.6 Ų158.644%0.44480%0.798SS.*  trans-48.7131.9158-82.3-174.43400111.9W96 N100W96-Q98 PolarHBondContact O-N 2.97Å; Q98-N100 PolarHBondContact O-N 2.83Å; Q98-N100 VanDerWaalsContact O-N 3.09Å
99K57.8Low52.5Low173 Ų173159.9 Ų159.975%0.75280%0.804SS**SBend74.41.6123.2-61.2176.1-173.6165.60120.5
100N56.2Low51.8Low145 Ų145158.9 Ų158.978%0.77580%0.803SS**  trans-12939.9-172.9-72.3-33.8000118Q98 P102Q98-N100 PolarHBondContact O-N 2.83Å; Q98-N100 VanDerWaalsContact O-N 3.09Å; N100-P102 WeakPolarHBondContact O-CD 3.35Å
101L55.8Low51.3Low176 Ų176162.4 Ų162.492%0.92180%0.804SS**  trans-103.5110.4163.9-87.896.6000112.1
102P49.9Very low51.2Low119 Ų119155.7 Ų155.777%0.77380%0.8SS**  trans-87.8135170.432.6-29.4000112.7N100N100-P102 WeakPolarHBondContact O-CD 3.35Å
103R48.6Very low51.3Low234 Ų234154.1 Ų154.188%0.88379%0.794SS**  trans28121155.9-64.4-176.4-165.4164.15.1119.9V105R103-V105 HydrophobicContact CB-CG2 4.4Å
104R43.8Very low51.9Low225 Ų225152.6 Ų152.685%0.84979%0.786SS**  trans-113116137.6-134.3-175.2-164.6-139.77.3108.1E106R104-E106 IonicContact NH1-OE1 3.38Å
105V50.8Low52.3Low108 Ų108150.6 Ų150.666%0.65578%0.783SS**  trans-91.8110.5175.5176.80000106.8R103R103-V105 HydrophobicContact CB-CG2 4.4Å
106E51.6Low52.3Low163 Ų163151.1 Ų151.176%0.76278%0.782SS**  trans-128.3116.6157.2-71.3-167.7-164.500107.7R104R104-E106 IonicContact NH1-OE1 3.38Å
107Q54.2Low52.5Low175 Ų175148.5 Ų148.582%0.81878%0.781SS**  trans-96.8179.3-175.9-135.8-17228.600107.9
108P46.9Very low52.8Low90 Ų90146.3 Ų146.358%0.58477%0.774SS**  -128151.1-74.936-19.3000113
109L52.9Low53.1Low186 Ų186148.4 Ų148.497%0.97478%0.782SS**SBendtrans-147.9113.5160.2-90.1165.6000109.3
110G41.3Very low53.1Low79 Ų79145.1 Ų145.181%0.81477%0.771SS**  trans108.565.9168.300000115.6
111F42.9Very low53.1Low199 Ų199144.3 Ų144.387%0.87377%0.774SS**  trans-63153.7158.4-93.3-95.2000111
112A51.5Low53.2Low97 Ų97139.8 Ų139.880%0.80277%0.77SS**  trans84.195.7154.500000117.5
113S54.1Low53.6Low89 Ų89139.7 Ų139.762%0.62276%0.762SS**  175.5123.4104-176.20000109.4
114P65.5Low53.9Low108 Ų108132.9 Ų132.970%0.70175%0.751SS**  trans-61.1154157.229.5-31.3000108.2K116P114-K116 PolarHBondContact O-N 2.86Å
115P63.2Low54.6Low130 Ų130128.8 Ų128.884%0.84474%0.742SS**  trans-58.3113.5179.924-31.9000108.9M117P115-M117 PolarHBondContact O-N 3.22Å; P115-M117 VanDerWaalsContact O-N 3.14Å
116K54.5Low54.8Low184 Ų184131.2 Ų131.280%0.875%0.751SS**  trans-64.9114.6168.7-92.7179.8177171.90107.1P114 V118P114-K116 PolarHBondContact O-N 2.86Å; K116-V118 PolarHBondContact O-N 2.85Å; K116-V118 VanDerWaalsContact O-N 3.13Å
117M55.5Low54.8Low168 Ų168128.1 Ų128.183%0.82875%0.747SS**  trans-46.1116160.3-121.5155.267.700108.3P115 K119P115-M117 PolarHBondContact O-N 3.22Å; P115-M117 VanDerWaalsContact O-N 3.14Å; M117-K119 PolarHBondContact O-N 3.03Å
118V59.4Low54.3Low129 Ų129130.6 Ų130.678%0.78277%0.774SS**  trans-72.297172.3177.90000106.4K116 I120K116-V118 PolarHBondContact O-N 2.85Å; K116-V118 VanDerWaalsContact O-N 3.13Å; V118-I120 PolarHBondContact O-N 2.85Å
119K58Low54.7Low139 Ų139132.6 Ų132.660%0.60478%0.783SS**  trans-68.1108.4164.8-90.5-171.7174.8-164.60107.6M117 E125M117-K119 PolarHBondContact O-N 3.03Å; K119-E125 WeakPolarHBondContact CE-OE1 3.31Å; K119-E125 IonicContact NZ-OE1 2.74Å; K119-E125 PolarHBondContact NZ-OE1 3.37Å; K119-E125 IonicContact NZ-OE2 2.85Å; K119-E125 PolarHBondContact NZ-OE2 3.39Å
120I58.3Low54.8Low104 Ų104129.8 Ų129.853%0.53377%0.773SS.*  trans-66.5124.5167.8-60165.6000106.9V118 G122 L123V118-I120 PolarHBondContact O-N 2.85Å; I120-G122 PolarHBondContact O-N 3.39Å; I120-G122 VanDerWaalsContact O-N 3.09Å; I120-L123 HydrophobicContact CB-CD1 4Å; I120-L123 HydrophobicContact CD1-CD1 3.64Å; I120-L123 HydrophobicContact CG1-CD1 4.42Å; I120-L123 HydrophobicContact CG2-CD1 4.05Å
121P57Low55.5Low128 Ų128132.6 Ų132.683%0.83177%0.771SS**THydrogen-bonded Turntrans-64.8113.3174.3-518000108.3
122G57.5Low56.3Low82 Ų82128.7 Ų128.785%0.84577%0.765SS**THydrogen-bonded Turntrans118.2-1.7175.400000116.5I120I120-G122 PolarHBondContact O-N 3.39Å; I120-G122 VanDerWaalsContact O-N 3.09Å
123L57.6Low56.6Low116 Ų116130.7 Ų130.761%0.60776%0.762SS**  trans-97.3112.7173.7-92152.2000110.7I120 E125I120-L123 HydrophobicContact CB-CD1 4Å; I120-L123 HydrophobicContact CD1-CD1 3.64Å; I120-L123 HydrophobicContact CG1-CD1 4.42Å; I120-L123 HydrophobicContact CG2-CD1 4.05Å; L123-E125 PolarHBondContact O-N 3.24Å
124S56.4Low56.7Low92 Ų92133.5 Ų133.564%0.64377%0.772SS**  trans-55.3120.4174.751.20000110.8N126S124-N126 PolarHBondContact O-N 2.74Å
125E57.6Low56.1Low139 Ų139135.3 Ų135.365%0.6578%0.777SS**SBendtrans-72.370173.1-53.3-179.194.900109K119 L123K119-E125 WeakPolarHBondContact CE-OE1 3.31Å; K119-E125 IonicContact NZ-OE1 2.74Å; K119-E125 PolarHBondContact NZ-OE1 3.37Å; K119-E125 IonicContact NZ-OE2 2.85Å; K119-E125 PolarHBondContact NZ-OE2 3.39Å; L123-E125 PolarHBondContact O-N 3.24Å
126N54.5Low55.6Low158 Ų158135.7 Ų135.785%0.84577%0.772SS**  trans-168.966.6171.6-81.5-38.2000109.9S124S124-N126 PolarHBondContact O-N 2.74Å
127S52.1Low55.7Low99 Ų99131.7 Ų131.769%0.69277%0.769SS**  trans-160.2125.8162.561.50000110.1
128V44.1Very low55.7Low226 Ų226128.4 Ų128.4100%1.3776%0.764SS**  trans89.60-174.8-164.60000114.7

Retrieved 128 of 128 residues in 43.4 ms (Link to these results)