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Interleukin-5

Homodimeric cytokine expressed predominantly by T-lymphocytes and NK cells that plays an important role in the survival, differentiation, and chemotaxis of eosinophils. Acts also on activated and resting B-cells to induce immunoglobulin production, growth, and differentiation. Mechanistically, exerts its biological effects through a receptor composed of IL5RA subunit and the cytokine receptor common subunit beta/CSF2RB. Binding to the receptor leads to activation of various kinases including LYN, SYK and JAK2 and thereby propagates signals through the RAS-MAPK and JAK-STAT5 pathways respectively. Homodimeric cytokine expressed predominantly by T-lymphocytes and NK cells that plays an important role in the survival, differentiation, and chemotaxis of eosinophils. Also acts on activated and resting B-cells to induce immunoglobulin production, growth, and differentiation. Mechanistically, exerts its biological effects through a receptor composed of IL5RA subunit and the cytokine receptor common subunit beta/CSF2RB. Binding to the receptor leads to activation of various kinases including LYN, SYK and JAK2 and thereby propagates signals through the RAS-MAPK and JAK-STAT5 pathways respectively.

AlphaFold DB , UniProt , Accession A0A096MPP8, Species PAPAN (Papio anubis, Olive baboon), Gene IL5, Length 134 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
1V41.2Very low47.8Very low186 Ų186154.4 Ų154.4100%1.12782%0.815SS**  075.90-164.20000107.3M3V1-M3 HydrophobicContact CG1-CB 4.41Å
2R52.7Low47.9Very low261 Ų261155.8 Ų155.899%0.98582%0.822SS**  cis55.144.547.8-131-175.8-163.3-172.64.9113.6
3M44Very low47.9Very low148 Ų148149.4 Ų149.473%0.72982%0.816SS**  trans-152.723.3173.3-136.3-177.198.900114.8V1V1-M3 HydrophobicContact CG1-CB 4.41Å
4L47.1Very low48.2Very low162 Ų162144.8 Ų144.885%0.84881%0.808SS**SBendtrans-118.61.4176-81.5162.7000113.6
5L49Very low48.1Very low146 Ų146141.9 Ų141.976%0.76481%0.81SS**SBendtrans-109.915.3-174.4-120.6138.6000113.2
6H47.9Very low48Very low162 Ų162143.9 Ų143.975%0.7580%0.802SS**SBendtrans-119-0.5-179.5-72.99.3000113.7
7L48.1Very low47.8Very low147 Ų147145.3 Ų145.377%0.7780%0.803SS**SBendtrans-94.8-9.1-177.8-90.9146.7000114.1
8S51Low47.3Very low92 Ų92147.2 Ų147.264%0.64380%0.798SS**SBendtrans-95.6-1.1-179.442.80000114.8
9L47.2Very low47Very low147 Ų147144.2 Ų144.277%0.7780%0.795SS**SBendtrans-110.11.8-177-102.8105.9000115.9
10L46.9Very low46.7Very low153 Ų153142.6 Ų142.680%0.80179%0.789SS**SBendtrans-99.54-179.2-90154.4000114.6
11A51.2Low46.7Very low94 Ų94140.8 Ų140.878%0.77778%0.784SS**SBendtrans-96.18.2-179.500000114.5
12L48.6Very low46.9Very low172 Ų172138.3 Ų138.390%0.90177%0.77SS**  trans-117.536.6173.9-88.7119.5000111.8A14L12-A14 VanDerWaalsContact C-N 3.29Å; L12-A14 PolarHBondContact O-N 3.31Å; L12-A14 VanDerWaalsContact O-N 3.11Å
13G47.7Very low47.1Very low72 Ų72134.4 Ų134.474%0.74276%0.763SS**SBendtrans-79.380.7163.400000109.9A15G13-A15 PolarHBondContact O-N 3.38Å
14A52.4Low48Very low85 Ų85132.2 Ų132.270%0.70275%0.753SS**  trans10.595.8161.200000116L12 Y16L12-A14 VanDerWaalsContact C-N 3.29Å; L12-A14 PolarHBondContact O-N 3.31Å; L12-A14 VanDerWaalsContact O-N 3.11Å; A14-Y16 PolarHBondContact O-N 3.41Å
15A47Very low49.4Very low102 Ų102128.3 Ų128.384%0.84374%0.737SS**  trans-65.963.8149.400000109G13 M17G13-A15 PolarHBondContact O-N 3.38Å; A15-M17 PolarHBondContact O-N 2.82Å
16Y45.8Very low50.8Low173 Ų173123.8 Ų123.868%0.67872%0.716SS**  trans-90.866.7159.3-148.2-91.2000105.8A14 Y18A14-Y16 PolarHBondContact O-N 3.41Å; Y16-Y18 AromaticContact CD1-CD2 3.57Å; Y16-Y18 HydrophobicContact CD1-CD2 3.57Å; Y16-Y18 AromaticContact CD1-CE2 3.6Å; Y16-Y18 HydrophobicContact CD1-CE2 3.6Å; Y16-Y18 HydrophobicContact CD1-CG 4.23Å; Y16-Y18 HydrophobicContact CE1-CD1 4.41Å; Y16-Y18 AromaticContact CE1-CD2 3.87Å; Y16-Y18 HydrophobicContact CE1-CD2 3.87Å; Y16-Y18 HydrophobicContact CE1-CE1 4.23Å; Y16-Y18 AromaticContact CE1-CE2 3.65Å; Y16-Y18 HydrophobicContact CE1-CE2 3.65Å; Y16-Y18 HydrophobicContact CE1-CG 4.24Å; Y16-Y18 AromaticContact CE1-CZ 3.85Å; Y16-Y18 PolarHBondContact O-N 3.2Å
17M44.3Very low52.7Low168 Ų168120.4 Ų120.483%0.82871%0.71SS**  trans-6196.1156.5-72.1-67.5-74.300103.9A15 A19A15-M17 PolarHBondContact O-N 2.82Å; M17-A19 VanDerWaalsContact C-N 3.32Å; M17-A19 PolarHBondContact O-N 3.22Å
18Y40.2Very low54.8Low179 Ų179115.7 Ų115.770%0.70269%0.692SS**  trans-45.1113156.7-95.1-91.4000104.4Y16 V20Y16-Y18 AromaticContact CD1-CD2 3.57Å; Y16-Y18 HydrophobicContact CD1-CD2 3.57Å; Y16-Y18 AromaticContact CD1-CE2 3.6Å; Y16-Y18 HydrophobicContact CD1-CE2 3.6Å; Y16-Y18 HydrophobicContact CD1-CG 4.23Å; Y16-Y18 HydrophobicContact CE1-CD1 4.41Å; Y16-Y18 AromaticContact CE1-CD2 3.87Å; Y16-Y18 HydrophobicContact CE1-CD2 3.87Å; Y16-Y18 HydrophobicContact CE1-CE1 4.23Å; Y16-Y18 AromaticContact CE1-CE2 3.65Å; Y16-Y18 HydrophobicContact CE1-CE2 3.65Å; Y16-Y18 HydrophobicContact CE1-CG 4.24Å; Y16-Y18 AromaticContact CE1-CZ 3.85Å; Y16-Y18 PolarHBondContact O-N 3.2Å; Y18-V20 PolarHBondContact O-N 3.18Å
19A41.1Very low56.8Low90 Ų90112 Ų11274%0.74467%0.665SS**  trans-60.987.8160.700000103.9M17 P21M17-A19 VanDerWaalsContact C-N 3.32Å; M17-A19 PolarHBondContact O-N 3.22Å; A19-P21 WeakPolarHBondContact O-CD 3.45Å
20V40.3Very low59.2Low112 Ų112107.7 Ų107.768%0.67965%0.645SS**  trans-52.6114.9159.8178.90000101.9Y18 T22Y18-V20 PolarHBondContact O-N 3.18Å; V20-T22 PolarHBondContact O-N 3.08Å
21P47.3Very low61.6Low105 Ų105108.1 Ų108.168%0.68264%0.641SS**  trans-50.8115.6173.8-2030.9000104.1A19 E23A19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-E23 PolarHBondContact O-N 3.21Å
22T45Very low63.7Low135 Ų135106.2 Ų106.283%0.82862%0.615SS**  trans-60.495.6174.622.20000104.2V20 I24V20-T22 PolarHBondContact O-N 3.08Å; T22-I24 PolarHBondContact O-N 3.45Å
23E57.5Low66Low178 Ų17898.4 Ų98.483%0.83258%0.575SS**  trans-55.4113177-73.2-169.8162.300104.4P21 P25P21-E23 PolarHBondContact O-N 3.21Å; E23-P25 VanDerWaalsContact O-CD 3.29Å; E23-P25 WeakPolarHBondContact O-CD 3.49Å
24I61.3Low68.4Low102 Ų102100.3 Ų100.352%0.52357%0.567SS.*  trans-54.4121.9174.8-62.8171.7000104.5T22 T26 A28 L29T22-I24 PolarHBondContact O-N 3.45Å; I24-T26 PolarHBondContact O-N 3.43Å; I24-T26 VanDerWaalsContact O-N 3.13Å; I24-A28 HydrophobicContact CG2-CB 4.04Å; I24-L29 HydrophobicContact CG2-CB 4.15Å
25P76.9Confident70.6Confident80 Ų8098.9 Ų98.952%0.51956%0.556SS.*  trans-50.2128.8179.5-27.734.1000108.5E23 S27 A28 L29E23-P25 VanDerWaalsContact O-CD 3.29Å; E23-P25 WeakPolarHBondContact O-CD 3.49Å; P25-S27 PolarHBondContact O-N 3.06Å; P25-A28 HydrophobicContact CB-CB 4.41Å; P25-A28 WeakPolarHBondContact O-CA 3.38Å; P25-A28 WeakPolarHBondContact O-CB 3.41Å; P25-A28 PolarHBondContact O-N 3.22Å; P25-L29 PolarHBondContact O-N 3.37Å; P25-L29 VanDerWaalsContact O-N 3.12Å
26T79.9Confident73Confident52 Ų5295.1 Ų95.132%0.31952%0.522SS..Hα-helixtrans-52.2-32.1-175.8-43.80000110.9I24 L29 V30 Y97I24-T26 PolarHBondContact O-N 3.43Å; I24-T26 VanDerWaalsContact O-N 3.13Å; T26-L29 PolarHBondContact O-N 3.21Å; T26-V30 HydrophobicContact CG2-CG2 4.45Å; T26-V30 WeakPolarHBondContact O-CB 3.5Å; T26-V30 VanDerWaalsContact O-CG2 3.23Å; T26-V30 WeakPolarHBondContact O-CG2 3.45Å; T26-V30 PolarHBondContact O-N 3Å; T26-Y97 HydrophobicContact CG2-CD1 4.19Å; T26-Y97 HydrophobicContact CG2-CE1 4.32Å; T26-Y97 HydrophobicContact CG2-CG 4.32Å
27S87.6Confident75.4Confident91 Ų9190.8 Ų90.864%0.63651%0.51SS*.Hα-helixtrans-61.2-43.7173.3570000114.3P25 K31P25-S27 PolarHBondContact O-N 3.06Å; S27-K31 WeakPolarHBondContact O-CB 3.49Å; S27-K31 PolarHBondContact O-N 3.26Å
28A91.4Very high78Confident47 Ų4787.1 Ų87.139%0.38850%0.5SS..Hα-helixtrans-67.4-42.1176.700000110.9I24 P25 K31 E32I24-A28 HydrophobicContact CG2-CB 4.04Å; P25-A28 HydrophobicContact CB-CB 4.41Å; P25-A28 WeakPolarHBondContact O-CA 3.38Å; P25-A28 WeakPolarHBondContact O-CB 3.41Å; P25-A28 PolarHBondContact O-N 3.22Å; A28-K31 PolarHBondContact O-N 3.3Å; A28-E32 WeakPolarHBondContact O-CB 3.32Å; A28-E32 PolarHBondContact O-N 3.39Å
29L93.9Very high80.7Confident14 Ų1483.7 Ų83.77%0.07350%0.498CS..Hα-helixtrans-61.3-46.3175.6-174.469.9000111.5I24 P25 T26 E32 T33 N90 L93 I94I24-L29 HydrophobicContact CG2-CB 4.15Å; P25-L29 PolarHBondContact O-N 3.37Å; P25-L29 VanDerWaalsContact O-N 3.12Å; T26-L29 PolarHBondContact O-N 3.21Å; L29-E32 PolarHBondContact O-N 2.93Å; L29-T33 WeakPolarHBondContact O-CB 3.24Å; L29-T33 PolarHBondContact O-N 3.41Å; L29-T33 PolarHBondContact O-OG1 2.73Å; L29-N90 HydrophobicContact CD1-CB 4.02Å; L29-N90 VanDerWaalsContact CD1-CG 3.49Å; L29-L93 HydrophobicContact CD1-CD1 4.38Å; L29-L93 HydrophobicContact CD2-CB 3.81Å; L29-L93 HydrophobicContact CD2-CD1 4.42Å; L29-I94 HydrophobicContact CD2-CG1 3.91Å; L29-I94 HydrophobicContact CG-CG1 4.37Å
30V95.9Very high83.3Confident58 Ų5880 Ų8035%0.35247%0.466SS..Hα-helixtrans-62.1-44.1177168.70000111T26 E32 T33 L34 I94T26-V30 HydrophobicContact CG2-CG2 4.45Å; T26-V30 WeakPolarHBondContact O-CB 3.5Å; T26-V30 VanDerWaalsContact O-CG2 3.23Å; T26-V30 WeakPolarHBondContact O-CG2 3.45Å; T26-V30 PolarHBondContact O-N 3Å; V30-E32 PolarHBondContact O-N 3.02Å; V30-T33 PolarHBondContact O-N 2.93Å; V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.38Å; V30-L34 PolarHBondContact O-N 3.31Å; V30-I94 HydrophobicContact CG2-CD1 3.99Å; V30-I94 HydrophobicContact CG2-CG1 4.35Å
31K97.2Very high85.9Confident162 Ų16283 Ų8370%0.70447%0.465SS*.Hα-helixtrans-60.1-44.9177.8-174.5178.6-179.2-179.70112S27 A28 L34 A35S27-K31 WeakPolarHBondContact O-CB 3.49Å; S27-K31 PolarHBondContact O-N 3.26Å; A28-K31 PolarHBondContact O-N 3.3Å; K31-L34 PolarHBondContact O-N 3.36Å; K31-A35 PolarHBondContact O-N 3.47Å
32E96.3Very high88.2Confident53 Ų5383.5 Ų83.525%0.24847%0.466CS..Hα-helixtrans-63.1-44175-178.9-174.5-153.600111.7A28 L29 V30 L34 A35 L36 R86 N90A28-E32 WeakPolarHBondContact O-CB 3.32Å; A28-E32 PolarHBondContact O-N 3.39Å; L29-E32 PolarHBondContact O-N 2.93Å; V30-E32 PolarHBondContact O-N 3.02Å; E32-L34 VanDerWaalsContact C-N 3.3Å; E32-L34 PolarHBondContact O-N 3.48Å; E32-A35 WeakPolarHBondContact O-CB 3.18Å; E32-A35 PolarHBondContact O-N 2.71Å; E32-A35 VanDerWaalsContact O-N 3.12Å; E32-L36 HydrophobicContact CG-CD1 4.05Å; E32-L36 HydrophobicContact CG-CG 4.45Å; E32-L36 WeakPolarHBondContact O-CG 3.41Å; E32-L36 PolarHBondContact O-N 3.21Å; E32-R86 IonicContact OE1-CZ 2.96Å; E32-R86 IonicContact OE1-NE 2.92Å; E32-R86 PolarHBondContact OE1-NE 3.47Å; E32-R86 IonicContact OE1-NH2 3.12Å; E32-R86 PolarHBondContact OE1-NH2 3.1Å; E32-N90 PolarHBondContact OE2-ND2 2.98Å
33T97.3Very high90.5Very high9 Ų981.1 Ų81.16%0.05545%0.448CS..Hα-helixtrans-60.6-41.1179.5-52.20000111.3L29 V30 L36 L37 L87 N90 L91 I94L29-T33 WeakPolarHBondContact O-CB 3.24Å; L29-T33 PolarHBondContact O-N 3.41Å; L29-T33 PolarHBondContact O-OG1 2.73Å; V30-T33 PolarHBondContact O-N 2.93Å; T33-L36 PolarHBondContact O-N 2.92Å; T33-L37 WeakPolarHBondContact O-CB 3.44Å; T33-L37 PolarHBondContact O-N 3.21Å; T33-L87 HydrophobicContact CG2-CD1 3.83Å; T33-N90 HydrophobicContact CG2-CB 4.22Å; T33-N90 VanDerWaalsContact OG1-CB 3.25Å; T33-N90 WeakPolarHBondContact OG1-CB 3.44Å; T33-N90 PolarHBondContact OG1-ND2 3.24Å; T33-L91 HydrophobicContact CG2-CD2 3.73Å; T33-L91 HydrophobicContact CG2-CG 3.95Å; T33-I94 HydrophobicContact CG2-CD1 4.11Å
34L98.2Very high92.3Very high111 Ų11173.7 Ų73.758%0.58141%0.414SS*.Hα-helixtrans-62-42.3174.2-74169.8000112.1V30 K31 E32 L37 S38V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.38Å; V30-L34 PolarHBondContact O-N 3.31Å; K31-L34 PolarHBondContact O-N 3.36Å; E32-L34 VanDerWaalsContact C-N 3.3Å; E32-L34 PolarHBondContact O-N 3.48Å; L34-L37 PolarHBondContact O-N 3.35Å; L34-S38 PolarHBondContact O-N 3.47Å
35A97.9Very high93.9Very high56 Ų5674 Ų7446%0.46342%0.416SS..Hα-helixtrans-63.6-45.4176.100000111.5K31 E32 L37 S38 T39K31-A35 PolarHBondContact O-N 3.47Å; E32-A35 WeakPolarHBondContact O-CB 3.18Å; E32-A35 PolarHBondContact O-N 2.71Å; E32-A35 VanDerWaalsContact O-N 3.12Å; A35-L37 PolarHBondContact O-N 2.84Å; A35-S38 WeakPolarHBondContact O-CB 3.35Å; A35-S38 PolarHBondContact O-N 3.24Å; A35-T39 PolarHBondContact O-N 3.11Å; A35-T39 PolarHBondContact O-OG1 3.08Å; A35-T39 VanDerWaalsContact O-OG1 3.11Å
36L97.2Very high94.7Very high23 Ų2373 Ų7312%0.1242%0.42CS..Hα-helixtrans-62.1-42.4176.2-71.5169.3000111.9E32 T33 S38 T39 H40 R86 L87E32-L36 HydrophobicContact CG-CD1 4.05Å; E32-L36 HydrophobicContact CG-CG 4.45Å; E32-L36 WeakPolarHBondContact O-CG 3.41Å; E32-L36 PolarHBondContact O-N 3.21Å; T33-L36 PolarHBondContact O-N 2.92Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.06Å; L36-T39 PolarHBondContact O-N 3.49Å; L36-H40 PolarHBondContact O-N 3.29Å; L36-H40 PolarHBondContact O-ND1 3.29Å; L36-R86 HydrophobicContact CD1-CB 4.16Å; L36-R86 HydrophobicContact CD1-CG 3.82Å; L36-L87 HydrophobicContact CB-CB 4.12Å; L36-L87 HydrophobicContact CB-CD1 3.97Å
37L97.6Very high95.3Very high82 Ų8273.5 Ų73.543%0.42942%0.42SS..Hα-helixtrans-59.6-42.3176.3179.763.9000111.3T33 L34 A35 R41 L44 L87T33-L37 WeakPolarHBondContact O-CB 3.44Å; T33-L37 PolarHBondContact O-N 3.21Å; L34-L37 PolarHBondContact O-N 3.35Å; A35-L37 PolarHBondContact O-N 2.84Å; L37-R41 PolarHBondContact O-N 3.34Å; L37-L44 HydrophobicContact CD1-CD1 3.77Å; L37-L87 HydrophobicContact CB-CD1 4.11Å; L37-L87 HydrophobicContact CD1-CD2 4.35Å
38S97.4Very high95.6Very high90 Ų9077.7 Ų77.763%0.62943%0.43SS*.Hα-helixtrans-62-50.6175.9-170.60000111.6L34 A35 L36 H40 R41L34-S38 PolarHBondContact O-N 3.47Å; A35-S38 WeakPolarHBondContact O-CB 3.35Å; A35-S38 PolarHBondContact O-N 3.24Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.06Å; S38-H40 VanDerWaalsContact C-N 3.31Å; S38-H40 PolarHBondContact O-N 3.19Å; S38-R41 WeakPolarHBondContact O-CB 3.39Å; S38-R41 PolarHBondContact O-N 2.92Å
39T97.1Very high95.8Very high108 Ų10881 Ų8166%0.66345%0.445SS*.Hα-helixtrans-61.4-36.9-178.9-590000112.9A35 L36A35-T39 PolarHBondContact O-N 3.11Å; A35-T39 PolarHBondContact O-OG1 3.08Å; A35-T39 VanDerWaalsContact O-OG1 3.11Å; L36-T39 PolarHBondContact O-N 3.49Å
40H95.8Very high95.9Very high13 Ų1382.6 Ų82.66%0.0645%0.454CS..THydrogen-bonded Turntrans-93.44.9-176.6-62.688000113.6L36 S38 T42 L43 L44 T83 V84 L87L36-H40 PolarHBondContact O-N 3.29Å; L36-H40 PolarHBondContact O-ND1 3.29Å; S38-H40 VanDerWaalsContact C-N 3.31Å; S38-H40 PolarHBondContact O-N 3.19Å; H40-T42 VanDerWaalsContact C-N 3.3Å; H40-T42 PolarHBondContact O-N 3.41Å; H40-L43 WeakPolarHBondContact O-CB 3.43Å; H40-L43 PolarHBondContact O-N 3.21Å; H40-L44 HydrophobicContact CB-CD1 4.18Å; H40-L44 HydrophobicContact CB-CG 4.31Å; H40-L44 WeakPolarHBondContact O-CG 3.26Å; H40-L44 PolarHBondContact O-N 2.77Å; H40-T83 PolarHBondContact CE1-O 3.19Å; H40-T83 PolarHBondContact CE1-OG1 3.39Å; H40-T83 WeakPolarHBondContact NE2-CB 3.4Å; H40-T83 PolarHBondContact NE2-OG1 3.48Å; H40-V84 HydrophobicContact CB-CG2 4.29Å; H40-V84 PolarHBondContact NE2-N 3.2Å; H40-L87 HydrophobicContact CB-CD2 4.43Å
41R95.9Very high95.9Very high173 Ų17390.3 Ų90.365%0.65348%0.477SS*.Hα-helixtrans-53.5-45.4-173.9-169.9176.7-176111.50.4112.9L37 S38 L43 L44 I45L37-R41 PolarHBondContact O-N 3.34Å; S38-R41 WeakPolarHBondContact O-CB 3.39Å; S38-R41 PolarHBondContact O-N 2.92Å; R41-L43 VanDerWaalsContact C-N 3.31Å; R41-L43 PolarHBondContact O-N 3.25Å; R41-L44 PolarHBondContact O-N 3.39Å; R41-I45 HydrophobicContact CG-CG2 4.49Å; R41-I45 WeakPolarHBondContact O-CG1 3.42Å; R41-I45 WeakPolarHBondContact O-CG2 3.37Å; R41-I45 PolarHBondContact O-N 2.99Å
42T94.6Very high95.9Very high117 Ų11785.3 Ų85.372%0.71846%0.457SS*.Hα-helixtrans-61-38.6179.6-50.70000112.6H40H40-T42 VanDerWaalsContact C-N 3.3Å; H40-T42 PolarHBondContact O-N 3.41Å
43L94.3Very high95.9Very high85 Ų8587.3 Ų87.345%0.44547%0.474SS..Hα-helixtrans-67-47175.5175.367.2000110.8H40 R41 I45 G46 T78 V84H40-L43 WeakPolarHBondContact O-CB 3.43Å; H40-L43 PolarHBondContact O-N 3.21Å; R41-L43 VanDerWaalsContact C-N 3.31Å; R41-L43 PolarHBondContact O-N 3.25Å; L43-I45 VanDerWaalsContact C-N 3.31Å; L43-I45 PolarHBondContact O-N 2.99Å; L43-G46 PolarHBondContact O-N 3.23Å; L43-G46 VanDerWaalsContact O-N 3.08Å; L43-T78 HydrophobicContact CD2-CG2 4.15Å; L43-T78 HydrophobicContact CG-CG2 4.33Å; L43-V84 HydrophobicContact CD2-CB 3.97Å; L43-V84 HydrophobicContact CD2-CG1 4.16Å; L43-V84 HydrophobicContact CD2-CG2 3.93Å
44L94.9Very high95.8Very high21 Ų2192.7 Ų92.711%0.1151%0.507CS..Hα-helixtrans-68-28.3-174-64.1169.9000113.2L37 H40 R41 G46 L74 T78 V84 L87 F88L37-L44 HydrophobicContact CD1-CD1 3.77Å; H40-L44 HydrophobicContact CB-CD1 4.18Å; H40-L44 HydrophobicContact CB-CG 4.31Å; H40-L44 WeakPolarHBondContact O-CG 3.26Å; H40-L44 PolarHBondContact O-N 2.77Å; R41-L44 PolarHBondContact O-N 3.39Å; L44-G46 VanDerWaalsContact C-N 3.32Å; L44-L74 HydrophobicContact CB-CD2 4.49Å; L44-L74 HydrophobicContact CD2-CD2 4.04Å; L44-L74 HydrophobicContact CD2-CG 4.17Å; L44-T78 HydrophobicContact CD2-CG2 4.31Å; L44-V84 HydrophobicContact CD2-CG2 4.26Å; L44-L87 HydrophobicContact CD1-CD2 3.76Å; L44-F88 HydrophobicContact CD2-CZ 3.91Å
45I95.3Very high95.7Very high109 Ų10989.7 Ų89.756%0.55949%0.494SS*.THydrogen-bonded Turntrans-87.50.9174.969.4-179.1000113.3R41 L43 N47R41-I45 HydrophobicContact CG-CG2 4.49Å; R41-I45 WeakPolarHBondContact O-CG1 3.42Å; R41-I45 WeakPolarHBondContact O-CG2 3.37Å; R41-I45 PolarHBondContact O-N 2.99Å; L43-I45 VanDerWaalsContact C-N 3.31Å; L43-I45 PolarHBondContact O-N 2.99Å; I45-N47 PolarHBondContact O-N 2.87Å
46G92.6Very high95.6Very high59 Ų5994.3 Ų94.361%0.60852%0.516SS*.  trans-63.4-22.8-173.100000114.6L43 L44L43-G46 PolarHBondContact O-N 3.23Å; L43-G46 VanDerWaalsContact O-N 3.08Å; L44-G46 VanDerWaalsContact C-N 3.32Å
47N93.5Very high95.3Very high62 Ų6297 Ų9733%0.33253%0.528SS..  trans-95.991.8171.3-173.4-13.6000110.6I45 T49 L50I45-N47 PolarHBondContact O-N 2.87Å; N47-T49 PolarHBondContact O-N 3.41Å; N47-T49 PolarHBondContact OD1-N 3.04Å; N47-T49 PolarHBondContact OD1-OG1 3.14Å; N47-L50 HydrophobicContact CB-CB 4.26Å; N47-L50 PolarHBondContact O-N 2.99Å; N47-L50 PolarHBondContact OD1-N 3.04Å
48E92.6Very high95Very high180 Ų180101.7 Ų101.784%0.84155%0.545SS*.THydrogen-bonded Turntrans-68.1-16-176.8-60.3-175.1169.300114.3
49T95.8Very high94.7Very high116 Ų11699.5 Ų99.571%0.71253%0.525SS*.THydrogen-bonded Turntrans-89.4-17.3-17969.10000112.9N47 R51N47-T49 PolarHBondContact O-N 3.41Å; N47-T49 PolarHBondContact OD1-N 3.04Å; N47-T49 PolarHBondContact OD1-OG1 3.14Å; T49-R51 PolarHBondContact O-N 3.48Å
50L95.9Very high94.5Very high48 Ų48100.6 Ų100.625%0.25152%0.522SS..  trans-65.7129.5-175.5-173.261.1000110.8N47 I52 T73 L74 Q77N47-L50 HydrophobicContact CB-CB 4.26Å; N47-L50 PolarHBondContact O-N 2.99Å; N47-L50 PolarHBondContact OD1-N 3.04Å; L50-I52 HydrophobicContact CD2-CD1 3.89Å; L50-I52 HydrophobicContact CD2-CG1 4.24Å; L50-I52 HydrophobicContact CG-CD1 4.29Å; L50-I52 HydrophobicContact CG-CG1 4.1Å; L50-T73 HydrophobicContact CD1-CG2 4Å; L50-L74 HydrophobicContact CD2-CD1 4.17Å; L50-Q77 HydrophobicContact CD1-CG 4.13Å; L50-Q77 HydrophobicContact CD2-CB 4.19Å; L50-Q77 HydrophobicContact CD2-CG 4.13Å
51R96.7Very high94.4Very high220 Ų220108.1 Ų108.183%0.8356%0.557SS**  trans-112.6121.1175.8-60.1-60.5-176.1155.1-0.9109.2T49T49-R51 PolarHBondContact O-N 3.48Å
52I97.1Very high94.3Very high57 Ų57104.4 Ų104.429%0.29255%0.55SS..  trans-120.8135.2177.3-62.8173.4000107.6L50 V54 G70 T73 L74L50-I52 HydrophobicContact CD2-CD1 3.89Å; L50-I52 HydrophobicContact CD2-CG1 4.24Å; L50-I52 HydrophobicContact CG-CD1 4.29Å; L50-I52 HydrophobicContact CG-CG1 4.1Å; I52-V54 PolarHBondContact O-N 3.3Å; I52-G70 VanDerWaalsContact CG2-CA 3.47Å; I52-T73 HydrophobicContact CG1-CG2 4.39Å; I52-L74 HydrophobicContact CD1-CB 3.92Å; I52-L74 HydrophobicContact CD1-CD1 4.21Å
53P95.6Very high94.5Very high94 Ų9499.5 Ų99.561%0.6152%0.52SS*.  trans-56.9133.5174.8-24.434.4000111.9
54V97.2Very high94.6Very high122 Ų12296.4 Ų96.474%0.73951%0.505SS*.  trans-123.4120173.6-179.20000107.9I52 V56I52-V54 PolarHBondContact O-N 3.3Å; V54-V56 PolarHBondContact O-N 3.23Å
55P95.2Very high94.7Very high49 Ų49100.9 Ų100.932%0.31853%0.525SS..  trans-57.3135176.5-26.435.4000111.9H57 C63P55-H57 VanDerWaalsContact C-N 3.3Å; P55-H57 PolarHBondContact O-N 3.2Å; P55-C63 HydrophobicContact CB-CB 4.25Å; P55-C63 HydrophobicContact CG-CB 3.6Å
56V94.9Very high94.8Very high152 Ų15299.6 Ų99.692%0.92152%0.517SS*.SBendtrans-78.3-14.1-178.9-62.80000113.4V54V54-V56 PolarHBondContact O-N 3.23Å
57H91Very high95.1Very high79 Ų7999.8 Ų99.837%0.36650%0.504SS..SBendtrans-115.3164.9-179.763.857.2000111.9P55 H59 C63P55-H57 VanDerWaalsContact C-N 3.3Å; P55-H57 PolarHBondContact O-N 3.2Å; H57-H59 PolarHBondContact ND1-N 3.42Å; H57-C63 PolarHBondContact CE1-SG 3.26Å
58K91.2Very high95.3Very high181 Ų18198.1 Ų98.179%0.78749%0.493SS*.SBendtrans-91.95.2-176.3-63.9-178.3-178.91740115.2H60K58-H60 PolarHBondContact O-CE1 3.47Å; K58-H60 VanDerWaalsContact O-CE1 3.3Å; K58-H60 PolarHBondContact O-N 2.72Å; K58-H60 PolarHBondContact O-ND1 3.35Å
59H92Very high95.5Very high44 Ų4495.9 Ų95.920%0.20448%0.483CS..  trans-76.268.2175.3-55.3-53.4000112.3H57 Q61 L62 W130H57-H59 PolarHBondContact ND1-N 3.42Å; H59-Q61 PolarHBondContact O-N 2.99Å; H59-Q61 VanDerWaalsContact O-N 3.1Å; H59-L62 HydrophobicContact CB-CB 4.48Å; H59-L62 HydrophobicContact CB-CD1 3.62Å; H59-L62 HydrophobicContact CB-CG 3.89Å; H59-L62 WeakPolarHBondContact O-CB 3.46Å; H59-L62 PolarHBondContact O-N 2.98Å; H59-W130 VanDerWaalsContact CE1-CB 3.49Å; H59-W130 WeakPolarHBondContact CE1-CB 3.16Å; H59-W130 AromaticContact CE1-CD1 3.63Å; H59-W130 AromaticContact CE1-CD2 3.94Å; H59-W130 AromaticContact CE1-CG 3.37Å; H59-W130 AromaticContact ND1-CD1 3.58Å; H59-W130 AromaticContact ND1-CD2 3.82Å; H59-W130 AromaticContact ND1-CE2 3.97Å; H59-W130 AromaticContact ND1-CG 3.6Å; H59-W130 AromaticContact ND1-NE1 3.79Å
60H93.4Very high95.6Very high131 Ų13190.6 Ų90.661%0.60645%0.452SS*.G310 helixtrans-54.1-33.9-173.8-54.199.5000114K58 L62 C63K58-H60 PolarHBondContact O-CE1 3.47Å; K58-H60 VanDerWaalsContact O-CE1 3.3Å; K58-H60 PolarHBondContact O-N 2.72Å; K58-H60 PolarHBondContact O-ND1 3.35Å; H60-L62 PolarHBondContact O-N 3.25Å; H60-C63 PolarHBondContact O-N 2.88Å
61Q92.9Very high95.7Very high171 Ų17189.8 Ų89.880%0.79945%0.447SS*.G310 helixtrans-63.6-28.3-179.2-64.4-179.44.900112.7H59 C63H59-Q61 PolarHBondContact O-N 2.99Å; H59-Q61 VanDerWaalsContact O-N 3.1Å; Q61-C63 VanDerWaalsContact C-N 3.34Å
62L94.6Very high95.7Very high95 Ų9581 Ų8150%0.49742%0.424SS..G310 helixtrans-74.7-25.2178.3-57-177.6000112.6H59 H60 W130H59-L62 HydrophobicContact CB-CB 4.48Å; H59-L62 HydrophobicContact CB-CD1 3.62Å; H59-L62 HydrophobicContact CB-CG 3.89Å; H59-L62 WeakPolarHBondContact O-CB 3.46Å; H59-L62 PolarHBondContact O-N 2.98Å; H60-L62 PolarHBondContact O-N 3.25Å; L62-W130 HydrophobicContact CD1-CH2 3.92Å; L62-W130 HydrophobicContact CD1-CZ3 4.07Å; L62-W130 HydrophobicContact CD2-CH2 3.93Å; L62-W130 HydrophobicContact CD2-CZ2 4.41Å; L62-W130 HydrophobicContact CG-CH2 4.33Å
63C97.2Very high95.8Very high14 Ų1480.9 Ų80.910%0.09543%0.427CS..G310 helixtrans-110.724.2-172.2-57.70000113.4P55 H57 H60 Q61 E65 E66 I67P55-C63 HydrophobicContact CB-CB 4.25Å; P55-C63 HydrophobicContact CG-CB 3.6Å; H57-C63 PolarHBondContact CE1-SG 3.26Å; H60-C63 PolarHBondContact O-N 2.88Å; Q61-C63 VanDerWaalsContact C-N 3.34Å; C63-E65 PolarHBondContact O-N 3.3Å; C63-E66 VanDerWaalsContact CA-OE2 3.24Å; C63-E66 WeakPolarHBondContact CA-OE2 3.14Å; C63-E66 PolarHBondContact O-N 2.96Å; C63-I67 HydrophobicContact CB-CD1 4.42Å; C63-I67 WeakPolarHBondContact O-CB 3.49Å; C63-I67 WeakPolarHBondContact O-CD1 3.43Å; C63-I67 WeakPolarHBondContact O-CG1 3.44Å; C63-I67 PolarHBondContact O-N 3.1Å
64T97Very high95.8Very high21 Ų2178.2 Ų78.213%0.12941%0.407CS..Hα-helixtrans-59.4-34-176.248.40000112.4F68 I98 K102T64-F68 WeakPolarHBondContact O-CD2 3.34Å; T64-F68 PolarHBondContact O-N 3.26Å; T64-F68 VanDerWaalsContact O-N 3.14Å; T64-I98 HydrophobicContact CG2-CG2 4.32Å; T64-K102 VanDerWaalsContact OG1-CE 3.27Å; T64-K102 WeakPolarHBondContact OG1-CE 3.27Å; T64-K102 PolarHBondContact OG1-NZ 3.48Å
65E96.3Very high95.7Very high115 Ų11575.9 Ų75.954%0.53739%0.388SS..Hα-helixtrans-72-46.7-179.8-75.3168.5-152.200112C63 I67 F68 Q69 K102C63-E65 PolarHBondContact O-N 3.3Å; E65-I67 VanDerWaalsContact C-N 3.3Å; E65-I67 PolarHBondContact O-N 3.04Å; E65-F68 PolarHBondContact O-N 3.03Å; E65-Q69 WeakPolarHBondContact O-CB 3.47Å; E65-Q69 WeakPolarHBondContact O-CG 3.41Å; E65-Q69 PolarHBondContact O-N 3.32Å; E65-K102 IonicContact OE1-NZ 2.75Å; E65-K102 PolarHBondContact OE1-NZ 3Å
66E98.1Very high95.7Very high82 Ų8277.5 Ų77.538%0.38340%0.401SS..Hα-helixtrans-60.6-41.2175.7-66.372-159.800111.1C63 Q69 G70C63-E66 VanDerWaalsContact CA-OE2 3.24Å; C63-E66 WeakPolarHBondContact CA-OE2 3.14Å; C63-E66 PolarHBondContact O-N 2.96Å; E66-Q69 PolarHBondContact O-N 3.17Å; E66-G70 PolarHBondContact O-N 2.89Å
67I98.3Very high95.5Very high63 Ų6375.4 Ų75.432%0.32338%0.381SS..Hα-helixtrans-58.8-49.8176-70.9164.5000110.5C63 E65 G70 I71C63-I67 HydrophobicContact CB-CD1 4.42Å; C63-I67 WeakPolarHBondContact O-CB 3.49Å; C63-I67 WeakPolarHBondContact O-CD1 3.43Å; C63-I67 WeakPolarHBondContact O-CG1 3.44Å; C63-I67 PolarHBondContact O-N 3.1Å; E65-I67 VanDerWaalsContact C-N 3.3Å; E65-I67 PolarHBondContact O-N 3.04Å; I67-G70 PolarHBondContact O-N 3.11Å; I67-I71 HydrophobicContact CG2-CD1 4.06Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 3.42Å
68F98.1Very high95.6Very high27 Ų2772.3 Ų72.312%0.11837%0.368CS..Hα-helixtrans-74.4-27.3-178.2-78.9-65.8000113.7T64 E65 I71 G72 L91 I94 K95 I98T64-F68 WeakPolarHBondContact O-CD2 3.34Å; T64-F68 PolarHBondContact O-N 3.26Å; T64-F68 VanDerWaalsContact O-N 3.14Å; E65-F68 PolarHBondContact O-N 3.03Å; F68-I71 HydrophobicContact CD1-CD1 3.62Å; F68-I71 HydrophobicContact CE1-CD1 3.79Å; F68-I71 HydrophobicContact CG-CD1 4.44Å; F68-I71 PolarHBondContact O-N 3.43Å; F68-G72 PolarHBondContact O-N 3.3Å; F68-L91 WeakPolarHBondContact CE1-O 3.4Å; F68-I94 HydrophobicContact CZ-CG2 4.26Å; F68-K95 HydrophobicContact CB-CD 3.95Å; F68-K95 HydrophobicContact CB-CG 4.41Å; F68-K95 HydrophobicContact CD1-CB 3.73Å; F68-K95 HydrophobicContact CD1-CD 3.83Å; F68-K95 HydrophobicContact CD1-CG 3.82Å; F68-K95 HydrophobicContact CD2-CB 4.25Å; F68-K95 HydrophobicContact CD2-CD 4.26Å; F68-K95 HydrophobicContact CD2-CG 3.78Å; F68-K95 HydrophobicContact CE1-CB 3.47Å; F68-K95 VanDerWaalsContact CE1-CB 3.47Å; F68-K95 HydrophobicContact CE1-CD 4.47Å; F68-K95 HydrophobicContact CE1-CG 4.02Å; F68-K95 HydrophobicContact CE2-CB 4.03Å; F68-K95 HydrophobicContact CE2-CG 3.98Å; F68-K95 HydrophobicContact CG-CB 4.14Å; F68-K95 HydrophobicContact CG-CD 3.74Å; F68-K95 HydrophobicContact CG-CG 3.72Å; F68-K95 HydrophobicContact CZ-CB 3.64Å; F68-K95 HydrophobicContact CZ-CG 4.1Å; F68-I98 HydrophobicContact CE2-CD1 3.68Å; F68-I98 HydrophobicContact CZ-CD1 3.97Å
69Q97.8Very high95.3Very high132 Ų13267.3 Ų67.362%0.61736%0.36SS*.Hα-helixtrans-63.6-45.7167.9-74176.25.700110.8E65 E66 I71 G72 T73E65-Q69 WeakPolarHBondContact O-CB 3.47Å; E65-Q69 WeakPolarHBondContact O-CG 3.41Å; E65-Q69 PolarHBondContact O-N 3.32Å; E66-Q69 PolarHBondContact O-N 3.17Å; Q69-I71 VanDerWaalsContact C-N 3.32Å; Q69-I71 PolarHBondContact O-N 2.85Å; Q69-G72 PolarHBondContact O-N 3.36Å; Q69-G72 VanDerWaalsContact O-N 3.1Å; Q69-T73 PolarHBondContact O-N 3.49Å; Q69-T73 PolarHBondContact O-OG1 3.24Å
70G97.9Very high94.7Very high6 Ų671 Ų716%0.06238%0.377CS..Hα-helixtrans-60.2-39.6175.400000113.2I52 E66 I67 T73 L74I52-G70 VanDerWaalsContact CG2-CA 3.47Å; E66-G70 PolarHBondContact O-N 2.89Å; I67-G70 PolarHBondContact O-N 3.11Å; G70-T73 PolarHBondContact O-N 2.93Å; G70-L74 WeakPolarHBondContact O-CB 3.31Å; G70-L74 PolarHBondContact O-N 3.49Å
71I97.8Very high94Very high31 Ų3166.4 Ų66.416%0.15937%0.366CS..Hα-helixtrans-60.6-45.2172.4-69.6163.6000110.9I67 F68 Q69 T73 L74 E75 F88 L91I67-I71 HydrophobicContact CG2-CD1 4.06Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 3.42Å; F68-I71 HydrophobicContact CD1-CD1 3.62Å; F68-I71 HydrophobicContact CE1-CD1 3.79Å; F68-I71 HydrophobicContact CG-CD1 4.44Å; F68-I71 PolarHBondContact O-N 3.43Å; Q69-I71 VanDerWaalsContact C-N 3.32Å; Q69-I71 PolarHBondContact O-N 2.85Å; I71-T73 VanDerWaalsContact C-N 3.35Å; I71-T73 PolarHBondContact O-N 3.3Å; I71-L74 PolarHBondContact O-N 3.43Å; I71-E75 WeakPolarHBondContact O-CB 3.46Å; I71-E75 PolarHBondContact O-N 2.68Å; I71-F88 HydrophobicContact CG2-CD1 4.21Å; I71-F88 HydrophobicContact CG2-CE1 4.46Å; I71-L91 HydrophobicContact CD1-CD1 4.26Å; I71-L91 HydrophobicContact CD1-CD2 4.08Å; I71-L91 HydrophobicContact CG1-CD1 4.4Å; I71-L91 HydrophobicContact CG2-CB 4.35Å; I71-L91 HydrophobicContact CG2-CD1 3.9Å
72G97.3Very high93.5Very high34 Ų3461.2 Ų61.235%0.35136%0.358SS..Hα-helixtrans-63-39.2177.600000112.9F68 Q69 S76F68-G72 PolarHBondContact O-N 3.3Å; Q69-G72 PolarHBondContact O-N 3.36Å; Q69-G72 VanDerWaalsContact O-N 3.1Å; G72-S76 PolarHBondContact O-N 2.92Å
73T97.2Very high93.3Very high56 Ų5661.1 Ų61.134%0.34436%0.362SS..Hα-helixtrans-61.1-47.9171.6-57.20000111.1L50 I52 Q69 G70 I71 E75 S76 Q77L50-T73 HydrophobicContact CD1-CG2 4Å; I52-T73 HydrophobicContact CG1-CG2 4.39Å; Q69-T73 PolarHBondContact O-N 3.49Å; Q69-T73 PolarHBondContact O-OG1 3.24Å; G70-T73 PolarHBondContact O-N 2.93Å; I71-T73 VanDerWaalsContact C-N 3.35Å; I71-T73 PolarHBondContact O-N 3.3Å; T73-E75 PolarHBondContact O-N 2.86Å; T73-S76 PolarHBondContact O-N 2.99Å; T73-S76 PolarHBondContact O-OG 3.29Å; T73-Q77 WeakPolarHBondContact O-CG 3.25Å; T73-Q77 PolarHBondContact O-N 3.36Å
74L96.3Very high93.2Very high37 Ų3760.6 Ų60.619%0.19436%0.358CS..Hα-helixtrans-61.3-43.9179.2-173.861.2000112.1L44 L50 I52 G70 I71 S76 Q77 T78 F88L44-L74 HydrophobicContact CB-CD2 4.49Å; L44-L74 HydrophobicContact CD2-CD2 4.04Å; L44-L74 HydrophobicContact CD2-CG 4.17Å; L50-L74 HydrophobicContact CD2-CD1 4.17Å; I52-L74 HydrophobicContact CD1-CB 3.92Å; I52-L74 HydrophobicContact CD1-CD1 4.21Å; G70-L74 WeakPolarHBondContact O-CB 3.31Å; G70-L74 PolarHBondContact O-N 3.49Å; I71-L74 PolarHBondContact O-N 3.43Å; L74-S76 PolarHBondContact O-N 3.42Å; L74-Q77 PolarHBondContact O-N 3.41Å; L74-T78 WeakPolarHBondContact O-CB 3.3Å; L74-T78 PolarHBondContact O-N 2.9Å; L74-T78 VanDerWaalsContact O-N 3.08Å; L74-T78 PolarHBondContact O-OG1 2.99Å; L74-F88 HydrophobicContact CG-CZ 4.45Å
75E95.9Very high93.1Very high73 Ų7364 Ų6434%0.34137%0.373SS..Hα-helixtrans-59.5-44.2176.8-176.1174.5-157.600111.7I71 T73 Q77 T78 F88I71-E75 WeakPolarHBondContact O-CB 3.46Å; I71-E75 PolarHBondContact O-N 2.68Å; T73-E75 PolarHBondContact O-N 2.86Å; E75-Q77 PolarHBondContact O-N 3.32Å; E75-T78 PolarHBondContact O-N 3.44Å; E75-F88 HydrophobicContact CB-CD1 3.74Å; E75-F88 HydrophobicContact CB-CD2 4.41Å; E75-F88 HydrophobicContact CB-CE1 3.66Å; E75-F88 HydrophobicContact CB-CE2 4.33Å; E75-F88 HydrophobicContact CB-CG 4.14Å; E75-F88 HydrophobicContact CB-CZ 3.98Å; E75-F88 HydrophobicContact CG-CB 4.3Å; E75-F88 HydrophobicContact CG-CD1 3.95Å; E75-F88 HydrophobicContact CG-CD2 3.98Å; E75-F88 HydrophobicContact CG-CE1 4.25Å; E75-F88 HydrophobicContact CG-CE2 4.26Å; E75-F88 HydrophobicContact CG-CG 3.82Å; E75-F88 HydrophobicContact CG-CZ 4.4Å; E75-F88 WeakPolarHBondContact OE1-CB 3.46Å
76S94.8Very high93Very high83 Ų8365.3 Ų65.358%0.5837%0.373SS*.Hα-helixtrans-64.2-23.4179.876.70000114.1G72 T73 L74G72-S76 PolarHBondContact O-N 2.92Å; T73-S76 PolarHBondContact O-N 2.99Å; T73-S76 PolarHBondContact O-OG 3.29Å; L74-S76 PolarHBondContact O-N 3.42Å
77Q91.5Very high93Very high108 Ų10861.5 Ų61.551%0.50536%0.355SS..Hα-helixtrans-100.8-8.5-179.2-62.4-59.6-58.300112.9L50 T73 L74 E75L50-Q77 HydrophobicContact CD1-CG 4.13Å; L50-Q77 HydrophobicContact CD2-CB 4.19Å; L50-Q77 HydrophobicContact CD2-CG 4.13Å; T73-Q77 WeakPolarHBondContact O-CG 3.25Å; T73-Q77 PolarHBondContact O-N 3.36Å; L74-Q77 PolarHBondContact O-N 3.41Å; E75-Q77 PolarHBondContact O-N 3.32Å
78T92.3Very high92.9Very high15 Ų1558.8 Ų58.89%0.09234%0.341CS..SBendtrans-90.3132.3-179.5-57.70000109.5L43 L44 L74 E75 Q80 V84 F88L43-T78 HydrophobicContact CD2-CG2 4.15Å; L43-T78 HydrophobicContact CG-CG2 4.33Å; L44-T78 HydrophobicContact CD2-CG2 4.31Å; L74-T78 WeakPolarHBondContact O-CB 3.3Å; L74-T78 PolarHBondContact O-N 2.9Å; L74-T78 VanDerWaalsContact O-N 3.08Å; L74-T78 PolarHBondContact O-OG1 2.99Å; E75-T78 PolarHBondContact O-N 3.44Å; T78-Q80 PolarHBondContact O-N 2.89Å; T78-V84 HydrophobicContact CG2-CG1 4.28Å; T78-V84 HydrophobicContact CG2-CG2 4.11Å; T78-F88 HydrophobicContact CG2-CE2 4Å; T78-F88 HydrophobicContact CG2-CZ 4.4Å
79A84.3Confident92.8Very high76 Ų7664.3 Ų64.363%0.62837%0.365SS*.PPolyproline II helixtrans-57.3123.7173.600000110
80Q80.5Confident92.8Very high120 Ų12058.5 Ų58.556%0.56134%0.338SS*.PPolyproline II helixtrans-72.6147.4180-64.5-70.9-28.700110.3T78T78-Q80 PolarHBondContact O-N 2.89Å
81G78.1Confident92.7Very high36 Ų3659.8 Ų59.837%0.37134%0.343SS..SBendtrans117.9151.1-178.400000115V84 E85G81-V84 WeakPolarHBondContact O-CG1 3.45Å; G81-E85 WeakPolarHBondContact CA-OE1 3.3Å; G81-E85 PolarHBondContact N-OE1 3.32Å
82G83.3Confident92.7Very high62 Ų6262 Ų6264%0.63936%0.361SS*.THydrogen-bonded Turntrans77.2-154.9173.200000114.2V84 E85G82-V84 PolarHBondContact O-N 2.89Å; G82-E85 PolarHBondContact O-N 3Å
83T89.4Confident92.6Very high92 Ų9264.2 Ų64.256%0.56436%0.364SS*.Hα-helixtrans-73.6-10.7-172.845.60000114.1H40 R86H40-T83 PolarHBondContact CE1-O 3.19Å; H40-T83 PolarHBondContact CE1-OG1 3.39Å; H40-T83 WeakPolarHBondContact NE2-CB 3.4Å; H40-T83 PolarHBondContact NE2-OG1 3.48Å; T83-R86 WeakPolarHBondContact O-CB 3.49Å; T83-R86 PolarHBondContact O-N 2.92Å
84V94.6Very high92.6Very high3 Ų362.7 Ų62.72%0.01835%0.354CS..Hα-helixtrans-74.7-28177.878.70000112.1H40 L43 L44 T78 G81 G82 R86 L87 F88H40-V84 HydrophobicContact CB-CG2 4.29Å; H40-V84 PolarHBondContact NE2-N 3.2Å; L43-V84 HydrophobicContact CD2-CB 3.97Å; L43-V84 HydrophobicContact CD2-CG1 4.16Å; L43-V84 HydrophobicContact CD2-CG2 3.93Å; L44-V84 HydrophobicContact CD2-CG2 4.26Å; T78-V84 HydrophobicContact CG2-CG1 4.28Å; T78-V84 HydrophobicContact CG2-CG2 4.11Å; G81-V84 WeakPolarHBondContact O-CG1 3.45Å; G82-V84 PolarHBondContact O-N 2.89Å; V84-R86 PolarHBondContact O-N 3.45Å; V84-L87 HydrophobicContact CG2-CD2 4.46Å; V84-L87 VanDerWaalsContact O-CB 3.26Å; V84-L87 WeakPolarHBondContact O-CB 3.41Å; V84-L87 PolarHBondContact O-N 3.12Å; V84-F88 HydrophobicContact CG2-CD2 4.29Å; V84-F88 HydrophobicContact CG2-CE2 3.8Å; V84-F88 WeakPolarHBondContact O-CD2 3.39Å; V84-F88 PolarHBondContact O-N 3.18Å
85E94.8Very high92.6Very high94 Ų9464.5 Ų64.544%0.43936%0.36SS..Hα-helixtrans-61.5-35.2173.7-67.8-178175.800111.5G81 G82 L87 F88 K89G81-E85 WeakPolarHBondContact CA-OE1 3.3Å; G81-E85 PolarHBondContact N-OE1 3.32Å; G82-E85 PolarHBondContact O-N 3Å; E85-L87 VanDerWaalsContact C-N 3.29Å; E85-L87 PolarHBondContact O-N 2.99Å; E85-F88 PolarHBondContact O-N 3.46Å; E85-K89 VanDerWaalsContact O-CB 3.31Å; E85-K89 WeakPolarHBondContact O-CB 3.46Å; E85-K89 PolarHBondContact O-N 2.97Å
86R95.4Very high92.6Very high142 Ų14268.5 Ų68.554%0.53638%0.377SS..Hα-helixtrans-64.1-35.5175.3-168176-178.3151.70.3111.6E32 L36 T83 V84 N90E32-R86 IonicContact OE1-CZ 2.96Å; E32-R86 IonicContact OE1-NE 2.92Å; E32-R86 PolarHBondContact OE1-NE 3.47Å; E32-R86 IonicContact OE1-NH2 3.12Å; E32-R86 PolarHBondContact OE1-NH2 3.1Å; L36-R86 HydrophobicContact CD1-CB 4.16Å; L36-R86 HydrophobicContact CD1-CG 3.82Å; T83-R86 WeakPolarHBondContact O-CB 3.49Å; T83-R86 PolarHBondContact O-N 2.92Å; V84-R86 PolarHBondContact O-N 3.45Å; R86-N90 WeakPolarHBondContact O-CB 3.35Å; R86-N90 VanDerWaalsContact O-CG 3.29Å; R86-N90 PolarHBondContact O-N 2.62Å; R86-N90 PolarHBondContact O-OD1 3.24Å
87L96.8Very high92.6Very high2 Ų270 Ų701%0.0137%0.37CS..Hα-helixtrans-61.4-52.9174.6173.462.2000110.7T33 L36 L37 H40 L44 V84 E85 K89 N90 L91T33-L87 HydrophobicContact CG2-CD1 3.83Å; L36-L87 HydrophobicContact CB-CB 4.12Å; L36-L87 HydrophobicContact CB-CD1 3.97Å; L37-L87 HydrophobicContact CB-CD1 4.11Å; L37-L87 HydrophobicContact CD1-CD2 4.35Å; H40-L87 HydrophobicContact CB-CD2 4.43Å; L44-L87 HydrophobicContact CD1-CD2 3.76Å; V84-L87 HydrophobicContact CG2-CD2 4.46Å; V84-L87 VanDerWaalsContact O-CB 3.26Å; V84-L87 WeakPolarHBondContact O-CB 3.41Å; V84-L87 PolarHBondContact O-N 3.12Å; E85-L87 VanDerWaalsContact C-N 3.29Å; E85-L87 PolarHBondContact O-N 2.99Å; L87-K89 PolarHBondContact O-N 3.24Å; L87-N90 PolarHBondContact O-N 3.43Å; L87-L91 HydrophobicContact CD1-CD1 4.11Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.12Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.5Å
88F97.1Very high92.8Very high6 Ų666.9 Ų66.93%0.02636%0.357CS..Hα-helixtrans-66.8-37.6-178.8-67.1-61.2000112.7L44 I71 L74 E75 T78 V84 E85 N90 L91 S92L44-F88 HydrophobicContact CD2-CZ 3.91Å; I71-F88 HydrophobicContact CG2-CD1 4.21Å; I71-F88 HydrophobicContact CG2-CE1 4.46Å; L74-F88 HydrophobicContact CG-CZ 4.45Å; E75-F88 HydrophobicContact CB-CD1 3.74Å; E75-F88 HydrophobicContact CB-CD2 4.41Å; E75-F88 HydrophobicContact CB-CE1 3.66Å; E75-F88 HydrophobicContact CB-CE2 4.33Å; E75-F88 HydrophobicContact CB-CG 4.14Å; E75-F88 HydrophobicContact CB-CZ 3.98Å; E75-F88 HydrophobicContact CG-CB 4.3Å; E75-F88 HydrophobicContact CG-CD1 3.95Å; E75-F88 HydrophobicContact CG-CD2 3.98Å; E75-F88 HydrophobicContact CG-CE1 4.25Å; E75-F88 HydrophobicContact CG-CE2 4.26Å; E75-F88 HydrophobicContact CG-CG 3.82Å; E75-F88 HydrophobicContact CG-CZ 4.4Å; E75-F88 WeakPolarHBondContact OE1-CB 3.46Å; T78-F88 HydrophobicContact CG2-CE2 4Å; T78-F88 HydrophobicContact CG2-CZ 4.4Å; V84-F88 HydrophobicContact CG2-CD2 4.29Å; V84-F88 HydrophobicContact CG2-CE2 3.8Å; V84-F88 WeakPolarHBondContact O-CD2 3.39Å; V84-F88 PolarHBondContact O-N 3.18Å; E85-F88 PolarHBondContact O-N 3.46Å; F88-N90 VanDerWaalsContact C-N 3.35Å; F88-N90 PolarHBondContact O-N 2.76Å; F88-L91 HydrophobicContact CD1-CD1 4.26Å; F88-L91 PolarHBondContact O-N 2.84Å; F88-S92 WeakPolarHBondContact O-CB 3.39Å; F88-S92 PolarHBondContact O-N 3.09Å
89K96.1Very high92.9Very high143 Ų14368.8 Ų68.862%0.62237%0.366SS*.Hα-helixtrans-59.1-45.2172.1-175.7177.7179.5178.60111.8E85 L87 S92 L93E85-K89 VanDerWaalsContact O-CB 3.31Å; E85-K89 WeakPolarHBondContact O-CB 3.46Å; E85-K89 PolarHBondContact O-N 2.97Å; L87-K89 PolarHBondContact O-N 3.24Å; K89-S92 PolarHBondContact O-N 3.31Å; K89-L93 WeakPolarHBondContact O-CG 3.42Å; K89-L93 PolarHBondContact O-N 3.03Å
90N96.6Very high93.5Very high9 Ų966.6 Ų66.65%0.04835%0.351CS..Hα-helixtrans-64.8-42.2178.1-77.212.1000111.7L29 E32 T33 R86 L87 F88 S92 L93 I94L29-N90 HydrophobicContact CD1-CB 4.02Å; L29-N90 VanDerWaalsContact CD1-CG 3.49Å; E32-N90 PolarHBondContact OE2-ND2 2.98Å; T33-N90 HydrophobicContact CG2-CB 4.22Å; T33-N90 VanDerWaalsContact OG1-CB 3.25Å; T33-N90 WeakPolarHBondContact OG1-CB 3.44Å; T33-N90 PolarHBondContact OG1-ND2 3.24Å; R86-N90 WeakPolarHBondContact O-CB 3.35Å; R86-N90 VanDerWaalsContact O-CG 3.29Å; R86-N90 PolarHBondContact O-N 2.62Å; R86-N90 PolarHBondContact O-OD1 3.24Å; L87-N90 PolarHBondContact O-N 3.43Å; F88-N90 VanDerWaalsContact C-N 3.35Å; F88-N90 PolarHBondContact O-N 2.76Å; N90-S92 VanDerWaalsContact C-N 3.32Å; N90-S92 PolarHBondContact O-N 2.61Å; N90-L93 PolarHBondContact O-N 3.31Å; N90-I94 WeakPolarHBondContact O-CG1 3.41Å; N90-I94 PolarHBondContact O-N 3.13Å
91L97.3Very high94.1Very high33 Ų3364.4 Ų64.417%0.17334%0.341CS..Hα-helixtrans-60.8-39.7174.8-70.2168.4000112T33 F68 I71 L87 F88 I94 K95T33-L91 HydrophobicContact CG2-CD2 3.73Å; T33-L91 HydrophobicContact CG2-CG 3.95Å; F68-L91 WeakPolarHBondContact CE1-O 3.4Å; I71-L91 HydrophobicContact CD1-CD1 4.26Å; I71-L91 HydrophobicContact CD1-CD2 4.08Å; I71-L91 HydrophobicContact CG1-CD1 4.4Å; I71-L91 HydrophobicContact CG2-CB 4.35Å; I71-L91 HydrophobicContact CG2-CD1 3.9Å; L87-L91 HydrophobicContact CD1-CD1 4.11Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.12Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.5Å; F88-L91 HydrophobicContact CD1-CD1 4.26Å; F88-L91 PolarHBondContact O-N 2.84Å; L91-I94 PolarHBondContact O-N 2.9Å; L91-K95 PolarHBondContact O-N 3.05Å
92S96.8Very high94.9Very high77 Ų7766.4 Ų66.454%0.53834%0.34SS..Hα-helixtrans-63.7-40.7175-177.50000112.7F88 K89 N90 K95 K96F88-S92 WeakPolarHBondContact O-CB 3.39Å; F88-S92 PolarHBondContact O-N 3.09Å; K89-S92 PolarHBondContact O-N 3.31Å; N90-S92 VanDerWaalsContact C-N 3.32Å; N90-S92 PolarHBondContact O-N 2.61Å; S92-K95 WeakPolarHBondContact O-CB 3.34Å; S92-K95 PolarHBondContact O-N 3.04Å; S92-K96 PolarHBondContact O-N 3Å
93L96.4Very high95.4Very high81 Ų8171.5 Ų71.542%0.42434%0.344SS..Hα-helixtrans-63.7-41.6173.7-69.9173.6000112L29 K89 N90 K96 Y97L29-L93 HydrophobicContact CD1-CD1 4.38Å; L29-L93 HydrophobicContact CD2-CB 3.81Å; L29-L93 HydrophobicContact CD2-CD1 4.42Å; K89-L93 WeakPolarHBondContact O-CG 3.42Å; K89-L93 PolarHBondContact O-N 3.03Å; N90-L93 PolarHBondContact O-N 3.31Å; L93-K96 PolarHBondContact O-N 3.36Å; L93-Y97 PolarHBondContact O-N 2.84Å
94I96.3Very high95.7Very high24 Ų2472.7 Ų72.712%0.12334%0.341CS..Hα-helixtrans-62.6-43.2174.3-66.3165.1000110.4L29 V30 T33 F68 N90 L91 K96 Y97 I98L29-I94 HydrophobicContact CD2-CG1 3.91Å; L29-I94 HydrophobicContact CG-CG1 4.37Å; V30-I94 HydrophobicContact CG2-CD1 3.99Å; V30-I94 HydrophobicContact CG2-CG1 4.35Å; T33-I94 HydrophobicContact CG2-CD1 4.11Å; F68-I94 HydrophobicContact CZ-CG2 4.26Å; N90-I94 WeakPolarHBondContact O-CG1 3.41Å; N90-I94 PolarHBondContact O-N 3.13Å; L91-I94 PolarHBondContact O-N 2.9Å; I94-K96 PolarHBondContact O-N 3.34Å; I94-Y97 WeakPolarHBondContact O-CB 3.43Å; I94-Y97 PolarHBondContact O-N 2.93Å; I94-I98 HydrophobicContact CG2-CD1 3.93Å; I94-I98 WeakPolarHBondContact O-CG1 3.35Å; I94-I98 PolarHBondContact O-N 3.29Å
95K96.4Very high95.7Very high75 Ų7577.8 Ų77.833%0.32638%0.376SS..Hα-helixtrans-56.8-50174.7-169.7-179.2-176.3-64.50111.4F68 L91 S92 Y97 I98 D99F68-K95 HydrophobicContact CB-CD 3.95Å; F68-K95 HydrophobicContact CB-CG 4.41Å; F68-K95 HydrophobicContact CD1-CB 3.73Å; F68-K95 HydrophobicContact CD1-CD 3.83Å; F68-K95 HydrophobicContact CD1-CG 3.82Å; F68-K95 HydrophobicContact CD2-CB 4.25Å; F68-K95 HydrophobicContact CD2-CD 4.26Å; F68-K95 HydrophobicContact CD2-CG 3.78Å; F68-K95 HydrophobicContact CE1-CB 3.47Å; F68-K95 VanDerWaalsContact CE1-CB 3.47Å; F68-K95 HydrophobicContact CE1-CD 4.47Å; F68-K95 HydrophobicContact CE1-CG 4.02Å; F68-K95 HydrophobicContact CE2-CB 4.03Å; F68-K95 HydrophobicContact CE2-CG 3.98Å; F68-K95 HydrophobicContact CG-CB 4.14Å; F68-K95 HydrophobicContact CG-CD 3.74Å; F68-K95 HydrophobicContact CG-CG 3.72Å; F68-K95 HydrophobicContact CZ-CB 3.64Å; F68-K95 HydrophobicContact CZ-CG 4.1Å; L91-K95 PolarHBondContact O-N 3.05Å; S92-K95 WeakPolarHBondContact O-CB 3.34Å; S92-K95 PolarHBondContact O-N 3.04Å; K95-Y97 VanDerWaalsContact C-N 3.25Å; K95-Y97 PolarHBondContact O-N 3.15Å; K95-I98 PolarHBondContact O-N 2.97Å; K95-I98 VanDerWaalsContact O-N 3.09Å; K95-D99 IonicContact NZ-OD1 2.83Å; K95-D99 IonicContact NZ-OD2 2.66Å; K95-D99 PolarHBondContact NZ-OD2 3.29Å; K95-D99 PolarHBondContact O-N 3.42Å
96K95.9Very high95.6Very high158 Ų15876.5 Ų76.569%0.68739%0.388SS*.Hα-helixtrans-59-38.9179.9-173.8-179.7178.8-176.50111.7S92 L93 I94 G100S92-K96 PolarHBondContact O-N 3Å; L93-K96 PolarHBondContact O-N 3.36Å; I94-K96 PolarHBondContact O-N 3.34Å; K96-G100 PolarHBondContact O-N 3.09Å
97Y94.4Very high95.5Very high113 Ų11376.8 Ų76.844%0.44340%0.395SS..Hα-helixtrans-61.8-50173.3171.3-93.2000111.5T26 L93 I94 K95 D99 G100 Q101T26-Y97 HydrophobicContact CG2-CD1 4.19Å; T26-Y97 HydrophobicContact CG2-CE1 4.32Å; T26-Y97 HydrophobicContact CG2-CG 4.32Å; L93-Y97 PolarHBondContact O-N 2.84Å; I94-Y97 WeakPolarHBondContact O-CB 3.43Å; I94-Y97 PolarHBondContact O-N 2.93Å; K95-Y97 VanDerWaalsContact C-N 3.25Å; K95-Y97 PolarHBondContact O-N 3.15Å; Y97-D99 PolarHBondContact O-N 3.02Å; Y97-G100 WeakPolarHBondContact O-CA 3.5Å; Y97-G100 PolarHBondContact O-N 3.2Å; Y97-G100 VanDerWaalsContact O-N 3.13Å; Y97-Q101 HydrophobicContact CD1-CG 4.32Å; Y97-Q101 HydrophobicContact CE1-CG 3.85Å; Y97-Q101 HydrophobicContact CE2-CG 4.3Å; Y97-Q101 VanDerWaalsContact CE2-NE2 3.28Å; Y97-Q101 WeakPolarHBondContact O-CG 3.44Å; Y97-Q101 PolarHBondContact O-N 2.91Å
98I95.5Very high95.5Very high44 Ų4482.2 Ų82.223%0.22642%0.421CS..Hα-helixtrans-60.4-47.3179-69165.4000111.2T64 F68 I94 K95 G100 Q101 K102T64-I98 HydrophobicContact CG2-CG2 4.32Å; F68-I98 HydrophobicContact CE2-CD1 3.68Å; F68-I98 HydrophobicContact CZ-CD1 3.97Å; I94-I98 HydrophobicContact CG2-CD1 3.93Å; I94-I98 WeakPolarHBondContact O-CG1 3.35Å; I94-I98 PolarHBondContact O-N 3.29Å; K95-I98 PolarHBondContact O-N 2.97Å; K95-I98 VanDerWaalsContact O-N 3.09Å; I98-G100 PolarHBondContact O-N 3.4Å; I98-Q101 PolarHBondContact O-N 3.41Å; I98-K102 PolarHBondContact O-N 3.44Å
99D95.9Very high95.5Very high54 Ų5493.4 Ų93.429%0.28946%0.463SS..Hα-helixtrans-59.7-36.5176.4-68.8-18.4000111.2K95 Y97 K103K95-D99 IonicContact NZ-OD1 2.83Å; K95-D99 IonicContact NZ-OD2 2.66Å; K95-D99 PolarHBondContact NZ-OD2 3.29Å; K95-D99 PolarHBondContact O-N 3.42Å; Y97-D99 PolarHBondContact O-N 3.02Å; D99-K103 WeakPolarHBondContact O-CG 3.48Å; D99-K103 PolarHBondContact O-N 2.98Å
100G95.2Very high95.5Very high30 Ų3093.6 Ų93.631%0.30946%0.459SS..Hα-helixtrans-63.8-42.8172.500000112.9K96 Y97 I98 K103K96-G100 PolarHBondContact O-N 3.09Å; Y97-G100 WeakPolarHBondContact O-CA 3.5Å; Y97-G100 PolarHBondContact O-N 3.2Å; Y97-G100 VanDerWaalsContact O-N 3.13Å; I98-G100 PolarHBondContact O-N 3.4Å; G100-K103 PolarHBondContact O-N 2.93Å
101Q94.3Very high95.6Very high75 Ų75102.4 Ų102.435%0.3549%0.492SS..Hα-helixtrans-66.5-41.3176-62.4-56.8-33.300111.7Y97 I98 K103 K104Y97-Q101 HydrophobicContact CD1-CG 4.32Å; Y97-Q101 HydrophobicContact CE1-CG 3.85Å; Y97-Q101 HydrophobicContact CE2-CG 4.3Å; Y97-Q101 VanDerWaalsContact CE2-NE2 3.28Å; Y97-Q101 WeakPolarHBondContact O-CG 3.44Å; Y97-Q101 PolarHBondContact O-N 2.91Å; I98-Q101 PolarHBondContact O-N 3.41Å; Q101-K103 VanDerWaalsContact C-N 3.26Å; Q101-K103 PolarHBondContact O-N 3.35Å; Q101-K104 WeakPolarHBondContact O-CB 3.23Å; Q101-K104 PolarHBondContact O-N 3Å
102K94.5Very high95.6Very high78 Ų78106 Ų10634%0.33952%0.515SS..Hα-helixtrans-56.8-39.1176.2-75-176.1172.7-176.20112.3T64 E65 I98 K104 C105T64-K102 VanDerWaalsContact OG1-CE 3.27Å; T64-K102 WeakPolarHBondContact OG1-CE 3.27Å; T64-K102 PolarHBondContact OG1-NZ 3.48Å; E65-K102 IonicContact OE1-NZ 2.75Å; E65-K102 PolarHBondContact OE1-NZ 3Å; I98-K102 PolarHBondContact O-N 3.44Å; K102-K104 PolarHBondContact O-N 2.87Å; K102-C105 WeakPolarHBondContact O-CB 3.41Å; K102-C105 PolarHBondContact O-N 2.98Å; K102-C105 PolarHBondContact O-SG 3.48Å
103K94.7Very high95.7Very high168 Ų168106.8 Ų106.873%0.7351%0.513SS*.Hα-helixtrans-63-29.4176.7-72175.2-177.5-176.80113.1D99 G100 Q101 C105D99-K103 WeakPolarHBondContact O-CG 3.48Å; D99-K103 PolarHBondContact O-N 2.98Å; G100-K103 PolarHBondContact O-N 2.93Å; Q101-K103 VanDerWaalsContact C-N 3.26Å; Q101-K103 PolarHBondContact O-N 3.35Å; K103-C105 VanDerWaalsContact C-N 3.31Å; K103-C105 PolarHBondContact O-N 3.39Å
104K94.7Very high95.8Very high118 Ų118106.5 Ų106.551%0.51351%0.51SS..Hα-helixtrans-74.5-19.3179.2-61.6-178.8179.2-179.70113.4Q101 K102 G106 E107Q101-K104 WeakPolarHBondContact O-CB 3.23Å; Q101-K104 PolarHBondContact O-N 3Å; K102-K104 PolarHBondContact O-N 2.87Å; K104-G106 PolarHBondContact O-N 3.41Å; K104-E107 PolarHBondContact O-N 3.12Å
105C94.6Very high95.9Very high109 Ų109111.3 Ų111.374%0.73653%0.53SS*.THydrogen-bonded Turntrans-58.3-32.5-177.8-64.60000113.5K102 K103K102-C105 WeakPolarHBondContact O-CB 3.41Å; K102-C105 PolarHBondContact O-N 2.98Å; K102-C105 PolarHBondContact O-SG 3.48Å; K103-C105 VanDerWaalsContact C-N 3.31Å; K103-C105 PolarHBondContact O-N 3.39Å
106G92.8Very high96Very high67 Ų67112.1 Ų112.169%0.69154%0.537SS*.THydrogen-bonded Turntrans-116.38.3179.800000114.4K104K104-G106 PolarHBondContact O-N 3.41Å
107E93.9Very high96.1Very high148 Ų148108.8 Ų108.869%0.69253%0.527SS*.THydrogen-bonded Turntrans-68-36.7-174.2-178.5172.2-15100111.8K104K104-E107 PolarHBondContact O-N 3.12Å
108E95.8Very high96.3Very high117 Ų117111 Ų11155%0.54754%0.536SS..  trans-113.6130.3-175.6-165.8168-160.400112.6R110E108-R110 HydrophobicContact CG-CG 4.26Å; E108-R110 IonicContact OE1-CZ 3.56Å; E108-R110 IonicContact OE1-NE 3.05Å; E108-R110 PolarHBondContact OE1-NE 3.19Å; E108-R110 VanDerWaalsContact OE1-NE 3.12Å; E108-R110 IonicContact OE1-NH1 3.12Å; E108-R110 PolarHBondContact OE1-NH1 3.29Å; E108-R110 VanDerWaalsContact OE1-NH1 3.12Å; E108-R110 IonicContact OE1-NH2 2.95Å; E108-R110 PolarHBondContact OE1-NH2 3.24Å; E108-R110 IonicContact OE2-CZ 2.68Å; E108-R110 IonicContact OE2-NE 2.61Å; E108-R110 PolarHBondContact OE2-NE 3.49Å; E108-R110 IonicContact OE2-NH2 2.76Å; E108-R110 PolarHBondContact OE2-NH2 3.32Å
109R96.9Very high96.4Very high241 Ų241111.8 Ų111.891%0.90954%0.54SS*.  trans-97.5117.4173.4-60.9-177.57799.1-1.3109.3
110R96.9Very high96.6Very high147 Ų147116.3 Ų116.356%0.55556%0.559SS**  trans-109.4170.8-177.8-64.3-63.6-162.8171.71111.8E108 Q114E108-R110 HydrophobicContact CG-CG 4.26Å; E108-R110 IonicContact OE1-CZ 3.56Å; E108-R110 IonicContact OE1-NE 3.05Å; E108-R110 PolarHBondContact OE1-NE 3.19Å; E108-R110 VanDerWaalsContact OE1-NE 3.12Å; E108-R110 IonicContact OE1-NH1 3.12Å; E108-R110 PolarHBondContact OE1-NH1 3.29Å; E108-R110 VanDerWaalsContact OE1-NH1 3.12Å; E108-R110 IonicContact OE1-NH2 2.95Å; E108-R110 PolarHBondContact OE1-NH2 3.24Å; E108-R110 IonicContact OE2-CZ 2.68Å; E108-R110 IonicContact OE2-NE 2.61Å; E108-R110 PolarHBondContact OE2-NE 3.49Å; E108-R110 IonicContact OE2-NH2 2.76Å; E108-R110 PolarHBondContact OE2-NH2 3.32Å; R110-Q114 HydrophobicContact CB-CB 4.05Å
111R98.4Very high96.7Very high194 Ų194121.1 Ų121.173%0.73257%0.574SS**  trans-70.8158.9175-67-176.2-177.3-169.11.4110.8N113 Q114 F115R111-N113 VanDerWaalsContact C-N 3.29Å; R111-N113 WeakPolarHBondContact CB-OD1 3.49Å; R111-N113 PolarHBondContact O-N 2.94Å; R111-Q114 PolarHBondContact O-N 3.26Å; R111-Q114 VanDerWaalsContact O-N 3.15Å; R111-F115 PolarHBondContact O-N 2.99Å; R111-F115 VanDerWaalsContact O-N 3.14Å
112V98.4Very high96.8Very high109 Ų109122 Ų12266%0.66158%0.577SS**Hα-helixtrans-55.8-41.4-177.3176.90000112.2Q114 F115 L116V112-Q114 PolarHBondContact O-N 3.28Å; V112-F115 WeakPolarHBondContact O-CB 3.49Å; V112-F115 PolarHBondContact O-N 3.42Å; V112-L116 HydrophobicContact CG1-CD1 3.94Å; V112-L116 HydrophobicContact CG1-CG 4.1Å; V112-L116 WeakPolarHBondContact O-CG 3.36Å; V112-L116 PolarHBondContact O-N 3.33Å
113N98.4Very high96.8Very high92 Ų92122.9 Ų122.949%0.49259%0.585SS.*Hα-helixtrans-59.6-45.7179.266.2-52.3000112.2R111 F115 L116 D117R111-N113 VanDerWaalsContact C-N 3.29Å; R111-N113 WeakPolarHBondContact CB-OD1 3.49Å; R111-N113 PolarHBondContact O-N 2.94Å; N113-F115 VanDerWaalsContact C-N 3.29Å; N113-F115 PolarHBondContact O-N 2.88Å; N113-L116 PolarHBondContact O-N 3.3Å; N113-L116 VanDerWaalsContact O-N 3.14Å; N113-D117 PolarHBondContact O-N 3.38Å
114Q98.4Very high96.9Very high76 Ų76116.5 Ų116.536%0.35557%0.566SS.*Hα-helixtrans-65.1-35.1178.3-58177.2-79.700112R110 R111 V112 Y118R110-Q114 HydrophobicContact CB-CB 4.05Å; R111-Q114 PolarHBondContact O-N 3.26Å; R111-Q114 VanDerWaalsContact O-N 3.15Å; V112-Q114 PolarHBondContact O-N 3.28Å; Q114-Y118 PolarHBondContact O-N 2.84Å; Q114-Y118 VanDerWaalsContact O-N 3.15Å
115F98.2Very high96.8Very high125 Ų125113.6 Ų113.655%0.54856%0.559SS.*Hα-helixtrans-66.7-42.2173.3172.3-97000111.7R111 V112 N113 D117 Y118 L119R111-F115 PolarHBondContact O-N 2.99Å; R111-F115 VanDerWaalsContact O-N 3.14Å; V112-F115 WeakPolarHBondContact O-CB 3.49Å; V112-F115 PolarHBondContact O-N 3.42Å; N113-F115 VanDerWaalsContact C-N 3.29Å; N113-F115 PolarHBondContact O-N 2.88Å; F115-D117 VanDerWaalsContact C-N 3.35Å; F115-Y118 PolarHBondContact O-N 3.31Å; F115-L119 HydrophobicContact CE1-CD2 4.25Å; F115-L119 WeakPolarHBondContact O-CB 3.47Å; F115-L119 PolarHBondContact O-N 3.15Å
116L98.7Very high96.7Very high91 Ų91110.6 Ų110.648%0.47653%0.534SS..Hα-helixtrans-65.5-38177.2-68.4177.6000111.9V112 N113 L119 Q120V112-L116 HydrophobicContact CG1-CD1 3.94Å; V112-L116 HydrophobicContact CG1-CG 4.1Å; V112-L116 WeakPolarHBondContact O-CG 3.36Å; V112-L116 PolarHBondContact O-N 3.33Å; N113-L116 PolarHBondContact O-N 3.3Å; N113-L116 VanDerWaalsContact O-N 3.14Å; L116-L119 HydrophobicContact CD2-CD2 4.3Å; L116-L119 PolarHBondContact O-N 2.96Å; L116-Q120 WeakPolarHBondContact O-CB 3.37Å; L116-Q120 PolarHBondContact O-N 2.87Å
117D98.6Very high96.5Very high89 Ų89113.7 Ų113.748%0.47654%0.535SS..Hα-helixtrans-58.6-49172.8-62.7-28.3000110.4N113 F115 L119 Q120 E121N113-D117 PolarHBondContact O-N 3.38Å; F115-D117 VanDerWaalsContact C-N 3.35Å; D117-L119 PolarHBondContact O-N 3.06Å; D117-Q120 PolarHBondContact O-N 2.96Å; D117-E121 PolarHBondContact O-N 2.81Å
118Y98.2Very high96.3Very high158 Ų158111.7 Ų111.762%0.6253%0.533SS*.Hα-helixtrans-63.9-38.3176.7-170.7-96000113Q114 F115 Q120 E121 F122Q114-Y118 PolarHBondContact O-N 2.84Å; Q114-Y118 VanDerWaalsContact O-N 3.15Å; F115-Y118 PolarHBondContact O-N 3.31Å; Y118-Q120 VanDerWaalsContact C-N 3.35Å; Y118-E121 PolarHBondContact O-N 3.13Å; Y118-F122 WeakPolarHBondContact O-CB 3.44Å; Y118-F122 PolarHBondContact O-N 2.91Å
119L98.1Very high95.9Very high61 Ų61112.6 Ų112.632%0.31954%0.537SS..Hα-helixtrans-64.6-40.2176177.762.1000111.4F115 L116 D117 F122 L123F115-L119 HydrophobicContact CE1-CD2 4.25Å; F115-L119 WeakPolarHBondContact O-CB 3.47Å; F115-L119 PolarHBondContact O-N 3.15Å; L116-L119 HydrophobicContact CD2-CD2 4.3Å; L116-L119 PolarHBondContact O-N 2.96Å; D117-L119 PolarHBondContact O-N 3.06Å; L119-F122 HydrophobicContact CD1-CD1 4.23Å; L119-F122 PolarHBondContact O-N 3.14Å; L119-L123 HydrophobicContact CD1-CD1 4.3Å; L119-L123 HydrophobicContact CD1-CG 4.27Å; L119-L123 HydrophobicContact CG-CD1 4.16Å; L119-L123 WeakPolarHBondContact O-CG 3.44Å; L119-L123 PolarHBondContact O-N 2.68Å
120Q98.3Very high95.3Very high149 Ų149104.2 Ų104.270%0.69651%0.506SS*.Hα-helixtrans-64.4-42.3176.3-177.7175.8-36.400111.2L116 D117 Y118 L123 G124L116-Q120 WeakPolarHBondContact O-CB 3.37Å; L116-Q120 PolarHBondContact O-N 2.87Å; D117-Q120 PolarHBondContact O-N 2.96Å; Y118-Q120 VanDerWaalsContact C-N 3.35Å; Q120-L123 PolarHBondContact O-N 2.83Å; Q120-G124 PolarHBondContact O-N 3.45Å
121E97.8Very high94.1Very high132 Ų132103.7 Ų103.762%0.61751%0.512SS*.Hα-helixtrans-59.6-46.2173-70.9177.4-17000111.5D117 Y118 G124 V125D117-E121 PolarHBondContact O-N 2.81Å; Y118-E121 PolarHBondContact O-N 3.13Å; E121-G124 PolarHBondContact O-N 3.2Å; E121-V125 WeakPolarHBondContact O-CG2 3.33Å; E121-V125 PolarHBondContact O-N 3.15Å
122F96.1Very high92.5Very high94 Ų9499.6 Ų99.641%0.41250%0.504SS..Hα-helixtrans-58.7-49.8177.4170.1-103.7000112.6Y118 L119 G124 V125 M126Y118-F122 WeakPolarHBondContact O-CB 3.44Å; Y118-F122 PolarHBondContact O-N 2.91Å; L119-F122 HydrophobicContact CD1-CD1 4.23Å; L119-F122 PolarHBondContact O-N 3.14Å; F122-G124 VanDerWaalsContact C-N 3.27Å; F122-G124 PolarHBondContact O-N 3.43Å; F122-V125 PolarHBondContact O-N 3.38Å; F122-M126 HydrophobicContact CD1-SD 4.08Å; F122-M126 HydrophobicContact CE1-CG 4.3Å; F122-M126 HydrophobicContact CE1-SD 3.3Å; F122-M126 WeakPolarHBondContact CE1-SD 3.29Å; F122-M126 HydrophobicContact CE2-CG 4.26Å; F122-M126 HydrophobicContact CE2-SD 4.09Å; F122-M126 HydrophobicContact CZ-CG 4.06Å; F122-M126 HydrophobicContact CZ-SD 3.3Å; F122-M126 WeakPolarHBondContact CZ-SD 3.21Å; F122-M126 WeakPolarHBondContact O-CG 3.45Å; F122-M126 PolarHBondContact O-N 3.26Å
123L96.1Very high90.6Very high95 Ų95103 Ų10350%0.49751%0.513SS..Hα-helixtrans-64-34.2177.2-69.1172.7000111.8L119 Q120 M126 N127L119-L123 HydrophobicContact CD1-CD1 4.3Å; L119-L123 HydrophobicContact CD1-CG 4.27Å; L119-L123 HydrophobicContact CG-CD1 4.16Å; L119-L123 WeakPolarHBondContact O-CG 3.44Å; L119-L123 PolarHBondContact O-N 2.68Å; Q120-L123 PolarHBondContact O-N 2.83Å; L123-M126 HydrophobicContact CD2-SD 4.44Å; L123-M126 PolarHBondContact O-N 3.14Å; L123-N127 WeakPolarHBondContact O-CB 3.48Å; L123-N127 PolarHBondContact O-N 2.96Å
124G95.9Very high88.2Confident34 Ų34107.3 Ų107.335%0.35155%0.55SS.*Hα-helixtrans-59.4-51.3173.300000112Q120 E121 F122 M126 N127 T128Q120-G124 PolarHBondContact O-N 3.45Å; E121-G124 PolarHBondContact O-N 3.2Å; F122-G124 VanDerWaalsContact C-N 3.27Å; F122-G124 PolarHBondContact O-N 3.43Å; G124-M126 VanDerWaalsContact C-N 3.34Å; G124-M126 PolarHBondContact O-N 2.66Å; G124-N127 PolarHBondContact O-N 3.12Å; G124-N127 VanDerWaalsContact O-N 3.15Å; G124-T128 PolarHBondContact O-N 2.71Å; G124-T128 PolarHBondContact O-OG1 2.91Å; G124-T128 VanDerWaalsContact O-OG1 3.09Å
125V93.4Very high87.7Confident58 Ų58108.9 Ų108.935%0.35256%0.56SS.*Hα-helixtrans-59.5-43.8176.5171.50000111.2E121 F122 N127 T128 E129E121-V125 WeakPolarHBondContact O-CG2 3.33Å; E121-V125 PolarHBondContact O-N 3.15Å; F122-V125 PolarHBondContact O-N 3.38Å; V125-N127 VanDerWaalsContact C-N 3.31Å; V125-N127 PolarHBondContact O-N 3.12Å; V125-T128 PolarHBondContact O-N 2.88Å; V125-E129 HydrophobicContact CG1-CB 4.33Å; V125-E129 HydrophobicContact CG1-CG 4.36Å; V125-E129 WeakPolarHBondContact O-CB 3.19Å; V125-E129 PolarHBondContact O-N 2.83Å
126M91.1Very high87.2Confident45 Ų45108 Ų10822%0.22256%0.56CS.*Hα-helixtrans-58.7-44175.6-72.1-175.36800111.7F122 L123 G124 W130F122-M126 HydrophobicContact CD1-SD 4.08Å; F122-M126 HydrophobicContact CE1-CG 4.3Å; F122-M126 HydrophobicContact CE1-SD 3.3Å; F122-M126 WeakPolarHBondContact CE1-SD 3.29Å; F122-M126 HydrophobicContact CE2-CG 4.26Å; F122-M126 HydrophobicContact CE2-SD 4.09Å; F122-M126 HydrophobicContact CZ-CG 4.06Å; F122-M126 HydrophobicContact CZ-SD 3.3Å; F122-M126 WeakPolarHBondContact CZ-SD 3.21Å; F122-M126 WeakPolarHBondContact O-CG 3.45Å; F122-M126 PolarHBondContact O-N 3.26Å; L123-M126 HydrophobicContact CD2-SD 4.44Å; L123-M126 PolarHBondContact O-N 3.14Å; G124-M126 VanDerWaalsContact C-N 3.34Å; G124-M126 PolarHBondContact O-N 2.66Å; M126-W130 HydrophobicContact CB-CD2 4.44Å; M126-W130 HydrophobicContact CE-CE3 3.9Å; M126-W130 HydrophobicContact CE-CZ3 3.8Å; M126-W130 HydrophobicContact CG-CD2 4.02Å; M126-W130 HydrophobicContact CG-CE3 3.95Å; M126-W130 HydrophobicContact CG-CH2 4.2Å; M126-W130 HydrophobicContact CG-CZ2 4.29Å; M126-W130 HydrophobicContact CG-CZ3 4.05Å; M126-W130 VanDerWaalsContact O-CB 3.25Å; M126-W130 WeakPolarHBondContact O-CB 3.38Å; M126-W130 PolarHBondContact O-N 2.83Å; M126-W130 HydrophobicContact SD-CZ3 4.29Å
127N89.6Confident86.5Confident132 Ų132108.9 Ų108.971%0.70657%0.565SS**Hα-helixtrans-69.9-33.3-178.3-177.676.3000113.3L123 G124 V125L123-N127 WeakPolarHBondContact O-CB 3.48Å; L123-N127 PolarHBondContact O-N 2.96Å; G124-N127 PolarHBondContact O-N 3.12Å; G124-N127 VanDerWaalsContact O-N 3.15Å; V125-N127 VanDerWaalsContact C-N 3.31Å; V125-N127 PolarHBondContact O-N 3.12Å
128T89.4Confident85.8Confident106 Ų106110.1 Ų110.165%0.6557%0.57SS**Hα-helixtrans-95-35.2-175.356.30000114G124 V125G124-T128 PolarHBondContact O-N 2.71Å; G124-T128 PolarHBondContact O-OG1 2.91Å; G124-T128 VanDerWaalsContact O-OG1 3.09Å; V125-T128 PolarHBondContact O-N 2.88Å
129E86.4Confident85.1Confident137 Ų137107.1 Ų107.164%0.6457%0.567SS**Hα-helixtrans-106-21.1-172-61.3-177.2-166.600112.8V125V125-E129 HydrophobicContact CG1-CB 4.33Å; V125-E129 HydrophobicContact CG1-CG 4.36Å; V125-E129 WeakPolarHBondContact O-CB 3.19Å; V125-E129 PolarHBondContact O-N 2.83Å
130W84.4Confident84.2Confident64 Ų64110.2 Ų110.224%0.24258%0.584CS.*  trans-95.8117.1-178.7-56.815.7000110.5H59 L62 M126 I132H59-W130 VanDerWaalsContact CE1-CB 3.49Å; H59-W130 WeakPolarHBondContact CE1-CB 3.16Å; H59-W130 AromaticContact CE1-CD1 3.63Å; H59-W130 AromaticContact CE1-CD2 3.94Å; H59-W130 AromaticContact CE1-CG 3.37Å; H59-W130 AromaticContact ND1-CD1 3.58Å; H59-W130 AromaticContact ND1-CD2 3.82Å; H59-W130 AromaticContact ND1-CE2 3.97Å; H59-W130 AromaticContact ND1-CG 3.6Å; H59-W130 AromaticContact ND1-NE1 3.79Å; L62-W130 HydrophobicContact CD1-CH2 3.92Å; L62-W130 HydrophobicContact CD1-CZ3 4.07Å; L62-W130 HydrophobicContact CD2-CH2 3.93Å; L62-W130 HydrophobicContact CD2-CZ2 4.41Å; L62-W130 HydrophobicContact CG-CH2 4.33Å; M126-W130 HydrophobicContact CB-CD2 4.44Å; M126-W130 HydrophobicContact CE-CE3 3.9Å; M126-W130 HydrophobicContact CE-CZ3 3.8Å; M126-W130 HydrophobicContact CG-CD2 4.02Å; M126-W130 HydrophobicContact CG-CE3 3.95Å; M126-W130 HydrophobicContact CG-CH2 4.2Å; M126-W130 HydrophobicContact CG-CZ2 4.29Å; M126-W130 HydrophobicContact CG-CZ3 4.05Å; M126-W130 VanDerWaalsContact O-CB 3.25Å; M126-W130 WeakPolarHBondContact O-CB 3.38Å; M126-W130 PolarHBondContact O-N 2.83Å; M126-W130 HydrophobicContact SD-CZ3 4.29Å; W130-I132 VanDerWaalsContact C-N 3.29Å; W130-I132 HydrophobicContact CB-CG1 4.45Å; W130-I132 PolarHBondContact O-N 3.31Å
131I71.5Confident83.2Confident136 Ų136107.4 Ų107.470%0.69758%0.576SS**  trans-73.593.8167.3-55.5176.4000105.7E133I131-E133 VanDerWaalsContact C-N 3.25Å; I131-E133 HydrophobicContact CG2-CG 3.98Å; I131-E133 PolarHBondContact O-N 2.79Å
132I66.1Low82.1Confident109 Ų109105.5 Ų105.556%0.55957%0.573SS**  trans-75.886.6172-55.1174.8000106.3W130 S134W130-I132 VanDerWaalsContact C-N 3.29Å; W130-I132 HydrophobicContact CB-CG1 4.45Å; W130-I132 PolarHBondContact O-N 3.31Å; I132-S134 PolarHBondContact O-N 3.28Å; I132-S134 VanDerWaalsContact O-N 3.11Å; I132-S134 PolarHBondContact O-OG 3.11Å
133E57.7Low80.9Confident179 Ų179106.5 Ų106.584%0.83659%0.586SS**  trans-63.1112.8164.9-68-173.517500106.9I131I131-E133 VanDerWaalsContact C-N 3.25Å; I131-E133 HydrophobicContact CG2-CG 3.98Å; I131-E133 PolarHBondContact O-N 2.79Å
134S49.3Very low79.5Confident183 Ų183107.5 Ų107.5100%1.2859%0.594SS**  trans-88.80-179.3-50.50000111.1I132I132-S134 PolarHBondContact O-N 3.28Å; I132-S134 VanDerWaalsContact O-N 3.11Å; I132-S134 PolarHBondContact O-OG 3.11Å

Retrieved 134 of 134 residues in 75.1 ms (Link to these results)