A0A077ZM21_TRITR Loading...

Peptidase A2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZM21, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 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
1M37.2Very low36.8Very low237 Ų237143.5 Ų143.5100%1.16784%0.837SS**  096.50-168.3-179.7-96.900105.9
2Y33.3Very low37.4Very low221 Ų221141.8 Ų141.887%0.86784%0.835SS**  trans-90.8136.2-179.2-74.8-81.7000109.1V4Y2-V4 PolarHBondContact O-N 2.87Å
3P43.8Very low37.9Very low117 Ų117138.7 Ų138.776%0.7683%0.825SS**  trans-72.4127.617927.5-30.1000110.2N5P3-N5 PolarHBondContact O-N 3.17Å
4V40.2Very low38.1Very low122 Ų122134.1 Ų134.174%0.73982%0.821SS**  trans-76.6104.2167.4178.50000106.8Y2 S6Y2-V4 PolarHBondContact O-N 2.87Å; V4-S6 WeakPolarHBondContact CG1-OG 3.43Å
5N40.7Very low38.5Very low167 Ų167136.9 Ų136.989%0.89382%0.821SS**  trans-94.494.4166-115.420.3000108.3P3P3-N5 PolarHBondContact O-N 3.17Å
6S36.3Very low39Very low107 Ų107135.6 Ų135.675%0.74882%0.821SS**  trans-99.4106.8165.9-65.40000108.5V4V4-S6 WeakPolarHBondContact CG1-OG 3.43Å
7A38.1Very low39.8Very low93 Ų93137.6 Ų137.677%0.76982%0.819SS**  trans-163.492.9156.500000106.4
8N33Very low40.4Very low171 Ų171139.8 Ų139.891%0.91482%0.819SS**  58.211196.6-93.32.9000114.3
9G32.4Very low41.2Very low67 Ų67144.1 Ų144.169%0.69182%0.82SS**  trans83.685.1134.300000115.5
10D33.8Very low42.1Very low163 Ų163140.9 Ų140.987%0.87280%0.803SS**  -152107.1124.3-102.8-22.1000107.7P12D10-P12 VanDerWaalsContact O-CD 3.27Å; D10-P12 WeakPolarHBondContact O-CD 3.4Å
11S35.6Very low43Very low113 Ų113141.9 Ų141.979%0.7981%0.806SS**  trans-61.4116.9168.9-580000106.7S13S11-S13 PolarHBondContact O-N 2.84Å
12P45Very low44.2Very low124 Ų124134.6 Ų134.681%0.80578%0.784SS**  trans-61.4109.8174.322.7-28.8000107.2D10 G14D10-P12 VanDerWaalsContact O-CD 3.27Å; D10-P12 WeakPolarHBondContact O-CD 3.4Å; P12-G14 PolarHBondContact O-N 2.79Å
13S42.9Very low45.8Very low101 Ų101128.1 Ų128.171%0.70677%0.771SS**  trans-41.9125.8168.145.50000108.2S11 E15S11-S13 PolarHBondContact O-N 2.84Å; S13-E15 VanDerWaalsContact C-N 3.31Å; S13-E15 PolarHBondContact O-N 2.86Å
14G41.4Very low46.7Very low75 Ų75125.8 Ų125.877%0.77375%0.754SS**  trans-5294.1-175.700000111.5P12 S16P12-G14 PolarHBondContact O-N 2.79Å; G14-S16 VanDerWaalsContact C-N 3.3Å; G14-S16 PolarHBondContact O-N 2.88Å
15E43.4Very low47.8Very low176 Ų176126.2 Ų126.282%0.82275%0.748SS**  trans-61.4106.4159.1-69.9-173.5155.600104.1S13 Q17S13-E15 VanDerWaalsContact C-N 3.31Å; S13-E15 PolarHBondContact O-N 2.86Å; E15-Q17 PolarHBondContact O-N 2.86Å
16S47.2Very low48.6Very low116 Ų116121 Ų12181%0.81173%0.725SS**  trans-58.692.1164.1-64.10000104.9G14 E18G14-S16 VanDerWaalsContact C-N 3.3Å; G14-S16 PolarHBondContact O-N 2.88Å; S16-E18 PolarHBondContact O-N 2.86Å
17Q52.6Low49.5Very low170 Ų170119.4 Ų119.479%0.79472%0.718SS**  trans-62.294.9178.2-134.1177.318.300104.6E15 R19E15-Q17 PolarHBondContact O-N 2.86Å; Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 2.84Å
18E51.4Low50.4Low177 Ų177117.9 Ų117.983%0.82771%0.705SS**  trans-59.2102.2175.5-173.5174.4-176.400105.1S16 V20S16-E18 PolarHBondContact O-N 2.86Å; E18-V20 VanDerWaalsContact C-N 3.28Å; E18-V20 PolarHBondContact O-N 2.67Å
19R55.3Low51.4Low221 Ų221113.7 Ų113.783%0.83469%0.686SS**  trans-67.396.9-178.8-73.2-172.8176.7178.7-0.5106.5Q17 N21Q17-R19 VanDerWaalsContact C-N 3.3Å; Q17-R19 PolarHBondContact O-N 2.84Å; R19-N21 PolarHBondContact O-N 3.27Å; R19-N21 VanDerWaalsContact O-N 3.09Å
20V58.9Low52.1Low80 Ų80114.7 Ų114.749%0.48568%0.682SS.*  trans-63.7111.5171.8-175.40000106.9E18 A22 D110E18-V20 VanDerWaalsContact C-N 3.28Å; E18-V20 PolarHBondContact O-N 2.67Å; V20-A22 PolarHBondContact O-N 3.08Å; V20-D110 WeakPolarHBondContact CG1-OD2 3.1Å
21N60.7Low53Low161 Ų161113.5 Ų113.586%0.86167%0.674SS**  trans-73.393.9177.3-83.6-18.6000109.1R19R19-N21 PolarHBondContact O-N 3.27Å; R19-N21 VanDerWaalsContact O-N 3.09Å
22A62Low53.9Low85 Ų85117.5 Ų117.570%0.70268%0.68SS**  trans-83127.516500000109.6V20V20-A22 PolarHBondContact O-N 3.08Å
23S67.3Low54.3Low84 Ų84114 Ų11459%0.58766%0.662SS**  trans-90122.4168.4-170.80000109
24V63.6Low55.2Low68 Ų68117.9 Ų117.941%0.41268%0.675SS.*  trans-106.6128.4177.3-179.30000108.5A41 V43V24-A41 HydrophobicContact CG1-CB 3.35Å; V24-V43 HydrophobicContact CB-CG1 4.41Å; V24-V43 HydrophobicContact CG1-CG1 4.03Å; V24-V43 HydrophobicContact CG2-CG1 3.96Å
25H62.4Low55.8Low131 Ų131117.4 Ų117.461%0.60666%0.66SS**EExtended strand (participates in β ladder)trans-95.2108.8171.5-69.2-3.4000108.9V42H25-V42 PolarHBondContact N-O 3.34Å; H25-V42 VanDerWaalsContact N-O 3.15Å; H25-V42 PolarHBondContact O-N 2.85Å
26S57.3Low56.4Low59 Ų59116.7 Ų116.741%0.41365%0.651SS.*EExtended strand (participates in β ladder)trans-102.1130.3-179.9-61.80000109.8V38S26-V38 VanDerWaalsContact CB-CG1 3.5Å; S26-V38 WeakPolarHBondContact OG-CG1 3.38Å
27A55.8Low56.8Low73 Ų73117.2 Ų117.260%0.60364%0.64SS**EExtended strand (participates in β ladder)trans-88.8118170.200000109.2
28A55.9Low57Low60 Ų60113 Ų11350%0.49663%0.625SS.*EExtended strand (participates in β ladder)trans-84126.4172.900000109.8Y36A28-Y36 HydrophobicContact CB-CD1 3.82Å; A28-Y36 HydrophobicContact CB-CE1 4.45Å
29V54.9Low58Low84 Ų84109.8 Ų109.851%0.50961%0.614SS.*  trans-93.5103.8169.8-1740000107.6I31 L39V29-I31 HydrophobicContact CG1-CD1 4.3Å; V29-I31 HydrophobicContact CG1-CG1 4.04Å; V29-I31 PolarHBondContact O-N 2.93Å; V29-L39 HydrophobicContact CG2-CD1 4.27Å
30S47.5Very low59.3Low88 Ų88100.8 Ų100.862%0.61558%0.584SS**  trans-83.1108.9175.6-179.50000109.7
31I52Low60.5Low137 Ų13797.9 Ų97.970%0.70357%0.568SS**SBendtrans-119.169165.1-47.6178.5000107.2V29 A33V29-I31 HydrophobicContact CG1-CD1 4.3Å; V29-I31 HydrophobicContact CG1-CG1 4.04Å; V29-I31 PolarHBondContact O-N 2.93Å; I31-A33 PolarHBondContact O-N 3.37Å
32Q54Low61.9Low197 Ų19792.8 Ų92.892%0.92154%0.543SS*.SBendtrans4723.6173.9-72.5-177.4-2200116.3
33A53.6Low63.4Low51 Ų5189.9 Ų89.942%0.42152%0.517SS..  trans-100.7132.618000000108.6I31 S35I31-A33 PolarHBondContact O-N 3.37Å; A33-S35 PolarHBondContact O-N 3.01Å
34N61.4Low64.7Low182 Ų18288 Ų8897%0.97350%0.502SS*.SBendtrans-649.3172.5-76.3-11.8000113.4
35S55.3Low66.3Low66 Ų6685.3 Ų85.346%0.46249%0.486SS..SBendtrans-134.5123.6177.356.20000110.3A33A33-S35 PolarHBondContact O-N 3.01Å
36Y55Low67.9Low161 Ų16183 Ų8363%0.63148%0.475SS*.  trans-87.6123.1172.4-60.1-82.3000109.2A28A28-Y36 HydrophobicContact CB-CD1 3.82Å; A28-Y36 HydrophobicContact CB-CE1 4.45Å
37H55.4Low69.9Low127 Ų12780.5 Ų80.559%0.58846%0.456SS*.  trans-98.6115.9166.2-64.4-83.2000107.9L39H37-L39 HydrophobicContact CB-CD2 4.22Å; H37-L39 PolarHBondContact O-N 2.93Å
38V57.9Low71.9Confident80 Ų8078.4 Ų78.449%0.48544%0.437SS..EExtended strand (participates in β ladder)trans-72.7109165.3175.60000106.3S26S26-V38 VanDerWaalsContact CB-CG1 3.5Å; S26-V38 WeakPolarHBondContact OG-CG1 3.38Å
39L70.9Confident73.9Confident110 Ų11077.2 Ų77.258%0.57642%0.421SS*.EExtended strand (participates in β ladder)trans-80.4-39-179.5-61.5177.3000110.9V29 H37V29-L39 HydrophobicContact CG2-CD1 4.27Å; H37-L39 HydrophobicContact CB-CD2 4.22Å; H37-L39 PolarHBondContact O-N 2.93Å
40C82.7Confident75.8Confident32 Ų3277 Ų7722%0.21644%0.435CS..EExtended strand (participates in β ladder)trans-144.3144.3-179.9-55.50000111.5L59 L60C40-L59 HydrophobicContact CB-CD1 3.49Å; C40-L59 VanDerWaalsContact CB-CD1 3.49Å; C40-L59 HydrophobicContact CB-CD2 4.49Å; C40-L59 HydrophobicContact CB-CG 3.93Å; C40-L60 WeakPolarHBondContact CA-O 3.48Å; C40-L60 WeakPolarHBondContact CB-O 3.47Å
41A85.9Confident78.1Confident19 Ų1978.5 Ų78.516%0.15745%0.446CS..EExtended strand (participates in β ladder)trans-101.2137.3176.200000110.7V24 V43 L59 L60V24-A41 HydrophobicContact CG1-CB 3.35Å; A41-V43 HydrophobicContact CB-CG1 4.47Å; A41-L59 CarbonylContact O-C 3.53Å; A41-L59 WeakPolarHBondContact O-CA 3.47Å; A41-L60 HydrophobicContact CB-CB 4.26Å; A41-L60 PolarHBondContact N-O 2.82Å; A41-L60 VanDerWaalsContact N-O 3.11Å; A41-L60 PolarHBondContact O-N 3.38Å
42V90.1Very high80.3Confident55 Ų5574.2 Ų74.233%0.33343%0.425SS..EExtended strand (participates in β ladder)trans-101.5119.1168.9-177.30000108.5H25 F57 A58 L59H25-V42 PolarHBondContact N-O 3.34Å; H25-V42 VanDerWaalsContact N-O 3.15Å; H25-V42 PolarHBondContact O-N 2.85Å; V42-F57 HydrophobicContact CG1-CB 3.87Å; V42-F57 HydrophobicContact CG1-CD1 4.03Å; V42-F57 HydrophobicContact CG1-CG 4.26Å; V42-A58 WeakPolarHBondContact CA-O 3.35Å; V42-L59 HydrophobicContact CG2-CD1 3.71Å
43V91.9Very high82.4Confident24 Ų2467.3 Ų67.315%0.14540%0.401CS..EExtended strand (participates in β ladder)trans-126.1137.5-177-620000111V24 A41 V45 F57 A58 L60V24-V43 HydrophobicContact CB-CG1 4.41Å; V24-V43 HydrophobicContact CG1-CG1 4.03Å; V24-V43 HydrophobicContact CG2-CG1 3.96Å; A41-V43 HydrophobicContact CB-CG1 4.47Å; V43-V45 HydrophobicContact CG2-CG1 3.96Å; V43-F57 CarbonylContact O-C 3.52Å; V43-F57 VanDerWaalsContact O-CA 3.27Å; V43-F57 WeakPolarHBondContact O-CA 3.45Å; V43-A58 HydrophobicContact CG2-CB 4.12Å; V43-A58 PolarHBondContact N-O 3.18Å; V43-A58 PolarHBondContact O-N 3.16Å; V43-L60 HydrophobicContact CG1-CD1 4.06Å; V43-L60 HydrophobicContact CG2-CD1 3.75Å; V43-L60 HydrophobicContact CG2-CD2 4.22Å; V43-L60 HydrophobicContact CG2-CG 3.84Å
44P95.2Very high84.5Confident44 Ų4465.6 Ų65.629%0.28639%0.386SS..EExtended strand (participates in β ladder)trans-71.313817232.3-34.6000109.9T56 F57 E109P44-T56 WeakPolarHBondContact CA-O 3.41Å; P44-F57 HydrophobicContact CB-CD1 4.02Å; P44-F57 HydrophobicContact CB-CE1 3.85Å; P44-E109 HydrophobicContact CB-CG 4.07Å; P44-E109 WeakPolarHBondContact CB-OE2 3.43Å; P44-E109 WeakPolarHBondContact CG-OE2 3.17Å
45V96.5Very high86.1Confident12 Ų1264.5 Ų64.57%0.07337%0.368CS..EExtended strand (participates in β ladder)trans-140.6157.2-178.2-61.50000110.7V43 V47 R55 T56 A58 I106 S107V43-V45 HydrophobicContact CG2-CG1 3.96Å; V45-V47 HydrophobicContact CG2-CG2 3.97Å; V45-R55 WeakPolarHBondContact O-CA 3.43Å; V45-T56 HydrophobicContact CG2-CG2 3.74Å; V45-T56 PolarHBondContact N-O 3.05Å; V45-T56 PolarHBondContact O-N 2.82Å; V45-T56 VanDerWaalsContact O-O 3.13Å; V45-A58 HydrophobicContact CG1-CB 4.02Å; V45-A58 HydrophobicContact CG2-CB 4.06Å; V45-I106 HydrophobicContact CB-CG2 3.83Å; V45-I106 HydrophobicContact CG1-CG2 3.93Å; V45-I106 HydrophobicContact CG2-CG2 4.21Å; V45-S107 WeakPolarHBondContact CA-O 3.22Å
46K97.6Very high88.1Confident83 Ų8363.5 Ų63.536%0.36136%0.359SS..EExtended strand (participates in β ladder)trans-103.5126.4162.8178.1-174.9178-171.50108.1A53 I106 S107K46-A53 VanDerWaalsContact CE-CB 3.47Å; K46-A53 HydrophobicContact CG-CB 4.31Å; K46-I106 CarbonylContact O-C 3.53Å; K46-I106 WeakPolarHBondContact O-CA 3.37Å; K46-S107 PolarHBondContact N-O 3.31Å; K46-S107 PolarHBondContact O-N 3.49Å
47V98.1Very high90Very high5 Ų562.5 Ų62.53%0.0336%0.358CS..EExtended strand (participates in β ladder)trans-107.3135.1175.2-173.20000108.2V45 A53 C54 T56 M69 L73 L77 C104 V105 I106V45-V47 HydrophobicContact CG2-CG2 3.97Å; V47-A53 CarbonylContact O-C 3.6Å; V47-A53 VanDerWaalsContact O-CA 3.22Å; V47-A53 WeakPolarHBondContact O-CA 3.27Å; V47-C54 PolarHBondContact N-O 3.41Å; V47-C54 PolarHBondContact O-N 2.79Å; V47-T56 HydrophobicContact CG2-CG2 3.79Å; V47-M69 HydrophobicContact CG1-CE 3.7Å; V47-L73 HydrophobicContact CG2-CD2 4.33Å; V47-L77 HydrophobicContact CB-CD1 4.06Å; V47-L77 HydrophobicContact CG1-CD1 3.6Å; V47-L77 WeakPolarHBondContact O-CD2 3.49Å; V47-C104 HydrophobicContact CG1-CB 4.16Å; V47-V105 CarbonylContact C-O 3.59Å; V47-V105 WeakPolarHBondContact CA-O 3.36Å; V47-I106 HydrophobicContact CG2-CG1 4.36Å
48S97.7Very high91.8Very high29 Ų2957.5 Ų57.520%0.20334%0.339CS..EExtended strand (participates in β ladder)trans-131145.4178.245.80000113N52 C104 V105S48-N52 CarbonylContact C-O 3.47Å; S48-N52 WeakPolarHBondContact CA-O 3.43Å; S48-N52 WeakPolarHBondContact CB-O 3.38Å; S48-C104 WeakPolarHBondContact O-CB 3.41Å; S48-V105 PolarHBondContact N-O 3.08Å; S48-V105 PolarHBondContact O-N 3.34Å; S48-V105 WeakPolarHBondContact OG-CB 3.44Å; S48-V105 PolarHBondContact OG-O 2.92Å
49F97.9Very high93.5Very high36 Ų3659.2 Ų59.216%0.15835%0.345CS..EExtended strand (participates in β ladder)trans-142.4116.9174.4179.2-100.6000109.1S51 N52 L77 M79 E103F49-S51 PolarHBondContact O-N 2.87Å; F49-N52 PolarHBondContact N-O 3.15Å; F49-N52 PolarHBondContact O-N 2.78Å; F49-L77 HydrophobicContact CB-CB 4.32Å; F49-M79 HydrophobicContact CB-CG 3.76Å; F49-M79 HydrophobicContact CB-SD 4.46Å; F49-M79 HydrophobicContact CD1-CB 4.22Å; F49-M79 HydrophobicContact CD1-CG 3.86Å; F49-M79 HydrophobicContact CD2-CE 4.05Å; F49-M79 HydrophobicContact CD2-CG 4.12Å; F49-M79 HydrophobicContact CE1-CB 4.39Å; F49-M79 HydrophobicContact CE1-CG 4.49Å; F49-M79 HydrophobicContact CG-CB 4.34Å; F49-M79 HydrophobicContact CG-CE 4.42Å; F49-M79 HydrophobicContact CG-CG 3.63Å; F49-E103 WeakPolarHBondContact CD2-O 3.49Å; F49-E103 HydrophobicContact CE2-CG 4.38Å
50G95.5Very high94.5Very high78 Ų7858.5 Ų58.580%0.80434%0.341SS*.THydrogen-bonded Turntrans53.6-125.8-169.200000111.1
51S96.2Very high94.8Very high121 Ų12160.8 Ų60.885%0.84635%0.351SS*.THydrogen-bonded Turntrans-84.4-4.1177.564.40000114.5F49F49-S51 PolarHBondContact O-N 2.87Å
52N98.1Very high94.8Very high47 Ų4766 Ų6625%0.25139%0.387SS..EExtended strand (participates in β ladder)trans-95.3142.4-176.2-56.1-63.8000110.4S48 F49 L77S48-N52 CarbonylContact C-O 3.47Å; S48-N52 WeakPolarHBondContact CA-O 3.43Å; S48-N52 WeakPolarHBondContact CB-O 3.38Å; F49-N52 PolarHBondContact N-O 3.15Å; F49-N52 PolarHBondContact O-N 2.78Å; N52-L77 HydrophobicContact CB-CD2 4.19Å; N52-L77 WeakPolarHBondContact CB-O 3.34Å; N52-L77 PolarHBondContact ND2-O 3.08Å
53A97.1Very high94.7Very high51 Ų5166.3 Ų66.342%0.42140%0.401SS..EExtended strand (participates in β ladder)trans-140.2149.2173.700000111.8K46 V47K46-A53 VanDerWaalsContact CE-CB 3.47Å; K46-A53 HydrophobicContact CG-CB 4.31Å; V47-A53 CarbonylContact O-C 3.6Å; V47-A53 VanDerWaalsContact O-CA 3.22Å; V47-A53 WeakPolarHBondContact O-CA 3.27Å
54C97.5Very high94.6Very high15 Ų1567.7 Ų67.710%0.10142%0.415CS..EExtended strand (participates in β ladder)trans-142.2134.9179-79.60000110.3V47 L73 L77V47-C54 PolarHBondContact N-O 3.41Å; V47-C54 PolarHBondContact O-N 2.79Å; C54-L73 HydrophobicContact CB-CD1 3.63Å; C54-L77 HydrophobicContact CB-CD2 3.87Å; C54-L77 HydrophobicContact CB-CG 4.19Å
55R96.5Very high94.4Very high160 Ų16074.9 Ų74.960%0.60444%0.444SS*.EExtended strand (participates in β ladder)trans-81.4138.4167.5-64.5-178.6-177.4-137.22.8110.1V45 E109V45-R55 WeakPolarHBondContact O-CA 3.43Å; R55-E109 IonicContact CZ-OE1 3.97Å; R55-E109 IonicContact NE-OE1 3.94Å; R55-E109 IonicContact NH1-OE1 2.71Å; R55-E109 PolarHBondContact NH1-OE1 3.11Å
56T96.3Very high94.3Very high45 Ų4578.8 Ų78.828%0.27647%0.468SS..EExtended strand (participates in β ladder)trans-159.4-169.3179.4-163.50000110.1P44 V45 V47 L73P44-T56 WeakPolarHBondContact CA-O 3.41Å; V45-T56 HydrophobicContact CG2-CG2 3.74Å; V45-T56 PolarHBondContact N-O 3.05Å; V45-T56 PolarHBondContact O-N 2.82Å; V45-T56 VanDerWaalsContact O-O 3.13Å; V47-T56 HydrophobicContact CG2-CG2 3.79Å; T56-L73 HydrophobicContact CG2-CD2 3.8Å
57F95.2Very high94.2Very high139 Ų13977.5 Ų77.561%0.6147%0.47SS*.EExtended strand (participates in β ladder)trans-116.6142.9171.8-62.5-89.9000109.7V42 V43 P44V42-F57 HydrophobicContact CG1-CB 3.87Å; V42-F57 HydrophobicContact CG1-CD1 4.03Å; V42-F57 HydrophobicContact CG1-CG 4.26Å; V43-F57 CarbonylContact O-C 3.52Å; V43-F57 VanDerWaalsContact O-CA 3.27Å; V43-F57 WeakPolarHBondContact O-CA 3.45Å; P44-F57 HydrophobicContact CB-CD1 4.02Å; P44-F57 HydrophobicContact CB-CE1 3.85Å
58A94.2Very high94.1Very high22 Ų2281.3 Ų81.318%0.18249%0.493CS..EExtended strand (participates in β ladder)trans-106.8137.9170.100000109.5V42 V43 V45 L60V42-A58 WeakPolarHBondContact CA-O 3.35Å; V43-A58 HydrophobicContact CG2-CB 4.12Å; V43-A58 PolarHBondContact N-O 3.18Å; V43-A58 PolarHBondContact O-N 3.16Å; V45-A58 HydrophobicContact CG1-CB 4.02Å; V45-A58 HydrophobicContact CG2-CB 4.06Å; A58-L60 HydrophobicContact CB-CD2 4.24Å
59L93Very high94Very high116 Ų11680.6 Ų80.661%0.60749%0.486SS*.EExtended strand (participates in β ladder)trans-92.4109.9165.5-175.970.3000107.2C40 A41 V42C40-L59 HydrophobicContact CB-CD1 3.49Å; C40-L59 VanDerWaalsContact CB-CD1 3.49Å; C40-L59 HydrophobicContact CB-CD2 4.49Å; C40-L59 HydrophobicContact CB-CG 3.93Å; A41-L59 CarbonylContact O-C 3.53Å; A41-L59 WeakPolarHBondContact O-CA 3.47Å; V42-L59 HydrophobicContact CG2-CD1 3.71Å
60L91.6Very high93.9Very high95 Ų9581.7 Ų81.750%0.49750%0.498SS..EExtended strand (participates in β ladder)trans-86.4113.4177.2-55.3-178.1000108.8C40 A41 V43 A58C40-L60 WeakPolarHBondContact CA-O 3.48Å; C40-L60 WeakPolarHBondContact CB-O 3.47Å; A41-L60 HydrophobicContact CB-CB 4.26Å; A41-L60 PolarHBondContact N-O 2.82Å; A41-L60 VanDerWaalsContact N-O 3.11Å; A41-L60 PolarHBondContact O-N 3.38Å; V43-L60 HydrophobicContact CG1-CD1 4.06Å; V43-L60 HydrophobicContact CG2-CD1 3.75Å; V43-L60 HydrophobicContact CG2-CD2 4.22Å; V43-L60 HydrophobicContact CG2-CG 3.84Å; A58-L60 HydrophobicContact CB-CD2 4.24Å
61D89.1Confident93.9Very high80 Ų8082.2 Ų82.243%0.42848%0.48SS..EExtended strand (participates in β ladder)trans-114.5115.3174.5179.21.6000108.1G63 A64D61-G63 PolarHBondContact O-N 3.43Å; D61-G63 PolarHBondContact OD1-N 2.89Å; D61-A64 HydrophobicContact CB-CB 3.99Å; D61-A64 WeakPolarHBondContact O-CB 3.4Å; D61-A64 PolarHBondContact O-N 2.86Å
62S85Confident94Very high130 Ų13080.5 Ų80.591%0.90946%0.464SS*.THydrogen-bonded Turntrans-71-13.9-179.556.70000113.2
63G88Confident93.9Very high60 Ų6078.9 Ų78.962%0.61946%0.456SS*.THydrogen-bonded Turntrans-90.2-3.2172.900000114D61D61-G63 PolarHBondContact O-N 3.43Å; D61-G63 PolarHBondContact OD1-N 2.89Å
64A90.4Very high94Very high54 Ų5477 Ų7745%0.44644%0.44SS..  trans-79.3122.6-178.400000111.7D61D61-A64 HydrophobicContact CB-CB 3.99Å; D61-A64 WeakPolarHBondContact O-CB 3.4Å; D61-A64 PolarHBondContact O-N 2.86Å
65E91.9Very high94Very high194 Ų19482.8 Ų82.891%0.90746%0.459SS*.SBendtrans-82.3-18.1172.9-63.5-177.6157.300112.9
66V93.3Very high94Very high94 Ų9482 Ų8257%0.5746%0.456SS*.SBendtrans-133.7146.3-174.5-64.10000111.6V68V66-V68 HydrophobicContact CG2-CG2 4.32Å
67S95.6Very high94.1Very high56 Ų5679.8 Ų79.839%0.39244%0.443SS..EExtended strand (participates in β ladder)trans-91.5132.4172.5-72.30000110.9I121S67-I121 PolarHBondContact O-N 3.33Å
68V95.8Very high94.2Very high86 Ų8680.3 Ų80.352%0.52145%0.445SS..EExtended strand (participates in β ladder)trans-121.5137.3-177.5179.70000110.4V66 I121 V123V66-V68 HydrophobicContact CG2-CG2 4.32Å; V68-I121 CarbonylContact C-O 3.59Å; V68-I121 WeakPolarHBondContact CA-O 3.23Å; V68-V123 HydrophobicContact CG1-CB 4.17Å; V68-V123 HydrophobicContact CG1-CG1 3.86Å; V68-V123 HydrophobicContact CG1-CG2 3.24Å
69M96.6Very high94.4Very high13 Ų1380.4 Ų80.46%0.06444%0.442CS..EExtended strand (participates in β ladder)trans-123.7143.5177.1-172.2-176.8-59.100110.9V47 L73 L77 M79 C104 V120 I121 V122 V123V47-M69 HydrophobicContact CG1-CE 3.7Å; M69-L73 HydrophobicContact CE-CD2 4.45Å; M69-L73 HydrophobicContact CG-CB 4Å; M69-L73 HydrophobicContact CG-CD2 3.86Å; M69-L73 HydrophobicContact CG-CG 4.13Å; M69-L73 HydrophobicContact SD-CB 4.08Å; M69-L73 HydrophobicContact SD-CD2 3.91Å; M69-L73 HydrophobicContact SD-CG 3.8Å; M69-L77 HydrophobicContact CE-CD1 4.37Å; M69-L77 HydrophobicContact SD-CD1 4.22Å; M69-M79 HydrophobicContact CE-CE 4.13Å; M69-M79 HydrophobicContact CE-SD 3.75Å; M69-M79 HydrophobicContact SD-CE 4.41Å; M69-M79 HydrophobicContact SD-SD 3.44Å; M69-C104 HydrophobicContact CE-CB 4.4Å; M69-V120 HydrophobicContact CB-CG2 3.64Å; M69-V120 HydrophobicContact CE-CG1 4.37Å; M69-V120 HydrophobicContact CE-CG2 4.04Å; M69-I121 PolarHBondContact N-O 3.29Å; M69-V122 CarbonylContact O-C 3.53Å; M69-V122 VanDerWaalsContact O-CA 3.31Å; M69-V122 WeakPolarHBondContact O-CA 3.14Å; M69-V123 PolarHBondContact O-N 2.89Å
70S95.6Very high94.5Very high59 Ų5979.8 Ų79.841%0.41344%0.443SS..EExtended strand (participates in β ladder)trans-69.3143.8171.475.10000112.2T72 L73 S74S70-T72 PolarHBondContact O-N 2.99Å; S70-L73 PolarHBondContact O-N 2.97Å; S70-L73 WeakPolarHBondContact OG-CB 3.12Å; S70-L73 PolarHBondContact OG-N 2.95Å; S70-S74 PolarHBondContact O-N 3.27Å
71E95.9Very high94.7Very high90 Ų9077.3 Ų77.342%0.42144%0.441SS..Hα-helixtrans-58.4-29.9172.7-156.7-165.1-173.700113.4S74 R75 V122 V123E71-S74 WeakPolarHBondContact CA-OG 3.49Å; E71-S74 PolarHBondContact O-N 3.2Å; E71-S74 PolarHBondContact O-OG 3.21Å; E71-R75 VanDerWaalsContact CG-NH1 3.27Å; E71-R75 WeakPolarHBondContact O-CB 3.43Å; E71-R75 WeakPolarHBondContact O-CG 3.28Å; E71-R75 PolarHBondContact O-N 3.22Å; E71-R75 IonicContact OE1-NH1 3.65Å; E71-R75 PolarHBondContact OE1-NH1 3.29Å; E71-R75 IonicContact OE2-CZ 3.37Å; E71-R75 IonicContact OE2-NH1 3.96Å; E71-R75 PolarHBondContact OE2-NH1 3.27Å; E71-V122 HydrophobicContact CB-CG1 4.2Å; E71-V122 HydrophobicContact CG-CG1 4.26Å; E71-V123 PolarHBondContact N-O 3.01Å
72T96.7Very high95.1Very high84 Ų8478 Ų7852%0.51544%0.444SS..Hα-helixtrans-64.7-41.5175-62.50000111.6S70 R75 R76S70-T72 PolarHBondContact O-N 2.99Å; T72-R75 PolarHBondContact OG1-NH2 3.01Å; T72-R75 VanDerWaalsContact OG1-NH2 3.15Å; T72-R76 WeakPolarHBondContact O-CG 3.31Å; T72-R76 PolarHBondContact O-N 3.13Å
73L97.7Very high95.6Very high14 Ų1479.3 Ų79.37%0.07343%0.433CS..Hα-helixtrans-70.5-41.8177.3-177.558.5000111.2V47 C54 T56 M69 S70 R75 R76 L77V47-L73 HydrophobicContact CG2-CD2 4.33Å; C54-L73 HydrophobicContact CB-CD1 3.63Å; T56-L73 HydrophobicContact CG2-CD2 3.8Å; M69-L73 HydrophobicContact CE-CD2 4.45Å; M69-L73 HydrophobicContact CG-CB 4Å; M69-L73 HydrophobicContact CG-CD2 3.86Å; M69-L73 HydrophobicContact CG-CG 4.13Å; M69-L73 HydrophobicContact SD-CB 4.08Å; M69-L73 HydrophobicContact SD-CD2 3.91Å; M69-L73 HydrophobicContact SD-CG 3.8Å; S70-L73 PolarHBondContact O-N 2.97Å; S70-L73 WeakPolarHBondContact OG-CB 3.12Å; S70-L73 PolarHBondContact OG-N 2.95Å; L73-R75 VanDerWaalsContact C-N 3.31Å; L73-R75 PolarHBondContact O-N 3.06Å; L73-R76 WeakPolarHBondContact O-CB 3.25Å; L73-R76 PolarHBondContact O-N 3.25Å; L73-R76 VanDerWaalsContact O-N 3.13Å; L73-L77 HydrophobicContact CD1-CD1 4.21Å; L73-L77 HydrophobicContact CD1-CG 4.41Å; L73-L77 HydrophobicContact CG-CD1 4.05Å; L73-L77 PolarHBondContact O-N 3.46Å
74S97.6Very high96Very high11 Ų1182.1 Ų82.18%0.07743%0.425CS..Hα-helixtrans-60.9-39.9178.176.50000112.1S70 E71 L77 K78 M79 V122S70-S74 PolarHBondContact O-N 3.27Å; E71-S74 WeakPolarHBondContact CA-OG 3.49Å; E71-S74 PolarHBondContact O-N 3.2Å; E71-S74 PolarHBondContact O-OG 3.21Å; S74-L77 CarbonylContact O-C 3.58Å; S74-L77 PolarHBondContact O-N 2.98Å; S74-K78 PolarHBondContact O-N 3.06Å; S74-M79 PolarHBondContact O-N 3.37Å; S74-V122 VanDerWaalsContact OG-CG1 3.25Å; S74-V122 WeakPolarHBondContact OG-CG1 3.42Å
75R97.4Very high96.2Very high136 Ų13683 Ų8351%0.51343%0.428SS..Hα-helixtrans-62.1-42.8173.5-76.6-170.2-63-95.3-2112.6E71 T72 L73 L77 K78E71-R75 VanDerWaalsContact CG-NH1 3.27Å; E71-R75 WeakPolarHBondContact O-CB 3.43Å; E71-R75 WeakPolarHBondContact O-CG 3.28Å; E71-R75 PolarHBondContact O-N 3.22Å; E71-R75 IonicContact OE1-NH1 3.65Å; E71-R75 PolarHBondContact OE1-NH1 3.29Å; E71-R75 IonicContact OE2-CZ 3.37Å; E71-R75 IonicContact OE2-NH1 3.96Å; E71-R75 PolarHBondContact OE2-NH1 3.27Å; T72-R75 PolarHBondContact OG1-NH2 3.01Å; T72-R75 VanDerWaalsContact OG1-NH2 3.15Å; L73-R75 VanDerWaalsContact C-N 3.31Å; L73-R75 PolarHBondContact O-N 3.06Å; R75-L77 VanDerWaalsContact C-N 3.26Å; R75-L77 PolarHBondContact O-N 3.04Å; R75-K78 PolarHBondContact O-N 3.02Å; R75-K78 VanDerWaalsContact O-N 3.08Å
76R97.9Very high96.3Very high143 Ų14376.2 Ų76.254%0.5440%0.398SS..Hα-helixtrans-62.4-36.5176.7-72171.761.4-162.3-1.5111.9T72 L73 K78T72-R76 WeakPolarHBondContact O-CG 3.31Å; T72-R76 PolarHBondContact O-N 3.13Å; L73-R76 WeakPolarHBondContact O-CB 3.25Å; L73-R76 PolarHBondContact O-N 3.25Å; L73-R76 VanDerWaalsContact O-N 3.13Å; R76-K78 VanDerWaalsContact C-N 3.28Å
77L98Very high96.3Very high0 Ų077.3 Ų77.30%040%0.4CS..THydrogen-bonded Turntrans-82.3-3.4176.3-71.8172000113.6V47 F49 N52 C54 M69 L73 S74 R75 M79V47-L77 HydrophobicContact CB-CD1 4.06Å; V47-L77 HydrophobicContact CG1-CD1 3.6Å; V47-L77 WeakPolarHBondContact O-CD2 3.49Å; F49-L77 HydrophobicContact CB-CB 4.32Å; N52-L77 HydrophobicContact CB-CD2 4.19Å; N52-L77 WeakPolarHBondContact CB-O 3.34Å; N52-L77 PolarHBondContact ND2-O 3.08Å; C54-L77 HydrophobicContact CB-CD2 3.87Å; C54-L77 HydrophobicContact CB-CG 4.19Å; M69-L77 HydrophobicContact CE-CD1 4.37Å; M69-L77 HydrophobicContact SD-CD1 4.22Å; L73-L77 HydrophobicContact CD1-CD1 4.21Å; L73-L77 HydrophobicContact CD1-CG 4.41Å; L73-L77 HydrophobicContact CG-CD1 4.05Å; L73-L77 PolarHBondContact O-N 3.46Å; S74-L77 CarbonylContact O-C 3.58Å; S74-L77 PolarHBondContact O-N 2.98Å; R75-L77 VanDerWaalsContact C-N 3.26Å; R75-L77 PolarHBondContact O-N 3.04Å; L77-M79 HydrophobicContact CB-CG 3.6Å; L77-M79 HydrophobicContact CB-SD 4.11Å; L77-M79 HydrophobicContact CD1-CG 4.45Å; L77-M79 HydrophobicContact CD1-SD 3.89Å; L77-M79 PolarHBondContact O-N 2.97Å
78K97.7Very high96Very high150 Ų15076.3 Ų76.365%0.65239%0.39SS*.THydrogen-bonded Turntrans50.740.4-173.6-56.3178.6-180175.80112.2S74 R75 R76S74-K78 PolarHBondContact O-N 3.06Å; R75-K78 PolarHBondContact O-N 3.02Å; R75-K78 VanDerWaalsContact O-N 3.08Å; R76-K78 VanDerWaalsContact C-N 3.28Å
79M97.2Very high95.6Very high24 Ų2482 Ų8212%0.11840%0.402CS..  trans-66.4142.8-178.1-64.7-179.772.100111.1F49 M69 S74 L77 S102 E103 C104 V120F49-M79 HydrophobicContact CB-CG 3.76Å; F49-M79 HydrophobicContact CB-SD 4.46Å; F49-M79 HydrophobicContact CD1-CB 4.22Å; F49-M79 HydrophobicContact CD1-CG 3.86Å; F49-M79 HydrophobicContact CD2-CE 4.05Å; F49-M79 HydrophobicContact CD2-CG 4.12Å; F49-M79 HydrophobicContact CE1-CB 4.39Å; F49-M79 HydrophobicContact CE1-CG 4.49Å; F49-M79 HydrophobicContact CG-CB 4.34Å; F49-M79 HydrophobicContact CG-CE 4.42Å; F49-M79 HydrophobicContact CG-CG 3.63Å; M69-M79 HydrophobicContact CE-CE 4.13Å; M69-M79 HydrophobicContact CE-SD 3.75Å; M69-M79 HydrophobicContact SD-CE 4.41Å; M69-M79 HydrophobicContact SD-SD 3.44Å; S74-M79 PolarHBondContact O-N 3.37Å; L77-M79 HydrophobicContact CB-CG 3.6Å; L77-M79 HydrophobicContact CB-SD 4.11Å; L77-M79 HydrophobicContact CD1-CG 4.45Å; L77-M79 HydrophobicContact CD1-SD 3.89Å; L77-M79 PolarHBondContact O-N 2.97Å; M79-S102 WeakPolarHBondContact CE-OG 3.42Å; M79-E103 VanDerWaalsContact CE-O 3.28Å; M79-E103 WeakPolarHBondContact CE-O 3.39Å; M79-C104 HydrophobicContact CE-CB 3.96Å; M79-V120 HydrophobicContact CE-CG1 3.83Å
80T95.9Very high95Very high103 Ų10382.2 Ų82.263%0.63241%0.405SS*.  trans-123.5157.5171.659.10000108.7S102T80-S102 WeakPolarHBondContact O-CB 3.39Å; T80-S102 PolarHBondContact O-OG 2.89Å
81G96.3Very high94.3Very high43 Ų4384.8 Ų84.844%0.44341%0.412SS..  trans176.3-178.4-176.200000112.5E101G81-E101 CarbonylContact C-O 3.57Å; G81-E101 WeakPolarHBondContact CA-O 3.42Å
82L96.6Very high93.5Very high95 Ų9583.2 Ų83.250%0.49741%0.411SS..EExtended strand (participates in β ladder)trans-80.7123.2-178.1-176.460.6000110.3R84 V100 E101L82-R84 HydrophobicContact CG-CG 4.49Å; L82-V100 WeakPolarHBondContact O-CA 3.38Å; L82-E101 PolarHBondContact N-O 2.89Å; L82-E101 PolarHBondContact O-N 2.87Å
83K96.2Very high93Very high157 Ų15780.8 Ų80.868%0.68340%0.403SS*.EExtended strand (participates in β ladder)trans-73.1132.2173.7-68.7-178.2-178.5-179.60110.2A99 V100K83-A99 CarbonylContact C-O 3.53Å; K83-A99 WeakPolarHBondContact CA-O 3.47Å; K83-V100 HydrophobicContact CG-CG2 4.23Å
84R94.9Very high92.4Very high118 Ų11883.7 Ų83.745%0.44542%0.421SS..EExtended strand (participates in β ladder)trans-133.4147.2175.5-66.2-64.3-175.494.3-1110.3L82 L86 T98 A99 E101L82-R84 HydrophobicContact CG-CG 4.49Å; R84-L86 HydrophobicContact CB-CD2 4.29Å; R84-L86 HydrophobicContact CB-CG 4.48Å; R84-T98 CarbonylContact O-C 3.6Å; R84-T98 WeakPolarHBondContact O-CA 3.41Å; R84-A99 PolarHBondContact N-O 2.9Å; R84-A99 PolarHBondContact O-N 2.79Å; R84-E101 HydrophobicContact CG-CG 4.01Å; R84-E101 IonicContact CZ-OE2 2.85Å; R84-E101 IonicContact NE-OE2 3.46Å; R84-E101 IonicContact NH1-OE2 3.34Å
85S95.5Very high91.9Very high74 Ų7485.6 Ų85.652%0.51744%0.435SS..EExtended strand (participates in β ladder)trans-91.3121.5167.4-171.40000108.5Q96 V97S85-Q96 WeakPolarHBondContact OG-CG 3.1Å; S85-Q96 PolarHBondContact OG-NE2 2.84Å; S85-V97 WeakPolarHBondContact CA-O 3.31Å
86L93.8Very high91.7Very high50 Ų5086 Ų8626%0.26244%0.442SS..EExtended strand (participates in β ladder)trans-120.5139.7-179.2-59.3-177.9000110R84 I88 Q96 V97 A99 I121R84-L86 HydrophobicContact CB-CD2 4.29Å; R84-L86 HydrophobicContact CB-CG 4.48Å; L86-I88 HydrophobicContact CB-CG1 4.32Å; L86-Q96 WeakPolarHBondContact O-CA 3.17Å; L86-V97 HydrophobicContact CB-CG2 4.3Å; L86-V97 PolarHBondContact N-O 3.15Å; L86-V97 PolarHBondContact O-N 2.83Å; L86-A99 HydrophobicContact CD1-CB 3.53Å; L86-A99 HydrophobicContact CG-CB 3.98Å; L86-I121 HydrophobicContact CD1-CG2 3.66Å
87N92.8Very high91.4Very high118 Ų11880 Ų8063%0.63142%0.421SS*.EExtended strand (participates in β ladder)trans-91.4107.6167.7-71.2-36.3000108.5V94N87-V94 HydrophobicContact CB-CG1 4.15Å
88I89.2Confident91.2Very high34 Ų3484.7 Ų84.717%0.17445%0.45CS..EExtended strand (participates in β ladder)trans-101.6118.4178.5-59.2-176000108.6L86 T90 S95 V97 V123 L126L86-I88 HydrophobicContact CB-CG1 4.32Å; I88-T90 HydrophobicContact CG2-CG2 4.09Å; I88-S95 PolarHBondContact N-O 2.81Å; I88-S95 PolarHBondContact O-N 2.81Å; I88-V97 HydrophobicContact CD1-CG2 3.43Å; I88-V97 VanDerWaalsContact CD1-CG2 3.43Å; I88-V97 HydrophobicContact CG1-CG2 3.82Å; I88-V123 HydrophobicContact CD1-CB 4.41Å; I88-V123 HydrophobicContact CD1-CG1 3.77Å; I88-L126 HydrophobicContact CD1-CD1 4.05Å; I88-L126 HydrophobicContact CD1-CD2 4.26Å; I88-L126 HydrophobicContact CG2-CD1 3.9Å; I88-L126 HydrophobicContact CG2-CD2 4.4Å
89R87.9Confident91.1Very high206 Ų20677.6 Ų77.678%0.77742%0.42SS*.EExtended strand (participates in β ladder)trans-93115.7173.5-173.3175-72.8-128.5-0.1109.4G93 V94R89-G93 WeakPolarHBondContact CA-O 3.41Å; R89-V94 HydrophobicContact CB-CG2 4Å; R89-V94 HydrophobicContact CG-CG2 3.87Å; R89-V94 VanDerWaalsContact NE-CG2 3.33Å
90T85Confident91Very high18 Ų1878.2 Ų78.211%0.1142%0.424CS..EExtended strand (participates in β ladder)trans-107.9177.3170.174.30000109.1I88 S92 G93 N127 L128I88-T90 HydrophobicContact CG2-CG2 4.09Å; T90-S92 PolarHBondContact O-N 3.17Å; T90-S92 PolarHBondContact OG1-N 2.78Å; T90-S92 VanDerWaalsContact OG1-N 3.16Å; T90-S92 PolarHBondContact OG1-OG 3.04Å; T90-G93 PolarHBondContact N-O 3.39Å; T90-G93 PolarHBondContact O-N 2.89Å; T90-G93 VanDerWaalsContact O-O 3.13Å; T90-N127 PolarHBondContact OG1-O 3.36Å; T90-L128 HydrophobicContact CG2-CD2 3.59Å
91I80.6Confident91.1Very high112 Ų11275.7 Ų75.757%0.57441%0.406SS*.THydrogen-bonded Turntrans-63.7-17.6173.162.8167.7000113.2G93 L128 L130I91-G93 VanDerWaalsContact C-N 3.32Å; I91-L128 WeakPolarHBondContact CD1-O 3.27Å; I91-L128 WeakPolarHBondContact CG1-O 3.47Å; I91-L130 HydrophobicContact CD1-CB 4.12Å; I91-L130 HydrophobicContact CD1-CD1 4.26Å; I91-L130 HydrophobicContact CD1-CG 3.84Å; I91-L130 HydrophobicContact CG1-CD1 4.42Å; I91-L130 HydrophobicContact CG1-CG 4.01Å
92S79.2Confident91.1Very high57 Ų5774.2 Ų74.240%0.39939%0.388SS..THydrogen-bonded Turntrans-87.30.3175.267.10000113.4T90 N127T90-S92 PolarHBondContact O-N 3.17Å; T90-S92 PolarHBondContact OG1-N 2.78Å; T90-S92 VanDerWaalsContact OG1-N 3.16Å; T90-S92 PolarHBondContact OG1-OG 3.04Å; S92-N127 PolarHBondContact OG-O 3.36Å
93G85.4Confident91.1Very high33 Ų3374.1 Ų74.134%0.3439%0.386SS..EExtended strand (participates in β ladder)trans121.5-166.4-179.300000113.1R89 T90 I91R89-G93 WeakPolarHBondContact CA-O 3.41Å; T90-G93 PolarHBondContact N-O 3.39Å; T90-G93 PolarHBondContact O-N 2.89Å; T90-G93 VanDerWaalsContact O-O 3.13Å; I91-G93 VanDerWaalsContact C-N 3.32Å
94V85.7Confident91.2Very high75 Ų7566.8 Ų66.846%0.45535%0.354SS..EExtended strand (participates in β ladder)trans-97.1129177.4-176.60000109.6N87 R89N87-V94 HydrophobicContact CB-CG1 4.15Å; R89-V94 HydrophobicContact CB-CG2 4Å; R89-V94 HydrophobicContact CG-CG2 3.87Å; R89-V94 VanDerWaalsContact NE-CG2 3.33Å
95S87.1Confident91.4Very high52 Ų5263.4 Ų63.436%0.36435%0.346SS..EExtended strand (participates in β ladder)trans-118.7124.9173.4-63.70000109.5I88I88-S95 PolarHBondContact N-O 2.81Å; I88-S95 PolarHBondContact O-N 2.81Å
96Q92.1Very high91.5Very high144 Ų14462 Ų6267%0.67333%0.332SS*.EExtended strand (participates in β ladder)trans-78122.8165.8-171178.346.100108.4S85 L86S85-Q96 WeakPolarHBondContact OG-CG 3.1Å; S85-Q96 PolarHBondContact OG-NE2 2.84Å; L86-Q96 WeakPolarHBondContact O-CA 3.17Å
97V92Very high91.6Very high16 Ų1660.1 Ų60.110%0.09732%0.324CS..EExtended strand (participates in β ladder)trans-124.6149.4-180-57.30000110.4S85 L86 I88 P124 L126S85-V97 WeakPolarHBondContact CA-O 3.31Å; L86-V97 HydrophobicContact CB-CG2 4.3Å; L86-V97 PolarHBondContact N-O 3.15Å; L86-V97 PolarHBondContact O-N 2.83Å; I88-V97 HydrophobicContact CD1-CG2 3.43Å; I88-V97 VanDerWaalsContact CD1-CG2 3.43Å; I88-V97 HydrophobicContact CG1-CG2 3.82Å; V97-P124 HydrophobicContact CB-CG 4.03Å; V97-P124 HydrophobicContact CG1-CG 3.96Å; V97-L126 HydrophobicContact CG1-CD2 4.3Å
98T94.4Very high91.7Very high100 Ų10056.1 Ų56.161%0.61331%0.307SS*.EExtended strand (participates in β ladder)trans-86.4113.3163.3-58.50000107.7R84R84-T98 CarbonylContact O-C 3.6Å; R84-T98 WeakPolarHBondContact O-CA 3.41Å
99A94.5Very high91.7Very high1 Ų158.2 Ų58.21%0.00832%0.316CS..EExtended strand (participates in β ladder)trans-104.2162.3175.800000110.7K83 R84 L86 I121 V122K83-A99 CarbonylContact C-O 3.53Å; K83-A99 WeakPolarHBondContact CA-O 3.47Å; R84-A99 PolarHBondContact N-O 2.9Å; R84-A99 PolarHBondContact O-N 2.79Å; L86-A99 HydrophobicContact CD1-CB 3.53Å; L86-A99 HydrophobicContact CG-CB 3.98Å; A99-I121 HydrophobicContact CB-CG2 3.91Å; A99-V122 VanDerWaalsContact CA-O 3.27Å; A99-V122 WeakPolarHBondContact CA-O 3.18Å; A99-V122 WeakPolarHBondContact CB-O 3.46Å
100V96.4Very high91.8Very high36 Ų3653.2 Ų53.222%0.21830%0.304CS..EExtended strand (participates in β ladder)trans-116.6121.6170-178.50000108.4L82 K83 V122L82-V100 WeakPolarHBondContact O-CA 3.38Å; K83-V100 HydrophobicContact CG-CG2 4.23Å; V100-V122 HydrophobicContact CB-CB 4.02Å; V100-V122 HydrophobicContact CB-CG2 4.38Å; V100-V122 PolarHBondContact N-O 2.67Å; V100-V122 VanDerWaalsContact N-O 3.08Å; V100-V122 WeakPolarHBondContact O-CB 3.22Å; V100-V122 PolarHBondContact O-N 2.93Å
101E96.8Very high91.8Very high51 Ų5154.4 Ų54.424%0.23832%0.32CS..EExtended strand (participates in β ladder)trans-85.7125168.6-59.8-176.3167.700108.2G81 L82 R84 I121G81-E101 CarbonylContact C-O 3.57Å; G81-E101 WeakPolarHBondContact CA-O 3.42Å; L82-E101 PolarHBondContact N-O 2.89Å; L82-E101 PolarHBondContact O-N 2.87Å; R84-E101 HydrophobicContact CG-CG 4.01Å; R84-E101 IonicContact CZ-OE2 2.85Å; R84-E101 IonicContact NE-OE2 3.46Å; R84-E101 IonicContact NH1-OE2 3.34Å; E101-I121 HydrophobicContact CB-CD1 4.44Å; E101-I121 HydrophobicContact CG-CD1 3.7Å
102S97.3Very high92.3Very high11 Ų1151.8 Ų51.88%0.07731%0.312CS..EExtended strand (participates in β ladder)trans-145.9-179.3-178-168.50000109.2M79 T80 P119 V120M79-S102 WeakPolarHBondContact CE-OG 3.42Å; T80-S102 WeakPolarHBondContact O-CB 3.39Å; T80-S102 PolarHBondContact O-OG 2.89Å; S102-P119 CarbonylContact O-C 3.42Å; S102-P119 WeakPolarHBondContact O-CA 3.34Å; S102-V120 PolarHBondContact N-O 3.45Å; S102-V120 VanDerWaalsContact N-O 3.08Å; S102-V120 WeakPolarHBondContact O-CG1 3.48Å; S102-V120 PolarHBondContact O-N 3.02Å
103E97.4Very high93Very high94 Ų9453.4 Ų53.444%0.43932%0.316SS..EExtended strand (participates in β ladder)trans-117.1156.417364.2-174.6-177.300109.4F49 M79 H116 V117 D118F49-E103 WeakPolarHBondContact CD2-O 3.49Å; F49-E103 HydrophobicContact CE2-CG 4.38Å; M79-E103 VanDerWaalsContact CE-O 3.28Å; M79-E103 WeakPolarHBondContact CE-O 3.39Å; E103-H116 IonicContact OE2-CE1 3.92Å; E103-H116 PolarHBondContact OE2-CE1 3.31Å; E103-H116 IonicContact OE2-NE2 3.74Å; E103-H116 PolarHBondContact OE2-NE2 2.71Å; E103-V117 CarbonylContact C-O 3.58Å; E103-V117 VanDerWaalsContact CA-O 3.31Å; E103-V117 WeakPolarHBondContact CA-O 3.43Å; E103-D118 HydrophobicContact CB-CB 4.13Å
104C98Very high93.5Very high3 Ų355.4 Ų55.42%0.0233%0.325CS..EExtended strand (participates in β ladder)trans-153.6171.9167.971.10000111.1V47 S48 M69 M79 V117 V120V47-C104 HydrophobicContact CG1-CB 4.16Å; S48-C104 WeakPolarHBondContact O-CB 3.41Å; M69-C104 HydrophobicContact CE-CB 4.4Å; M79-C104 HydrophobicContact CE-CB 3.96Å; C104-V117 PolarHBondContact N-O 3.24Å; C104-V117 PolarHBondContact O-N 2.75Å; C104-V120 HydrophobicContact CB-CG1 4.3Å
105V98.1Very high94Very high46 Ų4658.6 Ų58.628%0.27933%0.333SS..EExtended strand (participates in β ladder)trans-109.5131.4167.4174.50000108.6V47 S48 F115V47-V105 CarbonylContact C-O 3.59Å; V47-V105 WeakPolarHBondContact CA-O 3.36Å; S48-V105 PolarHBondContact N-O 3.08Å; S48-V105 PolarHBondContact O-N 3.34Å; S48-V105 WeakPolarHBondContact OG-CB 3.44Å; S48-V105 PolarHBondContact OG-O 2.92Å; V105-F115 CarbonylContact C-O 3.48Å; V105-F115 WeakPolarHBondContact CA-O 3.19Å
106I97.5Very high94.5Very high45 Ų4561.3 Ų61.323%0.23134%0.34CS..EExtended strand (participates in β ladder)trans-108.6132.1170.7-58-175.5000107.9V45 K46 V47 S114 F115 V117V45-I106 HydrophobicContact CB-CG2 3.83Å; V45-I106 HydrophobicContact CG1-CG2 3.93Å; V45-I106 HydrophobicContact CG2-CG2 4.21Å; K46-I106 CarbonylContact O-C 3.53Å; K46-I106 WeakPolarHBondContact O-CA 3.37Å; V47-I106 HydrophobicContact CG2-CG1 4.36Å; I106-S114 CarbonylContact O-C 3.56Å; I106-S114 WeakPolarHBondContact O-CA 3.43Å; I106-F115 PolarHBondContact N-O 3.43Å; I106-F115 PolarHBondContact O-N 3.27Å; I106-V117 HydrophobicContact CB-CG2 4.36Å; I106-V117 HydrophobicContact CD1-CG2 3.7Å; I106-V117 HydrophobicContact CG1-CG2 3.76Å
107S96.9Very high94.8Very high11 Ų1155.4 Ų55.48%0.07731%0.313CS..EExtended strand (participates in β ladder)trans-129159.1175.476.80000111.7V45 K46 N113V45-S107 WeakPolarHBondContact CA-O 3.22Å; K46-S107 PolarHBondContact N-O 3.31Å; K46-S107 PolarHBondContact O-N 3.49Å; S107-N113 CarbonylContact C-O 3.57Å; S107-N113 WeakPolarHBondContact CA-O 3.36Å; S107-N113 WeakPolarHBondContact CB-O 3.27Å
108A93.5Very high94.9Very high33 Ų3359.9 Ų59.927%0.27334%0.337SS..  trans-54.715416000000110D110 G111 N113A108-D110 WeakPolarHBondContact CB-OD1 3.18Å; A108-D110 PolarHBondContact O-N 2.79Å; A108-G111 PolarHBondContact O-N 2.78Å; A108-N113 PolarHBondContact N-O 2.97Å
109E90.6Very high94.9Very high79 Ų7958.1 Ų58.137%0.36933%0.327SS..THydrogen-bonded Turntrans-61.5-30.2-179-88.7-161.498.200113.5P44 R55 G111P44-E109 HydrophobicContact CB-CG 4.07Å; P44-E109 WeakPolarHBondContact CB-OE2 3.43Å; P44-E109 WeakPolarHBondContact CG-OE2 3.17Å; R55-E109 IonicContact CZ-OE1 3.97Å; R55-E109 IonicContact NE-OE1 3.94Å; R55-E109 IonicContact NH1-OE1 2.71Å; R55-E109 PolarHBondContact NH1-OE1 3.11Å; E109-G111 VanDerWaalsContact C-N 3.3Å
110D88.7Confident95Very high100 Ų10058.3 Ų58.354%0.53533%0.328SS..THydrogen-bonded Turntrans-81.6-8.8175.762.63.5000113.1V20 A108 S112V20-D110 WeakPolarHBondContact CG1-OD2 3.1Å; A108-D110 WeakPolarHBondContact CB-OD1 3.18Å; A108-D110 PolarHBondContact O-N 2.79Å; D110-S112 VanDerWaalsContact CG-OG 3.32Å; D110-S112 PolarHBondContact O-N 2.92Å; D110-S112 VanDerWaalsContact OD1-CB 3.23Å; D110-S112 WeakPolarHBondContact OD1-CB 3.47Å; D110-S112 PolarHBondContact OD1-N 2.96Å; D110-S112 PolarHBondContact OD1-OG 3.15Å; D110-S112 PolarHBondContact OD2-OG 2.89Å
111G86.2Confident95.1Very high43 Ų4357.4 Ų57.444%0.44332%0.322SS..SBendtrans74.28.7-176.600000114.5A108 E109 N113A108-G111 PolarHBondContact O-N 2.78Å; E109-G111 VanDerWaalsContact C-N 3.3Å; G111-N113 VanDerWaalsContact C-N 3.25Å; G111-N113 PolarHBondContact O-N 2.94Å
112S90.9Very high95.1Very high58 Ų5855.2 Ų55.241%0.40631%0.312SS..SBendtrans-60.6-35.7-179.257.90000112.7D110D110-S112 VanDerWaalsContact CG-OG 3.32Å; D110-S112 PolarHBondContact O-N 2.92Å; D110-S112 VanDerWaalsContact OD1-CB 3.23Å; D110-S112 WeakPolarHBondContact OD1-CB 3.47Å; D110-S112 PolarHBondContact OD1-N 2.96Å; D110-S112 PolarHBondContact OD1-OG 3.15Å; D110-S112 PolarHBondContact OD2-OG 2.89Å
113N93.7Very high94.9Very high91 Ų9155.2 Ų55.249%0.48731%0.311SS..  trans-134.5140.7-178.6-68.3-75000110.3S107 A108 G111 F115S107-N113 CarbonylContact C-O 3.57Å; S107-N113 WeakPolarHBondContact CA-O 3.36Å; S107-N113 WeakPolarHBondContact CB-O 3.27Å; A108-N113 PolarHBondContact N-O 2.97Å; G111-N113 VanDerWaalsContact C-N 3.25Å; G111-N113 PolarHBondContact O-N 2.94Å; N113-F115 HydrophobicContact CB-CE2 4.23Å
114S96.4Very high94.7Very high74 Ų7452.8 Ų52.852%0.51730%0.304SS..EExtended strand (participates in β ladder)trans-140142.2-176.9-49.50000110.7I106I106-S114 CarbonylContact O-C 3.56Å; I106-S114 WeakPolarHBondContact O-CA 3.43Å
115F95.9Very high94.2Very high142 Ų14262.5 Ų62.562%0.62335%0.346SS*.EExtended strand (participates in β ladder)trans-135133.7179.1-61-84.8000110.3V105 I106 N113V105-F115 CarbonylContact C-O 3.48Å; V105-F115 WeakPolarHBondContact CA-O 3.19Å; I106-F115 PolarHBondContact N-O 3.43Å; I106-F115 PolarHBondContact O-N 3.27Å; N113-F115 HydrophobicContact CB-CE2 4.23Å
116H97.5Very high93.5Very high110 Ų11062.4 Ų62.451%0.50934%0.343SS..EExtended strand (participates in β ladder)trans-76.2130.1168.4-165.9-107000109.3E103E103-H116 IonicContact OE2-CE1 3.92Å; E103-H116 PolarHBondContact OE2-CE1 3.31Å; E103-H116 IonicContact OE2-NE2 3.74Å; E103-H116 PolarHBondContact OE2-NE2 2.71Å
117V97.3Very high92.5Very high20 Ų2065.4 Ų65.412%0.12136%0.36CS..EExtended strand (participates in β ladder)trans-114.7108.6177.6-176.60000107.7E103 C104 I106 V120E103-V117 CarbonylContact C-O 3.58Å; E103-V117 VanDerWaalsContact CA-O 3.31Å; E103-V117 WeakPolarHBondContact CA-O 3.43Å; C104-V117 PolarHBondContact N-O 3.24Å; C104-V117 PolarHBondContact O-N 2.75Å; I106-V117 HydrophobicContact CB-CG2 4.36Å; I106-V117 HydrophobicContact CD1-CG2 3.7Å; I106-V117 HydrophobicContact CG1-CG2 3.76Å; V117-V120 HydrophobicContact CG1-CB 3.99Å
118D94.6Very high91.3Very high109 Ų10970.3 Ų70.358%0.58338%0.384SS*.EExtended strand (participates in β ladder)trans-143.4118.3177.3178.823.1000110E103E103-D118 HydrophobicContact CB-CB 4.13Å
119P94.8Very high90Very high64 Ų6471.5 Ų71.542%0.41640%0.395SS..EExtended strand (participates in β ladder)cis-82.7150.7-4.333.6-34.1000112.2S102 I121S102-P119 CarbonylContact O-C 3.42Å; S102-P119 WeakPolarHBondContact O-CA 3.34Å; P119-I121 HydrophobicContact CB-CD1 4.17Å; P119-I121 HydrophobicContact CG-CD1 4.29Å
120V97.5Very high88.7Confident4 Ų473.5 Ų73.52%0.02441%0.407CS..EExtended strand (participates in β ladder)trans-102.4126.7155.4630000109.7M69 M79 S102 C104 V117M69-V120 HydrophobicContact CB-CG2 3.64Å; M69-V120 HydrophobicContact CE-CG1 4.37Å; M69-V120 HydrophobicContact CE-CG2 4.04Å; M79-V120 HydrophobicContact CE-CG1 3.83Å; S102-V120 PolarHBondContact N-O 3.45Å; S102-V120 VanDerWaalsContact N-O 3.08Å; S102-V120 WeakPolarHBondContact O-CG1 3.48Å; S102-V120 PolarHBondContact O-N 3.02Å; C104-V120 HydrophobicContact CB-CG1 4.3Å; V117-V120 HydrophobicContact CG1-CB 3.99Å
121I96.9Very high87Confident17 Ų1779.3 Ų79.39%0.08742%0.422CS..EExtended strand (participates in β ladder)trans-92.3109.6-179-46.8-60.3000109.1S67 V68 M69 L86 A99 E101 P119 V123S67-I121 PolarHBondContact O-N 3.33Å; V68-I121 CarbonylContact C-O 3.59Å; V68-I121 WeakPolarHBondContact CA-O 3.23Å; M69-I121 PolarHBondContact N-O 3.29Å; L86-I121 HydrophobicContact CD1-CG2 3.66Å; A99-I121 HydrophobicContact CB-CG2 3.91Å; E101-I121 HydrophobicContact CB-CD1 4.44Å; E101-I121 HydrophobicContact CG-CD1 3.7Å; P119-I121 HydrophobicContact CB-CD1 4.17Å; P119-I121 HydrophobicContact CG-CD1 4.29Å; I121-V123 HydrophobicContact CG2-CG1 3.87Å; I121-V123 PolarHBondContact O-N 3.43Å
122V97.3Very high85.4Confident5 Ų583.7 Ų83.73%0.0344%0.444CS..EExtended strand (participates in β ladder)trans-79118173.1-178.90000109M69 E71 S74 A99 V100M69-V122 CarbonylContact O-C 3.53Å; M69-V122 VanDerWaalsContact O-CA 3.31Å; M69-V122 WeakPolarHBondContact O-CA 3.14Å; E71-V122 HydrophobicContact CB-CG1 4.2Å; E71-V122 HydrophobicContact CG-CG1 4.26Å; S74-V122 VanDerWaalsContact OG-CG1 3.25Å; S74-V122 WeakPolarHBondContact OG-CG1 3.42Å; A99-V122 VanDerWaalsContact CA-O 3.27Å; A99-V122 WeakPolarHBondContact CA-O 3.18Å; A99-V122 WeakPolarHBondContact CB-O 3.46Å; V100-V122 HydrophobicContact CB-CB 4.02Å; V100-V122 HydrophobicContact CB-CG2 4.38Å; V100-V122 PolarHBondContact N-O 2.67Å; V100-V122 VanDerWaalsContact N-O 3.08Å; V100-V122 WeakPolarHBondContact O-CB 3.22Å; V100-V122 PolarHBondContact O-N 2.93Å
123V94.6Very high83.6Confident11 Ų1185 Ų857%0.06745%0.453CS..EExtended strand (participates in β ladder)trans-118150.5179.9-590000111.3V68 M69 E71 I88 I121 L126V68-V123 HydrophobicContact CG1-CB 4.17Å; V68-V123 HydrophobicContact CG1-CG1 3.86Å; V68-V123 HydrophobicContact CG1-CG2 3.24Å; M69-V123 PolarHBondContact O-N 2.89Å; E71-V123 PolarHBondContact N-O 3.01Å; I88-V123 HydrophobicContact CD1-CB 4.41Å; I88-V123 HydrophobicContact CD1-CG1 3.77Å; I121-V123 HydrophobicContact CG2-CG1 3.87Å; I121-V123 PolarHBondContact O-N 3.43Å; V123-L126 HydrophobicContact CB-CD1 4.45Å; V123-L126 HydrophobicContact CG2-CD1 4.07Å; V123-L126 HydrophobicContact CG2-CG 4.32Å
124P91.9Very high81.6Confident43 Ų4383.4 Ų83.428%0.27945%0.449SS..  trans-64.6173.8168.830.4-36.4000110.7V97 L126V97-P124 HydrophobicContact CB-CG 4.03Å; V97-P124 HydrophobicContact CG1-CG 3.96Å; P124-L126 PolarHBondContact O-N 3.09Å
125K88.6Confident79.8Confident208 Ų20891 Ų9190%0.90447%0.466SS*.  trans-59.4110.3173.4-175.7179.8179.7-178.70110
126L82.4Confident77.9Confident43 Ų4392.8 Ų92.823%0.22547%0.474CS..  trans-88.5136.1175.5-61.6175.4000110.3I88 V97 V123 P124 L128I88-L126 HydrophobicContact CD1-CD1 4.05Å; I88-L126 HydrophobicContact CD1-CD2 4.26Å; I88-L126 HydrophobicContact CG2-CD1 3.9Å; I88-L126 HydrophobicContact CG2-CD2 4.4Å; V97-L126 HydrophobicContact CG1-CD2 4.3Å; V123-L126 HydrophobicContact CB-CD1 4.45Å; V123-L126 HydrophobicContact CG2-CD1 4.07Å; V123-L126 HydrophobicContact CG2-CG 4.32Å; P124-L126 PolarHBondContact O-N 3.09Å; L126-L128 HydrophobicContact CB-CD2 3.76Å; L126-L128 HydrophobicContact CB-CG 4.11Å; L126-L128 HydrophobicContact CD1-CD2 4.25Å; L126-L128 PolarHBondContact O-N 2.82Å
127N76.2Confident75.9Confident109 Ų10993.8 Ų93.858%0.58348%0.483SS*.  trans-83.292.9169.1-164.10.3000109.1T90 S92 A129T90-N127 PolarHBondContact OG1-O 3.36Å; S92-N127 PolarHBondContact OG-O 3.36Å; N127-A129 PolarHBondContact OD1-O 2.87Å; N127-A129 VanDerWaalsContact OD1-O 3.04Å
128L71.8Confident73.7Confident113 Ų11398.5 Ų98.559%0.59251%0.506SS*.  trans-87.8-9.1-178.7-57.3-178.3000113.1T90 I91 L126T90-L128 HydrophobicContact CG2-CD2 3.59Å; I91-L128 WeakPolarHBondContact CD1-O 3.27Å; I91-L128 WeakPolarHBondContact CG1-O 3.47Å; L126-L128 HydrophobicContact CB-CD2 3.76Å; L126-L128 HydrophobicContact CB-CG 4.11Å; L126-L128 HydrophobicContact CD1-CD2 4.25Å; L126-L128 PolarHBondContact O-N 2.82Å
129A66.5Low71.4Confident59 Ų59102.5 Ų102.549%0.48852%0.519SS..  trans-121.4122.2-174.200000111.1N127N127-A129 PolarHBondContact OD1-O 2.87Å; N127-A129 VanDerWaalsContact OD1-O 3.04Å
130L62.5Low69.4Low120 Ų120108.3 Ų108.363%0.62856%0.561SS**SBendtrans-76.8-29.5169-73.3175.1000111.6I91I91-L130 HydrophobicContact CD1-CB 4.12Å; I91-L130 HydrophobicContact CD1-CD1 4.26Å; I91-L130 HydrophobicContact CD1-CG 3.84Å; I91-L130 HydrophobicContact CG1-CD1 4.42Å; I91-L130 HydrophobicContact CG1-CG 4.01Å
131R54.9Low68Low223 Ų223113.6 Ų113.684%0.84259%0.588SS**  trans-98.8102.1-171.1-60.4-162.5-172-1694.5110.3S133R131-S133 VanDerWaalsContact C-N 3.29Å; R131-S133 PolarHBondContact O-N 2.83Å; R131-S133 VanDerWaalsContact O-N 3.15Å
132C52.6Low66.4Low134 Ų134118.6 Ų118.691%0.90561%0.614SS**  trans-72.894.1151.2-149.40000105.7S134C132-S134 PolarHBondContact O-N 2.75Å
133S52.2Low64.7Low86 Ų86124.9 Ų124.960%0.60165%0.646SS**  trans-67.7106.6173.741.30000108.3R131R131-S133 VanDerWaalsContact C-N 3.29Å; R131-S133 PolarHBondContact O-N 2.83Å; R131-S133 VanDerWaalsContact O-N 3.15Å
134S52.5Low63Low58 Ų58131.6 Ų131.641%0.40668%0.68SS.*  trans-60.4134.7163168.40000107.9C132 K136 D137C132-S134 PolarHBondContact O-N 2.75Å; S134-K136 PolarHBondContact O-N 3.43Å; S134-K136 PolarHBondContact OG-N 3.28Å; S134-D137 PolarHBondContact O-N 2.86Å
135R58Low61.2Low232 Ų232137.2 Ų137.288%0.87571%0.705SS**G310 helixtrans-52.2-19.4175.3-83.8-172.7177-159.1-0.5113.3D137 I138R135-D137 PolarHBondContact O-N 2.72Å; R135-I138 PolarHBondContact O-N 2.95Å
136K56.5Low59.3Low180 Ų180132.5 Ų132.578%0.78369%0.692SS**G310 helixtrans-66.3-21.6178.2-64.6-173.3178.4-179.60113.9S134S134-K136 PolarHBondContact O-N 3.43Å; S134-K136 PolarHBondContact OG-N 3.28Å
137D54.2Low57.7Low132 Ų132138.9 Ų138.971%0.70673%0.726SS**G310 helixtrans-94.2-2.1-177.4-58.7-41.2000113.3S134 R135 K139S134-D137 PolarHBondContact O-N 2.86Å; R135-D137 PolarHBondContact O-N 2.72Å; D137-K139 PolarHBondContact O-N 2.72Å
138I51.1Low56.3Low118 Ų118141.2 Ų141.261%0.60574%0.737SS**  trans-94.175.8171.9-56164.6000106.8R135R135-I138 PolarHBondContact O-N 2.95Å
139K47.5Very low55Low194 Ų194143.5 Ų143.584%0.84375%0.749SS**  trans-89.3110.5161.2-81.2-174.7176.4-178.30107.7D137D137-K139 PolarHBondContact O-N 2.72Å
140S51.2Low53.9Low186 Ų186151.2 Ų151.2100%1.30177%0.772SS**  trans-60.80157.9-61.70000111

Retrieved 140 of 140 residues in 172.9 ms (Link to these results)