A0A093JTT5_STRCA Loading...

Multiple coagulation factor deficiency protein 2

AlphaFold DB , UniProt , Accession A0A093JTT5, Species STRCA (Struthio camelus australis), Gene n/a, Length 143 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
1M57.2Low53.3Low220 Ų220139.7 Ų139.7100%1.08469%0.687SS**  0-5.60-72.7173.9178.700114.7N5M1-N5 PolarHBondContact O-ND2 3.43Å
2A54.9Low53.3Low89 Ų89141.7 Ų141.774%0.73669%0.689SS**  trans-91.6-17.7-17800000115.7
3L52.2Low53.3Low138 Ų138137 Ų13772%0.72368%0.68SS**SBendtrans-89.3-21.9-172.8-160.765.4000114.4
4Q52.8Low53.3Low159 Ų159135.5 Ų135.574%0.74367%0.674SS**Hα-helixtrans-77.3-29.6176.2-77.9-174-45.300112.8F6 T8Q4-F6 VanDerWaalsContact C-N 3.33Å; Q4-F6 PolarHBondContact O-N 3.33Å; Q4-T8 PolarHBondContact O-N 3.5Å; Q4-T8 PolarHBondContact O-OG1 3.49Å
5N49.8Very low53.4Low100 Ų100133.3 Ų133.354%0.53567%0.665SS.*Hα-helixtrans-76.6-19.5-178.9-64.5-21000113.4M1 T8 R9M1-N5 PolarHBondContact O-ND2 3.43Å; N5-T8 PolarHBondContact O-OG1 3.16Å; N5-R9 VanDerWaalsContact O-CG 3.27Å; N5-R9 WeakPolarHBondContact O-CG 3.49Å
6F52.9Low53.4Low147 Ų147128.3 Ų128.365%0.64565%0.651SS**Hα-helixtrans-80.8-37.7178-166.6-100.2000111.7Q4 L10Q4-F6 VanDerWaalsContact C-N 3.33Å; Q4-F6 PolarHBondContact O-N 3.33Å; F6-L10 PolarHBondContact O-N 3.15Å; F6-L10 VanDerWaalsContact O-N 3.16Å
7R53Low53.3Low186 Ų186123.9 Ų123.970%0.70264%0.639SS**Hα-helixtrans-69.5-38.7178.8-75.7-176.7154.4168.4-5.2113L11R7-L11 PolarHBondContact O-N 3.37Å
8T51.8Low53Low79 Ų79126.3 Ų126.349%0.48564%0.644SS.*Hα-helixtrans-70.5-34.4176.844.30000112.5Q4 N5 F12Q4-T8 PolarHBondContact O-N 3.5Å; Q4-T8 PolarHBondContact O-OG1 3.49Å; N5-T8 PolarHBondContact O-OG1 3.16Å; T8-F12 WeakPolarHBondContact O-CD2 3.27Å; T8-F12 PolarHBondContact O-N 3.36Å
9R53.7Low52.7Low199 Ų199127.9 Ų127.975%0.75165%0.647SS**Hα-helixtrans-71.1-33.9175.6-73.4-175.3175.1-147.8-1.7113.4N5 S13N5-R9 VanDerWaalsContact O-CG 3.27Å; N5-R9 WeakPolarHBondContact O-CG 3.49Å; R9-S13 PolarHBondContact O-N 3.2Å
10L54.2Low52.7Low105 Ų105127.9 Ų127.955%0.5565%0.647SS.*Hα-helixtrans-70.1-36.6177.9-158.175.1000112.3F6 L14F6-L10 PolarHBondContact O-N 3.15Å; F6-L10 VanDerWaalsContact O-N 3.16Å; L10-L14 PolarHBondContact O-N 3.3Å
11L53.7Low52.4Low115 Ų115126.5 Ų126.560%0.60265%0.649SS**Hα-helixtrans-70.4-37.2177.2-73.8166.4000112.8R7 L14 L15R7-L11 PolarHBondContact O-N 3.37Å; L11-L14 PolarHBondContact O-N 3.44Å; L11-L15 PolarHBondContact O-N 3.27Å
12F53.8Low51.9Low163 Ų163120 Ų12072%0.71563%0.63SS**Hα-helixtrans-68.2-33.1175.7-98.2-90.2000113T8 A16T8-F12 WeakPolarHBondContact O-CD2 3.27Å; T8-F12 PolarHBondContact O-N 3.36Å; F12-A16 PolarHBondContact O-N 3.26Å; F12-A16 VanDerWaalsContact O-N 3.16Å
13S53.2Low51.5Low81 Ų81123.4 Ų123.457%0.56664%0.635SS**Hα-helixtrans-70.1-32.9176.5-173.80000113.1R9 A17R9-S13 PolarHBondContact O-N 3.2Å; S13-A17 PolarHBondContact O-N 3.46Å
14L52.8Low51.4Low116 Ų116120.7 Ų120.761%0.60763%0.632SS**Hα-helixtrans-74.4-36.2177.7-84.3158.8000112.2L10 L11 A17 F18L10-L14 PolarHBondContact O-N 3.3Å; L11-L14 PolarHBondContact O-N 3.44Å; L14-A17 PolarHBondContact O-N 3.48Å; L14-F18 PolarHBondContact O-N 3.16Å
15L54.8Low51.1Low103 Ų103122 Ų12254%0.53964%0.639SS.*Hα-helixtrans-65.3-41.1172.6-95.7151.3000112.2L11 A17 F18 F19L11-L15 PolarHBondContact O-N 3.27Å; L15-A17 VanDerWaalsContact C-N 3.35Å; L15-A17 PolarHBondContact O-N 3.48Å; L15-F18 PolarHBondContact O-N 3.08Å; L15-F19 HydrophobicContact CD2-CE2 4.4Å; L15-F19 WeakPolarHBondContact O-CD2 3.29Å; L15-F19 PolarHBondContact O-N 3.3Å; L15-F19 VanDerWaalsContact O-N 3.08Å
16A52.9Low50.7Low52 Ų52125.1 Ų125.143%0.4365%0.65SS.*Hα-helixtrans-64.5-37.3177.100000112.7F12 F19 I20F12-A16 PolarHBondContact O-N 3.26Å; F12-A16 VanDerWaalsContact O-N 3.16Å; A16-F19 PolarHBondContact O-N 3.23Å; A16-I20 WeakPolarHBondContact O-CD1 3.45Å; A16-I20 VanDerWaalsContact O-CG1 3.29Å; A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.46Å
17A51.9Low50.1Low55 Ų55123.8 Ų123.846%0.45566%0.659SS.*Hα-helixtrans-68.8-34.6176.300000112.5S13 L14 L15 I20 S21S13-A17 PolarHBondContact O-N 3.46Å; L14-A17 PolarHBondContact O-N 3.48Å; L15-A17 VanDerWaalsContact C-N 3.35Å; L15-A17 PolarHBondContact O-N 3.48Å; A17-I20 PolarHBondContact O-N 3.31Å; A17-S21 PolarHBondContact O-N 3.43Å
18F48.8Very low49.4Very low167 Ų167121 Ų12173%0.73266%0.662SS**Hα-helixtrans-70.6-34.8176.5-152.9-95000112.2L14 L15 A22L14-F18 PolarHBondContact O-N 3.16Å; L15-F18 PolarHBondContact O-N 3.08Å; F18-A22 PolarHBondContact O-N 3.28Å
19F47.8Very low48.6Very low157 Ų157119.8 Ų119.869%0.68967%0.665SS**Hα-helixtrans-68.8-29.4174.3-97.3-83.3000113.5L15 A16L15-F19 HydrophobicContact CD2-CE2 4.4Å; L15-F19 WeakPolarHBondContact O-CD2 3.29Å; L15-F19 PolarHBondContact O-N 3.3Å; L15-F19 VanDerWaalsContact O-N 3.08Å; A16-F19 PolarHBondContact O-N 3.23Å
20I51.4Low47.8Very low127 Ų127119.5 Ų119.565%0.65167%0.672SS**Hα-helixtrans-77.5-33.1178.3-64.3163.7000111.2A16 A17 A22 L23A16-I20 WeakPolarHBondContact O-CD1 3.45Å; A16-I20 VanDerWaalsContact O-CG1 3.29Å; A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.46Å; A17-I20 PolarHBondContact O-N 3.31Å; I20-A22 VanDerWaalsContact C-N 3.3Å; I20-A22 PolarHBondContact O-N 3.36Å; I20-L23 PolarHBondContact O-N 3.45Å
21S46.8Very low47Very low99 Ų99118.1 Ų118.169%0.69267%0.672SS**Hα-helixtrans-74-17.2177-69.40000114.4A17 L23A17-S21 PolarHBondContact O-N 3.43Å; S21-L23 VanDerWaalsContact C-N 3.3Å
22A47.2Very low46.2Very low82 Ų82122.1 Ų122.168%0.67869%0.688SS**THydrogen-bonded Turntrans-85.70.5174.400000113.5F18 I20F18-A22 PolarHBondContact O-N 3.28Å; I20-A22 VanDerWaalsContact C-N 3.3Å; I20-A22 PolarHBondContact O-N 3.36Å
23L45.9Very low45.5Very low161 Ų161118.7 Ų118.784%0.84367%0.674SS**SBendtrans-115.641179.9-149.280.4000111.3I20 S21I20-L23 PolarHBondContact O-N 3.45Å; S21-L23 VanDerWaalsContact C-N 3.3Å
24A50.7Low44.9Very low81 Ų81118.3 Ų118.367%0.66968%0.675SS**  trans-132.970.3175.500000109.6
25E46.3Very low44.4Very low187 Ų187119.3 Ų119.387%0.87468%0.681SS**  trans-124.196.9155.6-73.9-174.6158.300104.9
26E41.4Very low44.1Very low166 Ų166117.7 Ų117.778%0.77667%0.672SS**  88.797.2101.6-167.8169-171.400109.5V28E26-V28 PolarHBondContact O-N 2.91Å
27S39.3Very low44.1Very low118 Ų118120.7 Ų120.783%0.82567%0.673SS**  trans-64.692.1165.654.70000107.8G29S27-G29 PolarHBondContact O-N 2.93Å; S27-G29 VanDerWaalsContact O-N 3.1Å
28V38.9Very low44.4Very low127 Ų127118.7 Ų118.777%0.7765%0.654SS**  trans-54.2116168174.20000107E26 E30E26-V28 PolarHBondContact O-N 2.91Å; V28-E30 PolarHBondContact O-N 3.14Å
29G35.6Very low44.6Very low54 Ų54114 Ų11456%0.55764%0.636SS**  trans-57.1129173.200000108.7S27 S31S27-G29 PolarHBondContact O-N 2.93Å; S27-G29 VanDerWaalsContact O-N 3.1Å; G29-S31 PolarHBondContact O-N 3.16Å; G29-S31 PolarHBondContact O-OG 2.91Å
30E35.5Very low44.8Very low193 Ų193110.5 Ų110.590%0.90262%0.621SS**  trans-63.781.3173.4-16617017900108.7V28V28-E30 PolarHBondContact O-N 3.14Å
31S38Very low44.7Very low77 Ų77109.4 Ų109.454%0.53862%0.617SS.*  trans-72.4125.7163.6-55.30000105.1G29 H33G29-S31 PolarHBondContact O-N 3.16Å; G29-S31 PolarHBondContact O-OG 2.91Å; S31-H33 WeakPolarHBondContact CB-NE2 3.36Å; S31-H33 PolarHBondContact O-CD2 3.01Å; S31-H33 VanDerWaalsContact O-CD2 3.28Å; S31-H33 PolarHBondContact O-N 3.33Å
32Q36.3Very low45.1Very low199 Ų199105.9 Ų105.993%0.9359%0.59SS**  trans-6875.7176.4-65.4178.3-26.700108.4A34Q32-A34 PolarHBondContact O-N 2.84Å
33H39.3Very low45.5Very low91 Ų91102.3 Ų102.342%0.42156%0.559SS.*  trans-68.5118.1172-75.3-85.8000106.6S31 N35S31-H33 WeakPolarHBondContact CB-NE2 3.36Å; S31-H33 PolarHBondContact O-CD2 3.01Å; S31-H33 VanDerWaalsContact O-CD2 3.28Å; S31-H33 PolarHBondContact O-N 3.33Å; H33-N35 PolarHBondContact O-N 3.2Å; H33-N35 VanDerWaalsContact O-N 3.1Å
34A41.5Very low45.8Very low73 Ų7399.6 Ų99.660%0.60354%0.543SS*.  trans-50122.616000000105.9Q32 I36Q32-A34 PolarHBondContact O-N 2.84Å; A34-I36 HydrophobicContact CB-CG1 4.41Å; A34-I36 PolarHBondContact O-N 2.96Å
35N42.1Very low46.1Very low137 Ų13798.1 Ų98.173%0.73352%0.523SS*.  trans-68.181.6178.6-82.1-110.5000107.1H33 R37H33-N35 PolarHBondContact O-N 3.2Å; H33-N35 VanDerWaalsContact O-N 3.1Å; N35-R37 PolarHBondContact O-N 3.12Å
36I47.8Very low46.4Very low68 Ų6895 Ų9535%0.34951%0.507SS..  trans-7879.6169-59.1-179.2000104.7A34 L42 L117A34-I36 HydrophobicContact CB-CG1 4.41Å; A34-I36 PolarHBondContact O-N 2.96Å; I36-L42 HydrophobicContact CG2-CD1 3.57Å; I36-L117 HydrophobicContact CB-CD2 3.55Å; I36-L117 HydrophobicContact CD1-CD1 4.16Å; I36-L117 HydrophobicContact CD1-CD2 4.05Å; I36-L117 HydrophobicContact CG1-CD2 4.18Å; I36-L117 HydrophobicContact CG2-CD2 4.05Å
37R53.4Low47Very low116 Ų11692.8 Ų92.844%0.43850%0.501SS..  trans-68.3164.2160.9-7116965.483.14.2107.1N35 D39 L42 D124N35-R37 PolarHBondContact O-N 3.12Å; R37-D39 PolarHBondContact O-N 3.48Å; R37-L42 WeakPolarHBondContact O-CD1 3.43Å; R37-D124 IonicContact CZ-OD2 2.93Å; R37-D124 IonicContact NH1-OD2 3.5Å; R37-D124 PolarHBondContact NH1-OD2 3.5Å
38L57.8Low47.8Very low12 Ų1288.7 Ų88.76%0.06347%0.468CS..SBendtrans-62.977.8155.6-114.6109.7000107.8V43 L90 V121 F138 L142L38-V43 HydrophobicContact CD2-CG2 4.27Å; L38-L90 HydrophobicContact CD1-CD2 4.15Å; L38-V121 HydrophobicContact CD1-CB 4.3Å; L38-V121 HydrophobicContact CD1-CG1 3.51Å; L38-V121 HydrophobicContact CD1-CG2 3.72Å; L38-F138 HydrophobicContact CD2-CD2 3.5Å; L38-F138 HydrophobicContact CD2-CE2 3.16Å; L38-F138 HydrophobicContact CD2-CZ 4.13Å; L38-L142 WeakPolarHBondContact O-CD2 2.97Å
39D52.9Low48.6Very low68 Ų6883 Ų8336%0.36443%0.433SS..  trans-83.6149.4-178.6170.7-9.6000106.8R37 N41 L42R37-D39 PolarHBondContact O-N 3.48Å; D39-N41 VanDerWaalsContact CG-ND2 3.29Å; D39-N41 PolarHBondContact O-N 2.79Å; D39-N41 PolarHBondContact OD1-N 2.93Å; D39-N41 PolarHBondContact OD1-ND2 3.14Å; D39-N41 PolarHBondContact OD2-ND2 2.95Å; D39-L42 PolarHBondContact O-N 2.88Å
40K51.8Low49.3Very low84 Ų8485 Ų8537%0.36543%0.429SS..Hα-helixtrans-39.4-37.2163.4-72.4175.7-171.4160.20112.1L42 V43 Q44 L142 E143K40-L42 PolarHBondContact O-N 3.3Å; K40-V43 CarbonylContact O-C 3.57Å; K40-V43 PolarHBondContact O-N 2.76Å; K40-Q44 HydrophobicContact CB-CG 4.17Å; K40-Q44 WeakPolarHBondContact O-CA 3.16Å; K40-Q44 WeakPolarHBondContact O-CB 3.47Å; K40-Q44 WeakPolarHBondContact O-CG 3.46Å; K40-Q44 PolarHBondContact O-N 2.91Å; K40-L142 WeakPolarHBondContact CE-O 3.08Å; K40-E143 PolarHBondContact NZ-O 3.33Å
41N49.3Very low50.3Low105 Ų10581.5 Ų81.556%0.56141%0.413SS*.Hα-helixtrans-60.4-38.1178.3-65.5-50000114.2D39 V43 D45D39-N41 VanDerWaalsContact CG-ND2 3.29Å; D39-N41 PolarHBondContact O-N 2.79Å; D39-N41 PolarHBondContact OD1-N 2.93Å; D39-N41 PolarHBondContact OD1-ND2 3.14Å; D39-N41 PolarHBondContact OD2-ND2 2.95Å; N41-V43 VanDerWaalsContact C-N 3.35Å; N41-V43 PolarHBondContact O-N 2.87Å; N41-D45 PolarHBondContact O-N 3.01Å
42L57.2Low51Low24 Ų2482.5 Ų82.513%0.12641%0.409CS..Hα-helixtrans-69.8-30.7177.1-97.3145.5000113I36 R37 D39 K40 V97I36-L42 HydrophobicContact CG2-CD1 3.57Å; R37-L42 WeakPolarHBondContact O-CD1 3.43Å; D39-L42 PolarHBondContact O-N 2.88Å; K40-L42 PolarHBondContact O-N 3.3Å; L42-V97 HydrophobicContact CD2-CB 3.88Å; L42-V97 HydrophobicContact CD2-CG1 3.79Å; L42-V97 HydrophobicContact CD2-CG2 3.95Å
43V55.5Low51.7Low7 Ų773.9 Ų73.94%0.04237%0.369CS..Hα-helixtrans-102-15.4-175.9-179.30000112.4L38 K40 N41 I49 Q70 Y73 F138 L142L38-V43 HydrophobicContact CD2-CG2 4.27Å; K40-V43 CarbonylContact O-C 3.57Å; K40-V43 PolarHBondContact O-N 2.76Å; N41-V43 VanDerWaalsContact C-N 3.35Å; N41-V43 PolarHBondContact O-N 2.87Å; V43-I49 WeakPolarHBondContact O-CD1 3.32Å; V43-Q70 HydrophobicContact CG1-CG 4.13Å; V43-Y73 HydrophobicContact CG1-CG 4.18Å; V43-Y73 HydrophobicContact CG2-CD1 4.14Å; V43-Y73 HydrophobicContact CG2-CE1 4.12Å; V43-Y73 HydrophobicContact CG2-CG 4.44Å; V43-F138 HydrophobicContact CG1-CZ 4.31Å; V43-F138 HydrophobicContact CG2-CE2 4.4Å; V43-F138 HydrophobicContact CG2-CZ 3.95Å; V43-L142 HydrophobicContact CB-CD1 4.25Å; V43-L142 HydrophobicContact CB-CD2 4.05Å; V43-L142 HydrophobicContact CG1-CD1 3.94Å; V43-L142 HydrophobicContact CG2-CD1 4.14Å; V43-L142 HydrophobicContact CG2-CD2 3.74Å
44Q50.6Low52Low105 Ų10578 Ų7849%0.49139%0.389SS..  trans-103.48.1-179.3-66.8-173.2-18.300113.3K40 K46K40-Q44 HydrophobicContact CB-CG 4.17Å; K40-Q44 WeakPolarHBondContact O-CA 3.16Å; K40-Q44 WeakPolarHBondContact O-CB 3.47Å; K40-Q44 WeakPolarHBondContact O-CG 3.46Å; K40-Q44 PolarHBondContact O-N 2.91Å; Q44-K46 WeakPolarHBondContact O-CG 3.14Å; Q44-K46 PolarHBondContact O-N 2.9Å
45D57.4Low52.4Low49 Ų4978.3 Ų78.326%0.26240%0.399SS..  trans-74.679.5168.9-143.8-24.2000109.7N41 D47 H48 I49N41-D45 PolarHBondContact O-N 3.01Å; D45-D47 PolarHBondContact O-N 3.19Å; D45-H48 HydrophobicContact CB-CB 4.3Å; D45-H48 PolarHBondContact O-N 2.75Å; D45-H48 IonicContact OD1-CD2 2.76Å; D45-H48 IonicContact OD2-CD2 2.65Å; D45-H48 PolarHBondContact OD2-CD2 3.24Å; D45-H48 IonicContact OD2-NE2 3.13Å; D45-I49 PolarHBondContact O-N 2.93Å
46K53.8Low52.7Low121 Ų12177.9 Ų77.953%0.52640%0.401SS..Hα-helixtrans-54-38.2-175.5-67.7172.3-178.5175.80111.4Q44 H48 I49 M50 E61Q44-K46 WeakPolarHBondContact O-CG 3.14Å; Q44-K46 PolarHBondContact O-N 2.9Å; K46-H48 VanDerWaalsContact C-N 3.29Å; K46-H48 PolarHBondContact O-N 2.89Å; K46-I49 PolarHBondContact O-N 3.3Å; K46-M50 PolarHBondContact O-N 3.38Å; K46-M50 VanDerWaalsContact O-N 3.14Å; K46-E61 WeakPolarHBondContact CA-OE1 3.35Å; K46-E61 VanDerWaalsContact CB-OE1 3.28Å; K46-E61 WeakPolarHBondContact CB-OE1 3.33Å; K46-E61 WeakPolarHBondContact CG-OE1 3.16Å; K46-E61 VanDerWaalsContact O-OE2 3.06Å
47D52.5Low52.6Low121 Ų12178 Ų7865%0.64740%0.402SS*.Hα-helixtrans-67.6-31.2-179.1-64.4-24000111D45 M50D45-D47 PolarHBondContact O-N 3.19Å; D47-M50 WeakPolarHBondContact O-CB 3.37Å; D47-M50 PolarHBondContact O-N 2.9Å
48H57Low52.6Low31 Ų3181 Ų8114%0.14443%0.426CS..Hα-helixtrans-78.8-30.9175.9-69.3-37000114.2D45 K46 M50 E100D45-H48 HydrophobicContact CB-CB 4.3Å; D45-H48 PolarHBondContact O-N 2.75Å; D45-H48 IonicContact OD1-CD2 2.76Å; D45-H48 IonicContact OD2-CD2 2.65Å; D45-H48 PolarHBondContact OD2-CD2 3.24Å; D45-H48 IonicContact OD2-NE2 3.13Å; K46-H48 VanDerWaalsContact C-N 3.29Å; K46-H48 PolarHBondContact O-N 2.89Å; H48-M50 PolarHBondContact O-N 2.89Å; H48-E100 WeakPolarHBondContact CE1-CB 3.46Å; H48-E100 IonicContact CE1-OE2 3.2Å; H48-E100 PolarHBondContact CE1-OE2 3.25Å; H48-E100 WeakPolarHBondContact ND1-CB 3.44Å; H48-E100 IonicContact ND1-OE2 3.89Å; H48-E100 PolarHBondContact ND1-OE2 3.24Å
49I54.9Low52.4Low7 Ų786.8 Ų86.84%0.03645%0.451CS..Hα-helixtrans-66.6-33.3171.3-63.3173.6000110V43 D45 K46 E51 H52 L53 L69 Y73V43-I49 WeakPolarHBondContact O-CD1 3.32Å; D45-I49 PolarHBondContact O-N 2.93Å; K46-I49 PolarHBondContact O-N 3.3Å; I49-E51 PolarHBondContact O-N 3.27Å; I49-H52 PolarHBondContact O-N 2.86Å; I49-L53 HydrophobicContact CG2-CD1 3.94Å; I49-L53 HydrophobicContact CG2-CG 4.43Å; I49-L53 WeakPolarHBondContact O-CG 3.2Å; I49-L53 PolarHBondContact O-N 3.23Å; I49-L69 HydrophobicContact CG2-CD2 4.41Å; I49-Y73 HydrophobicContact CD1-CD2 4.46Å; I49-Y73 HydrophobicContact CG1-CD2 4.48Å
50M51.4Low52.5Low97 Ų9786.7 Ų86.748%0.47845%0.454SS..Hα-helixtrans-66.6-33.5-178.8-158.6175.4-65.100114.2K46 D47 H48 H52 L53 E61K46-M50 PolarHBondContact O-N 3.38Å; K46-M50 VanDerWaalsContact O-N 3.14Å; D47-M50 WeakPolarHBondContact O-CB 3.37Å; D47-M50 PolarHBondContact O-N 2.9Å; H48-M50 PolarHBondContact O-N 2.89Å; M50-H52 VanDerWaalsContact C-N 3.32Å; M50-H52 PolarHBondContact O-N 2.9Å; M50-L53 WeakPolarHBondContact O-CB 3.28Å; M50-L53 PolarHBondContact O-N 3.38Å; M50-L53 VanDerWaalsContact O-N 3.13Å; M50-E61 HydrophobicContact CE-CB 4.47Å
51E56.5Low52.5Low120 Ų12083.4 Ų83.456%0.56144%0.44SS*.Hα-helixtrans-66.4-32.2178.4-173.4164.7174.600112.7I49I49-E51 PolarHBondContact O-N 3.27Å
52H52.6Low52.8Low98 Ų9883.6 Ų83.645%0.45445%0.45SS..Hα-helixtrans-83.2-12.1173.8-112.482.5000113.7I49 M50 M76 H96I49-H52 PolarHBondContact O-N 2.86Å; M50-H52 VanDerWaalsContact C-N 3.32Å; M50-H52 PolarHBondContact O-N 2.9Å; H52-M76 HydrophobicContact CB-CE 4.07Å; H52-M76 HydrophobicContact CB-SD 4.18Å; H52-H96 AromaticContact CE1-NE2 3.62Å; H52-H96 AromaticContact ND1-NE2 3.39Å; H52-H96 PolarHBondContact ND1-NE2 3.33Å
53L50.7Low53.3Low18 Ų1888.8 Ų88.89%0.09447%0.474CS..Hα-helixtrans-82.1-14.7177.9-78.2166.5000113.2I49 M50 G55 I57 E61 M64I49-L53 HydrophobicContact CG2-CD1 3.94Å; I49-L53 HydrophobicContact CG2-CG 4.43Å; I49-L53 WeakPolarHBondContact O-CG 3.2Å; I49-L53 PolarHBondContact O-N 3.23Å; M50-L53 WeakPolarHBondContact O-CB 3.28Å; M50-L53 PolarHBondContact O-N 3.38Å; M50-L53 VanDerWaalsContact O-N 3.13Å; L53-G55 PolarHBondContact O-N 2.89Å; L53-I57 HydrophobicContact CD2-CB 4.24Å; L53-I57 HydrophobicContact CD2-CD1 3.85Å; L53-I57 HydrophobicContact CD2-CG1 4.28Å; L53-E61 HydrophobicContact CD1-CB 4.13Å; L53-M64 HydrophobicContact CD1-CE 4.43Å
54E44.8Very low53.8Low177 Ų17790.5 Ų90.583%0.82748%0.481SS*.THydrogen-bonded Turntrans-65.793.2177.6-78.7-161.7157.300111.6
55G49.9Very low55.3Low80 Ų8087.4 Ų87.483%0.82547%0.472SS*.THydrogen-bonded Turntrans116.1-0.2166.400000117L53L53-G55 PolarHBondContact O-N 2.89Å
56V48Very low56.4Low127 Ų12788.9 Ų88.977%0.7748%0.484SS*.THydrogen-bonded Turntrans-113.4-23.4-178.4-175.10000113.3
57I46.9Very low57.7Low71 Ų7188.7 Ų88.736%0.36449%0.485SS..  trans-134.4126.7-176.7-57.6-174.7000110.7L53 K59L53-I57 HydrophobicContact CD2-CB 4.24Å; L53-I57 HydrophobicContact CD2-CD1 3.85Å; L53-I57 HydrophobicContact CD2-CG1 4.28Å; I57-K59 HydrophobicContact CG2-CB 3.89Å; I57-K59 PolarHBondContact O-N 3.17Å; I57-K59 VanDerWaalsContact O-N 3.16Å
58D53.2Low59.1Low179 Ų17987.6 Ų87.696%0.95748%0.476SS*.SBendtrans-76.514176.3-87-29.6000113.8
59K54.2Low60.2Low133 Ų13387.1 Ų87.158%0.57847%0.474SS*.SBendtrans-121.4126.7-176.5-82.4-175.9173.9-179.10111.1I57I57-K59 HydrophobicContact CG2-CB 3.89Å; I57-K59 PolarHBondContact O-N 3.17Å; I57-K59 VanDerWaalsContact O-N 3.16Å
60P54.9Low61.5Low67 Ų6788.6 Ų88.644%0.43548%0.481SS..  trans-70.2140.1174.530.2-33000110.4S62 E63P60-S62 PolarHBondContact O-N 3.27Å; P60-E63 HydrophobicContact CG-CG 4.13Å; P60-E63 PolarHBondContact O-N 3.47Å
61E51.8Low63.2Low14 Ų1487.5 Ų87.57%0.06548%0.476CS..G310 helixtrans-52-28.4176.1177178.8177.100113.8K46 M50 L53 E63 M64 L69K46-E61 WeakPolarHBondContact CA-OE1 3.35Å; K46-E61 VanDerWaalsContact CB-OE1 3.28Å; K46-E61 WeakPolarHBondContact CB-OE1 3.33Å; K46-E61 WeakPolarHBondContact CG-OE1 3.16Å; K46-E61 VanDerWaalsContact O-OE2 3.06Å; M50-E61 HydrophobicContact CE-CB 4.47Å; L53-E61 HydrophobicContact CD1-CB 4.13Å; E61-E63 PolarHBondContact O-N 3.07Å; E61-M64 HydrophobicContact CB-CE 4.35Å; E61-M64 PolarHBondContact O-N 3.27Å; E61-L69 HydrophobicContact CG-CD1 4.13Å; E61-L69 HydrophobicContact CG-CD2 3.59Å; E61-L69 HydrophobicContact CG-CG 4.44Å
62S55.8Low64.5Low109 Ų10983.8 Ų83.876%0.76246%0.459SS*.G310 helixtrans-59.2-12.7176.158.50000114.3P60P60-S62 PolarHBondContact O-N 3.27Å
63E66.1Low65.9Low134 Ų13479.9 Ų79.963%0.62644%0.44SS*.G310 helixtrans-102-4.8175.5-64-178.1-169.100113.9P60 E61P60-E63 HydrophobicContact CG-CG 4.13Å; P60-E63 PolarHBondContact O-N 3.47Å; E61-E63 PolarHBondContact O-N 3.07Å
64M67.3Low67.8Low42 Ų4279.1 Ų79.121%0.20744%0.437CS..SBendtrans-92.4140-178.4-74.4-167.7-84.900112.6L53 E61 E68 L69L53-M64 HydrophobicContact CD1-CE 4.43Å; E61-M64 HydrophobicContact CB-CE 4.35Å; E61-M64 PolarHBondContact O-N 3.27Å; M64-E68 HydrophobicContact CB-CB 4.12Å; M64-E68 HydrophobicContact CG-CB 4.34Å; M64-E68 HydrophobicContact SD-CB 4.39Å; M64-L69 HydrophobicContact CB-CD2 4.36Å; M64-L69 HydrophobicContact CB-CG 4.19Å; M64-L69 HydrophobicContact CE-CD2 4.19Å
65S81.3Confident69.9Low41 Ų4176.3 Ų76.329%0.28742%0.422SS..  trans-70156.2172.363.30000111.4Q67 E68 L69S65-Q67 PolarHBondContact O-N 3.43Å; S65-Q67 VanDerWaalsContact O-N 3.12Å; S65-E68 WeakPolarHBondContact CB-OE2 3.32Å; S65-E68 PolarHBondContact N-OE2 2.7Å; S65-E68 PolarHBondContact O-N 2.84Å; S65-E68 VanDerWaalsContact OG-CD 3.29Å; S65-E68 VanDerWaalsContact OG-CG 3.27Å; S65-E68 WeakPolarHBondContact OG-CG 3.32Å; S65-E68 PolarHBondContact OG-N 3.36Å; S65-E68 PolarHBondContact OG-OE2 2.96Å; S65-L69 PolarHBondContact O-N 3.46Å
66P79.9Confident71.7Confident79 Ų7974.2 Ų74.251%0.51339%0.39SS..Hα-helixtrans-53.4-34.1174.9-2735000113.3L69 Q70P66-L69 PolarHBondContact O-N 3.3Å; P66-Q70 VanDerWaalsContact O-CG 3.3Å; P66-Q70 WeakPolarHBondContact O-CG 3.3Å; P66-Q70 PolarHBondContact O-N 3.01Å
67Q81.5Confident73.6Confident117 Ų11768.3 Ų68.355%0.54736%0.355SS..Hα-helixtrans-70.8-37.8178.1-61.679.48.800112S65 L69 L71S65-Q67 PolarHBondContact O-N 3.43Å; S65-Q67 VanDerWaalsContact O-N 3.12Å; Q67-L69 VanDerWaalsContact C-N 3.33Å; Q67-L71 WeakPolarHBondContact O-CB 3.49Å; Q67-L71 PolarHBondContact O-N 3.41Å
68E81.8Confident75.8Confident99 Ų9965.6 Ų65.646%0.46334%0.341SS..Hα-helixtrans-67.4-35.7174.9-75.5163.5141.800111.4M64 S65 H72M64-E68 HydrophobicContact CB-CB 4.12Å; M64-E68 HydrophobicContact CG-CB 4.34Å; M64-E68 HydrophobicContact SD-CB 4.39Å; S65-E68 WeakPolarHBondContact CB-OE2 3.32Å; S65-E68 PolarHBondContact N-OE2 2.7Å; S65-E68 PolarHBondContact O-N 2.84Å; S65-E68 VanDerWaalsContact OG-CD 3.29Å; S65-E68 VanDerWaalsContact OG-CG 3.27Å; S65-E68 WeakPolarHBondContact OG-CG 3.32Å; S65-E68 PolarHBondContact OG-N 3.36Å; S65-E68 PolarHBondContact OG-OE2 2.96Å; E68-H72 VanDerWaalsContact O-CB 3.25Å; E68-H72 WeakPolarHBondContact O-CB 3.29Å; E68-H72 PolarHBondContact O-N 2.89Å
69L80.4Confident77.5Confident21 Ų2164.1 Ų64.111%0.1132%0.323CS..Hα-helixtrans-68.1-43.2175.4-72.6169.3000112.7I49 E61 M64 S65 P66 Q67 H72 Y73I49-L69 HydrophobicContact CG2-CD2 4.41Å; E61-L69 HydrophobicContact CG-CD1 4.13Å; E61-L69 HydrophobicContact CG-CD2 3.59Å; E61-L69 HydrophobicContact CG-CG 4.44Å; M64-L69 HydrophobicContact CB-CD2 4.36Å; M64-L69 HydrophobicContact CB-CG 4.19Å; M64-L69 HydrophobicContact CE-CD2 4.19Å; S65-L69 PolarHBondContact O-N 3.46Å; P66-L69 PolarHBondContact O-N 3.3Å; Q67-L69 VanDerWaalsContact C-N 3.33Å; L69-H72 PolarHBondContact O-N 2.95Å; L69-Y73 WeakPolarHBondContact O-CB 3.4Å; L69-Y73 PolarHBondContact O-N 2.94Å
70Q82.5Confident79.4Confident38 Ų3862.8 Ų62.818%0.17832%0.322CS..Hα-helixtrans-59.8-47.5173.9-74176-600111.7V43 P66 H72 Y73 F74 F138 L142V43-Q70 HydrophobicContact CG1-CG 4.13Å; P66-Q70 VanDerWaalsContact O-CG 3.3Å; P66-Q70 WeakPolarHBondContact O-CG 3.3Å; P66-Q70 PolarHBondContact O-N 3.01Å; Q70-H72 VanDerWaalsContact C-N 3.3Å; Q70-H72 PolarHBondContact O-N 3.26Å; Q70-Y73 PolarHBondContact O-N 3.42Å; Q70-F74 WeakPolarHBondContact O-CB 3.26Å; Q70-F74 PolarHBondContact O-N 3.29Å; Q70-F138 HydrophobicContact CB-CE1 4.29Å; Q70-L142 HydrophobicContact CB-CD1 4.39Å; Q70-L142 HydrophobicContact CG-CD1 3.69Å
71L86.6Confident81.2Confident73 Ų7361.8 Ų61.838%0.38232%0.324SS..Hα-helixtrans-62.4-40.1176.2-177.463.1000111.5Q67 F74 K75 Y135Q67-L71 WeakPolarHBondContact O-CB 3.49Å; Q67-L71 PolarHBondContact O-N 3.41Å; L71-F74 PolarHBondContact O-N 3.1Å; L71-K75 HydrophobicContact CD1-CD 4.32Å; L71-K75 HydrophobicContact CD1-CG 4.26Å; L71-K75 HydrophobicContact CG-CD 4.41Å; L71-K75 VanDerWaalsContact O-CG 3.3Å; L71-K75 WeakPolarHBondContact O-CG 3.3Å; L71-K75 PolarHBondContact O-N 3.35Å; L71-Y135 HydrophobicContact CB-CE2 4.04Å; L71-Y135 HydrophobicContact CD1-CD2 3.92Å; L71-Y135 HydrophobicContact CD1-CE2 3.65Å; L71-Y135 HydrophobicContact CD1-CG 4.46Å; L71-Y135 HydrophobicContact CG-CE2 4.48Å
72H83.7Confident83.3Confident43 Ų4363.7 Ų63.720%0.19934%0.335CS..Hα-helixtrans-63.4-47.5177.6-178.164.3000111.8E68 L69 Q70 F74 K75 M76E68-H72 VanDerWaalsContact O-CB 3.25Å; E68-H72 WeakPolarHBondContact O-CB 3.29Å; E68-H72 PolarHBondContact O-N 2.89Å; L69-H72 PolarHBondContact O-N 2.95Å; Q70-H72 VanDerWaalsContact C-N 3.3Å; Q70-H72 PolarHBondContact O-N 3.26Å; H72-F74 VanDerWaalsContact C-N 3.31Å; H72-F74 PolarHBondContact O-N 3.39Å; H72-K75 PolarHBondContact O-N 3.26Å; H72-K75 VanDerWaalsContact O-N 3.16Å; H72-M76 WeakPolarHBondContact O-CB 3.43Å; H72-M76 PolarHBondContact O-N 2.74Å
73Y83.6Confident85.2Confident15 Ų1562.8 Ų62.86%0.05932%0.321CS..Hα-helixtrans-56.6-46.2176.7-175.2-84.1000111.7V43 I49 L69 Q70 K75 M76 H77 F138V43-Y73 HydrophobicContact CG1-CG 4.18Å; V43-Y73 HydrophobicContact CG2-CD1 4.14Å; V43-Y73 HydrophobicContact CG2-CE1 4.12Å; V43-Y73 HydrophobicContact CG2-CG 4.44Å; I49-Y73 HydrophobicContact CD1-CD2 4.46Å; I49-Y73 HydrophobicContact CG1-CD2 4.48Å; L69-Y73 WeakPolarHBondContact O-CB 3.4Å; L69-Y73 PolarHBondContact O-N 2.94Å; Q70-Y73 PolarHBondContact O-N 3.42Å; Y73-K75 PolarHBondContact O-N 2.99Å; Y73-M76 PolarHBondContact O-N 3.48Å; Y73-H77 AromaticContact CE1-ND1 3.91Å; Y73-H77 AromaticContact CE2-CE1 3.71Å; Y73-H77 AromaticContact CZ-CE1 3.74Å; Y73-H77 PolarHBondContact O-ND1 3.1Å; Y73-F138 HydrophobicContact CD1-CE2 4.01Å; Y73-F138 AromaticContact CD1-CZ 3.7Å; Y73-F138 HydrophobicContact CD1-CZ 3.7Å; Y73-F138 HydrophobicContact CE1-CE2 4.27Å; Y73-F138 HydrophobicContact CE1-CZ 4.35Å
74F89.8Confident86.7Confident3 Ų358.6 Ų58.61%0.01330%0.303CS..Hα-helixtrans-56.5-50.4175.6-177.8-88.4000111.2Q70 L71 H72 M76 H77 D78 N83 L85 Y135 F138Q70-F74 WeakPolarHBondContact O-CB 3.26Å; Q70-F74 PolarHBondContact O-N 3.29Å; L71-F74 PolarHBondContact O-N 3.1Å; H72-F74 VanDerWaalsContact C-N 3.31Å; H72-F74 PolarHBondContact O-N 3.39Å; F74-M76 VanDerWaalsContact C-N 3.33Å; F74-M76 PolarHBondContact O-N 2.9Å; F74-H77 PolarHBondContact O-N 2.98Å; F74-D78 PolarHBondContact O-N 2.88Å; F74-N83 WeakPolarHBondContact CZ-O 3.09Å; F74-L85 HydrophobicContact CD2-CD1 3.6Å; F74-L85 HydrophobicContact CD2-CG 3.98Å; F74-L85 HydrophobicContact CE2-CD1 3.78Å; F74-L85 HydrophobicContact CE2-CG 3.72Å; F74-L85 HydrophobicContact CG-CD1 4.41Å; F74-L85 HydrophobicContact CZ-CG 4.22Å; F74-Y135 HydrophobicContact CB-CD2 4.1Å; F74-Y135 HydrophobicContact CB-CE2 4.38Å; F74-Y135 HydrophobicContact CD1-CD2 4.14Å; F74-Y135 HydrophobicContact CD2-CD2 4.05Å; F74-Y135 AromaticContact CG-CD2 3.82Å; F74-Y135 HydrophobicContact CG-CD2 3.82Å; F74-F138 HydrophobicContact CB-CD1 4.42Å; F74-F138 HydrophobicContact CB-CE1 4.27Å; F74-F138 HydrophobicContact CD2-CB 3.99Å; F74-F138 HydrophobicContact CD2-CD1 4.09Å; F74-F138 HydrophobicContact CD2-CD2 4.15Å; F74-F138 AromaticContact CD2-CG 3.84Å; F74-F138 HydrophobicContact CD2-CG 3.84Å; F74-F138 HydrophobicContact CE2-CB 4.2Å
75K89.5Confident88Confident118 Ų11856.8 Ų56.851%0.51329%0.294SS..Hα-helixtrans-73.7-20.7-177.7-64-163.395-173.90114.6L71 H72 Y73 H77L71-K75 HydrophobicContact CD1-CD 4.32Å; L71-K75 HydrophobicContact CD1-CG 4.26Å; L71-K75 HydrophobicContact CG-CD 4.41Å; L71-K75 VanDerWaalsContact O-CG 3.3Å; L71-K75 WeakPolarHBondContact O-CG 3.3Å; L71-K75 PolarHBondContact O-N 3.35Å; H72-K75 PolarHBondContact O-N 3.26Å; H72-K75 VanDerWaalsContact O-N 3.16Å; Y73-K75 PolarHBondContact O-N 2.99Å; K75-H77 VanDerWaalsContact C-N 3.29Å
76M86.6Confident88.7Confident35 Ų3556.6 Ų56.617%0.17229%0.29CS..Hα-helixtrans-69.1-32.4176.7-172-147.4-64.200111.3H52 H72 Y73 F74H52-M76 HydrophobicContact CB-CE 4.07Å; H52-M76 HydrophobicContact CB-SD 4.18Å; H72-M76 WeakPolarHBondContact O-CB 3.43Å; H72-M76 PolarHBondContact O-N 2.74Å; Y73-M76 PolarHBondContact O-N 3.48Å; F74-M76 VanDerWaalsContact C-N 3.33Å; F74-M76 PolarHBondContact O-N 2.9Å
77H88.9Confident89.4Confident3 Ų353.8 Ų53.81%0.01428%0.275CS..Hα-helixtrans-100.6-9.3-176-61.794.1000113.9Y73 F74 K75 Y79 L85 E89 A93Y73-H77 AromaticContact CE1-ND1 3.91Å; Y73-H77 AromaticContact CE2-CE1 3.71Å; Y73-H77 AromaticContact CZ-CE1 3.74Å; Y73-H77 PolarHBondContact O-ND1 3.1Å; F74-H77 PolarHBondContact O-N 2.98Å; K75-H77 VanDerWaalsContact C-N 3.29Å; H77-Y79 WeakPolarHBondContact O-CD2 3.45Å; H77-Y79 PolarHBondContact O-N 3.26Å; H77-Y79 VanDerWaalsContact O-N 3.14Å; H77-L85 HydrophobicContact CB-CD2 4.06Å; H77-E89 WeakPolarHBondContact O-CB 3.38Å; H77-E89 VanDerWaalsContact O-CG 3.32Å; H77-E89 WeakPolarHBondContact O-CG 3.4Å; H77-A93 HydrophobicContact CB-CB 4.38Å; H77-A93 VanDerWaalsContact CD2-CA 3.47Å; H77-A93 WeakPolarHBondContact CD2-CA 3.46Å; H77-A93 VanDerWaalsContact CD2-CB 3.41Å; H77-A93 WeakPolarHBondContact CD2-CB 3.48Å
78D91.9Very high90Very high15 Ų1554.8 Ų54.88%0.0828%0.284CS..  trans-76.486.4167.6174.713000109.5F74 G81 N82 N83 L85 E89F74-D78 PolarHBondContact O-N 2.88Å; D78-G81 WeakPolarHBondContact OD1-CA 3.25Å; D78-G81 PolarHBondContact OD1-N 2.97Å; D78-G81 WeakPolarHBondContact OD2-CA 3.13Å; D78-N82 PolarHBondContact OD1-N 3Å; D78-N82 VanDerWaalsContact OD1-N 3.12Å; D78-N83 VanDerWaalsContact OD2-CA 3.25Å; D78-N83 WeakPolarHBondContact OD2-CA 3.43Å; D78-N83 PolarHBondContact OD2-N 3.22Å; D78-L85 HydrophobicContact CB-CD2 4.29Å; D78-E89 WeakPolarHBondContact CA-OE1 3.31Å
79Y89.7Confident90.6Very high148 Ų14850.5 Ų50.558%0.5826%0.263SS*.SBendtrans-79.6-25.3-172.1-65.7-62000112.8H77 E89 A92H77-Y79 WeakPolarHBondContact O-CD2 3.45Å; H77-Y79 PolarHBondContact O-N 3.26Å; H77-Y79 VanDerWaalsContact O-N 3.14Å; Y79-E89 HydrophobicContact CD2-CG 4.02Å; Y79-E89 PolarHBondContact N-OE1 3.39Å; Y79-A92 HydrophobicContact CE2-CB 3.88Å
80D92.8Very high91.2Very high104 Ų10449.8 Ų49.856%0.55626%0.26SS*.SBendtrans-95.9-11.3-179.980.42.9000113.4N82D80-N82 VanDerWaalsContact CG-ND2 3.29Å; D80-N82 WeakPolarHBondContact OD1-CB 3.17Å; D80-N82 PolarHBondContact OD1-N 2.76Å; D80-N82 PolarHBondContact OD1-ND2 2.93Å; D80-N82 PolarHBondContact OD1-OD1 3.03Å; D80-N82 PolarHBondContact OD2-ND2 3.32Å
81G94.4Very high91.5Very high46 Ų4648.7 Ų48.747%0.47426%0.258SS..SBendtrans77.420174.600000113.9D78 N83D78-G81 WeakPolarHBondContact OD1-CA 3.25Å; D78-G81 PolarHBondContact OD1-N 2.97Å; D78-G81 WeakPolarHBondContact OD2-CA 3.13Å; G81-N83 VanDerWaalsContact C-N 3.25Å; G81-N83 PolarHBondContact O-N 3.25Å
82N96.1Very high91.5Very high55 Ų5546.9 Ų46.929%0.29425%0.253SS..SBendtrans-79.8-6.6-179.570.920.7000112.7D78 D80 L84D78-N82 PolarHBondContact OD1-N 3Å; D78-N82 VanDerWaalsContact OD1-N 3.12Å; D80-N82 VanDerWaalsContact CG-ND2 3.29Å; D80-N82 WeakPolarHBondContact OD1-CB 3.17Å; D80-N82 PolarHBondContact OD1-N 2.76Å; D80-N82 PolarHBondContact OD1-ND2 2.93Å; D80-N82 PolarHBondContact OD1-OD1 3.03Å; D80-N82 PolarHBondContact OD2-ND2 3.32Å; N82-L84 VanDerWaalsContact C-N 3.31Å; N82-L84 VanDerWaalsContact OD1-CA 3.32Å; N82-L84 WeakPolarHBondContact OD1-CA 3.25Å; N82-L84 WeakPolarHBondContact OD1-CB 3.34Å; N82-L84 PolarHBondContact OD1-N 2.85Å; N82-L84 PolarHBondContact OD1-O 3.02Å
83N94.8Very high91.6Very high89 Ų8945 Ų4548%0.47625%0.245SC..SBendtrans63.431.7-174.8-45-91.7000114.1F74 D78 G81F74-N83 WeakPolarHBondContact CZ-O 3.09Å; D78-N83 VanDerWaalsContact OD2-CA 3.25Å; D78-N83 WeakPolarHBondContact OD2-CA 3.43Å; D78-N83 PolarHBondContact OD2-N 3.22Å; G81-N83 VanDerWaalsContact C-N 3.25Å; G81-N83 PolarHBondContact O-N 3.25Å
84L96.8Very high91.6Very high47 Ų4745 Ų4525%0.24625%0.246CC..EExtended strand (participates in β ladder)trans-133.3149.4175.4-58.2171.3000107.2N82 E89 Y132 D134N82-L84 VanDerWaalsContact C-N 3.31Å; N82-L84 VanDerWaalsContact OD1-CA 3.32Å; N82-L84 WeakPolarHBondContact OD1-CA 3.25Å; N82-L84 WeakPolarHBondContact OD1-CB 3.34Å; N82-L84 PolarHBondContact OD1-N 2.85Å; N82-L84 PolarHBondContact OD1-O 3.02Å; L84-E89 VanDerWaalsContact O-OE2 3.14Å; L84-Y132 HydrophobicContact CB-CD1 3.78Å; L84-Y132 HydrophobicContact CB-CG 4.09Å; L84-Y132 HydrophobicContact CD1-CD1 4.17Å; L84-Y132 HydrophobicContact CD1-CD2 4.48Å; L84-Y132 HydrophobicContact CD1-CG 4.06Å; L84-D134 HydrophobicContact CD2-CB 3.79Å
85L95.9Very high91.1Very high4 Ų446.5 Ų46.52%0.02126%0.257CS..EExtended strand (participates in β ladder)trans-107.3118.3171.9-66175.4000109.8F74 H77 D78 E89 L90 Y132 I133 F138F74-L85 HydrophobicContact CD2-CD1 3.6Å; F74-L85 HydrophobicContact CD2-CG 3.98Å; F74-L85 HydrophobicContact CE2-CD1 3.78Å; F74-L85 HydrophobicContact CE2-CG 3.72Å; F74-L85 HydrophobicContact CG-CD1 4.41Å; F74-L85 HydrophobicContact CZ-CG 4.22Å; H77-L85 HydrophobicContact CB-CD2 4.06Å; D78-L85 HydrophobicContact CB-CD2 4.29Å; L85-E89 WeakPolarHBondContact CA-OE2 3.28Å; L85-E89 HydrophobicContact CD2-CB 4.15Å; L85-L90 HydrophobicContact CB-CD2 4.33Å; L85-L90 HydrophobicContact CB-CG 4.45Å; L85-L90 HydrophobicContact CD1-CD2 4.42Å; L85-Y132 CarbonylContact O-C 3.57Å; L85-Y132 WeakPolarHBondContact O-CA 3.49Å; L85-I133 HydrophobicContact CB-CB 4.35Å; L85-I133 PolarHBondContact N-O 2.85Å; L85-I133 PolarHBondContact O-N 3.4Å; L85-F138 HydrophobicContact CD1-CD2 4.24Å; L85-F138 HydrophobicContact CD1-CE2 4.5Å
86D96.3Very high90.4Very high36 Ų3643.3 Ų43.319%0.19324%0.244CC..  trans-88.9172.5173.47833.5000112.8L88 E89 L90 Y132D86-L88 VanDerWaalsContact C-N 3.25Å; D86-L88 PolarHBondContact O-N 3.19Å; D86-L88 VanDerWaalsContact OD1-CA 3.32Å; D86-L88 WeakPolarHBondContact OD1-CA 3.45Å; D86-L88 VanDerWaalsContact OD1-CB 3.28Å; D86-L88 WeakPolarHBondContact OD1-CB 3.27Å; D86-L88 PolarHBondContact OD1-N 2.65Å; D86-E89 PolarHBondContact N-OE2 3.5Å; D86-E89 PolarHBondContact O-N 3.46Å; D86-E89 PolarHBondContact OD1-N 2.53Å; D86-L90 WeakPolarHBondContact O-CB 3.38Å; D86-L90 VanDerWaalsContact O-CG 3.3Å; D86-L90 WeakPolarHBondContact O-CG 3.17Å; D86-L90 PolarHBondContact O-N 3.02Å; D86-Y132 HydrophobicContact CB-CD1 3.75Å; D86-Y132 HydrophobicContact CB-CE1 3.68Å
87G94.2Very high89.6Confident20 Ų2042 Ų4221%0.20624%0.238CC..Hα-helixtrans-60.5-28.4-179.600000114.8A91G87-A91 VanDerWaalsContact O-CB 3.29Å; G87-A91 WeakPolarHBondContact O-CB 3.28Å; G87-A91 PolarHBondContact O-N 2.76Å
88L94.6Very high88.7Confident139 Ų13944.5 Ų44.573%0.72825%0.249SC*.Hα-helixtrans-77.6-36.7176.6-61.7175.8000111.4D86 A91 A92D86-L88 VanDerWaalsContact C-N 3.25Å; D86-L88 PolarHBondContact O-N 3.19Å; D86-L88 VanDerWaalsContact OD1-CA 3.32Å; D86-L88 WeakPolarHBondContact OD1-CA 3.45Å; D86-L88 VanDerWaalsContact OD1-CB 3.28Å; D86-L88 WeakPolarHBondContact OD1-CB 3.27Å; D86-L88 PolarHBondContact OD1-N 2.65Å; L88-A91 WeakPolarHBondContact O-CB 3.49Å; L88-A91 PolarHBondContact O-N 2.99Å; L88-A92 PolarHBondContact O-N 3.28Å
89E93.9Very high87.4Confident8 Ų850 Ų504%0.03727%0.273CS..Hα-helixtrans-66.7-43173.9-67.6176.4138.500110.9H77 D78 Y79 L84 L85 D86 A91 A92 A93H77-E89 WeakPolarHBondContact O-CB 3.38Å; H77-E89 VanDerWaalsContact O-CG 3.32Å; H77-E89 WeakPolarHBondContact O-CG 3.4Å; D78-E89 WeakPolarHBondContact CA-OE1 3.31Å; Y79-E89 HydrophobicContact CD2-CG 4.02Å; Y79-E89 PolarHBondContact N-OE1 3.39Å; L84-E89 VanDerWaalsContact O-OE2 3.14Å; L85-E89 WeakPolarHBondContact CA-OE2 3.28Å; L85-E89 HydrophobicContact CD2-CB 4.15Å; D86-E89 PolarHBondContact N-OE2 3.5Å; D86-E89 PolarHBondContact O-N 3.46Å; D86-E89 PolarHBondContact OD1-N 2.53Å; E89-A91 VanDerWaalsContact C-N 3.33Å; E89-A91 PolarHBondContact O-N 2.74Å; E89-A92 PolarHBondContact O-N 3.16Å; E89-A93 WeakPolarHBondContact O-CB 3.49Å; E89-A93 PolarHBondContact O-N 3.12Å
90L91.8Very high85.9Confident6 Ų645.7 Ų45.73%0.03126%0.258CS..Hα-helixtrans-60.6-41.8169.8-67.8173.4000111.5L38 L85 D86 A92 A93 I94 I118 V121 L122 I133L38-L90 HydrophobicContact CD1-CD2 4.15Å; L85-L90 HydrophobicContact CB-CD2 4.33Å; L85-L90 HydrophobicContact CB-CG 4.45Å; L85-L90 HydrophobicContact CD1-CD2 4.42Å; D86-L90 WeakPolarHBondContact O-CB 3.38Å; D86-L90 VanDerWaalsContact O-CG 3.3Å; D86-L90 WeakPolarHBondContact O-CG 3.17Å; D86-L90 PolarHBondContact O-N 3.02Å; L90-A92 VanDerWaalsContact C-N 3.31Å; L90-A92 PolarHBondContact O-N 3.39Å; L90-A93 PolarHBondContact O-N 3.34Å; L90-I94 WeakPolarHBondContact O-CB 3.47Å; L90-I94 VanDerWaalsContact O-CG1 3.27Å; L90-I94 WeakPolarHBondContact O-CG1 3.29Å; L90-I94 PolarHBondContact O-N 2.84Å; L90-I118 HydrophobicContact CB-CG1 4.48Å; L90-V121 HydrophobicContact CD1-CG1 3.84Å; L90-V121 HydrophobicContact CD2-CG1 4.26Å; L90-L122 HydrophobicContact CD1-CD2 3.95Å; L90-L122 HydrophobicContact CD1-CG 4.25Å; L90-I133 HydrophobicContact CD1-CG1 4.33Å
91A90.2Very high84.4Confident16 Ų1646.8 Ų46.813%0.13226%0.259CS..Hα-helixtrans-60-43.317700000112G87 L88 E89 S95 L114 I118G87-A91 VanDerWaalsContact O-CB 3.29Å; G87-A91 WeakPolarHBondContact O-CB 3.28Å; G87-A91 PolarHBondContact O-N 2.76Å; L88-A91 WeakPolarHBondContact O-CB 3.49Å; L88-A91 PolarHBondContact O-N 2.99Å; E89-A91 VanDerWaalsContact C-N 3.33Å; E89-A91 PolarHBondContact O-N 2.74Å; A91-S95 WeakPolarHBondContact O-CB 3.3Å; A91-S95 PolarHBondContact O-N 3.33Å; A91-S95 PolarHBondContact O-OG 3.41Å; A91-L114 HydrophobicContact CB-CD1 4.43Å; A91-L114 HydrophobicContact CB-CD2 4.18Å; A91-L114 HydrophobicContact CB-CG 4.45Å; A91-I118 HydrophobicContact CB-CD1 3.57Å
92A86.8Confident82.6Confident34 Ų3446.3 Ų46.328%0.28125%0.254SS..Hα-helixtrans-64-45.8176.600000111Y79 L88 E89 L90 S95 H96Y79-A92 HydrophobicContact CE2-CB 3.88Å; L88-A92 PolarHBondContact O-N 3.28Å; E89-A92 PolarHBondContact O-N 3.16Å; L90-A92 VanDerWaalsContact C-N 3.31Å; L90-A92 PolarHBondContact O-N 3.39Å; A92-S95 PolarHBondContact O-N 2.94Å; A92-H96 VanDerWaalsContact O-CB 3.3Å; A92-H96 WeakPolarHBondContact O-CB 3.42Å; A92-H96 PolarHBondContact O-N 2.9Å
93A84.8Confident80.8Confident5 Ų545.6 Ų45.64%0.04126%0.26CS..Hα-helixtrans-60.8-49.3178.800000112.5H77 E89 L90 H96 V97H77-A93 HydrophobicContact CB-CB 4.38Å; H77-A93 VanDerWaalsContact CD2-CA 3.47Å; H77-A93 WeakPolarHBondContact CD2-CA 3.46Å; H77-A93 VanDerWaalsContact CD2-CB 3.41Å; H77-A93 WeakPolarHBondContact CD2-CB 3.48Å; E89-A93 WeakPolarHBondContact O-CB 3.49Å; E89-A93 PolarHBondContact O-N 3.12Å; L90-A93 PolarHBondContact O-N 3.34Å; A93-H96 WeakPolarHBondContact O-CB 3.38Å; A93-H96 PolarHBondContact O-N 3.39Å; A93-V97 PolarHBondContact O-N 3.34Å; A93-V97 VanDerWaalsContact O-N 3.12Å
94I83.9Confident78.9Confident13 Ų1351.5 Ų51.57%0.06729%0.285CS..Hα-helixtrans-66.2-43-180-64.1165000110.7L90 H96 V97 H98 M109 L114 L117 I118L90-I94 WeakPolarHBondContact O-CB 3.47Å; L90-I94 VanDerWaalsContact O-CG1 3.27Å; L90-I94 WeakPolarHBondContact O-CG1 3.29Å; L90-I94 PolarHBondContact O-N 2.84Å; I94-H96 VanDerWaalsContact C-N 3.26Å; I94-H96 PolarHBondContact O-N 3.45Å; I94-V97 PolarHBondContact O-N 3.49Å; I94-H98 WeakPolarHBondContact O-CB 3.29Å; I94-H98 PolarHBondContact O-N 3Å; I94-M109 HydrophobicContact CG2-CE 3.69Å; I94-L114 HydrophobicContact CB-CD1 4.07Å; I94-L114 HydrophobicContact CG2-CD1 3.98Å; I94-L117 HydrophobicContact CD1-CB 4.19Å; I94-L117 HydrophobicContact CG2-CD1 3.98Å; I94-I118 HydrophobicContact CD1-CG1 4.18Å
95S80.2Confident76.7Confident36 Ų3658.2 Ų58.225%0.25232%0.315SS..Hα-helixtrans-65.4-32.1178.1-62.30000112.5A91 A92 K99A91-S95 WeakPolarHBondContact O-CB 3.3Å; A91-S95 PolarHBondContact O-N 3.33Å; A91-S95 PolarHBondContact O-OG 3.41Å; A92-S95 PolarHBondContact O-N 2.94Å; S95-K99 WeakPolarHBondContact O-CG 3.38Å; S95-K99 PolarHBondContact O-N 3.3Å
96H73.7Confident74.8Confident50 Ų5060.8 Ų60.823%0.23133%0.331CS..Hα-helixtrans-63.7-54.7174.1-173.4-83.2000109.7H52 A92 A93 I94 H98 K99 E100H52-H96 AromaticContact CE1-NE2 3.62Å; H52-H96 AromaticContact ND1-NE2 3.39Å; H52-H96 PolarHBondContact ND1-NE2 3.33Å; A92-H96 VanDerWaalsContact O-CB 3.3Å; A92-H96 WeakPolarHBondContact O-CB 3.42Å; A92-H96 PolarHBondContact O-N 2.9Å; A93-H96 WeakPolarHBondContact O-CB 3.38Å; A93-H96 PolarHBondContact O-N 3.39Å; I94-H96 VanDerWaalsContact C-N 3.26Å; I94-H96 PolarHBondContact O-N 3.45Å; H96-H98 VanDerWaalsContact C-N 3.31Å; H96-H98 PolarHBondContact O-N 3.45Å; H96-K99 PolarHBondContact O-N 3.47Å; H96-E100 WeakPolarHBondContact O-CB 3.39Å; H96-E100 VanDerWaalsContact O-CG 3.28Å; H96-E100 WeakPolarHBondContact O-CG 3.41Å; H96-E100 PolarHBondContact O-N 3.16Å
97V70.4Confident73.2Confident8 Ų867.3 Ų67.35%0.04836%0.36CS..Hα-helixtrans-60.9-38.6179.8177.10000112.3L42 A93 I94 K99 E100 E101L42-V97 HydrophobicContact CD2-CB 3.88Å; L42-V97 HydrophobicContact CD2-CG1 3.79Å; L42-V97 HydrophobicContact CD2-CG2 3.95Å; A93-V97 PolarHBondContact O-N 3.34Å; A93-V97 VanDerWaalsContact O-N 3.12Å; I94-V97 PolarHBondContact O-N 3.49Å; V97-K99 PolarHBondContact O-N 3.03Å; V97-E100 WeakPolarHBondContact O-CB 3.3Å; V97-E100 PolarHBondContact O-N 3.19Å; V97-E101 HydrophobicContact CG1-CG 4.27Å; V97-E101 PolarHBondContact O-N 3.43Å
98H68.6Low72Confident56 Ų5670.1 Ų70.126%0.25938%0.382SS..Hα-helixtrans-66.3-37.2-179.1-17380.1000114.3I94 H96 E100I94-H98 WeakPolarHBondContact O-CB 3.29Å; I94-H98 PolarHBondContact O-N 3Å; H96-H98 VanDerWaalsContact C-N 3.31Å; H96-H98 PolarHBondContact O-N 3.45Å; H98-E100 VanDerWaalsContact C-N 3.27Å
99K64.6Low71.1Confident131 Ų13164.9 Ų64.957%0.5735%0.354SS*.Hα-helixtrans-67.8-36177-75.6175.6179.71760111.8S95 H96 V97 G103S95-K99 WeakPolarHBondContact O-CG 3.38Å; S95-K99 PolarHBondContact O-N 3.3Å; H96-K99 PolarHBondContact O-N 3.47Å; V97-K99 PolarHBondContact O-N 3.03Å; K99-G103 PolarHBondContact O-N 2.87Å
100E59.1Low70.6Confident57 Ų5771.4 Ų71.427%0.26638%0.382SS..Hα-helixtrans-71.3-46.3-176.5-85.1-49.3131.500111.5H48 H96 V97 H98 G102H48-E100 WeakPolarHBondContact CE1-CB 3.46Å; H48-E100 IonicContact CE1-OE2 3.2Å; H48-E100 PolarHBondContact CE1-OE2 3.25Å; H48-E100 WeakPolarHBondContact ND1-CB 3.44Å; H48-E100 IonicContact ND1-OE2 3.89Å; H48-E100 PolarHBondContact ND1-OE2 3.24Å; H96-E100 WeakPolarHBondContact O-CB 3.39Å; H96-E100 VanDerWaalsContact O-CG 3.28Å; H96-E100 WeakPolarHBondContact O-CG 3.41Å; H96-E100 PolarHBondContact O-N 3.16Å; V97-E100 WeakPolarHBondContact O-CB 3.3Å; V97-E100 PolarHBondContact O-N 3.19Å; H98-E100 VanDerWaalsContact C-N 3.27Å; E100-G102 VanDerWaalsContact C-N 3.27Å; E100-G102 PolarHBondContact O-N 3.04Å
101E60.8Low70.4Confident126 Ų12677.7 Ų77.759%0.58941%0.411SS*.Hα-helixtrans-65.4-26.7176.4-73-173.5168.200113.9V97V97-E101 HydrophobicContact CG1-CG 4.27Å; V97-E101 PolarHBondContact O-N 3.43Å
102G57.3Low70.3Confident36 Ų3683.4 Ų83.437%0.37144%0.435SS..THydrogen-bonded Turntrans-101-2.5-172.400000116.1E100 T106E100-G102 VanDerWaalsContact C-N 3.27Å; E100-G102 PolarHBondContact O-N 3.04Å; G102-T106 WeakPolarHBondContact CA-OG1 3.41Å; G102-T106 PolarHBondContact O-OG1 2.73Å
103G57.2Low70.3Confident41 Ų4185.9 Ų85.942%0.42344%0.441SS..  trans63.4179.1-176.300000115.2K99 H105 T106K99-G103 PolarHBondContact O-N 2.87Å; G103-H105 PolarHBondContact O-N 2.65Å; G103-T106 PolarHBondContact O-N 2.84Å; G103-T106 VanDerWaalsContact O-N 3.12Å; G103-T106 PolarHBondContact O-OG1 3.5Å
104E54.9Low70.5Confident212 Ų21287 Ų8799%0.99145%0.446SS*.THydrogen-bonded Turntrans-55.2-8.1-175.2-74.7-165.6135.500116.1
105H51.2Low70.7Confident188 Ų18890.1 Ų90.187%0.8746%0.462SS*.THydrogen-bonded Turntrans-113.15.1-176-107.7-62.3000115.3G103G103-H105 PolarHBondContact O-N 2.65Å
106T56.8Low71.2Confident58 Ų5889.8 Ų89.836%0.35646%0.46SS..PPolyproline II helixtrans-72.2135.5175.52.90000111.2G102 G103 A108G102-T106 WeakPolarHBondContact CA-OG1 3.41Å; G102-T106 PolarHBondContact O-OG1 2.73Å; G103-T106 PolarHBondContact O-N 2.84Å; G103-T106 VanDerWaalsContact O-N 3.12Å; G103-T106 PolarHBondContact O-OG1 3.5Å; T106-A108 PolarHBondContact O-N 2.95Å
107Q62.9Low72Confident173 Ų17387.7 Ų87.781%0.80845%0.45SS*.PPolyproline II helixtrans-65.1135.6166.1-70.9-176.5-21.200108.1M109Q107-M109 PolarHBondContact O-N 3.1Å
108A67.4Low73Confident80 Ų8088.2 Ų88.266%0.66145%0.452SS*.PPolyproline II helixtrans-51.1135.2170.800000109.3T106 K110T106-A108 PolarHBondContact O-N 2.95Å; A108-K110 PolarHBondContact O-N 3.29Å
109M75.9Confident74.1Confident28 Ų2889.8 Ų89.814%0.13846%0.463CS..PPolyproline II helixtrans-52.2141.3176.2-162.8165.862.200109.4I94 Q107 E113 L114 L117I94-M109 HydrophobicContact CG2-CE 3.69Å; Q107-M109 PolarHBondContact O-N 3.1Å; M109-E113 HydrophobicContact CG-CB 4.08Å; M109-E113 HydrophobicContact CG-CG 3.97Å; M109-E113 HydrophobicContact SD-CG 4.03Å; M109-L114 HydrophobicContact CE-CB 3.67Å; M109-L114 HydrophobicContact CE-CD1 3.36Å; M109-L114 HydrophobicContact CE-CG 4.08Å; M109-L117 HydrophobicContact CE-CD1 3.79Å; M109-L117 HydrophobicContact SD-CD1 3.77Å
110K85.1Confident75.4Confident145 Ų14585.1 Ų85.163%0.6344%0.444SS*.PPolyproline II helixtrans-65.4144.6178.7-71.1179.9-178.5172.10109.6A108 E112 E113 L114A108-K110 PolarHBondContact O-N 3.29Å; K110-E112 PolarHBondContact O-N 3.36Å; K110-E113 HydrophobicContact CB-CB 4.35Å; K110-E113 WeakPolarHBondContact O-CB 3.47Å; K110-E113 PolarHBondContact O-N 2.71Å; K110-E113 VanDerWaalsContact O-N 3.1Å; K110-L114 PolarHBondContact O-N 3.41Å
111E85.9Confident77Confident139 Ų13982.7 Ų82.765%0.6543%0.433SS*.Hα-helixtrans-59.3-38.6-179.5-174174.2179.300111.4E113 L114 I115E111-E113 VanDerWaalsContact C-N 3.3Å; E111-E113 PolarHBondContact O-N 2.87Å; E111-L114 PolarHBondContact O-N 2.85Å; E111-I115 HydrophobicContact CG-CD1 3.92Å; E111-I115 HydrophobicContact CG-CG1 4.49Å; E111-I115 VanDerWaalsContact O-CG1 3.26Å; E111-I115 WeakPolarHBondContact O-CG1 3.49Å; E111-I115 PolarHBondContact O-N 3.13Å
112E88.7Confident78.5Confident135 Ų13578.4 Ų78.463%0.63141%0.414SS*.Hα-helixtrans-65.6-34.4178.8-58.379.7-170.300112.6K110 S116K110-E112 PolarHBondContact O-N 3.36Å; E112-S116 WeakPolarHBondContact O-CB 3.41Å; E112-S116 PolarHBondContact O-N 2.74Å; E112-S116 VanDerWaalsContact O-N 3.07Å
113E87.3Confident80.3Confident87 Ų8784.1 Ų84.141%0.40742%0.424SS..Hα-helixtrans-72.4-42.2176-175.1172.8-16500110.6M109 K110 E111 I115 S116 L117M109-E113 HydrophobicContact CG-CB 4.08Å; M109-E113 HydrophobicContact CG-CG 3.97Å; M109-E113 HydrophobicContact SD-CG 4.03Å; K110-E113 HydrophobicContact CB-CB 4.35Å; K110-E113 WeakPolarHBondContact O-CB 3.47Å; K110-E113 PolarHBondContact O-N 2.71Å; K110-E113 VanDerWaalsContact O-N 3.1Å; E111-E113 VanDerWaalsContact C-N 3.3Å; E111-E113 PolarHBondContact O-N 2.87Å; E113-I115 PolarHBondContact O-N 3.42Å; E113-S116 WeakPolarHBondContact O-CB 3.19Å; E113-S116 PolarHBondContact O-N 2.81Å; E113-L117 VanDerWaalsContact O-CG 3.29Å; E113-L117 WeakPolarHBondContact O-CG 3.3Å; E113-L117 PolarHBondContact O-N 3.12Å
114L87.6Confident82Confident28 Ų2884.5 Ų84.515%0.14742%0.417CS..Hα-helixtrans-59.1-46.6174.7-176.359.9000112.1A91 I94 M109 K110 E111 L117 I118A91-L114 HydrophobicContact CB-CD1 4.43Å; A91-L114 HydrophobicContact CB-CD2 4.18Å; A91-L114 HydrophobicContact CB-CG 4.45Å; I94-L114 HydrophobicContact CB-CD1 4.07Å; I94-L114 HydrophobicContact CG2-CD1 3.98Å; M109-L114 HydrophobicContact CE-CB 3.67Å; M109-L114 HydrophobicContact CE-CD1 3.36Å; M109-L114 HydrophobicContact CE-CG 4.08Å; K110-L114 PolarHBondContact O-N 3.41Å; E111-L114 PolarHBondContact O-N 2.85Å; L114-L117 PolarHBondContact O-N 3Å; L114-I118 HydrophobicContact CD1-CD1 4.18Å; L114-I118 HydrophobicContact CG-CD1 3.92Å; L114-I118 WeakPolarHBondContact O-CD1 3.07Å; L114-I118 VanDerWaalsContact O-CG1 3.28Å; L114-I118 WeakPolarHBondContact O-CG1 3.27Å; L114-I118 PolarHBondContact O-N 3.45Å
115I89.5Confident83.8Confident78 Ų7874.9 Ų74.940%0.437%0.372SS..Hα-helixtrans-61.1-46.8177.3-68.7165000110.1E111 E113 L117 I118 D119E111-I115 HydrophobicContact CG-CD1 3.92Å; E111-I115 HydrophobicContact CG-CG1 4.49Å; E111-I115 VanDerWaalsContact O-CG1 3.26Å; E111-I115 WeakPolarHBondContact O-CG1 3.49Å; E111-I115 PolarHBondContact O-N 3.13Å; E113-I115 PolarHBondContact O-N 3.42Å; I115-L117 PolarHBondContact O-N 3.49Å; I115-I118 PolarHBondContact O-N 3.36Å; I115-I118 VanDerWaalsContact O-N 3.17Å; I115-D119 WeakPolarHBondContact O-CB 3.41Å; I115-D119 PolarHBondContact O-N 2.94Å
116S90.5Very high85.9Confident30 Ų3066.6 Ų66.621%0.2133%0.334CS..Hα-helixtrans-56.4-40.6177.8-173.70000112E112 E113 D120E112-S116 WeakPolarHBondContact O-CB 3.41Å; E112-S116 PolarHBondContact O-N 2.74Å; E112-S116 VanDerWaalsContact O-N 3.07Å; E113-S116 WeakPolarHBondContact O-CB 3.19Å; E113-S116 PolarHBondContact O-N 2.81Å; S116-D120 WeakPolarHBondContact O-CB 3.37Å; S116-D120 PolarHBondContact O-N 2.84Å
117L89.4Confident87.8Confident5 Ų570.1 Ų70.13%0.02635%0.345CS..Hα-helixtrans-68-42.2178.6-69.7177.1000112.5I36 I94 M109 E113 L114 I115 D120 V121I36-L117 HydrophobicContact CB-CD2 3.55Å; I36-L117 HydrophobicContact CD1-CD1 4.16Å; I36-L117 HydrophobicContact CD1-CD2 4.05Å; I36-L117 HydrophobicContact CG1-CD2 4.18Å; I36-L117 HydrophobicContact CG2-CD2 4.05Å; I94-L117 HydrophobicContact CD1-CB 4.19Å; I94-L117 HydrophobicContact CG2-CD1 3.98Å; M109-L117 HydrophobicContact CE-CD1 3.79Å; M109-L117 HydrophobicContact SD-CD1 3.77Å; E113-L117 VanDerWaalsContact O-CG 3.29Å; E113-L117 WeakPolarHBondContact O-CG 3.3Å; E113-L117 PolarHBondContact O-N 3.12Å; L114-L117 PolarHBondContact O-N 3Å; I115-L117 PolarHBondContact O-N 3.49Å; L117-D120 PolarHBondContact O-N 3.3Å; L117-V121 VanDerWaalsContact O-CG2 3.31Å; L117-V121 WeakPolarHBondContact O-CG2 3.25Å; L117-V121 PolarHBondContact O-N 3.33Å
118I91.4Very high89.3Confident19 Ų1965.9 Ų65.910%0.09733%0.328CS..Hα-helixtrans-64-45.3177.3-65.2158.5000110.2L90 A91 I94 L114 I115 D120 V121 L122L90-I118 HydrophobicContact CB-CG1 4.48Å; A91-I118 HydrophobicContact CB-CD1 3.57Å; I94-I118 HydrophobicContact CD1-CG1 4.18Å; L114-I118 HydrophobicContact CD1-CD1 4.18Å; L114-I118 HydrophobicContact CG-CD1 3.92Å; L114-I118 WeakPolarHBondContact O-CD1 3.07Å; L114-I118 VanDerWaalsContact O-CG1 3.28Å; L114-I118 WeakPolarHBondContact O-CG1 3.27Å; L114-I118 PolarHBondContact O-N 3.45Å; I115-I118 PolarHBondContact O-N 3.36Å; I115-I118 VanDerWaalsContact O-N 3.17Å; I118-D120 VanDerWaalsContact C-N 3.27Å; I118-D120 PolarHBondContact O-N 3.33Å; I118-V121 PolarHBondContact O-N 3.32Å; I118-L122 HydrophobicContact CG2-CD1 3.93Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.4Å; I118-L122 PolarHBondContact O-N 2.93Å
119D92.9Very high90.7Very high90 Ų9068.8 Ų68.848%0.48133%0.332SS..Hα-helixtrans-61.4-37.9177.4-75.7-12.3000111.6I115 R123I115-D119 WeakPolarHBondContact O-CB 3.41Å; I115-D119 PolarHBondContact O-N 2.94Å; D119-R123 WeakPolarHBondContact O-CB 3.19Å; D119-R123 PolarHBondContact O-N 3.05Å
120D92.1Very high91.7Very high33 Ų3371 Ų7118%0.17634%0.344CS..Hα-helixtrans-65.6-44.9175.6-72.5-11.7000111.8S116 L117 I118 R123 D124S116-D120 WeakPolarHBondContact O-CB 3.37Å; S116-D120 PolarHBondContact O-N 2.84Å; L117-D120 PolarHBondContact O-N 3.3Å; I118-D120 VanDerWaalsContact C-N 3.27Å; I118-D120 PolarHBondContact O-N 3.33Å; D120-R123 VanDerWaalsContact CG-NH2 3.35Å; D120-R123 IonicContact OD1-CZ 3.97Å; D120-R123 IonicContact OD1-NH1 3.13Å; D120-R123 PolarHBondContact OD1-NH1 3.24Å; D120-R123 IonicContact OD1-NH2 2.87Å; D120-R123 PolarHBondContact OD1-NH2 3.01Å; D120-D124 VanDerWaalsContact O-CB 3.29Å; D120-D124 WeakPolarHBondContact O-CB 3.28Å; D120-D124 PolarHBondContact O-N 3.45Å
121V91.3Very high92.3Very high6 Ų665.7 Ų65.74%0.03633%0.331CS..Hα-helixtrans-62.3-52.9177168.60000111.1L38 L90 L117 I118 R123 D124 D125L38-V121 HydrophobicContact CD1-CB 4.3Å; L38-V121 HydrophobicContact CD1-CG1 3.51Å; L38-V121 HydrophobicContact CD1-CG2 3.72Å; L90-V121 HydrophobicContact CD1-CG1 3.84Å; L90-V121 HydrophobicContact CD2-CG1 4.26Å; L117-V121 VanDerWaalsContact O-CG2 3.31Å; L117-V121 WeakPolarHBondContact O-CG2 3.25Å; L117-V121 PolarHBondContact O-N 3.33Å; I118-V121 PolarHBondContact O-N 3.32Å; V121-R123 VanDerWaalsContact C-N 3.34Å; V121-R123 PolarHBondContact O-N 3.24Å; V121-D124 PolarHBondContact O-N 3Å; V121-D125 WeakPolarHBondContact O-CB 3.36Å; V121-D125 PolarHBondContact O-N 2.99Å
122L93.7Very high92.8Very high36 Ų3663.3 Ų63.319%0.18832%0.317CS..Hα-helixtrans-60.7-45.7-179-70.2174.8000110.7L90 I118 D124 D125 D126 I133L90-L122 HydrophobicContact CD1-CD2 3.95Å; L90-L122 HydrophobicContact CD1-CG 4.25Å; I118-L122 HydrophobicContact CG2-CD1 3.93Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.4Å; I118-L122 PolarHBondContact O-N 2.93Å; L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 3.27Å; L122-D125 PolarHBondContact O-N 3.39Å; L122-D126 WeakPolarHBondContact O-CB 3.47Å; L122-D126 PolarHBondContact O-N 2.88Å; L122-I133 HydrophobicContact CD2-CD1 4.1Å; L122-I133 HydrophobicContact CD2-CG1 4.04Å
123R94.6Very high93.2Very high155 Ų15557 Ų5759%0.58529%0.288SS*.Hα-helixtrans-60.5-38178.2-177.1-178.565.8-118.24112.9D119 D120 V121D119-R123 WeakPolarHBondContact O-CB 3.19Å; D119-R123 PolarHBondContact O-N 3.05Å; D120-R123 VanDerWaalsContact CG-NH2 3.35Å; D120-R123 IonicContact OD1-CZ 3.97Å; D120-R123 IonicContact OD1-NH1 3.13Å; D120-R123 PolarHBondContact OD1-NH1 3.24Å; D120-R123 IonicContact OD1-NH2 2.87Å; D120-R123 PolarHBondContact OD1-NH2 3.01Å; V121-R123 VanDerWaalsContact C-N 3.34Å; V121-R123 PolarHBondContact O-N 3.24Å
124D91.9Very high93.6Very high49 Ų4955.3 Ų55.326%0.26228%0.281SS..Hα-helixtrans-83.8-30.5-175.8-83.312000112.8R37 D120 V121 L122 K127R37-D124 IonicContact CZ-OD2 2.93Å; R37-D124 IonicContact NH1-OD2 3.5Å; R37-D124 PolarHBondContact NH1-OD2 3.5Å; D120-D124 VanDerWaalsContact O-CB 3.29Å; D120-D124 WeakPolarHBondContact O-CB 3.28Å; D120-D124 PolarHBondContact O-N 3.45Å; V121-D124 PolarHBondContact O-N 3Å; L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 3.27Å; D124-K127 WeakPolarHBondContact O-CE 3.5Å; D124-K127 PolarHBondContact O-NZ 3.48Å
125D93.3Very high93.9Very high10 Ų1057.6 Ų57.65%0.05329%0.288CS..Hα-helixtrans-117.2-29.7-166.8-64.2-28.1000114.2V121 L122 K127 I133 S141V121-D125 WeakPolarHBondContact O-CB 3.36Å; V121-D125 PolarHBondContact O-N 2.99Å; L122-D125 PolarHBondContact O-N 3.39Å; D125-K127 WeakPolarHBondContact O-CG 3.31Å; D125-K127 PolarHBondContact O-N 2.93Å; D125-I133 HydrophobicContact CB-CD1 3.72Å; D125-S141 WeakPolarHBondContact OD1-CB 3.46Å; D125-S141 WeakPolarHBondContact OD2-CB 3.35Å; D125-S141 PolarHBondContact OD2-OG 3.02Å
126D95.8Very high94.1Very high15 Ų1557.1 Ų57.18%0.0830%0.296CS..  trans-71.797.4174.5-179.8-2.8000109.2L122 N128 N129 D130 G131 I133L122-D126 WeakPolarHBondContact O-CB 3.47Å; L122-D126 PolarHBondContact O-N 2.88Å; D126-N128 PolarHBondContact OD1-N 3.4Å; D126-N128 PolarHBondContact OD1-OD1 3.4Å; D126-N129 VanDerWaalsContact CG-CA 3.49Å; D126-N129 WeakPolarHBondContact OD1-CA 3.1Å; D126-N129 PolarHBondContact OD1-N 3.34Å; D126-N129 VanDerWaalsContact OD2-CA 3.25Å; D126-N129 WeakPolarHBondContact OD2-CA 3.4Å; D126-D130 PolarHBondContact OD1-N 3.16Å; D126-D130 PolarHBondContact OD2-N 3.47Å; D126-G131 WeakPolarHBondContact OD2-CA 3.3Å; D126-G131 PolarHBondContact OD2-N 3.37Å; D126-I133 HydrophobicContact CB-CD1 3.72Å
127K96.2Very high94.3Very high131 Ų13156.4 Ų56.457%0.5729%0.29SS*.SBendtrans-85.1-24.6-174.1-59.7-47.5-179.5-174.30112.5D124 D125 E137D124-K127 WeakPolarHBondContact O-CE 3.5Å; D124-K127 PolarHBondContact O-NZ 3.48Å; D125-K127 WeakPolarHBondContact O-CG 3.31Å; D125-K127 PolarHBondContact O-N 2.93Å; K127-E137 WeakPolarHBondContact CB-OE1 3.27Å; K127-E137 HydrophobicContact CG-CG 4.28Å; K127-E137 PolarHBondContact N-OE1 3.12Å
128N95.9Very high94.4Very high85 Ų8556.2 Ų56.246%0.45529%0.289SS..SBendtrans-95.6-9.8-177.875.722.8000112D126 D130 E137D126-N128 PolarHBondContact OD1-N 3.4Å; D126-N128 PolarHBondContact OD1-OD1 3.4Å; N128-D130 PolarHBondContact ND2-OD2 3.13Å; N128-D130 WeakPolarHBondContact OD1-CB 3.44Å; N128-D130 PolarHBondContact OD1-N 3.14Å; N128-D130 PolarHBondContact OD1-OD1 3.49Å; N128-D130 PolarHBondContact OD1-OD2 2.93Å; N128-D130 VanDerWaalsContact OD1-OD2 3.14Å; N128-E137 PolarHBondContact N-OE1 2.8Å
129N96.5Very high94.3Very high140 Ų14056.5 Ų56.575%0.74929%0.294SS*.  trans58.939.2179.3-153.6102.5000113.1D126D126-N129 VanDerWaalsContact CG-CA 3.49Å; D126-N129 WeakPolarHBondContact OD1-CA 3.1Å; D126-N129 PolarHBondContact OD1-N 3.34Å; D126-N129 VanDerWaalsContact OD2-CA 3.25Å; D126-N129 WeakPolarHBondContact OD2-CA 3.4Å
130D97Very high94.2Very high75 Ų7558.6 Ų58.640%0.40130%0.299SS..SBendtrans-90.5-517871.312.1000113.8D126 N128 Y132D126-D130 PolarHBondContact OD1-N 3.16Å; D126-D130 PolarHBondContact OD2-N 3.47Å; N128-D130 PolarHBondContact ND2-OD2 3.13Å; N128-D130 WeakPolarHBondContact OD1-CB 3.44Å; N128-D130 PolarHBondContact OD1-N 3.14Å; N128-D130 PolarHBondContact OD1-OD1 3.49Å; N128-D130 PolarHBondContact OD1-OD2 2.93Å; N128-D130 VanDerWaalsContact OD1-OD2 3.14Å; D130-Y132 WeakPolarHBondContact O-CD2 3.46Å; D130-Y132 WeakPolarHBondContact OD1-CA 3.32Å; D130-Y132 VanDerWaalsContact OD1-CB 3.3Å; D130-Y132 WeakPolarHBondContact OD1-CB 2.72Å; D130-Y132 PolarHBondContact OD1-N 3.22Å
131G96.3Very high93.8Very high34 Ų3457.6 Ų57.635%0.35129%0.294SS..SBendtrans87.49.3-179.200000113.7D126D126-G131 WeakPolarHBondContact OD2-CA 3.3Å; D126-G131 PolarHBondContact OD2-N 3.37Å
132Y97.1Very high93.2Very high89 Ų8957.6 Ų57.635%0.34929%0.294SS..  trans-128162.4178.3-59.4-92.4000111.1L84 L85 D86 D130L84-Y132 HydrophobicContact CB-CD1 3.78Å; L84-Y132 HydrophobicContact CB-CG 4.09Å; L84-Y132 HydrophobicContact CD1-CD1 4.17Å; L84-Y132 HydrophobicContact CD1-CD2 4.48Å; L84-Y132 HydrophobicContact CD1-CG 4.06Å; L85-Y132 CarbonylContact O-C 3.57Å; L85-Y132 WeakPolarHBondContact O-CA 3.49Å; D86-Y132 HydrophobicContact CB-CD1 3.75Å; D86-Y132 HydrophobicContact CB-CE1 3.68Å; D130-Y132 WeakPolarHBondContact O-CD2 3.46Å; D130-Y132 WeakPolarHBondContact OD1-CA 3.32Å; D130-Y132 VanDerWaalsContact OD1-CB 3.3Å; D130-Y132 WeakPolarHBondContact OD1-CB 2.72Å; D130-Y132 PolarHBondContact OD1-N 3.22Å
133I96.4Very high92.1Very high3 Ų365.4 Ų65.42%0.01533%0.329CS..EExtended strand (participates in β ladder)trans-113.4115.6169.5-56.4-62000108.7L85 L90 L122 D125 D126 E137 F138L85-I133 HydrophobicContact CB-CB 4.35Å; L85-I133 PolarHBondContact N-O 2.85Å; L85-I133 PolarHBondContact O-N 3.4Å; L90-I133 HydrophobicContact CD1-CG1 4.33Å; L122-I133 HydrophobicContact CD2-CD1 4.1Å; L122-I133 HydrophobicContact CD2-CG1 4.04Å; D125-I133 HydrophobicContact CB-CD1 3.72Å; D126-I133 HydrophobicContact CB-CD1 3.72Å; I133-E137 HydrophobicContact CG2-CB 3.94Å; I133-F138 HydrophobicContact CG2-CB 3.86Å
134D96.3Very high92Very high50 Ų5060.9 Ų60.927%0.26732%0.316SS..EExtended strand (participates in β ladder)trans-79.4167.5171.379.937.4000112.2L84 A136 E137 F138L84-D134 HydrophobicContact CD2-CB 3.79Å; D134-A136 VanDerWaalsContact C-N 3.26Å; D134-A136 PolarHBondContact O-N 3.25Å; D134-A136 VanDerWaalsContact OD1-CA 3.3Å; D134-A136 WeakPolarHBondContact OD1-CA 3.35Å; D134-A136 VanDerWaalsContact OD1-CB 3.28Å; D134-A136 WeakPolarHBondContact OD1-CB 3.41Å; D134-A136 PolarHBondContact OD1-N 3.06Å; D134-E137 PolarHBondContact N-OE2 3.01Å; D134-E137 PolarHBondContact O-N 3.2Å; D134-E137 PolarHBondContact OD1-N 2.76Å; D134-F138 WeakPolarHBondContact O-CB 3.48Å; D134-F138 PolarHBondContact O-N 3.27Å
135Y94Very high92Very high76 Ų7661.5 Ų61.530%0.29832%0.319SS..Hα-helixtrans-62.2-30.7-178.3-176.9-103.7000113.6L71 F74 F138 A139L71-Y135 HydrophobicContact CB-CE2 4.04Å; L71-Y135 HydrophobicContact CD1-CD2 3.92Å; L71-Y135 HydrophobicContact CD1-CE2 3.65Å; L71-Y135 HydrophobicContact CD1-CG 4.46Å; L71-Y135 HydrophobicContact CG-CE2 4.48Å; F74-Y135 HydrophobicContact CB-CD2 4.1Å; F74-Y135 HydrophobicContact CB-CE2 4.38Å; F74-Y135 HydrophobicContact CD1-CD2 4.14Å; F74-Y135 HydrophobicContact CD2-CD2 4.05Å; F74-Y135 AromaticContact CG-CD2 3.82Å; F74-Y135 HydrophobicContact CG-CD2 3.82Å; Y135-F138 HydrophobicContact CD2-CD1 4.37Å; Y135-F138 HydrophobicContact CE2-CD1 4.35Å; Y135-A139 HydrophobicContact CE1-CB 4.43Å; Y135-A139 WeakPolarHBondContact O-CB 3.28Å; Y135-A139 PolarHBondContact O-N 2.77Å
136A94.5Very high92Very high69 Ų6964.4 Ų64.457%0.5733%0.334SS*.Hα-helixtrans-73.7-37.3178.300000111.3D134 K140D134-A136 VanDerWaalsContact C-N 3.26Å; D134-A136 PolarHBondContact O-N 3.25Å; D134-A136 VanDerWaalsContact OD1-CA 3.3Å; D134-A136 WeakPolarHBondContact OD1-CA 3.35Å; D134-A136 VanDerWaalsContact OD1-CB 3.28Å; D134-A136 WeakPolarHBondContact OD1-CB 3.41Å; D134-A136 PolarHBondContact OD1-N 3.06Å; A136-K140 VanDerWaalsContact O-CB 3.27Å; A136-K140 WeakPolarHBondContact O-CB 3.39Å; A136-K140 PolarHBondContact O-N 3.45Å; A136-K140 VanDerWaalsContact O-N 3.16Å
137E94.3Very high91.7Very high15 Ų1567.3 Ų67.37%0.0735%0.349CS..Hα-helixtrans-64.4-48.5172-69.6171.9147.300111K127 N128 I133 D134 K140 S141K127-E137 WeakPolarHBondContact CB-OE1 3.27Å; K127-E137 HydrophobicContact CG-CG 4.28Å; K127-E137 PolarHBondContact N-OE1 3.12Å; N128-E137 PolarHBondContact N-OE1 2.8Å; I133-E137 HydrophobicContact CG2-CB 3.94Å; D134-E137 PolarHBondContact N-OE2 3.01Å; D134-E137 PolarHBondContact O-N 3.2Å; D134-E137 PolarHBondContact OD1-N 2.76Å; E137-K140 PolarHBondContact O-N 2.77Å; E137-S141 PolarHBondContact O-N 2.8Å
138F91.5Very high91.5Very high1 Ų163.3 Ų63.30%0.00434%0.335CS..Hα-helixtrans-58.6-49.4174.5177.6-93000112.8L38 V43 Q70 Y73 F74 L85 I133 D134 Y135 K140 S141 L142L38-F138 HydrophobicContact CD2-CD2 3.5Å; L38-F138 HydrophobicContact CD2-CE2 3.16Å; L38-F138 HydrophobicContact CD2-CZ 4.13Å; V43-F138 HydrophobicContact CG1-CZ 4.31Å; V43-F138 HydrophobicContact CG2-CE2 4.4Å; V43-F138 HydrophobicContact CG2-CZ 3.95Å; Q70-F138 HydrophobicContact CB-CE1 4.29Å; Y73-F138 HydrophobicContact CD1-CE2 4.01Å; Y73-F138 AromaticContact CD1-CZ 3.7Å; Y73-F138 HydrophobicContact CD1-CZ 3.7Å; Y73-F138 HydrophobicContact CE1-CE2 4.27Å; Y73-F138 HydrophobicContact CE1-CZ 4.35Å; F74-F138 HydrophobicContact CB-CD1 4.42Å; F74-F138 HydrophobicContact CB-CE1 4.27Å; F74-F138 HydrophobicContact CD2-CB 3.99Å; F74-F138 HydrophobicContact CD2-CD1 4.09Å; F74-F138 HydrophobicContact CD2-CD2 4.15Å; F74-F138 AromaticContact CD2-CG 3.84Å; F74-F138 HydrophobicContact CD2-CG 3.84Å; F74-F138 HydrophobicContact CE2-CB 4.2Å; L85-F138 HydrophobicContact CD1-CD2 4.24Å; L85-F138 HydrophobicContact CD1-CE2 4.5Å; I133-F138 HydrophobicContact CG2-CB 3.86Å; D134-F138 WeakPolarHBondContact O-CB 3.48Å; D134-F138 PolarHBondContact O-N 3.27Å; Y135-F138 HydrophobicContact CD2-CD1 4.37Å; Y135-F138 HydrophobicContact CE2-CD1 4.35Å; F138-K140 PolarHBondContact O-N 3.2Å; F138-S141 PolarHBondContact O-N 2.76Å; F138-S141 PolarHBondContact O-OG 3.5Å; F138-L142 HydrophobicContact CD1-CD1 4.08Å; F138-L142 HydrophobicContact CE1-CD1 3.5Å; F138-L142 HydrophobicContact CZ-CD1 3.82Å; F138-L142 PolarHBondContact O-N 2.69Å
139A89.2Confident91.2Very high25 Ų2561.9 Ų61.921%0.20733%0.327CS..Hα-helixtrans-62.4-33-179.400000111.8Y135 L142Y135-A139 HydrophobicContact CE1-CB 4.43Å; Y135-A139 WeakPolarHBondContact O-CB 3.28Å; Y135-A139 PolarHBondContact O-N 2.77Å; A139-L142 PolarHBondContact O-N 3.07Å
140K89.4Confident90.8Very high134 Ų13456.3 Ų56.358%0.58330%0.297SS*.Hα-helixtrans-75.1-30.2178.6-170.1177.4-176-179.80112.9A136 E137 F138 L142 E143A136-K140 VanDerWaalsContact O-CB 3.27Å; A136-K140 WeakPolarHBondContact O-CB 3.39Å; A136-K140 PolarHBondContact O-N 3.45Å; A136-K140 VanDerWaalsContact O-N 3.16Å; E137-K140 PolarHBondContact O-N 2.77Å; F138-K140 PolarHBondContact O-N 3.2Å; K140-L142 PolarHBondContact O-N 2.92Å; K140-E143 PolarHBondContact O-N 2.98Å
141S84.3Confident90.3Very high11 Ų1154.8 Ų54.88%0.07729%0.289CS..Hα-helixtrans-67.7-25.3175.572.60000112.3D125 E137 F138D125-S141 WeakPolarHBondContact OD1-CB 3.46Å; D125-S141 WeakPolarHBondContact OD2-CB 3.35Å; D125-S141 PolarHBondContact OD2-OG 3.02Å; E137-S141 PolarHBondContact O-N 2.8Å; F138-S141 PolarHBondContact O-N 2.76Å; F138-S141 PolarHBondContact O-OG 3.5Å
142L79.2Confident89.8Confident6 Ų656.6 Ų56.63%0.03128%0.284CS..THydrogen-bonded Turntrans-87.43.9176.5-60.7177000115.1L38 K40 V43 Q70 F138 A139 K140L38-L142 WeakPolarHBondContact O-CD2 2.97Å; K40-L142 WeakPolarHBondContact CE-O 3.08Å; V43-L142 HydrophobicContact CB-CD1 4.25Å; V43-L142 HydrophobicContact CB-CD2 4.05Å; V43-L142 HydrophobicContact CG1-CD1 3.94Å; V43-L142 HydrophobicContact CG2-CD1 4.14Å; V43-L142 HydrophobicContact CG2-CD2 3.74Å; Q70-L142 HydrophobicContact CB-CD1 4.39Å; Q70-L142 HydrophobicContact CG-CD1 3.69Å; F138-L142 HydrophobicContact CD1-CD1 4.08Å; F138-L142 HydrophobicContact CE1-CD1 3.5Å; F138-L142 HydrophobicContact CZ-CD1 3.82Å; F138-L142 PolarHBondContact O-N 2.69Å; A139-L142 PolarHBondContact O-N 3.07Å; K140-L142 PolarHBondContact O-N 2.92Å
143E71.5Confident89.1Confident200 Ų20053.6 Ų53.694%0.93528%0.278SS*.  trans-83.80175.3-73.6-169.9162.500112.6K40 K140K40-E143 PolarHBondContact NZ-O 3.33Å; K140-E143 PolarHBondContact O-N 2.98Å

Retrieved 143 of 143 residues in 99 ms (Link to these results)