A0A077ZE70_TRITR Loading...

RNA polymerase II-associated factor 1 homolog

AlphaFold DB , UniProt , Accession A0A077ZE70, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 373 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
1M44Very low42.3Very low222 Ų222160.9 Ų160.9100%1.09484%0.837SS**  0103.90-66.3-173.1-167.800106.2
2E41.6Very low42.2Very low180 Ų180165.8 Ų165.884%0.84184%0.836SS**  77.8125.7115.2-70.7171.615400111.1
3S44.6Very low42.4Very low109 Ų109166 Ų16676%0.76284%0.841SS**  cis-172.7134.2-0.639.90000104.8
4L40.5Very low42.1Very low167 Ų167162 Ų16287%0.87485%0.846SS**  trans-63.6135165.8-78.7148.9000109.6
5R47.2Very low41.9Very low247 Ų247155.7 Ų155.793%0.93284%0.836SS**  trans-150.7114.2149.3-113.2176.4-165.1-132.23.1112
6N43.1Very low42.2Very low154 Ų154157.8 Ų157.882%0.82484%0.839SS**  trans-56.1155.2169.7-74.1-9.8000112.6
7G41.4Very low42.2Very low73 Ų73158.6 Ų158.675%0.75384%0.844SS**  trans-158.977.4163.200000110.6N9G7-N9 PolarHBondContact O-N 2.73Å
8N39.2Very low42.4Very low155 Ų155154.9 Ų154.983%0.82984%0.839SS**  trans-56.7123.6165.8-87.1-12.2000109.4
9N40.8Very low42.9Very low136 Ų136151.2 Ų151.273%0.72783%0.825SS**  trans-144.7126.2147.6-81.9-44.7000105.2G7G7-N9 PolarHBondContact O-N 2.73Å
10Y43.3Very low43.8Very low233 Ų233154 Ų15491%0.91483%0.833SS**  176.4110123-79-58.7000107.3
11S39.5Very low44.7Very low94 Ų94153.9 Ų153.966%0.65783%0.826SS**  trans-73.1141.4178.3130.30000110.1
12R40.9Very low46Very low219 Ų219151.6 Ų151.683%0.82681%0.811SS**  trans62.7119150.5-64.9170.7-1751721.2116.1
13N45.4Very low47.5Very low169 Ų169149.6 Ų149.690%0.90481%0.811SS**  -154.8123.9117.6-83.7-34.1000108.9
14A37.9Very low49Very low110 Ų110154.1 Ų154.191%0.90981%0.811SS**  trans-81134.3167.900000108
15G39.4Very low50.7Low67 Ų67151 Ų15169%0.69180%0.8SS**  trans150.6112.2169.800000113.6
16E45.7Very low52.3Low189 Ų189144.7 Ų144.788%0.88379%0.789SS**  trans81.190.7146.5-62.3177.8153.800119.3
17N43.3Very low54.1Low173 Ų173146.3 Ų146.393%0.92579%0.789SS**  trans18.699.8130-60.3-17.4000118
18A44.6Very low56Low91 Ų91152.3 Ų152.375%0.75280%0.795SS**  trans-163111.1145.900000110.4
19S53.7Low58.2Low84 Ų84148.3 Ų148.359%0.58779%0.79SS**  trans41.1100.3162.9520000117.6H21S19-H21 VanDerWaalsContact C-N 3.28Å; S19-H21 PolarHBondContact O-CD2 3.08Å; S19-H21 VanDerWaalsContact O-CD2 3.23Å; S19-H21 PolarHBondContact O-N 3.48Å; S19-H21 PolarHBondContact OG-NE2 2.78Å
20E60.2Low60.5Low208 Ų208149 Ų14997%0.97279%0.794SS**  trans-60.288.8163.7-69.8179.9169.600109.9
21H62.3Low62.5Low151 Ų151144.3 Ų144.370%0.69979%0.79SS**  trans-68.1138.8173.1-76.6-80.5000109.8S19 V23S19-H21 VanDerWaalsContact C-N 3.28Å; S19-H21 PolarHBondContact O-CD2 3.08Å; S19-H21 VanDerWaalsContact O-CD2 3.23Å; S19-H21 PolarHBondContact O-N 3.48Å; S19-H21 PolarHBondContact OG-NE2 2.78Å; H21-V23 PolarHBondContact O-N 3.33Å
22F71.5Confident64.7Low175 Ų175147 Ų14777%0.76880%0.796SS**  trans-57.5109.1178.8-168.9-100.6000110.6W24F22-W24 HydrophobicContact CD1-CB 3.99Å; F22-W24 HydrophobicContact CD1-CG 4.11Å; F22-W24 HydrophobicContact CE1-CB 4.03Å; F22-W24 AromaticContact CE1-CD1 3.61Å; F22-W24 AromaticContact CE1-CD2 3.98Å; F22-W24 HydrophobicContact CE1-CD2 3.98Å; F22-W24 AromaticContact CE1-CG 3.65Å; F22-W24 HydrophobicContact CE1-CG 3.65Å; F22-W24 AromaticContact CE1-NE1 3.97Å; F22-W24 PolarHBondContact O-N 3.26Å; F22-W24 VanDerWaalsContact O-N 3.1Å
23V72.4Confident66.9Low138 Ų138142 Ų14284%0.83679%0.792SS**  trans-78.596.4179.2-177.70000108.5H21H21-V23 PolarHBondContact O-N 3.33Å
24W76.7Confident68.9Low204 Ų204141.4 Ų141.477%0.77379%0.789SS**  trans-105.1127171.5-134.419.1000109.9F22 V26F22-W24 HydrophobicContact CD1-CB 3.99Å; F22-W24 HydrophobicContact CD1-CG 4.11Å; F22-W24 HydrophobicContact CE1-CB 4.03Å; F22-W24 AromaticContact CE1-CD1 3.61Å; F22-W24 AromaticContact CE1-CD2 3.98Å; F22-W24 HydrophobicContact CE1-CD2 3.98Å; F22-W24 AromaticContact CE1-CG 3.65Å; F22-W24 HydrophobicContact CE1-CG 3.65Å; F22-W24 AromaticContact CE1-NE1 3.97Å; F22-W24 PolarHBondContact O-N 3.26Å; F22-W24 VanDerWaalsContact O-N 3.1Å; W24-V26 PolarHBondContact O-N 2.73Å
25P76.8Confident71.3Confident100 Ų100142.7 Ų142.765%0.64979%0.785SS**  trans-66.9110.5-18025-30.4000109.6K27P25-K27 PolarHBondContact O-N 2.85Å
26V79.7Confident73.5Confident115 Ų115144.9 Ų144.970%0.69779%0.787SS**  trans-67.7113.3173.7-177.20000108.1W24 F28W24-V26 PolarHBondContact O-N 2.73Å; V26-F28 HydrophobicContact CG1-CD2 4.28Å; V26-F28 HydrophobicContact CG1-CE1 4.29Å; V26-F28 HydrophobicContact CG1-CE2 3.67Å; V26-F28 HydrophobicContact CG1-CZ 3.68Å
27K80.8Confident75.4Confident188 Ų188145.8 Ų145.882%0.81779%0.788SS**  trans-114.2122.2169.6-73.6-175.1178178.60108.7P25P25-K27 PolarHBondContact O-N 2.85Å
28F82.6Confident77.4Confident199 Ų199146.2 Ų146.287%0.87379%0.785SS**  trans-85119.3169.3-61.8-80.6000108.5V26V26-F28 HydrophobicContact CG1-CD2 4.28Å; V26-F28 HydrophobicContact CG1-CE1 4.29Å; V26-F28 HydrophobicContact CG1-CE2 3.67Å; V26-F28 HydrophobicContact CG1-CZ 3.68Å
29G84.8Confident79.4Confident71 Ų71145 Ų14573%0.73278%0.775SS**  trans-104.6140.617600000110.9
30N88.8Confident80.9Confident151 Ų151150.6 Ų150.681%0.80779%0.788SS**  trans-128.858.3171-171.720.9000109.2
31T84.7Confident82Confident135 Ų135149.5 Ų149.583%0.82878%0.781SS**PPolyproline II helixtrans-82.6119.1173.236.90000108.9
32L87.1Confident83Confident149 Ų149149.7 Ų149.778%0.7879%0.786SS**PPolyproline II helixtrans-65.7143.9175-70.7165.7000110.2
33P86.4Confident83.5Confident115 Ų115147.1 Ų147.175%0.74779%0.787SS**PPolyproline II helixtrans-65.6154.2173.628.2-33000110.7
34D88.4Confident83.8Confident157 Ų157146.3 Ų146.384%0.8478%0.777SS**PPolyproline II helixtrans-59.7143.3173.5-74.8-27000110.6
35V86.7Confident83.5Confident137 Ų137142.5 Ų142.583%0.8378%0.778SS**PPolyproline II helixtrans-61.5122.8-177.9-178.60000108.8
36P85.7Confident83Confident112 Ų112146.6 Ų146.673%0.72778%0.781SS**PPolyproline II helixtrans-64.5151.9-179.726.3-33000110.5E38P36-E38 PolarHBondContact O-N 2.74Å
37F85.5Confident82.3Confident209 Ų209145.5 Ų145.592%0.91777%0.771SS**PPolyproline II helixtrans-61.6136.1178.5-72.6-81.9000111.2
38E86Confident81.6Confident181 Ų181143.1 Ų143.185%0.84677%0.766SS**PPolyproline II helixtrans-63.9135.4177.9-164.5166.3-158.900110.6P36 K40P36-E38 PolarHBondContact O-N 2.74Å; E38-K40 PolarHBondContact O-N 3.04Å
39A86.2Confident80.8Confident66 Ų66140.8 Ų140.855%0.54576%0.763SS.*PPolyproline II helixtrans-62.9123.7-179.400000109.9F41A39-F41 HydrophobicContact CB-CE2 4.32Å; A39-F41 HydrophobicContact CB-CZ 4.26Å; A39-F41 WeakPolarHBondContact O-CD2 3.37Å; A39-F41 PolarHBondContact O-N 3.4Å; A39-F41 VanDerWaalsContact O-N 3.13Å
40K84.9Confident79.6Confident201 Ų201147.5 Ų147.587%0.87477%0.766SS**  trans-8195.2174.9-67.1-176.5-178.5177.70109.2E38 L42E38-K40 PolarHBondContact O-N 3.04Å; K40-L42 PolarHBondContact O-N 3.49Å
41F85.1Confident78.2Confident186 Ų186148.8 Ų148.882%0.81676%0.761SS**  trans-66.1120.3172.6-62.6-77.1000110.3A39A39-F41 HydrophobicContact CB-CE2 4.32Å; A39-F41 HydrophobicContact CB-CZ 4.26Å; A39-F41 WeakPolarHBondContact O-CD2 3.37Å; A39-F41 PolarHBondContact O-N 3.4Å; A39-F41 VanDerWaalsContact O-N 3.13Å
42L83Confident77Confident155 Ų155148.2 Ų148.281%0.81276%0.757SS**  trans-77.1124.4173.8-70.3168.2000109K40 I44K40-L42 PolarHBondContact O-N 3.49Å; L42-I44 PolarHBondContact O-N 3.12Å
43P81.8Confident76Confident120 Ų120143.8 Ų143.878%0.77975%0.748SS**  trans-66112.3176.226.1-31.7000108.9P45P43-P45 WeakPolarHBondContact O-CD 3.38Å
44I77.6Confident75.2Confident122 Ų122147.2 Ų147.263%0.62675%0.747SS**  trans-68.2121.9170.9-56173.8000106.5L42 R46L42-I44 PolarHBondContact O-N 3.12Å; I44-R46 HydrophobicContact CB-CG 4.46Å; I44-R46 HydrophobicContact CG2-CG 3.91Å; I44-R46 PolarHBondContact O-N 3.36Å
45P71.4Confident74.4Confident123 Ų123147.2 Ų147.280%0.79974%0.739SS**  trans-72.471.9179.329.4-33.2000110.3P43 N47P43-P45 WeakPolarHBondContact O-CD 3.38Å; P45-N47 PolarHBondContact O-N 3.06Å
46R65.1Low74.1Confident187 Ų187145.4 Ų145.471%0.70672%0.724SS**  trans-81.875.4169.5-70.3-169.5-177.3171.91.8108.3I44 L48I44-R46 HydrophobicContact CB-CG 4.46Å; I44-R46 HydrophobicContact CG2-CG 3.91Å; I44-R46 PolarHBondContact O-N 3.36Å; R46-L48 VanDerWaalsContact C-N 3.32Å; R46-L48 HydrophobicContact CB-CD1 4.4Å; R46-L48 PolarHBondContact O-N 3.25Å
47N66.6Low73.8Confident91 Ų91143.2 Ų143.249%0.48771%0.709SS.*  trans-73.394.5166.3-157.3-26.6000107.1P45 N49 R50P45-N47 PolarHBondContact O-N 3.06Å; N47-N49 PolarHBondContact O-N 3.09Å; N47-N49 VanDerWaalsContact O-N 3.11Å; N47-N49 PolarHBondContact OD1-N 2.83Å; N47-R50 HydrophobicContact CB-CB 3.96Å; N47-R50 WeakPolarHBondContact O-CB 3.3Å; N47-R50 PolarHBondContact O-N 3.13Å
48L65.3Low73.6Confident138 Ų138139.6 Ų139.672%0.72370%0.699SS**G310 helixtrans-57-25.2178-90.284.2000111.6R46 R50R46-L48 VanDerWaalsContact C-N 3.32Å; R46-L48 HydrophobicContact CB-CD1 4.4Å; R46-L48 PolarHBondContact O-N 3.25Å; L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 3.31Å
49N65.1Low73.3Confident151 Ų151137.5 Ų137.581%0.80769%0.693SS**G310 helixtrans-79.1-7175.7-65.5-27.1000114N47N47-N49 PolarHBondContact O-N 3.09Å; N47-N49 VanDerWaalsContact O-N 3.11Å; N47-N49 PolarHBondContact OD1-N 2.83Å
50R60.3Low73.2Confident211 Ų211137 Ų13780%0.79668%0.679SS**G310 helixtrans-82.9-23.2175.3-177.3178.8-90.9-166.4-4.4112N47 L48N47-R50 HydrophobicContact CB-CB 3.96Å; N47-R50 WeakPolarHBondContact O-CB 3.3Å; N47-R50 PolarHBondContact O-N 3.13Å; L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 3.31Å
51Y60.2Low73.2Confident179 Ų179136 Ų13670%0.70267%0.67SS**SBendtrans-80.1131.9166.1-59-75.1000107.8G53Y51-G53 PolarHBondContact O-N 3.03Å
52V58.5Low73.2Confident123 Ų123131.3 Ų131.375%0.74566%0.66SS**  trans-44.8114-175.8179.80000109.2Y54V52-Y54 PolarHBondContact O-N 2.94Å; V52-Y54 VanDerWaalsContact O-N 3.15Å
53G65.7Low73.3Confident56 Ų56130 Ų13058%0.57765%0.648SS**  trans-49.7126.9171.200000107.8Y51 K55Y51-G53 PolarHBondContact O-N 3.03Å; G53-K55 WeakPolarHBondContact O-CG 3.5Å; G53-K55 PolarHBondContact O-N 3.12Å
54Y69.5Low73.5Confident187 Ų187133.1 Ų133.173%0.73365%0.649SS**  trans-45.7114-171.2-174.7-87.2000110.2V52 E60V52-Y54 PolarHBondContact O-N 2.94Å; V52-Y54 VanDerWaalsContact O-N 3.15Å; Y54-E60 PolarHBondContact OH-OE1 2.83Å; Y54-E60 VanDerWaalsContact OH-OE1 3.07Å; Y54-E60 PolarHBondContact OH-OE2 2.64Å
55K71.8Confident73.8Confident156 Ų156135.7 Ų135.768%0.67865%0.652SS**  trans-116129.1175-77.7-179.6-175.7-176.60106.5G53 T57G53-K55 WeakPolarHBondContact O-CG 3.5Å; G53-K55 PolarHBondContact O-N 3.12Å; K55-T57 VanDerWaalsContact O-CG2 3.3Å; K55-T57 WeakPolarHBondContact O-CG2 3.39Å; K55-T57 PolarHBondContact O-N 3.22Å
56I80Confident74.3Confident100 Ų100136.6 Ų136.651%0.51365%0.651SS.*  trans-48.1107.5175.9-64.1170.4000108.5E60 R61I56-E60 HydrophobicContact CG2-CB 4Å; I56-R61 HydrophobicContact CG2-CG 3.98Å
57T79.9Confident74.9Confident65 Ų65134 Ų13440%0.39966%0.655SS.*  trans-78.7164.5-173.857.80000110.2K55 L59 E60 R61K55-T57 VanDerWaalsContact O-CG2 3.3Å; K55-T57 WeakPolarHBondContact O-CG2 3.39Å; K55-T57 PolarHBondContact O-N 3.22Å; T57-L59 PolarHBondContact O-N 3.04Å; T57-L59 WeakPolarHBondContact OG1-CB 3.46Å; T57-L59 PolarHBondContact OG1-N 3.39Å; T57-E60 PolarHBondContact N-OE1 3.45Å; T57-E60 PolarHBondContact O-N 3.21Å; T57-E60 PolarHBondContact OG1-N 3.41Å; T57-E60 PolarHBondContact OG1-OE1 2.84Å; T57-E60 VanDerWaalsContact OG1-OE1 3.08Å; T57-R61 PolarHBondContact O-N 3.4Å; T57-R61 VanDerWaalsContact O-N 3.16Å
58N81Confident75.3Confident134 Ų134137.5 Ų137.572%0.71767%0.672SS**Hα-helixtrans-59.9-25.3169.9-75.5-13.4000111.9R61 S62N58-R61 PolarHBondContact O-N 3.43Å; N58-S62 VanDerWaalsContact O-CB 3.22Å; N58-S62 WeakPolarHBondContact O-CB 3.39Å; N58-S62 PolarHBondContact O-N 3.02Å; N58-S62 PolarHBondContact O-OG 3.02Å
59L79.8Confident75.4Confident136 Ų136135.4 Ų135.471%0.71267%0.665SS**Hα-helixtrans-60.6-49.5175.3-171.867.6000111T57 S62 F63T57-L59 PolarHBondContact O-N 3.04Å; T57-L59 WeakPolarHBondContact OG1-CB 3.46Å; T57-L59 PolarHBondContact OG1-N 3.39Å; L59-S62 WeakPolarHBondContact CA-OG 3.47Å; L59-S62 PolarHBondContact O-N 2.86Å; L59-S62 PolarHBondContact O-OG 2.99Å; L59-F63 PolarHBondContact O-N 3.13Å; L59-F63 VanDerWaalsContact O-N 3.15Å
60E85.3Confident75.8Confident55 Ų55135 Ų13526%0.25766%0.663SS.*Hα-helixtrans-63.1-41.5174.6-72.3158.6-98.700112.3Y54 I56 T57 S62 F63Y54-E60 PolarHBondContact OH-OE1 2.83Å; Y54-E60 VanDerWaalsContact OH-OE1 3.07Å; Y54-E60 PolarHBondContact OH-OE2 2.64Å; I56-E60 HydrophobicContact CG2-CB 4Å; T57-E60 PolarHBondContact N-OE1 3.45Å; T57-E60 PolarHBondContact O-N 3.21Å; T57-E60 PolarHBondContact OG1-N 3.41Å; T57-E60 PolarHBondContact OG1-OE1 2.84Å; T57-E60 VanDerWaalsContact OG1-OE1 3.08Å; E60-S62 VanDerWaalsContact C-N 3.28Å; E60-S62 PolarHBondContact O-N 2.85Å; E60-F63 WeakPolarHBondContact O-CB 3.3Å; E60-F63 PolarHBondContact O-N 3.26Å
61R83.8Confident76.3Confident181 Ų181135 Ų13568%0.68367%0.669SS**Hα-helixtrans-68.1-28178.3-63.9-180-163-109.90113.4I56 T57 N58 F63I56-R61 HydrophobicContact CG2-CG 3.98Å; T57-R61 PolarHBondContact O-N 3.4Å; T57-R61 VanDerWaalsContact O-N 3.16Å; N58-R61 PolarHBondContact O-N 3.43Å; R61-F63 VanDerWaalsContact C-N 3.34Å
62S84.6Confident76.5Confident87 Ų87132.5 Ų132.561%0.60867%0.668SS**Hα-helixtrans-86.3-7.9177.966.20000113.2N58 L59 E60 K64N58-S62 VanDerWaalsContact O-CB 3.22Å; N58-S62 WeakPolarHBondContact O-CB 3.39Å; N58-S62 PolarHBondContact O-N 3.02Å; N58-S62 PolarHBondContact O-OG 3.02Å; L59-S62 WeakPolarHBondContact CA-OG 3.47Å; L59-S62 PolarHBondContact O-N 2.86Å; L59-S62 PolarHBondContact O-OG 2.99Å; E60-S62 VanDerWaalsContact C-N 3.28Å; E60-S62 PolarHBondContact O-N 2.85Å; S62-K64 PolarHBondContact O-N 3.42Å
63F85.6Confident76.7Confident129 Ų129130.9 Ų130.957%0.56666%0.659SS**  trans-69.6119.4178.9-172.4-97.3000109.8L59 E60 R61 Y65L59-F63 PolarHBondContact O-N 3.13Å; L59-F63 VanDerWaalsContact O-N 3.15Å; E60-F63 WeakPolarHBondContact O-CB 3.3Å; E60-F63 PolarHBondContact O-N 3.26Å; R61-F63 VanDerWaalsContact C-N 3.34Å; F63-Y65 AromaticContact CD1-CD1 3.95Å; F63-Y65 HydrophobicContact CD1-CD1 3.95Å; F63-Y65 HydrophobicContact CD1-CD2 4.43Å; F63-Y65 AromaticContact CD1-CE1 3.9Å; F63-Y65 HydrophobicContact CD1-CE1 3.9Å; F63-Y65 HydrophobicContact CD1-CE2 4.39Å; F63-Y65 HydrophobicContact CD1-CG 4.21Å; F63-Y65 AromaticContact CE1-CD1 3.9Å; F63-Y65 HydrophobicContact CE1-CD1 3.9Å; F63-Y65 HydrophobicContact CE1-CE1 4.11Å; F63-Y65 HydrophobicContact CE1-CG 4.4Å; F63-Y65 PolarHBondContact O-N 3.03Å
64K85.9Confident76.6Confident184 Ų184134 Ų13480%0.867%0.669SS**  trans-85.3106.3177.1-171.3-179.1179.2-173.10108.1S62 D66S62-K64 PolarHBondContact O-N 3.42Å; K64-D66 PolarHBondContact O-N 3.3Å
65Y84Confident76.6Confident177 Ų177130 Ų13069%0.69466%0.664SS**  trans-66.4131.9173.3-64.7-83000109.9F63 V67F63-Y65 AromaticContact CD1-CD1 3.95Å; F63-Y65 HydrophobicContact CD1-CD1 3.95Å; F63-Y65 HydrophobicContact CD1-CD2 4.43Å; F63-Y65 AromaticContact CD1-CE1 3.9Å; F63-Y65 HydrophobicContact CD1-CE1 3.9Å; F63-Y65 HydrophobicContact CD1-CE2 4.39Å; F63-Y65 HydrophobicContact CD1-CG 4.21Å; F63-Y65 AromaticContact CE1-CD1 3.9Å; F63-Y65 HydrophobicContact CE1-CD1 3.9Å; F63-Y65 HydrophobicContact CE1-CE1 4.11Å; F63-Y65 HydrophobicContact CE1-CG 4.4Å; F63-Y65 PolarHBondContact O-N 3.03Å; Y65-V67 PolarHBondContact O-N 3Å
66D81.5Confident76.4Confident142 Ų142130.6 Ų130.676%0.75967%0.674SS**  trans-65.2129.8169.2-70.8-26.3000108.9K64 I68K64-D66 PolarHBondContact O-N 3.3Å; D66-I68 PolarHBondContact O-N 3.23Å
67V78.9Confident75.8Confident133 Ų133132 Ų13281%0.80668%0.681SS**  trans-75.493.6176.1-176.40000107.1Y65 T69Y65-V67 PolarHBondContact O-N 3Å; V67-T69 HydrophobicContact CG1-CG2 4.06Å; V67-T69 PolarHBondContact O-N 3.35Å; V67-T69 VanDerWaalsContact O-N 3.13Å
68I75.5Confident75.3Confident164 Ų164132.2 Ų132.284%0.84168%0.68SS**  trans-73.9101.4173.2-55.1172.6000107.3D66D66-I68 PolarHBondContact O-N 3.23Å
69T67.4Low74.7Confident93 Ų93132.5 Ų132.557%0.57168%0.681SS**  trans-89.7159.5165.556.80000109.9V67V67-T69 HydrophobicContact CG1-CG2 4.06Å; V67-T69 PolarHBondContact O-N 3.35Å; V67-T69 VanDerWaalsContact O-N 3.13Å
70D73.2Confident74.2Confident142 Ų142132.4 Ų132.476%0.75969%0.685SS**  trans-53.3152.8167-69.4-37.4000110D72D70-D72 PolarHBondContact O-N 3.47Å
71K69.7Low73.2Confident212 Ų212133.7 Ų133.792%0.92270%0.697SS**SBendtrans-60.5-18.1-175.5-70.5-173.6177.7-178.10113.4
72D64.5Low72.2Confident127 Ų127130.4 Ų130.468%0.67969%0.693SS**SBendtrans-103.4136.4175.1-59.4-46.3000109.2D70D70-D72 PolarHBondContact O-N 3.47Å
73P64.2Low71.1Confident88 Ų88133.5 Ų133.557%0.57170%0.702SS**  trans-56.1140.7174.424.7-32.4000109V75P73-V75 PolarHBondContact O-N 3.41Å
74P62.8Low69.9Low121 Ų121131.3 Ų131.379%0.78670%0.703SS**SBendtrans-64.31.2-179.626-34.6000113.9L76P74-L76 PolarHBondContact O-N 3.36Å
75V69.6Low68.4Low104 Ų104126.4 Ų126.463%0.6369%0.689SS**SBendtrans-87.2101173.9-174.70000108.3P73 I77P73-V75 PolarHBondContact O-N 3.41Å; V75-I77 PolarHBondContact O-N 3.13Å
76L67.3Low67.1Low168 Ų168123.8 Ų123.888%0.8869%0.693SS**  trans-59.9106.5167.8-87.2145000109.2P74 D78P74-L76 PolarHBondContact O-N 3.36Å; L76-D78 VanDerWaalsContact C-N 3.28Å; L76-D78 PolarHBondContact O-N 2.81Å
77I67.2Low65.6Low130 Ų130124.2 Ų124.267%0.66770%0.696SS**  trans-79.582.1172.2-52.2176.1000107.6V75 L79V75-I77 PolarHBondContact O-N 3.13Å; I77-L79 HydrophobicContact CG2-CD2 3.75Å; I77-L79 HydrophobicContact CG2-CG 3.96Å; I77-L79 PolarHBondContact O-N 2.84Å
78D69.6Low64.2Low70 Ų70122.4 Ų122.437%0.37468%0.681SS.*  trans-82.196.6173.5-164.9-20.3000110L76 V80 T81 L82L76-D78 VanDerWaalsContact C-N 3.28Å; L76-D78 PolarHBondContact O-N 2.81Å; D78-V80 WeakPolarHBondContact OD1-CA 3.47Å; D78-V80 VanDerWaalsContact OD1-CB 3.3Å; D78-V80 WeakPolarHBondContact OD1-CB 3.35Å; D78-V80 PolarHBondContact OD1-N 3.4Å; D78-T81 PolarHBondContact OD1-N 3.3Å; D78-T81 PolarHBondContact OD2-OG1 3.16Å; D78-L82 WeakPolarHBondContact O-CD1 3.28Å
79L69.5Low62.8Low140 Ų140124.1 Ų124.173%0.73369%0.686SS**SBendtrans-80.5-5.1174.6-59.9178.5000112.8I77I77-L79 HydrophobicContact CG2-CD2 3.75Å; I77-L79 HydrophobicContact CG2-CG 3.96Å; I77-L79 PolarHBondContact O-N 2.84Å
80V68.8Low61.9Low133 Ų133127.1 Ų127.181%0.80669%0.691SS**SBendtrans-95.2-36.2-172.7-173.80000110.8D78D78-V80 WeakPolarHBondContact OD1-CA 3.47Å; D78-V80 VanDerWaalsContact OD1-CB 3.3Å; D78-V80 WeakPolarHBondContact OD1-CB 3.35Å; D78-V80 PolarHBondContact OD1-N 3.4Å
81T63.9Low60.5Low83 Ų83125.4 Ų125.451%0.50969%0.686SS.*SBendtrans-10318.1179.767.90000114D78 N83D78-T81 PolarHBondContact OD1-N 3.3Å; D78-T81 PolarHBondContact OD2-OG1 3.16Å; T81-N83 PolarHBondContact O-N 3.26Å; T81-N83 PolarHBondContact O-OD1 3.28Å
82L63.6Low59.4Low111 Ų111125 Ų12558%0.58169%0.687SS**  trans-71.178.6-178.4-141.8100.6000110.4D78 S84D78-L82 WeakPolarHBondContact O-CD1 3.28Å; L82-S84 VanDerWaalsContact C-N 3.27Å
83N60Low59.1Low152 Ų152126.5 Ų126.581%0.81369%0.69SS**  trans-85.5-4-179.8-59.4-18.4000112.1T81T81-N83 PolarHBondContact O-N 3.26Å; T81-N83 PolarHBondContact O-OD1 3.28Å
84S60.1Low59.2Low83 Ų83125.9 Ų125.958%0.5870%0.7SS**SBendtrans-91.5111.2175.640.20000109.7L82L82-S84 VanDerWaalsContact C-N 3.27Å
85T55.4Low59.7Low82 Ų82125.2 Ų125.250%0.50369%0.689SS.*  trans-59.7132.7173.241.70000109.9N87 D88T85-N87 PolarHBondContact O-N 3.42Å; T85-D88 PolarHBondContact OG1-OD1 3.15Å
86P55.8Low60.3Low122 Ų122122.8 Ų122.879%0.79268%0.676SS**THydrogen-bonded Turntrans-72.618.8-174.528.1-33.4000114.1
87N49.8Very low61Low150 Ų150121.5 Ų121.580%0.80267%0.671SS**THydrogen-bonded Turntrans-166.128.9-175.6-101.6-24.1000114.6T85 Q89T85-N87 PolarHBondContact O-N 3.42Å; N87-Q89 PolarHBondContact O-N 3.5Å; N87-Q89 VanDerWaalsContact O-N 3.08Å
88D49.4Very low61.7Low95 Ų95120.7 Ų120.751%0.50867%0.666SS.*  trans-67.3113.4173-107.333.8000109.8T85 K90T85-D88 PolarHBondContact OG1-OD1 3.15Å; D88-K90 PolarHBondContact O-N 3.36Å; D88-K90 IonicContact OD2-NZ 3.48Å; D88-K90 PolarHBondContact OD2-NZ 2.9Å
89Q46.7Very low62.4Low200 Ų200121.3 Ų121.394%0.93567%0.669SS**  trans-57.571.4179.1-62.7174-21.100112.5N87N87-Q89 PolarHBondContact O-N 3.5Å; N87-Q89 VanDerWaalsContact O-N 3.08Å
90K49Very low62.9Low156 Ų156117.7 Ų117.768%0.67865%0.653SS**  trans-127.7101.9-178.9-78.7174.9-178.2151.80110.7D88D88-K90 PolarHBondContact O-N 3.36Å; D88-K90 IonicContact OD2-NZ 3.48Å; D88-K90 PolarHBondContact OD2-NZ 2.9Å
91T43.1Very low63.5Low107 Ų107117.8 Ų117.866%0.65665%0.645SS**  trans73.2116.7146.3-27.10000115.6E93T91-E93 HydrophobicContact CG2-CG 3.95Å; T91-E93 PolarHBondContact O-N 3.34Å
92E47.5Very low64.3Low202 Ų202120.3 Ų120.394%0.94465%0.654SS**  trans-60.668.2157.5-62.8-177.3167.900109.5G94E92-G94 PolarHBondContact O-N 2.88Å
93E57.9Low65.1Low159 Ų159121.1 Ų121.174%0.74366%0.659SS**  trans-75.9109162.5-74.2-178.2-176.100105.6T91 I95T91-E93 HydrophobicContact CG2-CG 3.95Å; T91-E93 PolarHBondContact O-N 3.34Å; E93-I95 PolarHBondContact O-N 3.15Å; E93-I95 VanDerWaalsContact O-N 3.12Å
94G66.4Low66Low76 Ų76120.3 Ų120.378%0.78465%0.65SS**PPolyproline II helixtrans-48.2122.2-179.800000110E92 S96E92-G94 PolarHBondContact O-N 2.88Å; G94-S96 PolarHBondContact O-N 3.24Å
95I73.8Confident66.8Low107 Ų107123.2 Ų123.255%0.54966%0.659SS.*PPolyproline II helixtrans-53.7128175.2-59.1167.8000107E93 D97 D99 V100E93-I95 PolarHBondContact O-N 3.15Å; E93-I95 VanDerWaalsContact O-N 3.12Å; I95-D97 PolarHBondContact O-N 2.98Å; I95-D99 HydrophobicContact CG2-CB 3.72Å; I95-V100 HydrophobicContact CB-CG2 3.93Å; I95-V100 HydrophobicContact CG2-CG2 3.54Å
96S81.1Confident67.3Low52 Ų52127.3 Ų127.336%0.36468%0.678SS.*PPolyproline II helixtrans-54.7139.6175.7170.40000109.8G94 I98 D99 V100G94-S96 PolarHBondContact O-N 3.24Å; S96-I98 PolarHBondContact O-N 3.36Å; S96-I98 PolarHBondContact OG-N 3.25Å; S96-D99 WeakPolarHBondContact CB-OD2 2.93Å; S96-D99 WeakPolarHBondContact O-CA 3.4Å; S96-D99 PolarHBondContact O-N 2.88Å; S96-V100 PolarHBondContact O-N 2.96Å
97D83.2Confident67.2Low142 Ų142126.6 Ų126.676%0.75968%0.675SS**Hα-helixtrans-52.3-31.3176.2-66.8-22.5000112.2I95 Q101I95-D97 PolarHBondContact O-N 2.98Å; D97-Q101 WeakPolarHBondContact O-CB 3.4Å; D97-Q101 PolarHBondContact O-N 2.97Å; D97-Q101 VanDerWaalsContact O-N 3.09Å
98I81.8Confident67.3Low112 Ų112122.2 Ų122.257%0.57467%0.665SS**Hα-helixtrans-67.8-41.3176.4-57.6172.2000110.8S96 Q101 L102S96-I98 PolarHBondContact O-N 3.36Å; S96-I98 PolarHBondContact OG-N 3.25Å; I98-Q101 WeakPolarHBondContact O-CB 3.5Å; I98-Q101 PolarHBondContact O-N 3.44Å; I98-L102 WeakPolarHBondContact O-CG 3.11Å; I98-L102 PolarHBondContact O-N 3.05Å; I98-L102 VanDerWaalsContact O-N 3.13Å
99D82.9Confident67.3Low83 Ų83121.5 Ų121.544%0.44466%0.664SS.*Hα-helixtrans-75.3-34.1-179-60.2-29.9000110.9I95 S96 Q101 L102 L103I95-D99 HydrophobicContact CG2-CB 3.72Å; S96-D99 WeakPolarHBondContact CB-OD2 2.93Å; S96-D99 WeakPolarHBondContact O-CA 3.4Å; S96-D99 PolarHBondContact O-N 2.88Å; D99-Q101 VanDerWaalsContact C-N 3.28Å; D99-Q101 PolarHBondContact O-N 3.49Å; D99-L102 PolarHBondContact O-N 3.21Å; D99-L103 VanDerWaalsContact O-CG 3.3Å; D99-L103 WeakPolarHBondContact O-CG 3.18Å; D99-L103 PolarHBondContact O-N 3.32Å; D99-L103 VanDerWaalsContact O-N 3.12Å
100V81.5Confident67.5Low64 Ų64117.9 Ų117.939%0.38865%0.647SS.*Hα-helixtrans-58.3-43.8168.91780000110.3I95 S96 L102 L103 E104I95-V100 HydrophobicContact CB-CG2 3.93Å; I95-V100 HydrophobicContact CG2-CG2 3.54Å; S96-V100 PolarHBondContact O-N 2.96Å; V100-L102 VanDerWaalsContact C-N 3.31Å; V100-L102 PolarHBondContact O-N 2.86Å; V100-L103 PolarHBondContact O-N 2.87Å; V100-E104 PolarHBondContact O-N 2.99Å
101Q80.1Confident67.7Low135 Ų135121.1 Ų121.163%0.63166%0.655SS**Hα-helixtrans-65.6-31.2178.3-171176.66.700113D97 I98 D99D97-Q101 WeakPolarHBondContact O-CB 3.4Å; D97-Q101 PolarHBondContact O-N 2.97Å; D97-Q101 VanDerWaalsContact O-N 3.09Å; I98-Q101 WeakPolarHBondContact O-CB 3.5Å; I98-Q101 PolarHBondContact O-N 3.44Å; D99-Q101 VanDerWaalsContact C-N 3.28Å; D99-Q101 PolarHBondContact O-N 3.49Å
102L81.7Confident68.3Low136 Ų136121.2 Ų121.271%0.71265%0.651SS**Hα-helixtrans-77.8-19.6176.3-68.2172.2000113.5I98 D99 V100I98-L102 WeakPolarHBondContact O-CG 3.11Å; I98-L102 PolarHBondContact O-N 3.05Å; I98-L102 VanDerWaalsContact O-N 3.13Å; D99-L102 PolarHBondContact O-N 3.21Å; V100-L102 VanDerWaalsContact C-N 3.31Å; V100-L102 PolarHBondContact O-N 2.86Å
103L80.5Confident68.7Low128 Ų128118 Ų11867%0.6763%0.63SS**SBendtrans-86.2-10.7175.7-70.5168000112.9D99 V100 D105D99-L103 VanDerWaalsContact O-CG 3.3Å; D99-L103 WeakPolarHBondContact O-CG 3.18Å; D99-L103 PolarHBondContact O-N 3.32Å; D99-L103 VanDerWaalsContact O-N 3.12Å; V100-L103 PolarHBondContact O-N 2.87Å; L103-D105 PolarHBondContact O-N 3.48Å
104E78.7Confident68.8Low135 Ų135117.5 Ų117.563%0.63163%0.626SS**SBendtrans-66.4118172.3-65.4-177.2177.200108.9V100 D106V100-E104 PolarHBondContact O-N 2.99Å; E104-D106 PolarHBondContact O-N 3.08Å
105D76.6Confident68.5Low144 Ų144122.9 Ų122.977%0.7762%0.623SS**  trans-53.9137.8165.9-76.8-30000108.5L103 C107L103-D105 PolarHBondContact O-N 3.48Å; D105-C107 PolarHBondContact O-N 3.23Å
106D66.1Low67.9Low168 Ų168123.9 Ų123.990%0.89862%0.623SS**  trans-62.472.8171.7-91.4-28.2000110.4E104 G108E104-D106 PolarHBondContact O-N 3.08Å; D106-G108 PolarHBondContact O-N 2.78Å
107C52.7Low67.3Low108 Ų108125.7 Ų125.773%0.7363%0.628SS**  trans-74.243.5162.2-68.60000109.3D105 T109D105-C107 PolarHBondContact O-N 3.23Å; C107-T109 PolarHBondContact O-N 2.97Å
108G52.3Low66.6Low57 Ų57125.1 Ų125.159%0.58862%0.621SS**THydrogen-bonded Turntrans-73.762.9-178.800000111.8D106D106-G108 PolarHBondContact O-N 2.78Å
109T50.9Low66.1Low81 Ų81126.9 Ų126.950%0.49763%0.625SS.*THydrogen-bonded Turntrans-149.6-12.9163.156.70000114.8C107 R113C107-T109 PolarHBondContact O-N 2.97Å; T109-R113 WeakPolarHBondContact O-CB 3.22Å; T109-R113 PolarHBondContact O-N 3.1Å; T109-R113 VanDerWaalsContact O-N 3.13Å
110H49.8Very low65.4Low123 Ų123126.4 Ų126.457%0.56962%0.622SS**THydrogen-bonded Turntrans-83-24.5-168.3-129.8-73.3000115.9
111R53.9Low65Low225 Ų225129.4 Ų129.485%0.84963%0.631SS**THydrogen-bonded Turntrans-90-40.3176.2-72.4-175.4-178.51783.1112.5K114 R115R111-K114 PolarHBondContact O-N 3.13Å; R111-R115 PolarHBondContact O-N 3.47Å
112D54.1Low64.6Low109 Ų109126.9 Ų126.958%0.58362%0.622SS**Hα-helixtrans-72.6-31177.2-65.6-47.9000112.7K114 R115 F116D112-K114 VanDerWaalsContact C-N 3.3Å; D112-K114 PolarHBondContact O-N 2.89Å; D112-R115 PolarHBondContact O-N 3.36Å; D112-F116 VanDerWaalsContact O-CB 3.28Å; D112-F116 WeakPolarHBondContact O-CB 3.48Å; D112-F116 PolarHBondContact O-N 3.07Å
113R56.2Low64.1Low134 Ų134124.9 Ų124.951%0.50661%0.611SS.*Hα-helixtrans-63.3-34.2174.2-171.2148.568.7172.44.1112.6T109 N117T109-R113 WeakPolarHBondContact O-CB 3.22Å; T109-R113 PolarHBondContact O-N 3.1Å; T109-R113 VanDerWaalsContact O-N 3.13Å; R113-N117 WeakPolarHBondContact O-CB 3.3Å; R113-N117 PolarHBondContact O-N 3.23Å; R113-N117 PolarHBondContact O-ND2 2.88Å
114K60.2Low63.5Low149 Ų149122.4 Ų122.465%0.64860%0.601SS**Hα-helixtrans-67.7-43.9173.9-71.8-174.5178.6-178.70112.1R111 D112 Q118R111-K114 PolarHBondContact O-N 3.13Å; D112-K114 VanDerWaalsContact C-N 3.3Å; D112-K114 PolarHBondContact O-N 2.89Å; K114-Q118 WeakPolarHBondContact O-CB 3.45Å; K114-Q118 PolarHBondContact O-N 3.45Å
115R60.1Low62.8Low189 Ų189118.5 Ų118.571%0.71359%0.589SS**Hα-helixtrans-67.8-38.5177.1-75.1-176.7173.7-176.6-0.9112.5R111 D112 Q118 K119R111-R115 PolarHBondContact O-N 3.47Å; D112-R115 PolarHBondContact O-N 3.36Å; R115-Q118 PolarHBondContact O-N 2.84Å; R115-K119 PolarHBondContact O-N 2.8Å
116F61.4Low62.3Low128 Ų128117.6 Ų117.656%0.56158%0.58SS**Hα-helixtrans-66.7-45.5175-178.3-102.1000111.5D112 Q118 K119 L120D112-F116 VanDerWaalsContact O-CB 3.28Å; D112-F116 WeakPolarHBondContact O-CB 3.48Å; D112-F116 PolarHBondContact O-N 3.07Å; F116-Q118 VanDerWaalsContact C-N 3.27Å; F116-Q118 PolarHBondContact O-N 3.01Å; F116-K119 PolarHBondContact O-N 3.09Å; F116-L120 HydrophobicContact CD1-CD1 3.86Å; F116-L120 HydrophobicContact CD1-CG 4.23Å; F116-L120 HydrophobicContact CE1-CD1 3.26Å; F116-L120 HydrophobicContact CE1-CG 3.85Å; F116-L120 HydrophobicContact CE2-CG 4.43Å; F116-L120 HydrophobicContact CZ-CD1 3.71Å; F116-L120 HydrophobicContact CZ-CD2 4.2Å; F116-L120 HydrophobicContact CZ-CG 3.95Å; F116-L120 PolarHBondContact O-N 3.27Å
117N67.7Low62.2Low89 Ų89113.9 Ų113.948%0.47656%0.563SS.*Hα-helixtrans-61.5-36.3174.7-76.5-29.1000112.1R113 H121R113-N117 WeakPolarHBondContact O-CB 3.3Å; R113-N117 PolarHBondContact O-N 3.23Å; R113-N117 PolarHBondContact O-ND2 2.88Å; N117-H121 VanDerWaalsContact O-CB 3.29Å; N117-H121 WeakPolarHBondContact O-CB 3.21Å; N117-H121 PolarHBondContact O-N 3.37Å
118Q69.4Low62.8Low130 Ų130112.4 Ų112.461%0.60755%0.548SS*.Hα-helixtrans-68.1-44.7175.5-165.2160.52000111.8K114 R115 F116 L120 H121 D122K114-Q118 WeakPolarHBondContact O-CB 3.45Å; K114-Q118 PolarHBondContact O-N 3.45Å; R115-Q118 PolarHBondContact O-N 2.84Å; F116-Q118 VanDerWaalsContact C-N 3.27Å; F116-Q118 PolarHBondContact O-N 3.01Å; Q118-L120 PolarHBondContact O-N 3.15Å; Q118-H121 WeakPolarHBondContact O-CB 3.47Å; Q118-H121 PolarHBondContact O-N 3.14Å; Q118-D122 VanDerWaalsContact O-CG 3.23Å; Q118-D122 PolarHBondContact O-N 3.37Å
119K72.3Confident63.4Low150 Ų150113 Ų11365%0.65254%0.536SS*.Hα-helixtrans-60.9-41.2172.6-87-174.5174.1-177.30113R115 F116 D122 I123R115-K119 PolarHBondContact O-N 2.8Å; F116-K119 PolarHBondContact O-N 3.09Å; K119-D122 PolarHBondContact O-N 3.48Å; K119-I123 VanDerWaalsContact O-CG1 3.26Å; K119-I123 WeakPolarHBondContact O-CG1 3.46Å; K119-I123 PolarHBondContact O-N 3.21Å
120L68.3Low64.6Low72 Ų72113.9 Ų113.938%0.37753%0.531SS..Hα-helixtrans-64.5-42.1175.1-78-173.7000111.3F116 Q118 D122 I123 V124F116-L120 HydrophobicContact CD1-CD1 3.86Å; F116-L120 HydrophobicContact CD1-CG 4.23Å; F116-L120 HydrophobicContact CE1-CD1 3.26Å; F116-L120 HydrophobicContact CE1-CG 3.85Å; F116-L120 HydrophobicContact CE2-CG 4.43Å; F116-L120 HydrophobicContact CZ-CD1 3.71Å; F116-L120 HydrophobicContact CZ-CD2 4.2Å; F116-L120 HydrophobicContact CZ-CG 3.95Å; F116-L120 PolarHBondContact O-N 3.27Å; Q118-L120 PolarHBondContact O-N 3.15Å; L120-D122 VanDerWaalsContact C-N 3.32Å; L120-D122 PolarHBondContact O-N 3.04Å; L120-I123 PolarHBondContact O-N 2.71Å; L120-V124 VanDerWaalsContact O-CB 3.27Å; L120-V124 WeakPolarHBondContact O-CB 3.26Å; L120-V124 WeakPolarHBondContact O-CG2 3.38Å; L120-V124 PolarHBondContact O-N 3.46Å
121H72.3Confident66Low128 Ų128114.6 Ų114.659%0.59353%0.534SS*.Hα-helixtrans-60.3-42.9174.6-178.2-79.7000111.4N117 Q118 V124 S125N117-H121 VanDerWaalsContact O-CB 3.29Å; N117-H121 WeakPolarHBondContact O-CB 3.21Å; N117-H121 PolarHBondContact O-N 3.37Å; Q118-H121 WeakPolarHBondContact O-CB 3.47Å; Q118-H121 PolarHBondContact O-N 3.14Å; H121-V124 PolarHBondContact O-N 3.27Å; H121-S125 WeakPolarHBondContact O-CB 3.43Å; H121-S125 PolarHBondContact O-N 3.44Å; H121-S125 PolarHBondContact O-OG 3.24Å
122D72.3Confident67.5Low82 Ų82106.5 Ų106.544%0.43951%0.512SS..Hα-helixtrans-62.9-48.7177.1-65.8-17.2000111.1Q118 K119 L120 V124 S125 E126Q118-D122 VanDerWaalsContact O-CG 3.23Å; Q118-D122 PolarHBondContact O-N 3.37Å; K119-D122 PolarHBondContact O-N 3.48Å; L120-D122 VanDerWaalsContact C-N 3.32Å; L120-D122 PolarHBondContact O-N 3.04Å; D122-V124 PolarHBondContact O-N 2.85Å; D122-S125 WeakPolarHBondContact CA-OG 3.49Å; D122-S125 PolarHBondContact O-N 3.4Å; D122-S125 PolarHBondContact O-OG 3.49Å; D122-E126 PolarHBondContact O-N 2.82Å
123I70.8Confident69.1Low93 Ų93109.1 Ų109.148%0.47752%0.518SS..Hα-helixtrans-61.8-46.2177.5-66.6164.6000111.3K119 L120 S125 E126 V127K119-I123 VanDerWaalsContact O-CG1 3.26Å; K119-I123 WeakPolarHBondContact O-CG1 3.46Å; K119-I123 PolarHBondContact O-N 3.21Å; L120-I123 PolarHBondContact O-N 2.71Å; I123-S125 VanDerWaalsContact C-N 3.3Å; I123-S125 PolarHBondContact O-N 3.2Å; I123-E126 PolarHBondContact O-N 2.88Å; I123-V127 WeakPolarHBondContact O-CG2 3.29Å; I123-V127 PolarHBondContact O-N 3.12Å
124V66.9Low70.6Confident76 Ų76110.5 Ų110.546%0.46153%0.53SS..Hα-helixtrans-64.8-37.7178.5171.20000110.6L120 H121 D122 V127 N128L120-V124 VanDerWaalsContact O-CB 3.27Å; L120-V124 WeakPolarHBondContact O-CB 3.26Å; L120-V124 WeakPolarHBondContact O-CG2 3.38Å; L120-V124 PolarHBondContact O-N 3.46Å; H121-V124 PolarHBondContact O-N 3.27Å; D122-V124 PolarHBondContact O-N 2.85Å; V124-V127 PolarHBondContact O-N 2.93Å; V124-N128 WeakPolarHBondContact O-CB 3.4Å; V124-N128 PolarHBondContact O-N 2.99Å; V124-N128 PolarHBondContact O-ND2 3.5Å; V124-N128 PolarHBondContact O-OD1 2.82Å
125S65Low71.9Confident53 Ų53105.1 Ų105.137%0.37151%0.511SS..Hα-helixtrans-66.6-36.9175.974.60000112.6H121 D122 I123 N128 Q129H121-S125 WeakPolarHBondContact O-CB 3.43Å; H121-S125 PolarHBondContact O-N 3.44Å; H121-S125 PolarHBondContact O-OG 3.24Å; D122-S125 WeakPolarHBondContact CA-OG 3.49Å; D122-S125 PolarHBondContact O-N 3.4Å; D122-S125 PolarHBondContact O-OG 3.49Å; I123-S125 VanDerWaalsContact C-N 3.3Å; I123-S125 PolarHBondContact O-N 3.2Å; S125-N128 PolarHBondContact O-N 2.95Å; S125-Q129 PolarHBondContact O-N 3.4Å; S125-Q129 VanDerWaalsContact O-N 3.12Å
126E65.1Low73.2Confident126 Ų126100.3 Ų100.359%0.58950%0.497SS*.Hα-helixtrans-65.8-41.9173.3-76.8-174.2171.600111.7D122 I123 Q129 Y130D122-E126 PolarHBondContact O-N 2.82Å; I123-E126 PolarHBondContact O-N 2.88Å; E126-Q129 WeakPolarHBondContact O-CB 3Å; E126-Q129 PolarHBondContact O-N 3.01Å; E126-Y130 WeakPolarHBondContact O-CD2 3.46Å; E126-Y130 WeakPolarHBondContact O-CE2 3.18Å
127V64Low74.5Confident90 Ų9099 Ų9955%0.54550%0.496SS..Hα-helixtrans-67.2-39.9176.9176.90000111I123 V124 Q129 Y130I123-V127 WeakPolarHBondContact O-CG2 3.29Å; I123-V127 PolarHBondContact O-N 3.12Å; V124-V127 PolarHBondContact O-N 2.93Å; V127-Q129 VanDerWaalsContact C-N 3.25Å; V127-Q129 PolarHBondContact O-N 3.05Å; V127-Y130 PolarHBondContact O-N 2.84Å
128N65.1Low75.5Confident77 Ų7797.4 Ų97.441%0.41250%0.495SS..Hα-helixtrans-63.8-30.1177.1-72-13000112.6V124 S125 Y130 Q131V124-N128 WeakPolarHBondContact O-CB 3.4Å; V124-N128 PolarHBondContact O-N 2.99Å; V124-N128 PolarHBondContact O-ND2 3.5Å; V124-N128 PolarHBondContact O-OD1 2.82Å; S125-N128 PolarHBondContact O-N 2.95Å; N128-Y130 PolarHBondContact O-N 3.48Å; N128-Y130 VanDerWaalsContact O-N 3.12Å; N128-Q131 PolarHBondContact O-N 3.36Å; N128-Q131 PolarHBondContact OD1-NE2 2.69Å
129Q66.5Low76.4Confident70 Ų7091.5 Ų91.533%0.32747%0.468SS..THydrogen-bonded Turntrans-63.8-16.7179.3-162.8-177.3-4.700113.3S125 E126 V127 S135S125-Q129 PolarHBondContact O-N 3.4Å; S125-Q129 VanDerWaalsContact O-N 3.12Å; E126-Q129 WeakPolarHBondContact O-CB 3Å; E126-Q129 PolarHBondContact O-N 3.01Å; V127-Q129 VanDerWaalsContact C-N 3.25Å; V127-Q129 PolarHBondContact O-N 3.05Å; Q129-S135 VanDerWaalsContact O-CB 3.26Å; Q129-S135 WeakPolarHBondContact O-CB 3.35Å; Q129-S135 PolarHBondContact O-OG 2.91Å
130Y76Confident77.1Confident99 Ų9988.6 Ų88.639%0.38846%0.459SS..THydrogen-bonded Turntrans-118.514.5-178.2-54-73.8000113.9E126 V127 N128 Q136 A139E126-Y130 WeakPolarHBondContact O-CD2 3.46Å; E126-Y130 WeakPolarHBondContact O-CE2 3.18Å; V127-Y130 PolarHBondContact O-N 2.84Å; N128-Y130 PolarHBondContact O-N 3.48Å; N128-Y130 VanDerWaalsContact O-N 3.12Å; Y130-Q136 HydrophobicContact CD1-CG 4.36Å; Y130-Q136 WeakPolarHBondContact O-CG 3.35Å; Y130-Q136 PolarHBondContact O-NE2 3.47Å; Y130-A139 HydrophobicContact CD1-CB 4.21Å; Y130-A139 HydrophobicContact CE1-CB 3.58Å
131Q78.7Confident78.1Confident137 Ų13791.7 Ų91.764%0.6447%0.472SS*.SBendtrans-70.9-40.1-177.2-78.2-179.8-3.700114.1N128N128-Q131 PolarHBondContact O-N 3.36Å; N128-Q131 PolarHBondContact OD1-NE2 2.69Å
132S85Confident78.8Confident56 Ų5691 Ų9139%0.39247%0.467SS..SBendtrans-101.9147.7179.274.20000111.4E134 S135 Q136S132-E134 PolarHBondContact O-N 3.11Å; S132-S135 PolarHBondContact O-N 2.94Å; S132-S135 VanDerWaalsContact O-N 3.09Å; S132-S135 VanDerWaalsContact OG-CB 3.24Å; S132-S135 WeakPolarHBondContact OG-CB 3.17Å; S132-S135 PolarHBondContact OG-N 3.08Å; S132-Q136 WeakPolarHBondContact O-CG 3.33Å; S132-Q136 PolarHBondContact O-N 3.43Å
133K87.7Confident79.3Confident164 Ų16493.1 Ų93.171%0.71347%0.472SS*.Hα-helixtrans-52.7-39.2172.4-179.5-178.8176.7-1780111.7Q136 L137K133-Q136 PolarHBondContact O-N 2.88Å; K133-L137 HydrophobicContact CG-CD1 4.38Å; K133-L137 WeakPolarHBondContact O-CG 3.44Å; K133-L137 PolarHBondContact O-N 3.4Å
134E88.9Confident79.9Confident162 Ų16295.3 Ų95.376%0.75748%0.478SS*.Hα-helixtrans-65.6-43.5177.5-67.2177.5175.900112S132 Q136 L137 A138S132-E134 PolarHBondContact O-N 3.11Å; E134-Q136 VanDerWaalsContact C-N 3.33Å; E134-Q136 PolarHBondContact O-N 3.01Å; E134-L137 PolarHBondContact O-N 3.29Å; E134-A138 WeakPolarHBondContact O-CB 3.49Å; E134-A138 PolarHBondContact O-N 3.16Å
135S86.9Confident80.6Confident36 Ų3694.7 Ų94.725%0.25248%0.477SS..Hα-helixtrans-66.9-36177.1-164.60000111.7Q129 S132 A138 A139Q129-S135 VanDerWaalsContact O-CB 3.26Å; Q129-S135 WeakPolarHBondContact O-CB 3.35Å; Q129-S135 PolarHBondContact O-OG 2.91Å; S132-S135 PolarHBondContact O-N 2.94Å; S132-S135 VanDerWaalsContact O-N 3.09Å; S132-S135 VanDerWaalsContact OG-CB 3.24Å; S132-S135 WeakPolarHBondContact OG-CB 3.17Å; S132-S135 PolarHBondContact OG-N 3.08Å; S135-A138 PolarHBondContact O-N 3Å; S135-A139 VanDerWaalsContact O-CB 3.26Å; S135-A139 WeakPolarHBondContact O-CB 3.27Å; S135-A139 PolarHBondContact O-N 3.43Å
136Q87.2Confident81.4Confident88 Ų8896.8 Ų96.841%0.41148%0.481SS..Hα-helixtrans-62.4-47.7171.9-67.9173.414.100111.7Y130 S132 K133 E134 A139 I140Y130-Q136 HydrophobicContact CD1-CG 4.36Å; Y130-Q136 WeakPolarHBondContact O-CG 3.35Å; Y130-Q136 PolarHBondContact O-NE2 3.47Å; S132-Q136 WeakPolarHBondContact O-CG 3.33Å; S132-Q136 PolarHBondContact O-N 3.43Å; K133-Q136 PolarHBondContact O-N 2.88Å; E134-Q136 VanDerWaalsContact C-N 3.33Å; E134-Q136 PolarHBondContact O-N 3.01Å; Q136-A139 PolarHBondContact O-N 3.43Å; Q136-I140 VanDerWaalsContact O-CG1 3.27Å; Q136-I140 WeakPolarHBondContact O-CG1 3.27Å; Q136-I140 PolarHBondContact O-N 3.03Å
137L88.4Confident81.8Confident101 Ų10196 Ų9653%0.52949%0.485SS..Hα-helixtrans-61.7-44.5176.6-71.4173.7000111.7K133 E134 A139 I140 E141K133-L137 HydrophobicContact CG-CD1 4.38Å; K133-L137 WeakPolarHBondContact O-CG 3.44Å; K133-L137 PolarHBondContact O-N 3.4Å; E134-L137 PolarHBondContact O-N 3.29Å; L137-A139 VanDerWaalsContact C-N 3.35Å; L137-A139 PolarHBondContact O-N 2.87Å; L137-I140 PolarHBondContact O-N 2.99Å; L137-E141 PolarHBondContact O-N 3.12Å
138A89.5Confident82.2Confident55 Ų55102 Ų10246%0.45550%0.498SS..Hα-helixtrans-63.2-39.2176.700000112.2E134 S135 E141 K142E134-A138 WeakPolarHBondContact O-CB 3.49Å; E134-A138 PolarHBondContact O-N 3.16Å; S135-A138 PolarHBondContact O-N 3Å; A138-E141 PolarHBondContact O-N 2.85Å; A138-K142 VanDerWaalsContact O-CB 3.27Å; A138-K142 WeakPolarHBondContact O-CB 3.45Å; A138-K142 PolarHBondContact O-N 3.26Å
139A87.7Confident82.4Confident7 Ų7102.1 Ų102.16%0.05851%0.505CS..Hα-helixtrans-67-37.8175.700000112.3Y130 S135 Q136 L137 K143Y130-A139 HydrophobicContact CD1-CB 4.21Å; Y130-A139 HydrophobicContact CE1-CB 3.58Å; S135-A139 VanDerWaalsContact O-CB 3.26Å; S135-A139 WeakPolarHBondContact O-CB 3.27Å; S135-A139 PolarHBondContact O-N 3.43Å; Q136-A139 PolarHBondContact O-N 3.43Å; L137-A139 VanDerWaalsContact C-N 3.35Å; L137-A139 PolarHBondContact O-N 2.87Å; A139-K143 PolarHBondContact O-N 3.33Å
140I86.5Confident82.3Confident89 Ų89103 Ų10346%0.45651%0.511SS..Hα-helixtrans-63.3-48.8173.1-70.3165.8000110.2Q136 L137 K142 K143 F144Q136-I140 VanDerWaalsContact O-CG1 3.27Å; Q136-I140 WeakPolarHBondContact O-CG1 3.27Å; Q136-I140 PolarHBondContact O-N 3.03Å; L137-I140 PolarHBondContact O-N 2.99Å; I140-K142 VanDerWaalsContact C-N 3.32Å; I140-K142 PolarHBondContact O-N 3.33Å; I140-K143 WeakPolarHBondContact O-CB 3.48Å; I140-K143 PolarHBondContact O-N 3.34Å; I140-K143 VanDerWaalsContact O-N 3.16Å; I140-F144 HydrophobicContact CG2-CD2 3.73Å; I140-F144 HydrophobicContact CG2-CE2 3.45Å; I140-F144 VanDerWaalsContact CG2-CE2 3.45Å; I140-F144 WeakPolarHBondContact O-CD2 3.28Å; I140-F144 PolarHBondContact O-N 2.73Å
141E88.9Confident81.8Confident137 Ų137103.1 Ų103.164%0.6452%0.524SS*.Hα-helixtrans-64.4-36.3179.2-170.4169.6-164.300112.4L137 A138 F144 S145L137-E141 PolarHBondContact O-N 3.12Å; A138-E141 PolarHBondContact O-N 2.85Å; E141-F144 PolarHBondContact O-N 3.46Å; E141-S145 WeakPolarHBondContact O-CB 3.48Å; E141-S145 PolarHBondContact O-N 2.68Å; E141-S145 PolarHBondContact O-OG 3.27Å
142K88.2Confident81.4Confident112 Ų112105.6 Ų105.649%0.48753%0.527SS..Hα-helixtrans-60-47.4170.6-178.4-180172.2-175.90111.2A138 I140 F144 S145 E146A138-K142 VanDerWaalsContact O-CB 3.27Å; A138-K142 WeakPolarHBondContact O-CB 3.45Å; A138-K142 PolarHBondContact O-N 3.26Å; I140-K142 VanDerWaalsContact C-N 3.32Å; I140-K142 PolarHBondContact O-N 3.33Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.4Å; K142-S145 WeakPolarHBondContact O-CB 3.35Å; K142-S145 PolarHBondContact O-N 3.27Å; K142-S145 VanDerWaalsContact O-N 3.08Å; K142-E146 WeakPolarHBondContact CE-OE1 3.16Å; K142-E146 HydrophobicContact CG-CG 4.47Å; K142-E146 IonicContact NZ-OE1 2.83Å; K142-E146 WeakPolarHBondContact O-CG 3.44Å; K142-E146 PolarHBondContact O-N 3.11Å
143K83.3Confident81.1Confident128 Ų128109.2 Ų109.256%0.55754%0.536SS*.Hα-helixtrans-58.8-42.4174.9-78.5-173.3177.7179.10111.9A139 I140 S145 E146 V147A139-K143 PolarHBondContact O-N 3.33Å; I140-K143 WeakPolarHBondContact O-CB 3.48Å; I140-K143 PolarHBondContact O-N 3.34Å; I140-K143 VanDerWaalsContact O-N 3.16Å; K143-S145 VanDerWaalsContact C-N 3.3Å; K143-S145 PolarHBondContact O-N 2.86Å; K143-E146 PolarHBondContact O-N 3.19Å; K143-V147 VanDerWaalsContact O-CG2 3.28Å; K143-V147 WeakPolarHBondContact O-CG2 3.26Å; K143-V147 PolarHBondContact O-N 3.24Å
144F82.2Confident80.7Confident138 Ų138105.4 Ų105.461%0.60552%0.521SS*.Hα-helixtrans-63.6-35.5175-78.8-68.2000112.7I140 E141 K142 R148I140-F144 HydrophobicContact CG2-CD2 3.73Å; I140-F144 HydrophobicContact CG2-CE2 3.45Å; I140-F144 VanDerWaalsContact CG2-CE2 3.45Å; I140-F144 WeakPolarHBondContact O-CD2 3.28Å; I140-F144 PolarHBondContact O-N 2.73Å; E141-F144 PolarHBondContact O-N 3.46Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.4Å; F144-R148 WeakPolarHBondContact O-CG 3.3Å; F144-R148 PolarHBondContact O-N 3.48Å
145S81.4Confident80.2Confident63 Ų63103.5 Ų103.544%0.44152%0.522SS..Hα-helixtrans-70.8-41.3176.5-600000112.2E141 K142 K143 V147 R148 S149E141-S145 WeakPolarHBondContact O-CB 3.48Å; E141-S145 PolarHBondContact O-N 2.68Å; E141-S145 PolarHBondContact O-OG 3.27Å; K142-S145 WeakPolarHBondContact O-CB 3.35Å; K142-S145 PolarHBondContact O-N 3.27Å; K142-S145 VanDerWaalsContact O-N 3.08Å; K143-S145 VanDerWaalsContact C-N 3.3Å; K143-S145 PolarHBondContact O-N 2.86Å; S145-V147 VanDerWaalsContact C-N 3.35Å; S145-V147 PolarHBondContact O-N 3Å; S145-R148 WeakPolarHBondContact O-CB 3.23Å; S145-R148 PolarHBondContact O-N 3.4Å; S145-R148 VanDerWaalsContact O-N 3.14Å; S145-S149 PolarHBondContact O-N 3.28Å
146E81.8Confident79.9Confident98 Ų98107.2 Ų107.246%0.45855%0.547SS..Hα-helixtrans-64.1-37.9175.9-73.3174.2177.900112.2K142 K143 R148 S149K142-E146 WeakPolarHBondContact CE-OE1 3.16Å; K142-E146 HydrophobicContact CG-CG 4.47Å; K142-E146 IonicContact NZ-OE1 2.83Å; K142-E146 WeakPolarHBondContact O-CG 3.44Å; K142-E146 PolarHBondContact O-N 3.11Å; K143-E146 PolarHBondContact O-N 3.19Å; E146-R148 PolarHBondContact O-N 3.31Å; E146-S149 WeakPolarHBondContact CA-OG 3.46Å; E146-S149 CarbonylContact O-C 3.52Å; E146-S149 WeakPolarHBondContact O-CA 3.4Å; E146-S149 PolarHBondContact O-N 3.33Å; E146-S149 VanDerWaalsContact O-N 3.09Å; E146-S149 PolarHBondContact O-OG 3.06Å
147V74.2Confident79.4Confident110 Ų110109.4 Ų109.467%0.66756%0.555SS**Hα-helixtrans-64.9-30.2174.9172.10000111.7K143 S145 S149K143-V147 VanDerWaalsContact O-CG2 3.28Å; K143-V147 WeakPolarHBondContact O-CG2 3.26Å; K143-V147 PolarHBondContact O-N 3.24Å; S145-V147 VanDerWaalsContact C-N 3.35Å; S145-V147 PolarHBondContact O-N 3Å; V147-S149 VanDerWaalsContact C-N 3.35Å
148R71.4Confident79Confident215 Ų215108.4 Ų108.481%0.81156%0.561SS**Hα-helixtrans-69-33172.5-68.2175.5-179.7-179.82.2111.9F144 S145 E146 I150F144-R148 WeakPolarHBondContact O-CG 3.3Å; F144-R148 PolarHBondContact O-N 3.48Å; S145-R148 WeakPolarHBondContact O-CB 3.23Å; S145-R148 PolarHBondContact O-N 3.4Å; S145-R148 VanDerWaalsContact O-N 3.14Å; E146-R148 PolarHBondContact O-N 3.31Å; R148-I150 VanDerWaalsContact C-N 3.33Å; R148-I150 PolarHBondContact O-N 2.7Å; R148-I150 VanDerWaalsContact O-N 3.13Å
149S70.6Confident78.5Confident80 Ų80110.5 Ų110.556%0.55957%0.573SS**SBendtrans-83.576.3170.4590000110.6S145 E146 V147 P151S145-S149 PolarHBondContact O-N 3.28Å; E146-S149 WeakPolarHBondContact CA-OG 3.46Å; E146-S149 CarbonylContact O-C 3.52Å; E146-S149 WeakPolarHBondContact O-CA 3.4Å; E146-S149 PolarHBondContact O-N 3.33Å; E146-S149 VanDerWaalsContact O-N 3.09Å; E146-S149 PolarHBondContact O-OG 3.06Å; V147-S149 VanDerWaalsContact C-N 3.35Å; S149-P151 WeakPolarHBondContact O-CD 3.19Å; S149-P151 VanDerWaalsContact O-N 3.1Å
150I63.5Low78.2Confident87 Ų87113.3 Ų113.345%0.44659%0.589SS.*  trans-49.8113.9-176.4-62.5165.1000111.7R148 R152 V165R148-I150 VanDerWaalsContact C-N 3.33Å; R148-I150 PolarHBondContact O-N 2.7Å; R148-I150 VanDerWaalsContact O-N 3.13Å; I150-R152 HydrophobicContact CG2-CG 4.33Å; I150-R152 PolarHBondContact O-N 2.88Å; I150-R152 VanDerWaalsContact O-N 3.1Å; I150-V165 HydrophobicContact CD1-CG2 4.36Å; I150-V165 HydrophobicContact CG2-CG2 3.61Å
151P65.5Low77.8Confident103 Ų103114.6 Ų114.667%0.66959%0.592SS**  trans-71.5107.6168.127.3-29.7000108.6S149 K153S149-P151 WeakPolarHBondContact O-CD 3.19Å; S149-P151 VanDerWaalsContact O-N 3.1Å; P151-K153 PolarHBondContact O-N 3.28Å
152R69.8Low77Confident188 Ų188110.6 Ų110.671%0.70958%0.582SS**  trans-73.8-8.6177.2-71.5-173.3176.3173.9-1113.7I150 F161 A162I150-R152 HydrophobicContact CG2-CG 4.33Å; I150-R152 PolarHBondContact O-N 2.88Å; I150-R152 VanDerWaalsContact O-N 3.1Å; R152-F161 CarbonylContact O-C 3.58Å; R152-F161 WeakPolarHBondContact O-CA 3.47Å; R152-F161 WeakPolarHBondContact O-CB 3.39Å; R152-A162 PolarHBondContact O-N 3.3Å
153K78.9Confident76.3Confident133 Ų133112.4 Ų112.458%0.57860%0.602SS**EExtended strand (participates in β ladder)trans-112141.4-175.5-66-177.8-179.5178.60110.7P151 F161P151-K153 PolarHBondContact O-N 3.28Å; K153-F161 HydrophobicContact CD-CE1 4.13Å; K153-F161 HydrophobicContact CG-CD1 3.81Å; K153-F161 HydrophobicContact CG-CE1 3.59Å
154H79.5Confident75.4Confident84 Ų84114.6 Ų114.639%0.38961%0.614SS.*EExtended strand (participates in β ladder)trans-67.6135.5174-175.2-76.5000110.7C156 K157 V160H154-C156 VanDerWaalsContact C-N 3.33Å; H154-C156 PolarHBondContact ND1-N 3.46Å; H154-C156 VanDerWaalsContact ND1-N 3.15Å; H154-C156 PolarHBondContact O-N 2.91Å; H154-K157 HydrophobicContact CB-CB 4.42Å; H154-K157 PolarHBondContact ND1-N 2.86Å; H154-K157 PolarHBondContact O-N 3.31Å; H154-V160 HydrophobicContact CB-CB 3.63Å; H154-V160 HydrophobicContact CB-CG1 3.9Å; H154-V160 PolarHBondContact N-O 3.25Å
155P78.4Confident74.5Confident121 Ų121112 Ų11279%0.78661%0.61SS**THydrogen-bonded Turntrans-58.8-39.7-172.420.5-32.6000113.5
156C81.5Confident73.5Confident114 Ų114111.9 Ų111.977%0.7762%0.618SS**THydrogen-bonded Turntrans-100.3-4.4-176.9-48.60000114.8H154H154-C156 VanDerWaalsContact C-N 3.33Å; H154-C156 PolarHBondContact ND1-N 3.46Å; H154-C156 VanDerWaalsContact ND1-N 3.15Å; H154-C156 PolarHBondContact O-N 2.91Å
157K76.2Confident72.5Confident134 Ų134109.2 Ų109.258%0.58362%0.617SS**EExtended strand (participates in β ladder)trans-143.596.5-172.3-69.6-174.8-179.11780109.9H154 S159 V160H154-K157 HydrophobicContact CB-CB 4.42Å; H154-K157 PolarHBondContact ND1-N 2.86Å; H154-K157 PolarHBondContact O-N 3.31Å; K157-S159 PolarHBondContact O-N 3.48Å; K157-V160 HydrophobicContact CB-CB 4.4Å; K157-V160 HydrophobicContact CB-CG2 3.96Å; K157-V160 HydrophobicContact CD-CG2 4.34Å; K157-V160 PolarHBondContact O-N 2.87Å
158A79.5Confident71.9Confident80 Ų80110.8 Ų110.866%0.66162%0.62SS**EExtended strand (participates in β ladder)trans-59-20-174.700000114.7
159S80.4Confident71.6Confident100 Ų100107.7 Ų107.770%0.69961%0.613SS**EExtended strand (participates in β ladder)trans-84-10.6178.856.90000114.7K157 F161K157-S159 PolarHBondContact O-N 3.48Å; S159-F161 WeakPolarHBondContact O-CD2 3.2Å; S159-F161 WeakPolarHBondContact O-CE2 3.46Å
160V81.3Confident71.6Confident65 Ų65108.9 Ų108.939%0.39461%0.606SS.*EExtended strand (participates in β ladder)trans-98.5123.2-178178.10000108.9H154 K157H154-V160 HydrophobicContact CB-CB 3.63Å; H154-V160 HydrophobicContact CB-CG1 3.9Å; H154-V160 PolarHBondContact N-O 3.25Å; K157-V160 HydrophobicContact CB-CB 4.4Å; K157-V160 HydrophobicContact CB-CG2 3.96Å; K157-V160 HydrophobicContact CD-CG2 4.34Å; K157-V160 PolarHBondContact O-N 2.87Å
161F78.4Confident72.1Confident117 Ų117109.9 Ų109.951%0.51361%0.612SS.*EExtended strand (participates in β ladder)trans-116.9144-179-60.1-92.7000111.5R152 K153 S159 V163R152-F161 CarbonylContact O-C 3.58Å; R152-F161 WeakPolarHBondContact O-CA 3.47Å; R152-F161 WeakPolarHBondContact O-CB 3.39Å; K153-F161 HydrophobicContact CD-CE1 4.13Å; K153-F161 HydrophobicContact CG-CD1 3.81Å; K153-F161 HydrophobicContact CG-CE1 3.59Å; S159-F161 WeakPolarHBondContact O-CD2 3.2Å; S159-F161 WeakPolarHBondContact O-CE2 3.46Å; F161-V163 PolarHBondContact O-N 2.96Å
162A70.8Confident72.5Confident53 Ų53108.6 Ų108.644%0.43860%0.602SS.*  trans-71.7118.6172.900000109.7R152R152-A162 PolarHBondContact O-N 3.3Å
163V72.7Confident72.9Confident150 Ų150100.7 Ų100.791%0.90957%0.573SS**SBendtrans-80-40.9179.7176.50000111.2F161F161-V163 PolarHBondContact O-N 2.96Å
164E65.9Low73.1Confident173 Ų17395.8 Ų95.881%0.80855%0.553SS**  trans-144.4136180-168176.3176.200109.1
165V62.4Low73.1Confident85 Ų8596 Ų9652%0.51556%0.56SS.*  trans-104.996.7175.9-175.50000107.7I150 G167I150-V165 HydrophobicContact CD1-CG2 4.36Å; I150-V165 HydrophobicContact CG2-CG2 3.61Å; V165-G167 PolarHBondContact O-N 3.09Å
166G60.2Low73.3Confident59 Ų5995.7 Ų95.761%0.60856%0.556SS**  trans-68.5110.8168.800000109.2
167G61.7Low73.5Confident42 Ų4290.9 Ų90.943%0.43352%0.524SS..  trans-60.3146.3173.400000110.7V165 F169 Y170V165-G167 PolarHBondContact O-N 3.09Å; G167-F169 PolarHBondContact O-N 3.04Å; G167-Y170 WeakPolarHBondContact O-CB 3.36Å; G167-Y170 PolarHBondContact O-N 3.48Å
168L62.3Low74Confident143 Ų14385.8 Ų85.875%0.74951%0.505SS*.Hα-helixtrans-51.5-33.4176.5-149.780.8000111.4Y170 L171 T172L168-Y170 VanDerWaalsContact C-N 3.28Å; L168-Y170 PolarHBondContact O-N 2.87Å; L168-L171 PolarHBondContact O-N 3.01Å; L168-L171 VanDerWaalsContact O-N 3.17Å; L168-T172 PolarHBondContact O-N 3.27Å; L168-T172 PolarHBondContact O-OG1 3.43Å
169F64.3Low74.5Confident151 Ų15184.4 Ų84.466%0.66249%0.486SS*.Hα-helixtrans-55.7-38.3175.3-167.3-96.2000113.5G167 F173G167-F169 PolarHBondContact O-N 3.04Å; F169-F173 WeakPolarHBondContact O-CB 3.24Å; F169-F173 PolarHBondContact O-N 2.57Å
170Y71.4Confident75Confident105 Ų10583.5 Ų83.541%0.41248%0.479SS..Hα-helixtrans-68.4-43.7178.2-175.7-104.5000111.3G167 L168 F173 L174 L202G167-Y170 WeakPolarHBondContact O-CB 3.36Å; G167-Y170 PolarHBondContact O-N 3.48Å; L168-Y170 VanDerWaalsContact C-N 3.28Å; L168-Y170 PolarHBondContact O-N 2.87Å; Y170-F173 PolarHBondContact O-N 2.82Å; Y170-L174 HydrophobicContact CD1-CD1 3.72Å; Y170-L174 HydrophobicContact CD1-CG 4.28Å; Y170-L174 HydrophobicContact CE1-CD1 3.25Å; Y170-L174 HydrophobicContact CE1-CG 3.94Å; Y170-L174 WeakPolarHBondContact O-CB 3.26Å; Y170-L174 WeakPolarHBondContact O-CG 3.47Å; Y170-L174 PolarHBondContact O-N 2.83Å; Y170-L202 HydrophobicContact CE2-CD2 3.71Å
171L72.8Confident75.3Confident107 Ų10787 Ų8756%0.5649%0.486SS*.Hα-helixtrans-65.7-45.8177.4-174.966.1000111.3L168 F173 L174 V175L168-L171 PolarHBondContact O-N 3.01Å; L168-L171 VanDerWaalsContact O-N 3.17Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.47Å; L171-L174 PolarHBondContact O-N 3.38Å; L171-V175 VanDerWaalsContact O-CG2 3.29Å; L171-V175 WeakPolarHBondContact O-CG2 3.26Å; L171-V175 PolarHBondContact O-N 3.23Å
172T73.5Confident75.8Confident76 Ų7684.3 Ų84.347%0.46649%0.49SS..Hα-helixtrans-58.1-46.8174.6-54.30000110.5L168 L174 V175 T176L168-T172 PolarHBondContact O-N 3.27Å; L168-T172 PolarHBondContact O-OG1 3.43Å; T172-L174 PolarHBondContact O-N 3.29Å; T172-V175 PolarHBondContact O-N 3.03Å; T172-T176 WeakPolarHBondContact O-CB 3.28Å; T172-T176 PolarHBondContact O-N 3.45Å; T172-T176 PolarHBondContact O-OG1 2.96Å
173F79Confident76.6Confident23 Ų2384.2 Ų84.210%0.10148%0.481CS..Hα-helixtrans-63.2-41.5179.4-174-104.5000112.7F169 Y170 L171 S177 L202 I205 K206F169-F173 WeakPolarHBondContact O-CB 3.24Å; F169-F173 PolarHBondContact O-N 2.57Å; Y170-F173 PolarHBondContact O-N 2.82Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.47Å; F173-S177 WeakPolarHBondContact O-CB 3.1Å; F173-S177 PolarHBondContact O-N 2.93Å; F173-S177 PolarHBondContact O-OG 2.95Å; F173-L202 HydrophobicContact CD1-CD1 3.68Å; F173-L202 HydrophobicContact CD1-CG 4.31Å; F173-L202 HydrophobicContact CE1-CD1 3.45Å; F173-L202 VanDerWaalsContact CE1-CD1 3.45Å; F173-L202 HydrophobicContact CE1-CG 3.95Å; F173-I205 HydrophobicContact CE2-CG2 4.37Å; F173-I205 HydrophobicContact CZ-CB 4.24Å; F173-I205 HydrophobicContact CZ-CG2 3.73Å; F173-K206 HydrophobicContact CE1-CB 3.81Å; F173-K206 HydrophobicContact CE1-CG 4.32Å; F173-K206 VanDerWaalsContact CZ-CA 3.48Å; F173-K206 HydrophobicContact CZ-CB 3.73Å; F173-K206 HydrophobicContact CZ-CG 4.27Å
174L82.1Confident77.2Confident30 Ų3082.5 Ų82.516%0.15747%0.465CS..Hα-helixtrans-60.8-47.9174-81.4177.1000111.8Y170 L171 T172 S177 S178 L202Y170-L174 HydrophobicContact CD1-CD1 3.72Å; Y170-L174 HydrophobicContact CD1-CG 4.28Å; Y170-L174 HydrophobicContact CE1-CD1 3.25Å; Y170-L174 HydrophobicContact CE1-CG 3.94Å; Y170-L174 WeakPolarHBondContact O-CB 3.26Å; Y170-L174 WeakPolarHBondContact O-CG 3.47Å; Y170-L174 PolarHBondContact O-N 2.83Å; L171-L174 PolarHBondContact O-N 3.38Å; T172-L174 PolarHBondContact O-N 3.29Å; L174-S177 PolarHBondContact O-N 2.83Å; L174-S178 WeakPolarHBondContact O-CB 3.35Å; L174-S178 PolarHBondContact O-N 2.87Å; L174-L202 HydrophobicContact CD2-CD1 3.74Å; L174-L202 HydrophobicContact CD2-CD2 3.64Å; L174-L202 HydrophobicContact CD2-CG 4.35Å
175V80.8Confident77.9Confident89 Ų8976.3 Ų76.354%0.53944%0.438SS..Hα-helixtrans-64.8-46.7-179.4173.20000110.5L171 T172 S177 S178L171-V175 VanDerWaalsContact O-CG2 3.29Å; L171-V175 WeakPolarHBondContact O-CG2 3.26Å; L171-V175 PolarHBondContact O-N 3.23Å; T172-V175 PolarHBondContact O-N 3.03Å; V175-S177 VanDerWaalsContact C-N 3.27Å; V175-S177 PolarHBondContact O-N 2.82Å; V175-S178 WeakPolarHBondContact O-CB 3.27Å; V175-S178 PolarHBondContact O-N 3.12Å; V175-S178 PolarHBondContact O-OG 2.87Å
176T81.9Confident79.1Confident113 Ų11381.3 Ų81.369%0.69346%0.455SS*.Hα-helixtrans-66-29.4177.9-55.30000112.7T172T172-T176 WeakPolarHBondContact O-CB 3.28Å; T172-T176 PolarHBondContact O-N 3.45Å; T172-T176 PolarHBondContact O-OG1 2.96Å
177S85.1Confident80.2Confident14 Ų1484.1 Ų84.110%0.09846%0.457CS..Hα-helixtrans-87.8-7.5177.1-54.20000113.5F173 L174 V175 Y224F173-S177 WeakPolarHBondContact O-CB 3.1Å; F173-S177 PolarHBondContact O-N 2.93Å; F173-S177 PolarHBondContact O-OG 2.95Å; L174-S177 PolarHBondContact O-N 2.83Å; V175-S177 VanDerWaalsContact C-N 3.27Å; V175-S177 PolarHBondContact O-N 2.82Å; S177-Y224 VanDerWaalsContact O-CE1 3.23Å; S177-Y224 WeakPolarHBondContact O-CE1 3.41Å; S177-Y224 PolarHBondContact O-OH 2.86Å
178S88.5Confident81.1Confident27 Ų2788.3 Ų88.319%0.18947%0.469CS..  trans-77.1158.8179.575.90000112L174 V175 L195L174-S178 WeakPolarHBondContact O-CB 3.35Å; L174-S178 PolarHBondContact O-N 2.87Å; V175-S178 WeakPolarHBondContact O-CB 3.27Å; V175-S178 PolarHBondContact O-N 3.12Å; V175-S178 PolarHBondContact O-OG 2.87Å; S178-L195 WeakPolarHBondContact CA-O 3.44Å
179I89.7Confident82.1Confident50 Ų5086.7 Ų86.726%0.25646%0.458SS..EExtended strand (participates in β ladder)trans-118.5128.8176.1-64.6167.4000108.3L195 Y224 V285I179-L195 HydrophobicContact CB-CB 4.32Å; I179-L195 HydrophobicContact CG2-CD1 4.46Å; I179-L195 PolarHBondContact N-O 3.11Å; I179-L195 PolarHBondContact O-N 2.96Å; I179-Y224 HydrophobicContact CB-CE1 4.48Å; I179-Y224 HydrophobicContact CD1-CD1 3.88Å; I179-Y224 HydrophobicContact CD1-CD2 4.26Å; I179-Y224 HydrophobicContact CD1-CE1 3.57Å; I179-Y224 HydrophobicContact CD1-CE2 3.99Å; I179-Y224 HydrophobicContact CD1-CG 4.22Å; I179-Y224 HydrophobicContact CG1-CD1 4.26Å; I179-Y224 HydrophobicContact CG1-CE1 3.78Å; I179-V285 HydrophobicContact CD1-CB 4.25Å; I179-V285 HydrophobicContact CD1-CG1 3.9Å; I179-V285 HydrophobicContact CD1-CG2 3.66Å
180S89.3Confident83.1Confident81 Ų8184.2 Ų84.257%0.56645%0.448SS*.EExtended strand (participates in β ladder)trans-96.9130.3168.748.10000109.7A193S180-A193 WeakPolarHBondContact CA-O 3.39Å
181R89.3Confident83.9Confident140 Ų14079.8 Ų79.853%0.52843%0.431SS..EExtended strand (participates in β ladder)trans-129.3128.4176.1-171.1175.4-179.894.20.1110.3V192 A193 L195R181-V192 WeakPolarHBondContact O-CA 3.46Å; R181-A193 PolarHBondContact N-O 3.5Å; R181-A193 PolarHBondContact O-N 2.89Å; R181-L195 HydrophobicContact CB-CD1 4.46Å
182G89.3Confident84.8Confident59 Ų5975.8 Ų75.861%0.60841%0.411SS*.EExtended strand (participates in β ladder)trans-72.2133.9168.600000110.6
183M86.6Confident85.5Confident51 Ų5172.2 Ų72.225%0.25139%0.389SS..EExtended strand (participates in β ladder)trans-135.6158.5179.2-65.1178.76900109Q190 F191 A193 L278 L281M183-Q190 WeakPolarHBondContact O-CA 3.41Å; M183-F191 HydrophobicContact CB-CD1 4.24Å; M183-F191 HydrophobicContact CB-CD2 4.05Å; M183-F191 HydrophobicContact CB-CE1 3.75Å; M183-F191 HydrophobicContact CB-CE2 3.55Å; M183-F191 HydrophobicContact CB-CG 4.39Å; M183-F191 HydrophobicContact CB-CZ 3.38Å; M183-F191 HydrophobicContact CE-CE2 4.26Å; M183-F191 HydrophobicContact CE-CZ 3.96Å; M183-F191 HydrophobicContact CG-CE2 4.17Å; M183-F191 HydrophobicContact CG-CZ 4.27Å; M183-F191 PolarHBondContact N-O 2.78Å; M183-F191 PolarHBondContact O-N 3.17Å; M183-F191 VanDerWaalsContact O-O 3.12Å; M183-F191 HydrophobicContact SD-CE2 3.77Å; M183-F191 HydrophobicContact SD-CZ 4.05Å; M183-A193 HydrophobicContact CG-CB 4.48Å; M183-A193 HydrophobicContact SD-CB 3.6Å; M183-A193 VanDerWaalsContact SD-CB 3.6Å; M183-L278 HydrophobicContact CE-CD2 3.72Å; M183-L281 HydrophobicContact CE-CD2 4.41Å; M183-L281 HydrophobicContact SD-CD2 4.47Å
184M85.2Confident86.1Confident114 Ų11474.3 Ų74.356%0.56240%0.397SS*.EExtended strand (participates in β ladder)trans-122.5137.4173.1-75.5169.8161.400108.1E189 Q190M184-E189 WeakPolarHBondContact CA-O 3.29Å; M184-Q190 HydrophobicContact CE-CG 3.46Å; M184-Q190 VanDerWaalsContact CE-CG 3.46Å; M184-Q190 HydrophobicContact CG-CG 3.75Å; M184-Q190 HydrophobicContact SD-CG 4.47Å
185D81.7Confident86.6Confident44 Ų4473.2 Ų73.224%0.23539%0.391CS..  trans-83.6-179.4173.8740000111.8N187 N188 E189 F191D185-N187 PolarHBondContact O-N 3.38Å; D185-N187 VanDerWaalsContact O-N 3.17Å; D185-N187 WeakPolarHBondContact OD1-CA 3.44Å; D185-N187 WeakPolarHBondContact OD1-CB 3.45Å; D185-N187 PolarHBondContact OD1-N 3.45Å; D185-N188 PolarHBondContact O-N 3.32Å; D185-N188 VanDerWaalsContact O-N 3.12Å; D185-N188 PolarHBondContact OD1-N 3Å; D185-N188 VanDerWaalsContact OD1-N 3.11Å; D185-E189 PolarHBondContact N-O 3.46Å; D185-E189 WeakPolarHBondContact OD1-CA 3.38Å; D185-E189 WeakPolarHBondContact OD1-CB 3.43Å; D185-E189 PolarHBondContact OD1-N 2.86Å; D185-F191 HydrophobicContact CB-CD1 4.42Å; D185-F191 HydrophobicContact CB-CE1 4.01Å
186E85.7Confident87.1Confident189 Ų18971.8 Ų71.888%0.88338%0.38SS*.THydrogen-bonded Turntrans-63-17.8177.9-62.9178.3173.200113
187N84.9Confident87.5Confident119 Ų11966.9 Ų66.964%0.63635%0.35SS*.THydrogen-bonded Turntrans-94.55.4179.1-58.1-27.3000112.6D185 E189D185-N187 PolarHBondContact O-N 3.38Å; D185-N187 VanDerWaalsContact O-N 3.17Å; D185-N187 WeakPolarHBondContact OD1-CA 3.44Å; D185-N187 WeakPolarHBondContact OD1-CB 3.45Å; D185-N187 PolarHBondContact OD1-N 3.45Å; N187-E189 HydrophobicContact CB-CG 4.31Å; N187-E189 PolarHBondContact O-N 2.94Å
188N80.7Confident87.8Confident130 Ų13067 Ų6770%0.69535%0.35SS*.  trans6318.8-170.8-57-50.4000114.6D185D185-N188 PolarHBondContact O-N 3.32Å; D185-N188 VanDerWaalsContact O-N 3.12Å; D185-N188 PolarHBondContact OD1-N 3Å; D185-N188 VanDerWaalsContact OD1-N 3.11Å
189E82.9Confident87.8Confident109 Ų10971.2 Ų71.251%0.50937%0.371SS..  trans-76.8125.5170.1-61.3-167.9161.900109.8M184 D185 N187M184-E189 WeakPolarHBondContact CA-O 3.29Å; D185-E189 PolarHBondContact N-O 3.46Å; D185-E189 WeakPolarHBondContact OD1-CA 3.38Å; D185-E189 WeakPolarHBondContact OD1-CB 3.43Å; D185-E189 PolarHBondContact OD1-N 2.86Å; N187-E189 HydrophobicContact CB-CG 4.31Å; N187-E189 PolarHBondContact O-N 2.94Å
190Q85.7Confident87.7Confident98 Ų9873.1 Ų73.146%0.45838%0.382SS..EExtended strand (participates in β ladder)trans-82.7131.7178.7-64.3178.716.400110.7M183 M184M183-Q190 WeakPolarHBondContact O-CA 3.41Å; M184-Q190 HydrophobicContact CE-CG 3.46Å; M184-Q190 VanDerWaalsContact CE-CG 3.46Å; M184-Q190 HydrophobicContact CG-CG 3.75Å; M184-Q190 HydrophobicContact SD-CG 4.47Å
191F87.4Confident87.6Confident12 Ų1269.3 Ų69.35%0.05336%0.355CS..EExtended strand (participates in β ladder)trans-136.9156.9175.166.6-87.5000111.5M183 D185 A193 Q229 Y230 L278M183-F191 HydrophobicContact CB-CD1 4.24Å; M183-F191 HydrophobicContact CB-CD2 4.05Å; M183-F191 HydrophobicContact CB-CE1 3.75Å; M183-F191 HydrophobicContact CB-CE2 3.55Å; M183-F191 HydrophobicContact CB-CG 4.39Å; M183-F191 HydrophobicContact CB-CZ 3.38Å; M183-F191 HydrophobicContact CE-CE2 4.26Å; M183-F191 HydrophobicContact CE-CZ 3.96Å; M183-F191 HydrophobicContact CG-CE2 4.17Å; M183-F191 HydrophobicContact CG-CZ 4.27Å; M183-F191 PolarHBondContact N-O 2.78Å; M183-F191 PolarHBondContact O-N 3.17Å; M183-F191 VanDerWaalsContact O-O 3.12Å; M183-F191 HydrophobicContact SD-CE2 3.77Å; M183-F191 HydrophobicContact SD-CZ 4.05Å; D185-F191 HydrophobicContact CB-CD1 4.42Å; D185-F191 HydrophobicContact CB-CE1 4.01Å; F191-A193 HydrophobicContact CE2-CB 4.49Å; F191-Q229 HydrophobicContact CD2-CB 4.01Å; F191-Q229 HydrophobicContact CE2-CB 4.47Å; F191-Y230 WeakPolarHBondContact CA-O 3.26Å; F191-L278 HydrophobicContact CE2-CD1 4.14Å; F191-L278 HydrophobicContact CZ-CD1 3.94Å
192V90.8Very high87.5Confident24 Ų2463 Ų6315%0.14533%0.332CS..EExtended strand (participates in β ladder)trans-104.6122.7174.8178.30000109.1R181 Y194 Q229 Y230 W232R181-V192 WeakPolarHBondContact O-CA 3.46Å; V192-Y194 HydrophobicContact CG1-CD2 4.47Å; V192-Y194 HydrophobicContact CG1-CE2 4.18Å; V192-Q229 CarbonylContact O-C 3.33Å; V192-Q229 WeakPolarHBondContact O-CA 3.42Å; V192-Y230 PolarHBondContact N-O 3.19Å; V192-Y230 PolarHBondContact O-N 3.42Å; V192-W232 HydrophobicContact CG2-CB 4.42Å; V192-W232 HydrophobicContact CG2-CG 4.08Å
193A90Very high87.2Confident0 Ų066.7 Ų66.70%033%0.333CS..EExtended strand (participates in β ladder)trans-93.4130.1171.500000110.5S180 R181 M183 F191 F226S180-A193 WeakPolarHBondContact CA-O 3.39Å; R181-A193 PolarHBondContact N-O 3.5Å; R181-A193 PolarHBondContact O-N 2.89Å; M183-A193 HydrophobicContact CG-CB 4.48Å; M183-A193 HydrophobicContact SD-CB 3.6Å; M183-A193 VanDerWaalsContact SD-CB 3.6Å; F191-A193 HydrophobicContact CE2-CB 4.49Å; A193-F226 HydrophobicContact CB-CD2 4Å; A193-F226 HydrophobicContact CB-CE2 3.78Å
194Y90.9Very high87.1Confident68 Ų6868.4 Ų68.427%0.26734%0.337SS..EExtended strand (participates in β ladder)trans-96.2119.4169.5-77.4-93.3000109.5V192 A227 R228 Y230 L266V192-Y194 HydrophobicContact CG1-CD2 4.47Å; V192-Y194 HydrophobicContact CG1-CE2 4.18Å; Y194-A227 PolarHBondContact O-N 2.96Å; Y194-R228 PolarHBondContact N-O 2.97Å; Y194-R228 PolarHBondContact O-N 2.87Å; Y194-Y230 AromaticContact CD2-CD2 3.43Å; Y194-Y230 HydrophobicContact CD2-CD2 3.43Å; Y194-Y230 VanDerWaalsContact CD2-CD2 3.43Å; Y194-Y230 AromaticContact CD2-CE2 3.54Å; Y194-Y230 HydrophobicContact CD2-CE2 3.54Å; Y194-Y230 AromaticContact CE2-CD2 3.45Å; Y194-Y230 HydrophobicContact CE2-CD2 3.45Å; Y194-Y230 VanDerWaalsContact CE2-CD2 3.45Å; Y194-Y230 AromaticContact CE2-CE2 3.72Å; Y194-Y230 HydrophobicContact CE2-CE2 3.72Å; Y194-Y230 HydrophobicContact CE2-CG 4.33Å; Y194-Y230 HydrophobicContact CG-CE2 4.48Å; Y194-L266 HydrophobicContact CE2-CD1 4.24Å; Y194-L266 VanDerWaalsContact OH-CD1 3.26Å; Y194-L266 WeakPolarHBondContact OH-CD1 3.33Å
195L92.2Very high86.9Confident6 Ų664.3 Ų64.33%0.03132%0.317CS..EExtended strand (participates in β ladder)trans-104.8121.5176.7-68.4155.3000108.3S178 I179 R181 Y224 E225 F226 L281 V283S178-L195 WeakPolarHBondContact CA-O 3.44Å; I179-L195 HydrophobicContact CB-CB 4.32Å; I179-L195 HydrophobicContact CG2-CD1 4.46Å; I179-L195 PolarHBondContact N-O 3.11Å; I179-L195 PolarHBondContact O-N 2.96Å; R181-L195 HydrophobicContact CB-CD1 4.46Å; L195-Y224 HydrophobicContact CB-CD1 4.22Å; L195-E225 CarbonylContact C-O 3.48Å; L195-E225 WeakPolarHBondContact CA-O 3.48Å; L195-F226 HydrophobicContact CD2-CB 4.26Å; L195-L281 HydrophobicContact CD2-CD2 4.44Å; L195-V283 HydrophobicContact CD1-CG2 4.14Å; L195-V283 HydrophobicContact CD2-CG2 3.95Å
196L92Very high86.8Confident60 Ų6067.8 Ų67.831%0.31433%0.33SS..EExtended strand (participates in β ladder)trans-101.3141.5176.1-67.3179.6000109.8S198 Y224 E225 A227L196-S198 PolarHBondContact O-N 3.26Å; L196-Y224 CarbonylContact O-C 3.58Å; L196-Y224 WeakPolarHBondContact O-CA 3.4Å; L196-E225 PolarHBondContact N-O 2.97Å; L196-E225 PolarHBondContact O-N 2.95Å; L196-A227 HydrophobicContact CB-CB 4.23Å; L196-A227 HydrophobicContact CD1-CB 3.51Å; L196-A227 HydrophobicContact CG-CB 3.56Å
197P90.7Very high86.5Confident9 Ų962.3 Ų62.36%0.05832%0.317CS..EExtended strand (participates in β ladder)trans-64138.4173.428.2-34.4000110A201 L202 I205 D223 Y224P197-A201 HydrophobicContact CB-CB 3.97Å; P197-L202 HydrophobicContact CG-CB 4.27Å; P197-L202 HydrophobicContact CG-CD1 3.68Å; P197-I205 HydrophobicContact CB-CD1 3.97Å; P197-I205 HydrophobicContact CG-CD1 4.3Å; P197-D223 WeakPolarHBondContact CA-O 3.17Å; P197-Y224 HydrophobicContact CB-CD1 4.22Å; P197-Y224 HydrophobicContact CB-CE1 3.9Å; P197-Y224 HydrophobicContact CB-CE2 4.34Å; P197-Y224 HydrophobicContact CG-CE1 4.2Å
198S89.9Confident85.8Confident16 Ų1658.5 Ų58.511%0.11231%0.306CS..PPolyproline II helixtrans-56.8156.2171.4-56.90000110.3L196 D200 A201 L202 D223 E225L196-S198 PolarHBondContact O-N 3.26Å; S198-D200 VanDerWaalsContact C-N 3.25Å; S198-D200 PolarHBondContact O-N 2.89Å; S198-D200 VanDerWaalsContact O-N 3.12Å; S198-A201 CarbonylContact O-C 3.55Å; S198-A201 WeakPolarHBondContact O-CA 3.3Å; S198-A201 WeakPolarHBondContact O-CB 3.44Å; S198-A201 PolarHBondContact O-N 2.89Å; S198-L202 PolarHBondContact O-N 3.14Å; S198-D223 PolarHBondContact N-O 3.18Å; S198-D223 PolarHBondContact OG-O 2.95Å; S198-E225 VanDerWaalsContact OG-CD 3.29Å; S198-E225 PolarHBondContact OG-OE1 2.86Å
199N88.4Confident85Confident116 Ų11655.9 Ų55.962%0.6230%0.298SS*.Hα-helixtrans-53.1-39.3-176.2-81.5-51.8000113.8L202 Q203N199-L202 PolarHBondContact O-N 2.84Å; N199-Q203 WeakPolarHBondContact O-CG 3.48Å; N199-Q203 PolarHBondContact O-N 3.48Å
200D88.2Confident83.4Confident90 Ų9058.4 Ų58.448%0.48131%0.314SS..Hα-helixtrans-65.9-45.1174.9175.468.5000112.3S198 L202 Q203 R204S198-D200 VanDerWaalsContact C-N 3.25Å; S198-D200 PolarHBondContact O-N 2.89Å; S198-D200 VanDerWaalsContact O-N 3.12Å; D200-L202 VanDerWaalsContact C-N 3.32Å; D200-L202 PolarHBondContact O-N 2.87Å; D200-Q203 PolarHBondContact O-N 2.94Å; D200-R204 WeakPolarHBondContact O-CG 3.37Å; D200-R204 PolarHBondContact O-N 3.28Å; D200-R204 IonicContact OD2-CZ 3.34Å; D200-R204 IonicContact OD2-NE 2.66Å; D200-R204 PolarHBondContact OD2-NE 3.4Å; D200-R204 IonicContact OD2-NH2 3.5Å; D200-R204 PolarHBondContact OD2-NH2 2.79Å
201A87.5Confident81.4Confident1 Ų162.4 Ų62.41%0.00833%0.325CS..Hα-helixtrans-60.7-42.9175.300000111P197 S198 Q203 R204 I205 F222 D223P197-A201 HydrophobicContact CB-CB 3.97Å; S198-A201 CarbonylContact O-C 3.55Å; S198-A201 WeakPolarHBondContact O-CA 3.3Å; S198-A201 WeakPolarHBondContact O-CB 3.44Å; S198-A201 PolarHBondContact O-N 2.89Å; A201-Q203 PolarHBondContact O-N 2.83Å; A201-R204 PolarHBondContact O-N 3.41Å; A201-I205 WeakPolarHBondContact O-CG1 3.33Å; A201-I205 PolarHBondContact O-N 3.45Å; A201-F222 HydrophobicContact CB-CB 4.15Å; A201-F222 HydrophobicContact CB-CD1 4.02Å; A201-D223 WeakPolarHBondContact CB-O 3.39Å
202L86.2Confident79.3Confident9 Ų970.3 Ų70.35%0.04737%0.365CS..Hα-helixtrans-60.9-42.5177-170.773.6000111.9Y170 F173 L174 P197 S198 N199 D200 I205 K206Y170-L202 HydrophobicContact CE2-CD2 3.71Å; F173-L202 HydrophobicContact CD1-CD1 3.68Å; F173-L202 HydrophobicContact CD1-CG 4.31Å; F173-L202 HydrophobicContact CE1-CD1 3.45Å; F173-L202 VanDerWaalsContact CE1-CD1 3.45Å; F173-L202 HydrophobicContact CE1-CG 3.95Å; L174-L202 HydrophobicContact CD2-CD1 3.74Å; L174-L202 HydrophobicContact CD2-CD2 3.64Å; L174-L202 HydrophobicContact CD2-CG 4.35Å; P197-L202 HydrophobicContact CG-CB 4.27Å; P197-L202 HydrophobicContact CG-CD1 3.68Å; S198-L202 PolarHBondContact O-N 3.14Å; N199-L202 PolarHBondContact O-N 2.84Å; D200-L202 VanDerWaalsContact C-N 3.32Å; D200-L202 PolarHBondContact O-N 2.87Å; L202-I205 PolarHBondContact O-N 3.46Å; L202-K206 VanDerWaalsContact O-CB 3.28Å; L202-K206 WeakPolarHBondContact O-CB 3.48Å; L202-K206 PolarHBondContact O-N 3.12Å
203Q84.2Confident77.1Confident135 Ų13574.7 Ų74.763%0.63138%0.383SS*.Hα-helixtrans-63.5-43175.5-73.7179.614.800111.7N199 D200 A201 K206 A207N199-Q203 WeakPolarHBondContact O-CG 3.48Å; N199-Q203 PolarHBondContact O-N 3.48Å; D200-Q203 PolarHBondContact O-N 2.94Å; A201-Q203 PolarHBondContact O-N 2.83Å; Q203-K206 PolarHBondContact O-N 2.85Å; Q203-A207 WeakPolarHBondContact O-CB 3.46Å; Q203-A207 PolarHBondContact O-N 3.32Å
204R83.1Confident75Confident87 Ų8785 Ų8533%0.32842%0.424SS..Hα-helixtrans-63.2-41.3175.2-71.8-172.8-80152.6-4.5112.2D200 A201 G208 R221 F222D200-R204 WeakPolarHBondContact O-CG 3.37Å; D200-R204 PolarHBondContact O-N 3.28Å; D200-R204 IonicContact OD2-CZ 3.34Å; D200-R204 IonicContact OD2-NE 2.66Å; D200-R204 PolarHBondContact OD2-NE 3.4Å; D200-R204 IonicContact OD2-NH2 3.5Å; D200-R204 PolarHBondContact OD2-NH2 2.79Å; A201-R204 PolarHBondContact O-N 3.41Å; R204-G208 PolarHBondContact O-N 3.47Å; R204-R221 PolarHBondContact NH1-O 3.05Å; R204-F222 HydrophobicContact CB-CE1 3.84Å
205I81.3Confident72.8Confident28 Ų2887.3 Ų87.314%0.14444%0.441CS..Hα-helixtrans-65.2-42.3175.1-63.2163.5000109.8F173 P197 A201 L202 G208 S209 F222F173-I205 HydrophobicContact CE2-CG2 4.37Å; F173-I205 HydrophobicContact CZ-CB 4.24Å; F173-I205 HydrophobicContact CZ-CG2 3.73Å; P197-I205 HydrophobicContact CB-CD1 3.97Å; P197-I205 HydrophobicContact CG-CD1 4.3Å; A201-I205 WeakPolarHBondContact O-CG1 3.33Å; A201-I205 PolarHBondContact O-N 3.45Å; L202-I205 PolarHBondContact O-N 3.46Å; I205-G208 CarbonylContact O-C 3.56Å; I205-G208 PolarHBondContact O-N 3.43Å; I205-S209 WeakPolarHBondContact O-CB 3.29Å; I205-S209 PolarHBondContact O-N 3.43Å; I205-F222 HydrophobicContact CD1-CD1 4.14Å; I205-F222 HydrophobicContact CD1-CE1 4.49Å; I205-F222 HydrophobicContact CG1-CD1 3.8Å; I205-F222 HydrophobicContact CG1-CE1 3.65Å; I205-F222 HydrophobicContact CG1-CZ 4.33Å
206K80.6Confident71Confident117 Ų11793.1 Ų93.151%0.50947%0.466SS..Hα-helixtrans-65.3-42.3179.8-170.2177.8-179.6-178.50112.1F173 L202 Q203 G208 S209 L210F173-K206 HydrophobicContact CE1-CB 3.81Å; F173-K206 HydrophobicContact CE1-CG 4.32Å; F173-K206 VanDerWaalsContact CZ-CA 3.48Å; F173-K206 HydrophobicContact CZ-CB 3.73Å; F173-K206 HydrophobicContact CZ-CG 4.27Å; L202-K206 VanDerWaalsContact O-CB 3.28Å; L202-K206 WeakPolarHBondContact O-CB 3.48Å; L202-K206 PolarHBondContact O-N 3.12Å; Q203-K206 PolarHBondContact O-N 2.85Å; K206-G208 VanDerWaalsContact C-N 3.27Å; K206-G208 PolarHBondContact O-N 3.24Å; K206-S209 PolarHBondContact O-N 3.17Å; K206-L210 PolarHBondContact O-N 3.05Å
207A79Confident69.1Low74 Ų7492.2 Ų92.261%0.61246%0.464SS*.Hα-helixtrans-62.9-35.3173.800000111.9Q203Q203-A207 WeakPolarHBondContact O-CB 3.46Å; Q203-A207 PolarHBondContact O-N 3.32Å
208G70.7Confident67.4Low40 Ų40101.2 Ų101.241%0.41250%0.503SS..Hα-helixtrans-71.5-46.417400000113.3R204 I205 K206 L210 R211R204-G208 PolarHBondContact O-N 3.47Å; I205-G208 CarbonylContact O-C 3.56Å; I205-G208 PolarHBondContact O-N 3.43Å; K206-G208 VanDerWaalsContact C-N 3.27Å; K206-G208 PolarHBondContact O-N 3.24Å; G208-L210 PolarHBondContact O-N 2.86Å; G208-R211 CarbonylContact O-C 3.43Å; G208-R211 WeakPolarHBondContact O-CA 3.4Å; G208-R211 WeakPolarHBondContact O-CB 3.34Å; G208-R211 PolarHBondContact O-N 2.85Å
209S62.5Low66Low74 Ų74107.6 Ų107.652%0.51754%0.535SS..Hα-helixtrans-64.9-22.7-172.8-173.50000114.3I205 K206 R211I205-S209 WeakPolarHBondContact O-CB 3.29Å; I205-S209 PolarHBondContact O-N 3.43Å; K206-S209 PolarHBondContact O-N 3.17Å; S209-R211 PolarHBondContact O-N 2.9Å
210L49.1Very low65.3Low162 Ų162107.4 Ų107.485%0.84853%0.529SS*.THydrogen-bonded Turntrans-71.1-23.5173.7-150.981.1000111.8K206 G208K206-L210 PolarHBondContact O-N 3.05Å; G208-L210 PolarHBondContact O-N 2.86Å
211R45.7Very low65.2Low182 Ų182110.1 Ų110.169%0.68753%0.533SS*.SBendtrans-94.3108.7167.4-85.1177.3154.1164.9-7.4107.2G208 S209 E213G208-R211 CarbonylContact O-C 3.43Å; G208-R211 WeakPolarHBondContact O-CA 3.4Å; G208-R211 WeakPolarHBondContact O-CB 3.34Å; G208-R211 PolarHBondContact O-N 2.85Å; S209-R211 PolarHBondContact O-N 2.9Å; R211-E213 PolarHBondContact O-N 2.73Å
212M42.4Very low65.2Low179 Ų179110.9 Ų110.988%0.88254%0.536SS*.  trans-60.639169.3-79.8-79.1-69.800113.1
213E43.8Very low65.4Low115 Ų115113.6 Ų113.654%0.53755%0.55SS.*  trans-107.7120178.1-74.7178.1-166.400107.8R211 N215R211-E213 PolarHBondContact O-N 2.73Å; E213-N215 HydrophobicContact CB-CB 4.36Å; E213-N215 PolarHBondContact O-N 2.91Å; E213-N215 PolarHBondContact OE2-ND2 3.37Å
214Y46.6Very low65.8Low216 Ų216107.3 Ų107.385%0.84752%0.521SS*.  trans-57.125.8164.7-78.5-96.1000113.8K216Y214-K216 VanDerWaalsContact C-N 3.26Å; Y214-K216 PolarHBondContact O-N 3.34Å
215N45.1Very low66.2Low117 Ų117106.9 Ų106.963%0.62652%0.523SS*.  trans-91.465.7170.3-72-34.7000108.9E213 S217E213-N215 HydrophobicContact CB-CB 4.36Å; E213-N215 PolarHBondContact O-N 2.91Å; E213-N215 PolarHBondContact OE2-ND2 3.37Å; N215-S217 PolarHBondContact O-N 2.97Å
216K53.6Low66.6Low128 Ų128106.6 Ų106.656%0.55752%0.52SS*.  trans-58.878.8139.7-88.5155.5161.9-164.90105.5Y214 K218 F287Y214-K216 VanDerWaalsContact C-N 3.26Å; Y214-K216 PolarHBondContact O-N 3.34Å; K216-K218 PolarHBondContact O-N 2.87Å; K216-F287 HydrophobicContact CB-CB 3.83Å; K216-F287 HydrophobicContact CD-CB 3.39Å; K216-F287 HydrophobicContact CD-CD1 4.05Å; K216-F287 HydrophobicContact CD-CD2 3.93Å; K216-F287 HydrophobicContact CD-CG 3.54Å; K216-F287 VanDerWaalsContact CE-CD2 3.43Å; K216-F287 HydrophobicContact CG-CB 3.63Å; K216-F287 HydrophobicContact CG-CD2 3.82Å; K216-F287 HydrophobicContact CG-CG 3.87Å
217S52.9Low67Low41 Ų41102.9 Ų102.929%0.28751%0.511SS..  trans-48.3117.8-174.942.60000107.5N215 N219 K220N215-S217 PolarHBondContact O-N 2.97Å; S217-N219 PolarHBondContact O-N 2.86Å; S217-K220 PolarHBondContact O-N 3.28Å; S217-K220 VanDerWaalsContact O-N 3.12Å; S217-K220 WeakPolarHBondContact OG-CD 3.2Å; S217-K220 WeakPolarHBondContact OG-CE 3.38Å; S217-K220 WeakPolarHBondContact OG-CG 3.33Å; S217-K220 PolarHBondContact OG-NZ 2.93Å
218K55.5Low67.5Low198 Ų198105.8 Ų105.886%0.86151%0.506SS*.THydrogen-bonded Turntrans-39.9123.7-179.8-67.8178.6176.7-179.10108.3K216K216-K218 PolarHBondContact O-N 2.87Å
219N59.1Low68.3Low150 Ų150104.4 Ų104.480%0.80249%0.489SS*.THydrogen-bonded Turntrans79.515.8179.7-69.4-5.5000120.2S217 R221S217-N219 PolarHBondContact O-N 2.86Å; N219-R221 PolarHBondContact O-N 2.84Å
220K75Confident69.7Low112 Ų112102.8 Ų102.849%0.48747%0.472SS..  trans-79.2120164.8-73.1-171.1-171.5152.20111.5S217 F222S217-K220 PolarHBondContact O-N 3.28Å; S217-K220 VanDerWaalsContact O-N 3.12Å; S217-K220 WeakPolarHBondContact OG-CD 3.2Å; S217-K220 WeakPolarHBondContact OG-CE 3.38Å; S217-K220 WeakPolarHBondContact OG-CG 3.33Å; S217-K220 PolarHBondContact OG-NZ 2.93Å; K220-F222 HydrophobicContact CB-CE2 3.94Å; K220-F222 HydrophobicContact CB-CZ 4.19Å
221R84.6Confident71.6Confident148 Ų14897.3 Ų97.356%0.55844%0.444SS*.EExtended strand (participates in β ladder)trans-86.7131.1171.8-68.5172.9179.5-175-1.2109.5R204 N219 M284 T286R204-R221 PolarHBondContact NH1-O 3.05Å; N219-R221 PolarHBondContact O-N 2.84Å; R221-M284 HydrophobicContact CB-SD 4.21Å; R221-T286 HydrophobicContact CB-CG2 4.29Å; R221-T286 HydrophobicContact CG-CG2 3.4Å; R221-T286 VanDerWaalsContact CG-CG2 3.4Å
222F87.6Confident73.5Confident17 Ų1792.7 Ų92.78%0.07543%0.426CS..EExtended strand (participates in β ladder)trans-116.3130174.8-64.7-85.8000108.7A201 R204 I205 K220 Y224 V285 F287A201-F222 HydrophobicContact CB-CB 4.15Å; A201-F222 HydrophobicContact CB-CD1 4.02Å; R204-F222 HydrophobicContact CB-CE1 3.84Å; I205-F222 HydrophobicContact CD1-CD1 4.14Å; I205-F222 HydrophobicContact CD1-CE1 4.49Å; I205-F222 HydrophobicContact CG1-CD1 3.8Å; I205-F222 HydrophobicContact CG1-CE1 3.65Å; I205-F222 HydrophobicContact CG1-CZ 4.33Å; K220-F222 HydrophobicContact CB-CE2 3.94Å; K220-F222 HydrophobicContact CB-CZ 4.19Å; F222-Y224 HydrophobicContact CB-CD2 4.17Å; F222-Y224 HydrophobicContact CB-CE2 3.73Å; F222-V285 PolarHBondContact N-O 2.95Å; F222-V285 PolarHBondContact O-N 2.67Å; F222-F287 AromaticContact CD2-CD2 3.74Å; F222-F287 HydrophobicContact CD2-CD2 3.74Å; F222-F287 AromaticContact CD2-CE2 3.58Å; F222-F287 HydrophobicContact CD2-CE2 3.58Å; F222-F287 AromaticContact CE2-CD2 3.7Å; F222-F287 HydrophobicContact CE2-CD2 3.7Å; F222-F287 AromaticContact CE2-CE2 3.79Å; F222-F287 HydrophobicContact CE2-CE2 3.79Å; F222-F287 HydrophobicContact CG-CE2 4.34Å
223D91.2Very high75.5Confident65 Ų6588.6 Ų88.635%0.34841%0.405SS..EExtended strand (participates in β ladder)trans-84128177.9-58.4-28.9000108.9P197 S198 A201 M284P197-D223 WeakPolarHBondContact CA-O 3.17Å; S198-D223 PolarHBondContact N-O 3.18Å; S198-D223 PolarHBondContact OG-O 2.95Å; A201-D223 WeakPolarHBondContact CB-O 3.39Å; D223-M284 WeakPolarHBondContact OD1-CG 3.16Å
224Y92.2Very high77.3Confident4 Ų487.6 Ų87.62%0.01640%0.403CS..EExtended strand (participates in β ladder)trans-118.4134.8175.2-80-104.7000109.3S177 I179 L195 L196 P197 F222 R282 V283 V285S177-Y224 VanDerWaalsContact O-CE1 3.23Å; S177-Y224 WeakPolarHBondContact O-CE1 3.41Å; S177-Y224 PolarHBondContact O-OH 2.86Å; I179-Y224 HydrophobicContact CB-CE1 4.48Å; I179-Y224 HydrophobicContact CD1-CD1 3.88Å; I179-Y224 HydrophobicContact CD1-CD2 4.26Å; I179-Y224 HydrophobicContact CD1-CE1 3.57Å; I179-Y224 HydrophobicContact CD1-CE2 3.99Å; I179-Y224 HydrophobicContact CD1-CG 4.22Å; I179-Y224 HydrophobicContact CG1-CD1 4.26Å; I179-Y224 HydrophobicContact CG1-CE1 3.78Å; L195-Y224 HydrophobicContact CB-CD1 4.22Å; L196-Y224 CarbonylContact O-C 3.58Å; L196-Y224 WeakPolarHBondContact O-CA 3.4Å; P197-Y224 HydrophobicContact CB-CD1 4.22Å; P197-Y224 HydrophobicContact CB-CE1 3.9Å; P197-Y224 HydrophobicContact CB-CE2 4.34Å; P197-Y224 HydrophobicContact CG-CE1 4.2Å; F222-Y224 HydrophobicContact CB-CD2 4.17Å; F222-Y224 HydrophobicContact CB-CE2 3.73Å; Y224-R282 CarbonylContact O-C 3.58Å; Y224-R282 VanDerWaalsContact O-CA 3.3Å; Y224-R282 WeakPolarHBondContact O-CA 2.91Å; Y224-V283 WeakPolarHBondContact CB-O 3.27Å; Y224-V283 PolarHBondContact N-O 3.44Å; Y224-V283 PolarHBondContact O-N 2.86Å; Y224-V285 HydrophobicContact CD2-CB 3.78Å; Y224-V285 HydrophobicContact CD2-CG2 3.54Å; Y224-V285 HydrophobicContact CE2-CB 3.85Å; Y224-V285 HydrophobicContact CE2-CG1 4.43Å; Y224-V285 HydrophobicContact CE2-CG2 4Å; Y224-V285 HydrophobicContact CG-CG2 4.08Å
225E91.4Very high79.1Confident78 Ų7882.4 Ų82.436%0.36438%0.382SS..EExtended strand (participates in β ladder)trans-111139.9-179.9-72.9168.6-156.300109.7L195 L196 S198 A227 R282L195-E225 CarbonylContact C-O 3.48Å; L195-E225 WeakPolarHBondContact CA-O 3.48Å; L196-E225 PolarHBondContact N-O 2.97Å; L196-E225 PolarHBondContact O-N 2.95Å; S198-E225 VanDerWaalsContact OG-CD 3.29Å; S198-E225 PolarHBondContact OG-OE1 2.86Å; E225-A227 PolarHBondContact O-N 2.81Å; E225-R282 HydrophobicContact CG-CG 4.05Å; E225-R282 IonicContact OE1-NH2 3.99Å
226F90.6Very high80.9Confident21 Ų2179.3 Ų79.39%0.09237%0.369CS..EExtended strand (participates in β ladder)trans-62.9122.6172.6174.8-92.4000110.5A193 L195 R228 Q229 L278 L281A193-F226 HydrophobicContact CB-CD2 4Å; A193-F226 HydrophobicContact CB-CE2 3.78Å; L195-F226 HydrophobicContact CD2-CB 4.26Å; F226-R228 WeakPolarHBondContact CE2-O 3.23Å; F226-R228 VanDerWaalsContact CZ-C 3.5Å; F226-Q229 HydrophobicContact CE2-CB 4.04Å; F226-Q229 HydrophobicContact CZ-CB 3.74Å; F226-Q229 HydrophobicContact CZ-CG 3.97Å; F226-L278 WeakPolarHBondContact CB-O 3.41Å; F226-L278 VanDerWaalsContact CD1-O 3.23Å; F226-L278 WeakPolarHBondContact CD1-O 3.23Å; F226-L278 HydrophobicContact CE1-CB 4.39Å; F226-L278 VanDerWaalsContact CG-O 3.3Å; F226-L278 WeakPolarHBondContact CG-O 3.43Å; F226-L278 HydrophobicContact CZ-CB 4.35Å; F226-L281 HydrophobicContact CB-CB 3.93Å; F226-L281 HydrophobicContact CB-CD2 4.49Å; F226-L281 WeakPolarHBondContact CB-O 3.45Å; F226-L281 HydrophobicContact CD2-CD2 4.44Å; F226-L281 PolarHBondContact N-O 3.41Å
227A88.7Confident82.3Confident39 Ų3977.3 Ų77.332%0.32236%0.36SS..EExtended strand (participates in β ladder)trans-102.9-47.5-18000000111.7Y194 L196 E225Y194-A227 PolarHBondContact O-N 2.96Å; L196-A227 HydrophobicContact CB-CB 4.23Å; L196-A227 HydrophobicContact CD1-CB 3.51Å; L196-A227 HydrophobicContact CG-CB 3.56Å; E225-A227 PolarHBondContact O-N 2.81Å
228R88.5Confident83.6Confident135 Ų13580 Ų8051%0.50939%0.385SS..EExtended strand (participates in β ladder)trans-155.8154.9-171.7-62.6-173.2-179.21741.5111.8Y194 F226 Y230Y194-R228 PolarHBondContact N-O 2.97Å; Y194-R228 PolarHBondContact O-N 2.87Å; F226-R228 WeakPolarHBondContact CE2-O 3.23Å; F226-R228 VanDerWaalsContact CZ-C 3.5Å; R228-Y230 HydrophobicContact CB-CD2 4.33Å; R228-Y230 HydrophobicContact CB-CE2 3.58Å; R228-Y230 VanDerWaalsContact CD-OH 3.26Å; R228-Y230 WeakPolarHBondContact CD-OH 3.43Å; R228-Y230 HydrophobicContact CG-CE2 4.47Å
229Q89.2Confident84.8Confident11 Ų1172.4 Ų72.45%0.05136%0.356CS..EExtended strand (participates in β ladder)trans-122.2147.9167.457.317978.900111.2F191 V192 F226 C269 N275F191-Q229 HydrophobicContact CD2-CB 4.01Å; F191-Q229 HydrophobicContact CE2-CB 4.47Å; V192-Q229 CarbonylContact O-C 3.33Å; V192-Q229 WeakPolarHBondContact O-CA 3.42Å; F226-Q229 HydrophobicContact CE2-CB 4.04Å; F226-Q229 HydrophobicContact CZ-CB 3.74Å; F226-Q229 HydrophobicContact CZ-CG 3.97Å; Q229-C269 HydrophobicContact CG-CB 4.05Å; Q229-C269 PolarHBondContact O-N 3.02Å; Q229-N275 PolarHBondContact NE2-ND2 3.04Å; Q229-N275 VanDerWaalsContact NE2-ND2 3.14Å
230Y90.7Very high85.6Confident40 Ų4072.7 Ų72.716%0.15736%0.364CS..EExtended strand (participates in β ladder)trans-135.4134.4177.3-64.2-98.9000109.8F191 V192 Y194 R228 L266 N267 R268F191-Y230 WeakPolarHBondContact CA-O 3.26Å; V192-Y230 PolarHBondContact N-O 3.19Å; V192-Y230 PolarHBondContact O-N 3.42Å; Y194-Y230 AromaticContact CD2-CD2 3.43Å; Y194-Y230 HydrophobicContact CD2-CD2 3.43Å; Y194-Y230 VanDerWaalsContact CD2-CD2 3.43Å; Y194-Y230 AromaticContact CD2-CE2 3.54Å; Y194-Y230 HydrophobicContact CD2-CE2 3.54Å; Y194-Y230 AromaticContact CE2-CD2 3.45Å; Y194-Y230 HydrophobicContact CE2-CD2 3.45Å; Y194-Y230 VanDerWaalsContact CE2-CD2 3.45Å; Y194-Y230 AromaticContact CE2-CE2 3.72Å; Y194-Y230 HydrophobicContact CE2-CE2 3.72Å; Y194-Y230 HydrophobicContact CE2-CG 4.33Å; Y194-Y230 HydrophobicContact CG-CE2 4.48Å; R228-Y230 HydrophobicContact CB-CD2 4.33Å; R228-Y230 HydrophobicContact CB-CE2 3.58Å; R228-Y230 VanDerWaalsContact CD-OH 3.26Å; R228-Y230 WeakPolarHBondContact CD-OH 3.43Å; R228-Y230 HydrophobicContact CG-CE2 4.47Å; Y230-L266 HydrophobicContact CD1-CB 3.88Å; Y230-L266 HydrophobicContact CG-CB 4.21Å; Y230-N267 CarbonylContact C-O 3.58Å; Y230-N267 VanDerWaalsContact CA-O 3.29Å; Y230-N267 WeakPolarHBondContact CA-O 3.46Å; Y230-R268 VanDerWaalsContact CD1-CA 3.48Å; Y230-R268 HydrophobicContact CD1-CB 3.91Å; Y230-R268 HydrophobicContact CD1-CG 4.45Å; Y230-R268 HydrophobicContact CE1-CB 3.64Å; Y230-R268 HydrophobicContact CE1-CG 3.99Å
231N88.7Confident85.7Confident48 Ų4871.9 Ų71.926%0.25737%0.365SS..EExtended strand (participates in β ladder)trans-72.5142.6159.6-70.3-3.2000107.4L266 N267 C269N231-L266 WeakPolarHBondContact O-CA 3.49Å; N231-N267 PolarHBondContact N-O 3.17Å; N231-N267 PolarHBondContact O-N 2.71Å; N231-C269 PolarHBondContact N-SG 3.12Å; N231-C269 PolarHBondContact ND2-SG 2.73Å; N231-C269 PolarHBondContact OD1-SG 3.22Å
232W87.1Confident85.3Confident84 Ų8467 Ų6732%0.31835%0.347SS..EExtended strand (participates in β ladder)trans-122.7139-178.365.3-77.5000109.6V192 L234 V264 R265 L266V192-W232 HydrophobicContact CG2-CB 4.42Å; V192-W232 HydrophobicContact CG2-CG 4.08Å; W232-L234 HydrophobicContact CE3-CB 4.34Å; W232-L234 HydrophobicContact CZ3-CB 3.9Å; W232-V264 HydrophobicContact CB-CG1 4.07Å; W232-R265 WeakPolarHBondContact CA-O 3.36Å; W232-L266 HydrophobicContact CB-CD2 3.71Å
233H82.8Confident85Confident93 Ų9373.7 Ų73.743%0.43138%0.378SS..EExtended strand (participates in β ladder)trans-121.6122.5173.4-59.2-69.4000108.1R265 N267H233-R265 PolarHBondContact N-O 3.46Å; H233-R265 PolarHBondContact O-N 3.24Å; H233-N267 PolarHBondContact CD2-ND2 3.2Å; H233-N267 VanDerWaalsContact CD2-ND2 3.28Å; H233-N267 PolarHBondContact NE2-ND2 3.27Å
234L83Confident84.4Confident94 Ų9472.8 Ų72.849%0.49238%0.379SS..EExtended strand (participates in β ladder)trans-82.6127.6173.9-166.263.2000109.4W232 T262 V264W232-L234 HydrophobicContact CE3-CB 4.34Å; W232-L234 HydrophobicContact CZ3-CB 3.9Å; L234-T262 HydrophobicContact CD1-CG2 4.19Å; L234-V264 HydrophobicContact CD1-CG2 3.81Å
235R83.5Confident84.1Confident108 Ų10875.7 Ų75.741%0.40840%0.395SS..EExtended strand (participates in β ladder)trans-112.4136.2166.7-62.2-62.9-170.3176.57.6107.8D241 T262 S263R235-D241 IonicContact CZ-OD2 3.58Å; R235-D241 IonicContact NH2-OD2 3.46Å; R235-T262 CarbonylContact O-C 3.52Å; R235-T262 VanDerWaalsContact O-CA 3.23Å; R235-T262 WeakPolarHBondContact O-CA 3.48Å; R235-S263 PolarHBondContact N-O 3.37Å; R235-S263 PolarHBondContact O-N 3.1Å
236S82.9Confident83.8Confident51 Ų5178.7 Ų78.736%0.35740%0.404SS..EExtended strand (participates in β ladder)trans-110.7161.6176.2175.50000109.3A238 C239 Y242S236-A238 PolarHBondContact O-N 2.92Å; S236-C239 WeakPolarHBondContact O-CB 3.33Å; S236-C239 PolarHBondContact O-N 3.39Å; S236-Y242 WeakPolarHBondContact O-CD2 3.4Å
237K83.7Confident83.5Confident87 Ų8780.3 Ų80.338%0.37842%0.417SS..THydrogen-bonded Turntrans-48-24.8170.1-84179.3168.6178.10114.6C239 Y242 E259 D261K237-C239 VanDerWaalsContact C-N 3.28Å; K237-C239 PolarHBondContact O-N 2.76Å; K237-Y242 WeakPolarHBondContact CE-OH 3.46Å; K237-Y242 HydrophobicContact CG-CD1 4.08Å; K237-Y242 HydrophobicContact CG-CD2 4.28Å; K237-Y242 HydrophobicContact CG-CE1 3.55Å; K237-Y242 HydrophobicContact CG-CE2 3.76Å; K237-Y242 HydrophobicContact CG-CG 4.42Å; K237-E259 WeakPolarHBondContact CE-OE1 3.02Å; K237-E259 WeakPolarHBondContact CE-OE2 3.05Å; K237-E259 IonicContact NZ-OE1 2.67Å; K237-E259 PolarHBondContact NZ-OE1 3.3Å; K237-E259 IonicContact NZ-OE2 3.28Å; K237-E259 PolarHBondContact NZ-OE2 2.91Å; K237-D261 HydrophobicContact CD-CB 3.93Å; K237-D261 WeakPolarHBondContact CD-OD1 3.35Å; K237-D261 WeakPolarHBondContact CE-OD1 3.47Å; K237-D261 HydrophobicContact CG-CB 4.32Å; K237-D261 PolarHBondContact N-O 3.06Å; K237-D261 IonicContact NZ-OD1 3.92Å; K237-D261 PolarHBondContact NZ-OD1 3.12Å
238A80.2Confident83.4Confident96 Ų9683.9 Ų83.979%0.79343%0.431SS*.THydrogen-bonded Turntrans-74.5-10.2176.400000114.7S236S236-A238 PolarHBondContact O-N 2.92Å
239C79.4Confident83.2Confident40 Ų4079.8 Ų79.827%0.2742%0.421SS..SBendtrans-79.5137.4177-68.30000111.1S236 K237 D241 Y242S236-C239 WeakPolarHBondContact O-CB 3.33Å; S236-C239 PolarHBondContact O-N 3.39Å; K237-C239 VanDerWaalsContact C-N 3.28Å; K237-C239 PolarHBondContact O-N 2.76Å; C239-D241 WeakPolarHBondContact CB-OD1 3.41Å; C239-D241 PolarHBondContact O-N 3.11Å; C239-Y242 WeakPolarHBondContact O-CB 3.42Å; C239-Y242 PolarHBondContact O-N 3.31Å
240T77.7Confident83.1Confident156 Ų15685.1 Ų85.196%0.95745%0.448SS*.THydrogen-bonded Turntrans-63.1-23-179.251.60000114
241D76.9Confident82.8Confident94 Ų9491.2 Ų91.250%0.50347%0.471SS..THydrogen-bonded Turntrans-100.720177.167.3-24.3000113R235 C239 E243R235-D241 IonicContact CZ-OD2 3.58Å; R235-D241 IonicContact NH2-OD2 3.46Å; C239-D241 WeakPolarHBondContact CB-OD1 3.41Å; C239-D241 PolarHBondContact O-N 3.11Å; D241-E243 PolarHBondContact O-N 3.07Å
242Y76.2Confident82.7Confident46 Ų4696.9 Ų96.918%0.1850%0.501CS..PPolyproline II helixtrans-68.2120.3179.7173.9-94.1000111.5S236 K237 C239 A244 E259 L260S236-Y242 WeakPolarHBondContact O-CD2 3.4Å; K237-Y242 WeakPolarHBondContact CE-OH 3.46Å; K237-Y242 HydrophobicContact CG-CD1 4.08Å; K237-Y242 HydrophobicContact CG-CD2 4.28Å; K237-Y242 HydrophobicContact CG-CE1 3.55Å; K237-Y242 HydrophobicContact CG-CE2 3.76Å; K237-Y242 HydrophobicContact CG-CG 4.42Å; C239-Y242 WeakPolarHBondContact O-CB 3.42Å; C239-Y242 PolarHBondContact O-N 3.31Å; Y242-A244 HydrophobicContact CE1-CB 4.12Å; Y242-E259 PolarHBondContact OH-OE1 3.13Å; Y242-L260 PolarHBondContact OH-O 3.42Å
243E79.9Confident82.6Confident158 Ų15896.7 Ų96.774%0.73853%0.525SS*.PPolyproline II helixtrans-100.4125.6166.9-67.9179.517500109.2D241 N245D241-E243 PolarHBondContact O-N 3.07Å; E243-N245 PolarHBondContact O-N 2.68Å; E243-N245 PolarHBondContact O-ND2 3.5Å
244A80.3Confident82.5Confident45 Ų4595.4 Ų95.437%0.37253%0.526SS..PPolyproline II helixtrans-59120.5178.200000110.7Y242 Y246 E259Y242-A244 HydrophobicContact CE1-CB 4.12Å; A244-Y246 HydrophobicContact CB-CE2 4.17Å; A244-E259 HydrophobicContact CB-CG 4.37Å
245N84.2Confident82.6Confident65 Ų6594.3 Ų94.335%0.34853%0.53SS..EExtended strand (participates in β ladder)trans-106.2143.3174.2-78.5-80.7000109.3E243 L260 S263E243-N245 PolarHBondContact O-N 2.68Å; E243-N245 PolarHBondContact O-ND2 3.5Å; N245-L260 HydrophobicContact CB-CB 4.41Å; N245-L260 HydrophobicContact CB-CD1 4.44Å; N245-L260 WeakPolarHBondContact O-CB 3.34Å; N245-L260 PolarHBondContact O-N 2.92Å; N245-S263 VanDerWaalsContact ND2-CB 3.33Å; N245-S263 WeakPolarHBondContact ND2-CB 3.47Å; N245-S263 PolarHBondContact ND2-OG 3.19Å
246Y86.4Confident82.8Confident141 Ų14195.2 Ų95.255%0.55354%0.535SS*.EExtended strand (participates in β ladder)trans-118134.2-178.9-60.8-86000110.5A244 Y257 N258 E259A244-Y246 HydrophobicContact CB-CE2 4.17Å; Y246-Y257 AromaticContact CD1-CD2 3.98Å; Y246-Y257 HydrophobicContact CD1-CD2 3.98Å; Y246-Y257 HydrophobicContact CE1-CD2 4.47Å; Y246-N258 CarbonylContact C-O 3.55Å; Y246-N258 WeakPolarHBondContact CA-O 3.48Å; Y246-E259 HydrophobicContact CD1-CB 4.07Å; Y246-E259 HydrophobicContact CD1-CG 4.24Å; Y246-E259 HydrophobicContact CE1-CB 3.93Å; Y246-E259 HydrophobicContact CE1-CG 3.91Å
247C84.6Confident83.1Confident55 Ų55100.5 Ų100.537%0.37255%0.548SS..EExtended strand (participates in β ladder)trans-88.3115.3168.5-179.10000108.9Y257 N258 L260C247-Y257 VanDerWaalsContact O-CA 3.23Å; C247-Y257 WeakPolarHBondContact O-CA 3.43Å; C247-N258 PolarHBondContact N-O 2.77Å; C247-N258 PolarHBondContact O-N 2.83Å; C247-L260 HydrophobicContact CB-CD1 4.14Å; C247-L260 HydrophobicContact CB-CD2 3.86Å; C247-L260 HydrophobicContact CB-CG 3.96Å
248L86.3Confident83.2Confident115 Ų115102 Ų10260%0.60256%0.56SS**EExtended strand (participates in β ladder)trans-96.8126.8175.8-174.775.2000110A255 Y256L248-A255 HydrophobicContact CD1-CB 4.23Å; L248-Y256 WeakPolarHBondContact CA-O 3.42Å
249T83.9Confident83.4Confident48 Ų48101 Ų10129%0.29454%0.539SS..EExtended strand (participates in β ladder)trans-127126.3173.5-60.20000110R251 Y256T249-R251 HydrophobicContact CG2-CG 3.89Å; T249-Y256 PolarHBondContact N-O 2.82Å; T249-Y256 PolarHBondContact O-N 3.2Å
250I86.4Confident83.7Confident123 Ų123102.6 Ų102.663%0.63155%0.545SS*.EExtended strand (participates in β ladder)trans-102.6117.3176.4-57.4172.9000108.3C254 A255I250-C254 WeakPolarHBondContact CA-O 3.46Å; I250-A255 HydrophobicContact CG1-CB 4.43Å
251R85Confident83.8Confident169 Ų16999.3 Ų99.364%0.63852%0.521SS*.EExtended strand (participates in β ladder)trans-138.8136.7177-71.5174-171.5178.85.6109T249 G253 C254 Y256T249-R251 HydrophobicContact CG2-CG 3.89Å; R251-G253 VanDerWaalsContact C-N 3.25Å; R251-G253 PolarHBondContact O-N 2.8Å; R251-C254 PolarHBondContact N-O 2.77Å; R251-C254 PolarHBondContact O-N 3.26Å; R251-C254 VanDerWaalsContact O-O 3.08Å; R251-Y256 HydrophobicContact CB-CE2 4.44Å
252N86Confident84.1Confident166 Ų16698 Ų9889%0.88852%0.516SS*.THydrogen-bonded Turntrans5435177-57.2-17.7000114.8C254N252-C254 PolarHBondContact O-N 3.43Å
253G85.2Confident84.5Confident80 Ų8097.1 Ų97.183%0.82552%0.517SS*.THydrogen-bonded Turntrans77.5-3-178.800000114.9R251R251-G253 VanDerWaalsContact C-N 3.25Å; R251-G253 PolarHBondContact O-N 2.8Å
254C81.1Confident84.7Confident67 Ų6793.3 Ų93.345%0.45350%0.504SS..EExtended strand (participates in β ladder)trans-102.7141.3174.7-640000110.6I250 R251 N252 Y256I250-C254 WeakPolarHBondContact CA-O 3.46Å; R251-C254 PolarHBondContact N-O 2.77Å; R251-C254 PolarHBondContact O-N 3.26Å; R251-C254 VanDerWaalsContact O-O 3.08Å; N252-C254 PolarHBondContact O-N 3.43Å; C254-Y256 HydrophobicContact CB-CD2 4.43Å; C254-Y256 HydrophobicContact CB-CE2 3.68Å
255A86.1Confident84.9Confident70 Ų7099.1 Ų99.158%0.57952%0.517SS*.EExtended strand (participates in β ladder)trans-96.3121.6171.800000109.1L248 I250L248-A255 HydrophobicContact CD1-CB 4.23Å; I250-A255 HydrophobicContact CG1-CB 4.43Å
256Y86.8Confident85.1Confident128 Ų12899.1 Ų99.150%0.50252%0.517SS..EExtended strand (participates in β ladder)trans-106.9139.8173.5-60.6-90.6000108.4L248 T249 R251 C254L248-Y256 WeakPolarHBondContact CA-O 3.42Å; T249-Y256 PolarHBondContact N-O 2.82Å; T249-Y256 PolarHBondContact O-N 3.2Å; R251-Y256 HydrophobicContact CB-CE2 4.44Å; C254-Y256 HydrophobicContact CB-CD2 4.43Å; C254-Y256 HydrophobicContact CB-CE2 3.68Å
257Y89.2Confident85.2Confident161 Ų16195.5 Ų95.563%0.63151%0.507SS*.EExtended strand (participates in β ladder)trans-131.7138.6173.268.4-86.5000110.1Y246 C247Y246-Y257 AromaticContact CD1-CD2 3.98Å; Y246-Y257 HydrophobicContact CD1-CD2 3.98Å; Y246-Y257 HydrophobicContact CE1-CD2 4.47Å; C247-Y257 VanDerWaalsContact O-CA 3.23Å; C247-Y257 WeakPolarHBondContact O-CA 3.43Å
258N85.6Confident85.3Confident119 Ų119101.5 Ų101.564%0.63652%0.522SS*.EExtended strand (participates in β ladder)trans-123.8140.8170.6-70.9-5.1000108.5Y246 C247Y246-N258 CarbonylContact C-O 3.55Å; Y246-N258 WeakPolarHBondContact CA-O 3.48Å; C247-N258 PolarHBondContact N-O 2.77Å; C247-N258 PolarHBondContact O-N 2.83Å
259E85.2Confident85.1Confident75 Ų7597.4 Ų97.435%0.3550%0.502SS..EExtended strand (participates in β ladder)trans-68.1139.2169-160.6-167165.300109.3K237 Y242 A244 Y246K237-E259 WeakPolarHBondContact CE-OE1 3.02Å; K237-E259 WeakPolarHBondContact CE-OE2 3.05Å; K237-E259 IonicContact NZ-OE1 2.67Å; K237-E259 PolarHBondContact NZ-OE1 3.3Å; K237-E259 IonicContact NZ-OE2 3.28Å; K237-E259 PolarHBondContact NZ-OE2 2.91Å; Y242-E259 PolarHBondContact OH-OE1 3.13Å; A244-E259 HydrophobicContact CB-CG 4.37Å; Y246-E259 HydrophobicContact CD1-CB 4.07Å; Y246-E259 HydrophobicContact CD1-CG 4.24Å; Y246-E259 HydrophobicContact CE1-CB 3.93Å; Y246-E259 HydrophobicContact CE1-CG 3.91Å
260L84.2Confident84.6Confident74 Ų7498.5 Ų98.539%0.38752%0.516SS..EExtended strand (participates in β ladder)trans-98.1112.3174.9-67.4174.6000108.7Y242 N245 C247 T262Y242-L260 PolarHBondContact OH-O 3.42Å; N245-L260 HydrophobicContact CB-CB 4.41Å; N245-L260 HydrophobicContact CB-CD1 4.44Å; N245-L260 WeakPolarHBondContact O-CB 3.34Å; N245-L260 PolarHBondContact O-N 2.92Å; C247-L260 HydrophobicContact CB-CD1 4.14Å; C247-L260 HydrophobicContact CB-CD2 3.86Å; C247-L260 HydrophobicContact CB-CG 3.96Å; L260-T262 PolarHBondContact O-N 3Å
261D81.5Confident83.6Confident87 Ų8797.6 Ų97.647%0.46551%0.512SS..SBendtrans-61.6-15.4177.6-56.9-29.5000113.9K237K237-D261 HydrophobicContact CD-CB 3.93Å; K237-D261 WeakPolarHBondContact CD-OD1 3.35Å; K237-D261 WeakPolarHBondContact CE-OD1 3.47Å; K237-D261 HydrophobicContact CG-CB 4.32Å; K237-D261 PolarHBondContact N-O 3.06Å; K237-D261 IonicContact NZ-OD1 3.92Å; K237-D261 PolarHBondContact NZ-OD1 3.12Å
262T83.1Confident82.5Confident65 Ų6594.7 Ų94.740%0.39951%0.509SS..EExtended strand (participates in β ladder)trans-124.9135.317956.70000111.1L234 R235 L260L234-T262 HydrophobicContact CD1-CG2 4.19Å; R235-T262 CarbonylContact O-C 3.52Å; R235-T262 VanDerWaalsContact O-CA 3.23Å; R235-T262 WeakPolarHBondContact O-CA 3.48Å; L260-T262 PolarHBondContact O-N 3Å
263S84.7Confident81.1Confident29 Ų2996.2 Ų96.220%0.20351%0.508CS..EExtended strand (participates in β ladder)trans-112.2130.6172.4-170.90000109.5R235 N245R235-S263 PolarHBondContact N-O 3.37Å; R235-S263 PolarHBondContact O-N 3.1Å; N245-S263 VanDerWaalsContact ND2-CB 3.33Å; N245-S263 WeakPolarHBondContact ND2-CB 3.47Å; N245-S263 PolarHBondContact ND2-OG 3.19Å
264V83.1Confident79.9Confident77 Ų77100.5 Ų100.547%0.46751%0.507SS..EExtended strand (participates in β ladder)trans-105.9116.2178.2-179.30000109W232 L234 L266W232-V264 HydrophobicContact CB-CG1 4.07Å; L234-V264 HydrophobicContact CD1-CG2 3.81Å; V264-L266 HydrophobicContact CG1-CD2 3.9Å; V264-L266 HydrophobicContact CG1-CG 4.4Å
265R84.9Confident78.8Confident167 Ų16799.4 Ų99.463%0.6350%0.496SS*.EExtended strand (participates in β ladder)trans-95121.7172.7-171.7172.4178.8166.52.4109.9W232 H233W232-R265 WeakPolarHBondContact CA-O 3.36Å; H233-R265 PolarHBondContact N-O 3.46Å; H233-R265 PolarHBondContact O-N 3.24Å
266L88.7Confident77.7Confident66 Ų6699.1 Ų99.135%0.34649%0.49SS..EExtended strand (participates in β ladder)trans-99.5124.3177.9-61.1178.6000110.8Y194 Y230 N231 W232 V264Y194-L266 HydrophobicContact CE2-CD1 4.24Å; Y194-L266 VanDerWaalsContact OH-CD1 3.26Å; Y194-L266 WeakPolarHBondContact OH-CD1 3.33Å; Y230-L266 HydrophobicContact CD1-CB 3.88Å; Y230-L266 HydrophobicContact CG-CB 4.21Å; N231-L266 WeakPolarHBondContact O-CA 3.49Å; W232-L266 HydrophobicContact CB-CD2 3.71Å; V264-L266 HydrophobicContact CG1-CD2 3.9Å; V264-L266 HydrophobicContact CG1-CG 4.4Å
267N88.2Confident76.9Confident65 Ų65101.5 Ų101.535%0.34850%0.503SS..EExtended strand (participates in β ladder)trans-109.5119.2174.8-70.5-29.7000109Y230 N231 H233 C269Y230-N267 CarbonylContact C-O 3.58Å; Y230-N267 VanDerWaalsContact CA-O 3.29Å; Y230-N267 WeakPolarHBondContact CA-O 3.46Å; N231-N267 PolarHBondContact N-O 3.17Å; N231-N267 PolarHBondContact O-N 2.71Å; H233-N267 PolarHBondContact CD2-ND2 3.2Å; H233-N267 VanDerWaalsContact CD2-ND2 3.28Å; H233-N267 PolarHBondContact NE2-ND2 3.27Å; N267-C269 PolarHBondContact O-N 3.19Å
268R87.4Confident76.3Confident180 Ų18095.1 Ų95.168%0.67948%0.48SS*.EExtended strand (participates in β ladder)trans-68.4123.7-178.2-171.2-179.774.9-175.24110.1Y230Y230-R268 VanDerWaalsContact CD1-CA 3.48Å; Y230-R268 HydrophobicContact CD1-CB 3.91Å; Y230-R268 HydrophobicContact CD1-CG 4.45Å; Y230-R268 HydrophobicContact CE1-CB 3.64Å; Y230-R268 HydrophobicContact CE1-CG 3.99Å
269C81.1Confident75.7Confident29 Ų2992.3 Ų92.320%0.19647%0.469CS..PPolyproline II helixtrans-88136.6173-51.80000109.7Q229 N231 N267Q229-C269 HydrophobicContact CG-CB 4.05Å; Q229-C269 PolarHBondContact O-N 3.02Å; N231-C269 PolarHBondContact N-SG 3.12Å; N231-C269 PolarHBondContact ND2-SG 2.73Å; N231-C269 PolarHBondContact OD1-SG 3.22Å; N267-C269 PolarHBondContact O-N 3.19Å
270A73.7Confident75.5Confident71 Ų7195.1 Ų95.159%0.58749%0.487SS*.PPolyproline II helixtrans-72.8144.7170.600000109.7N272A270-N272 PolarHBondContact O-N 3.01Å
271L65Low75.6Confident104 Ų10494.2 Ų94.255%0.54548%0.482SS..  trans-66102.8169.8-80.2125.9000108.8
272N61.9Low75.9Confident108 Ų10898.7 Ų98.758%0.57849%0.492SS*.  trans-87.2161.2168.1-81-11.6000110.3A270 Q274 N275 S276A270-N272 PolarHBondContact O-N 3.01Å; N272-Q274 PolarHBondContact O-N 2.84Å; N272-N275 WeakPolarHBondContact O-CA 3.23Å; N272-N275 PolarHBondContact O-N 3.02Å; N272-S276 PolarHBondContact O-N 3.04Å
273K57.4Low76.2Confident199 Ų19997 Ų9787%0.86548%0.482SS*.G310 helixtrans-52.8-31.6-179.1-70.3-178.3179179.50113.6S276K273-S276 WeakPolarHBondContact O-CB 3.21Å; K273-S276 PolarHBondContact O-N 2.82Å; K273-S276 PolarHBondContact O-OG 2.74Å
274Q58.2Low76.4Confident170 Ų170100.6 Ų100.679%0.79450%0.497SS*.G310 helixtrans-67.4-34.4175.2-73.2175.7-36.900112.9N272 S276N272-Q274 PolarHBondContact O-N 2.84Å; Q274-S276 VanDerWaalsContact C-N 3.31Å; Q274-S276 PolarHBondContact O-N 3.21Å
275N59.5Low76.6Confident44 Ų4498.1 Ų98.124%0.23548%0.482CS..G310 helixtrans-896.2178.7-67.9-12.2000113.2Q229 N272 K277 L278Q229-N275 PolarHBondContact NE2-ND2 3.04Å; Q229-N275 VanDerWaalsContact NE2-ND2 3.14Å; N272-N275 WeakPolarHBondContact O-CA 3.23Å; N272-N275 PolarHBondContact O-N 3.02Å; N275-K277 PolarHBondContact O-N 2.99Å; N275-L278 HydrophobicContact CB-CD1 4.37Å; N275-L278 WeakPolarHBondContact O-CB 3.5Å; N275-L278 PolarHBondContact O-N 2.98Å
276S63.1Low76.6Confident64 Ų6493.5 Ų93.545%0.44847%0.472SS..Hα-helixtrans-57.5-31.1178.156.10000112.6N272 K273 Q274 L278 S279N272-S276 PolarHBondContact O-N 3.04Å; K273-S276 WeakPolarHBondContact O-CB 3.21Å; K273-S276 PolarHBondContact O-N 2.82Å; K273-S276 PolarHBondContact O-OG 2.74Å; Q274-S276 VanDerWaalsContact C-N 3.31Å; Q274-S276 PolarHBondContact O-N 3.21Å; S276-L278 PolarHBondContact O-N 2.76Å; S276-S279 PolarHBondContact O-N 3.34Å; S276-S279 PolarHBondContact O-OG 2.66Å
277K69.5Low76.1Confident178 Ų17892.9 Ų92.977%0.77447%0.467SS*.Hα-helixtrans-63.9-24.8176.4-64.7-178.2-177.9174.30113.6N275N275-K277 PolarHBondContact O-N 2.99Å
278L75.9Confident75.8Confident27 Ų2796.8 Ų96.814%0.14148%0.477CS..Hα-helixtrans-78.8-21.6-179.6-71.3167.5000112.8M183 F191 F226 N275 S276 D280 L281M183-L278 HydrophobicContact CE-CD2 3.72Å; F191-L278 HydrophobicContact CE2-CD1 4.14Å; F191-L278 HydrophobicContact CZ-CD1 3.94Å; F226-L278 WeakPolarHBondContact CB-O 3.41Å; F226-L278 VanDerWaalsContact CD1-O 3.23Å; F226-L278 WeakPolarHBondContact CD1-O 3.23Å; F226-L278 HydrophobicContact CE1-CB 4.39Å; F226-L278 VanDerWaalsContact CG-O 3.3Å; F226-L278 WeakPolarHBondContact CG-O 3.43Å; F226-L278 HydrophobicContact CZ-CB 4.35Å; N275-L278 HydrophobicContact CB-CD1 4.37Å; N275-L278 WeakPolarHBondContact O-CB 3.5Å; N275-L278 PolarHBondContact O-N 2.98Å; S276-L278 PolarHBondContact O-N 2.76Å; L278-D280 PolarHBondContact O-N 3Å; L278-L281 HydrophobicContact CD2-CD2 4.25Å; L278-L281 WeakPolarHBondContact O-CB 3.37Å; L278-L281 PolarHBondContact O-N 2.83Å; L278-L281 VanDerWaalsContact O-N 3.11Å
279S73.9Confident75.6Confident60 Ų6094.9 Ų94.942%0.4248%0.476SS..Hα-helixtrans-64.4-27.9178.762.50000112.7S276 L281S276-S279 PolarHBondContact O-N 3.34Å; S276-S279 PolarHBondContact O-OG 2.66Å; S279-L281 VanDerWaalsContact C-N 3.33Å
280D80.2Confident75.8Confident133 Ų13396.2 Ų96.271%0.71148%0.484SS*.THydrogen-bonded Turntrans-94.24.9-179.4-62.6-4.9000111.8L278 R282L278-D280 PolarHBondContact O-N 3Å; D280-R282 PolarHBondContact O-N 2.96Å; D280-R282 VanDerWaalsContact O-N 3.11Å
281L85.9Confident76.6Confident55 Ų5595 Ų9529%0.28847%0.468SS..  trans-66114.1178.6-177.672.4000109.7M183 L195 F226 L278 S279 V283M183-L281 HydrophobicContact CE-CD2 4.41Å; M183-L281 HydrophobicContact SD-CD2 4.47Å; L195-L281 HydrophobicContact CD2-CD2 4.44Å; F226-L281 HydrophobicContact CB-CB 3.93Å; F226-L281 HydrophobicContact CB-CD2 4.49Å; F226-L281 WeakPolarHBondContact CB-O 3.45Å; F226-L281 HydrophobicContact CD2-CD2 4.44Å; F226-L281 PolarHBondContact N-O 3.41Å; L278-L281 HydrophobicContact CD2-CD2 4.25Å; L278-L281 WeakPolarHBondContact O-CB 3.37Å; L278-L281 PolarHBondContact O-N 2.83Å; L278-L281 VanDerWaalsContact O-N 3.11Å; S279-L281 VanDerWaalsContact C-N 3.33Å; L281-V283 HydrophobicContact CG-CG2 4.39Å
282R88.2Confident78Confident181 Ų18196.7 Ų96.768%0.68348%0.477SS*.EExtended strand (participates in β ladder)trans-117.5136.4171.6-67.8-175.3176.7-178.2-3109.5Y224 E225 D280Y224-R282 CarbonylContact O-C 3.58Å; Y224-R282 VanDerWaalsContact O-CA 3.3Å; Y224-R282 WeakPolarHBondContact O-CA 2.91Å; E225-R282 HydrophobicContact CG-CG 4.05Å; E225-R282 IonicContact OE1-NH2 3.99Å; D280-R282 PolarHBondContact O-N 2.96Å; D280-R282 VanDerWaalsContact O-N 3.11Å
283V88.7Confident79.5Confident30 Ų3098.8 Ų98.818%0.18248%0.483CS..EExtended strand (participates in β ladder)trans-123.9126.9179.6-176.60000108.3L195 Y224 L281 V285 W372L195-V283 HydrophobicContact CD1-CG2 4.14Å; L195-V283 HydrophobicContact CD2-CG2 3.95Å; Y224-V283 WeakPolarHBondContact CB-O 3.27Å; Y224-V283 PolarHBondContact N-O 3.44Å; Y224-V283 PolarHBondContact O-N 2.86Å; L281-V283 HydrophobicContact CG-CG2 4.39Å; V283-V285 HydrophobicContact CG1-CG2 3.96Å; V283-W372 HydrophobicContact CG1-CZ3 4.48Å
284M89.5Confident81.1Confident104 Ų10493.1 Ų93.151%0.51246%0.46SS..EExtended strand (participates in β ladder)trans-86.7120.2168.5-74.4-146.2-62.900109.7R221 D223R221-M284 HydrophobicContact CB-SD 4.21Å; D223-M284 WeakPolarHBondContact OD1-CG 3.16Å
285V87.3Confident82.7Confident26 Ų2688 Ų8816%0.15844%0.437CS..EExtended strand (participates in β ladder)trans-108.9123.7-178.1-178.60000109.4I179 F222 Y224 V283 F287I179-V285 HydrophobicContact CD1-CB 4.25Å; I179-V285 HydrophobicContact CD1-CG1 3.9Å; I179-V285 HydrophobicContact CD1-CG2 3.66Å; F222-V285 PolarHBondContact N-O 2.95Å; F222-V285 PolarHBondContact O-N 2.67Å; Y224-V285 HydrophobicContact CD2-CB 3.78Å; Y224-V285 HydrophobicContact CD2-CG2 3.54Å; Y224-V285 HydrophobicContact CE2-CB 3.85Å; Y224-V285 HydrophobicContact CE2-CG1 4.43Å; Y224-V285 HydrophobicContact CE2-CG2 4Å; Y224-V285 HydrophobicContact CG-CG2 4.08Å; V283-V285 HydrophobicContact CG1-CG2 3.96Å; V285-F287 HydrophobicContact CG1-CD1 4.43Å; V285-F287 HydrophobicContact CG1-CE1 4.16Å; V285-F287 HydrophobicContact CG1-CZ 4.31Å
286T84.8Confident84.4Confident70 Ų7088.3 Ų88.343%0.42945%0.446SS..EExtended strand (participates in β ladder)trans-110.4125.9169.551.80000109.5R221R221-T286 HydrophobicContact CB-CG2 4.29Å; R221-T286 HydrophobicContact CG-CG2 3.4Å; R221-T286 VanDerWaalsContact CG-CG2 3.4Å
287F78.8Confident85.8Confident53 Ų5388.1 Ų88.123%0.23245%0.448CS..  trans-85124174.3-58.3-73.6000110.8K216 F222 V285K216-F287 HydrophobicContact CB-CB 3.83Å; K216-F287 HydrophobicContact CD-CB 3.39Å; K216-F287 HydrophobicContact CD-CD1 4.05Å; K216-F287 HydrophobicContact CD-CD2 3.93Å; K216-F287 HydrophobicContact CD-CG 3.54Å; K216-F287 VanDerWaalsContact CE-CD2 3.43Å; K216-F287 HydrophobicContact CG-CB 3.63Å; K216-F287 HydrophobicContact CG-CD2 3.82Å; K216-F287 HydrophobicContact CG-CG 3.87Å; F222-F287 AromaticContact CD2-CD2 3.74Å; F222-F287 HydrophobicContact CD2-CD2 3.74Å; F222-F287 AromaticContact CD2-CE2 3.58Å; F222-F287 HydrophobicContact CD2-CE2 3.58Å; F222-F287 AromaticContact CE2-CD2 3.7Å; F222-F287 HydrophobicContact CE2-CD2 3.7Å; F222-F287 AromaticContact CE2-CE2 3.79Å; F222-F287 HydrophobicContact CE2-CE2 3.79Å; F222-F287 HydrophobicContact CG-CE2 4.34Å; V285-F287 HydrophobicContact CG1-CD1 4.43Å; V285-F287 HydrophobicContact CG1-CE1 4.16Å; V285-F287 HydrophobicContact CG1-CZ 4.31Å
288R82.6Confident86.9Confident147 Ų14785.7 Ų85.756%0.55544%0.44SS*.  trans-121.7159.917665.9-178.7-174.3110.9-7.5110.3E294R288-E294 IonicContact CZ-OE1 2.87Å; R288-E294 IonicContact CZ-OE2 3.2Å; R288-E294 IonicContact NH1-OE2 2.82Å; R288-E294 PolarHBondContact NH1-OE2 3.46Å; R288-E294 VanDerWaalsContact NH2-CD 3.31Å; R288-E294 IonicContact NH2-OE1 3.79Å; R288-E294 PolarHBondContact NH2-OE1 3.28Å; R288-E294 IonicContact NH2-OE2 3.93Å; R288-E294 PolarHBondContact NH2-OE2 2.67Å
289Q82.2Confident87.7Confident140 Ų14089.6 Ų89.665%0.65446%0.457SS*.PPolyproline II helixtrans-66.6142.7164.6-69.1-68.3-6.500108.6
290P85.1Confident88.6Confident56 Ų5688.7 Ų88.736%0.36445%0.453SS..PPolyproline II helixtrans-60.4144175.927.3-33.3000109.9E294 I295P290-E294 VanDerWaalsContact CA-OE2 3.27Å; P290-E294 WeakPolarHBondContact CA-OE2 3.06Å; P290-E294 HydrophobicContact CB-CB 4.04Å; P290-I295 HydrophobicContact CB-CG1 3.99Å; P290-I295 HydrophobicContact CG-CD1 4.26Å; P290-I295 HydrophobicContact CG-CG1 3.88Å
291N90.8Very high89.1Confident47 Ų4791 Ų9125%0.25145%0.452SS..PPolyproline II helixtrans-78.8168174.270.316.7000111Q293 E294 I295N291-Q293 PolarHBondContact O-N 2.9Å; N291-Q293 VanDerWaalsContact O-N 3.16Å; N291-Q293 PolarHBondContact OD1-N 3.16Å; N291-E294 PolarHBondContact N-OE2 3.4Å; N291-E294 PolarHBondContact O-N 3.41Å; N291-E294 VanDerWaalsContact O-N 3.1Å; N291-E294 VanDerWaalsContact OD1-CB 3.27Å; N291-E294 WeakPolarHBondContact OD1-CB 3.43Å; N291-E294 WeakPolarHBondContact OD1-CG 3.3Å; N291-E294 PolarHBondContact OD1-N 2.82Å; N291-E294 PolarHBondContact OD1-OE2 2.74Å; N291-I295 WeakPolarHBondContact O-CG1 3.33Å; N291-I295 PolarHBondContact O-N 3.12Å
292D93.6Very high89.2Confident138 Ų13892.9 Ų92.974%0.73846%0.46SS*.Hα-helixtrans-59.2-31-177.5-60.2-22.5000113A296D292-A296 VanDerWaalsContact O-CB 3.26Å; D292-A296 WeakPolarHBondContact O-CB 3.33Å; D292-A296 PolarHBondContact O-N 3.1Å
293Q93.7Very high89.2Confident153 Ų15391.7 Ų91.772%0.71546%0.456SS*.Hα-helixtrans-69.8-43.1176.1-66.9179-16.500112.3N291 I295 A296 A297N291-Q293 PolarHBondContact O-N 2.9Å; N291-Q293 VanDerWaalsContact O-N 3.16Å; N291-Q293 PolarHBondContact OD1-N 3.16Å; Q293-I295 VanDerWaalsContact C-N 3.35Å; Q293-A296 PolarHBondContact O-N 2.92Å; Q293-A297 VanDerWaalsContact O-CB 3.3Å; Q293-A297 WeakPolarHBondContact O-CB 3.27Å; Q293-A297 PolarHBondContact O-N 2.92Å
294E91.8Very high89.1Confident79 Ų7995.8 Ų95.837%0.36948%0.476SS..Hα-helixtrans-65.6-40.1176.2-73.1165.2156.700110.3R288 P290 N291 Q298R288-E294 IonicContact CZ-OE1 2.87Å; R288-E294 IonicContact CZ-OE2 3.2Å; R288-E294 IonicContact NH1-OE2 2.82Å; R288-E294 PolarHBondContact NH1-OE2 3.46Å; R288-E294 VanDerWaalsContact NH2-CD 3.31Å; R288-E294 IonicContact NH2-OE1 3.79Å; R288-E294 PolarHBondContact NH2-OE1 3.28Å; R288-E294 IonicContact NH2-OE2 3.93Å; R288-E294 PolarHBondContact NH2-OE2 2.67Å; P290-E294 VanDerWaalsContact CA-OE2 3.27Å; P290-E294 WeakPolarHBondContact CA-OE2 3.06Å; P290-E294 HydrophobicContact CB-CB 4.04Å; N291-E294 PolarHBondContact N-OE2 3.4Å; N291-E294 PolarHBondContact O-N 3.41Å; N291-E294 VanDerWaalsContact O-N 3.1Å; N291-E294 VanDerWaalsContact OD1-CB 3.27Å; N291-E294 WeakPolarHBondContact OD1-CB 3.43Å; N291-E294 WeakPolarHBondContact OD1-CG 3.3Å; N291-E294 PolarHBondContact OD1-N 2.82Å; N291-E294 PolarHBondContact OD1-OE2 2.74Å; E294-Q298 VanDerWaalsContact O-CB 3.3Å; E294-Q298 WeakPolarHBondContact O-CB 3.46Å; E294-Q298 PolarHBondContact O-N 2.88Å
295I92.2Very high88.6Confident63 Ų6395.8 Ų95.832%0.32348%0.477SS..Hα-helixtrans-63.2-50.7173.9-64.6167.9000110.1P290 N291 Q293 A297 Q298 E299P290-I295 HydrophobicContact CB-CG1 3.99Å; P290-I295 HydrophobicContact CG-CD1 4.26Å; P290-I295 HydrophobicContact CG-CG1 3.88Å; N291-I295 WeakPolarHBondContact O-CG1 3.33Å; N291-I295 PolarHBondContact O-N 3.12Å; Q293-I295 VanDerWaalsContact C-N 3.35Å; I295-A297 VanDerWaalsContact C-N 3.33Å; I295-A297 PolarHBondContact O-N 3.38Å; I295-Q298 WeakPolarHBondContact O-CB 3.3Å; I295-Q298 PolarHBondContact O-N 2.86Å; I295-Q298 VanDerWaalsContact O-N 3.14Å; I295-E299 HydrophobicContact CG2-CG 4.45Å; I295-E299 WeakPolarHBondContact O-CG 3.33Å; I295-E299 PolarHBondContact O-N 3.22Å
296A94.4Very high88.3Confident50 Ų5099.8 Ų99.841%0.41349%0.494SS..Hα-helixtrans-60.8-40.617900000112.3D292 Q293 E299 A300D292-A296 VanDerWaalsContact O-CB 3.26Å; D292-A296 WeakPolarHBondContact O-CB 3.33Å; D292-A296 PolarHBondContact O-N 3.1Å; Q293-A296 PolarHBondContact O-N 2.92Å; A296-E299 PolarHBondContact O-N 3.33Å; A296-A300 WeakPolarHBondContact O-CB 3.49Å; A296-A300 PolarHBondContact O-N 3.14Å
297A93.3Very high87.7Confident61 Ų61101.6 Ų101.650%0.50450%0.5SS..Hα-helixtrans-65.1-40.3175.100000112Q293 I295 A300 R301Q293-A297 VanDerWaalsContact O-CB 3.3Å; Q293-A297 WeakPolarHBondContact O-CB 3.27Å; Q293-A297 PolarHBondContact O-N 2.92Å; I295-A297 VanDerWaalsContact C-N 3.33Å; I295-A297 PolarHBondContact O-N 3.38Å; A297-A300 PolarHBondContact O-N 3.32Å; A297-R301 WeakPolarHBondContact O-CB 3.36Å; A297-R301 PolarHBondContact O-N 2.72Å
298Q90.9Very high87.2Confident126 Ų126101.2 Ų101.259%0.58951%0.507SS*.Hα-helixtrans-63.6-44.6174.7-177.4177.5-20.100111.4E294 I295 R301 M302E294-Q298 VanDerWaalsContact O-CB 3.3Å; E294-Q298 WeakPolarHBondContact O-CB 3.46Å; E294-Q298 PolarHBondContact O-N 2.88Å; I295-Q298 WeakPolarHBondContact O-CB 3.3Å; I295-Q298 PolarHBondContact O-N 2.86Å; I295-Q298 VanDerWaalsContact O-N 3.14Å; Q298-R301 PolarHBondContact O-N 3.43Å; Q298-M302 WeakPolarHBondContact O-CG 3.49Å; Q298-M302 PolarHBondContact O-N 3.41Å
299E93.2Very high86.2Confident110 Ų11097 Ų9751%0.51450%0.5SS..Hα-helixtrans-63.4-41.2176.8-73.4179.8175.900112.6I295 A296 M302 R303I295-E299 HydrophobicContact CG2-CG 4.45Å; I295-E299 WeakPolarHBondContact O-CG 3.33Å; I295-E299 PolarHBondContact O-N 3.22Å; A296-E299 PolarHBondContact O-N 3.33Å; E299-M302 PolarHBondContact O-N 3.15Å; E299-R303 PolarHBondContact O-N 2.93Å
300A93.1Very high85.4Confident40 Ų4094.8 Ų94.833%0.33149%0.493SS..Hα-helixtrans-61.2-44.817500000111.4A296 A297 M302 R303 I304A296-A300 WeakPolarHBondContact O-CB 3.49Å; A296-A300 PolarHBondContact O-N 3.14Å; A297-A300 PolarHBondContact O-N 3.32Å; A300-M302 VanDerWaalsContact C-N 3.35Å; A300-M302 PolarHBondContact O-N 3.47Å; A300-R303 PolarHBondContact O-N 3.36Å; A300-I304 WeakPolarHBondContact O-CG1 3.4Å; A300-I304 PolarHBondContact O-N 3.47Å; A300-I304 VanDerWaalsContact O-N 3.15Å
301R90.1Very high84.2Confident183 Ų18398.2 Ų98.269%0.69150%0.504SS*.Hα-helixtrans-63.6-39.4176.3-171.7173.1-176.5150.42.7112.4A297 Q298 R303 I304 L305A297-R301 WeakPolarHBondContact O-CB 3.36Å; A297-R301 PolarHBondContact O-N 2.72Å; Q298-R301 PolarHBondContact O-N 3.43Å; R301-R303 VanDerWaalsContact C-N 3.35Å; R301-I304 PolarHBondContact O-N 3.04Å; R301-L305 WeakPolarHBondContact O-CG 3.41Å; R301-L305 PolarHBondContact O-N 3.28Å; R301-L305 VanDerWaalsContact O-N 3.15Å
302M88.3Confident82.7Confident93 Ų93100.1 Ų100.146%0.45851%0.514SS..Hα-helixtrans-62.7-40.5175-75.1-61.8-57.200112Q298 E299 A300 L305 Q306Q298-M302 WeakPolarHBondContact O-CG 3.49Å; Q298-M302 PolarHBondContact O-N 3.41Å; E299-M302 PolarHBondContact O-N 3.15Å; A300-M302 VanDerWaalsContact C-N 3.35Å; A300-M302 PolarHBondContact O-N 3.47Å; M302-L305 PolarHBondContact O-N 3.37Å; M302-Q306 WeakPolarHBondContact O-CG 3.42Å; M302-Q306 PolarHBondContact O-N 3.25Å
303R88.5Confident80.8Confident156 Ų15696.9 Ų96.959%0.58950%0.5SS*.Hα-helixtrans-61.9-42.2175.5-86.2-170.7-89.1143-8.7112.6E299 A300 R301 L305 Q306 L307E299-R303 PolarHBondContact O-N 2.93Å; A300-R303 PolarHBondContact O-N 3.36Å; R301-R303 VanDerWaalsContact C-N 3.35Å; R303-L305 VanDerWaalsContact C-N 3.33Å; R303-L305 PolarHBondContact O-N 3.1Å; R303-Q306 PolarHBondContact O-N 3.15Å; R303-L307 WeakPolarHBondContact O-CG 3.26Å; R303-L307 PolarHBondContact O-N 3.29Å
304I86.3Confident78.9Confident117 Ų11796 Ų9660%0.650%0.496SS*.Hα-helixtrans-61.6-43.2176.8-64.7165.6000110.9A300 R301 Q306 L307 A308A300-I304 WeakPolarHBondContact O-CG1 3.4Å; A300-I304 PolarHBondContact O-N 3.47Å; A300-I304 VanDerWaalsContact O-N 3.15Å; R301-I304 PolarHBondContact O-N 3.04Å; I304-Q306 VanDerWaalsContact C-N 3.33Å; I304-Q306 PolarHBondContact O-N 2.97Å; I304-L307 PolarHBondContact O-N 3.3Å; I304-A308 PolarHBondContact O-N 2.98Å; I304-A308 VanDerWaalsContact O-N 3.15Å
305L80.6Confident77Confident104 Ų10497.8 Ų97.855%0.54551%0.507SS..Hα-helixtrans-66.6-34.1178.9-69172.2000112.8R301 M302 R303 S309R301-L305 WeakPolarHBondContact O-CG 3.41Å; R301-L305 PolarHBondContact O-N 3.28Å; R301-L305 VanDerWaalsContact O-N 3.15Å; M302-L305 PolarHBondContact O-N 3.37Å; R303-L305 VanDerWaalsContact C-N 3.33Å; R303-L305 PolarHBondContact O-N 3.1Å; L305-S309 PolarHBondContact O-N 3.48Å
306Q79.2Confident75Confident109 Ų109102.2 Ų102.251%0.50952%0.524SS..Hα-helixtrans-68.5-42.9175.3-75.1174.5-24.300111.8M302 R303 I304 A308 S309 D310M302-Q306 WeakPolarHBondContact O-CG 3.42Å; M302-Q306 PolarHBondContact O-N 3.25Å; R303-Q306 PolarHBondContact O-N 3.15Å; I304-Q306 VanDerWaalsContact C-N 3.33Å; I304-Q306 PolarHBondContact O-N 2.97Å; Q306-A308 VanDerWaalsContact C-N 3.33Å; Q306-A308 PolarHBondContact O-N 3.23Å; Q306-S309 WeakPolarHBondContact CA-OG 3.46Å; Q306-S309 PolarHBondContact O-N 2.93Å; Q306-S309 VanDerWaalsContact O-N 3.15Å; Q306-S309 PolarHBondContact O-OG 3.24Å; Q306-D310 PolarHBondContact O-N 3.03Å
307L73.8Confident72.7Confident108 Ų108106 Ų10657%0.56553%0.533SS*.Hα-helixtrans-60.4-43.7176.8-70.7168.6000111.7R303 I304 S309 D310 E311R303-L307 WeakPolarHBondContact O-CG 3.26Å; R303-L307 PolarHBondContact O-N 3.29Å; I304-L307 PolarHBondContact O-N 3.3Å; L307-S309 VanDerWaalsContact C-N 3.29Å; L307-S309 PolarHBondContact O-N 3.48Å; L307-D310 PolarHBondContact O-N 3.32Å; L307-E311 WeakPolarHBondContact O-CG 3.4Å; L307-E311 PolarHBondContact O-N 3.03Å; L307-E311 VanDerWaalsContact O-N 3.13Å
308A67.1Low70.3Confident46 Ų46109.4 Ų109.438%0.3854%0.543SS..Hα-helixtrans-61.5-35.9176.200000112.6I304 Q306 D312I304-A308 PolarHBondContact O-N 2.98Å; I304-A308 VanDerWaalsContact O-N 3.15Å; Q306-A308 VanDerWaalsContact C-N 3.33Å; Q306-A308 PolarHBondContact O-N 3.23Å; A308-D312 PolarHBondContact O-N 2.89Å
309S62.5Low68.2Low57 Ų57110.7 Ų110.740%0.39955%0.554SS.*Hα-helixtrans-71.6-33.9176.4590000113.4L305 Q306 L307 T313L305-S309 PolarHBondContact O-N 3.48Å; Q306-S309 WeakPolarHBondContact CA-OG 3.46Å; Q306-S309 PolarHBondContact O-N 2.93Å; Q306-S309 VanDerWaalsContact O-N 3.15Å; Q306-S309 PolarHBondContact O-OG 3.24Å; L307-S309 VanDerWaalsContact C-N 3.29Å; L307-S309 PolarHBondContact O-N 3.48Å; S309-T313 WeakPolarHBondContact O-CB 3.48Å; S309-T313 PolarHBondContact O-N 2.99Å; S309-T313 VanDerWaalsContact O-N 3.12Å; S309-T313 PolarHBondContact O-OG1 3.43Å
310D65.6Low65.7Low95 Ų95109.7 Ų109.751%0.50856%0.559SS.*Hα-helixtrans-70.4-41.1179.9-66.9-18.5000110.5Q306 L307 D312 T313 E314Q306-D310 PolarHBondContact O-N 3.03Å; L307-D310 PolarHBondContact O-N 3.32Å; D310-D312 PolarHBondContact O-N 2.64Å; D310-T313 PolarHBondContact O-N 3.06Å; D310-T313 VanDerWaalsContact O-N 3.1Å; D310-E314 PolarHBondContact O-N 3.15Å
311E58.8Low62.8Low128 Ų128113.1 Ų113.160%0.59858%0.579SS**Hα-helixtrans-59.4-45.4174.4-69.9178.5173.700112.2L307 T313 E314 L315L307-E311 WeakPolarHBondContact O-CG 3.4Å; L307-E311 PolarHBondContact O-N 3.03Å; L307-E311 VanDerWaalsContact O-N 3.13Å; E311-T313 PolarHBondContact O-N 3.3Å; E311-E314 PolarHBondContact O-N 3.39Å; E311-L315 WeakPolarHBondContact O-CG 3.46Å; E311-L315 PolarHBondContact O-N 3.47Å; E311-L315 VanDerWaalsContact O-N 3.14Å
312D59.4Low60.4Low87 Ų87112.8 Ų112.847%0.46559%0.585SS.*Hα-helixtrans-64.2-29.4175.7-80.5-19.8000112.9A308 D310 K316A308-D312 PolarHBondContact O-N 2.89Å; D310-D312 PolarHBondContact O-N 2.64Å; D312-K316 WeakPolarHBondContact O-CG 3.42Å; D312-K316 PolarHBondContact O-N 3.15Å
313T54.5Low57.8Low70 Ų70114.2 Ų114.243%0.42960%0.602SS.*Hα-helixtrans-79.2-39.4-178.7-51.40000111.2S309 D310 E311 K316 Q317S309-T313 WeakPolarHBondContact O-CB 3.48Å; S309-T313 PolarHBondContact O-N 2.99Å; S309-T313 VanDerWaalsContact O-N 3.12Å; S309-T313 PolarHBondContact O-OG1 3.43Å; D310-T313 PolarHBondContact O-N 3.06Å; D310-T313 VanDerWaalsContact O-N 3.1Å; E311-T313 PolarHBondContact O-N 3.3Å; T313-K316 PolarHBondContact O-N 3.13Å; T313-Q317 WeakPolarHBondContact O-CG 3.48Å; T313-Q317 PolarHBondContact O-N 3.21Å; T313-Q317 VanDerWaalsContact O-N 3.11Å
314E53.1Low55.8Low135 Ų135113.4 Ų113.463%0.63161%0.614SS**Hα-helixtrans-65.4-38.6174.3-71.4-16916900111.8D310 E311 Q317 N318D310-E314 PolarHBondContact O-N 3.15Å; E311-E314 PolarHBondContact O-N 3.39Å; E314-Q317 PolarHBondContact O-N 3.12Å; E314-N318 PolarHBondContact O-N 2.96Å; E314-N318 PolarHBondContact O-ND2 3.04Å
315L51.4Low53.7Low115 Ų115116.9 Ų116.960%0.60263%0.627SS**Hα-helixtrans-64.2-40.8175.6-70.5169.8000112.2E311 N318E311-L315 WeakPolarHBondContact O-CG 3.46Å; E311-L315 PolarHBondContact O-N 3.47Å; E311-L315 VanDerWaalsContact O-N 3.14Å; L315-N318 PolarHBondContact O-N 3.45Å
316K50.5Low51.6Low156 Ų156121.1 Ų121.168%0.67864%0.644SS**Hα-helixtrans-72.3-27.2178.6-75174.7-177.6167.20114D312 T313D312-K316 WeakPolarHBondContact O-CG 3.42Å; D312-K316 PolarHBondContact O-N 3.15Å; T313-K316 PolarHBondContact O-N 3.13Å
317Q46.5Very low49.7Very low129 Ų129125.3 Ų125.360%0.60366%0.664SS**Hα-helixtrans-71.5-33.4175.8-78-178.811.300112T313 E314 S320T313-Q317 WeakPolarHBondContact O-CG 3.48Å; T313-Q317 PolarHBondContact O-N 3.21Å; T313-Q317 VanDerWaalsContact O-N 3.11Å; E314-Q317 PolarHBondContact O-N 3.12Å; Q317-S320 PolarHBondContact O-OG 3.1Å
318N43.7Very low48Very low133 Ų133125.7 Ų125.771%0.71168%0.676SS**Hα-helixtrans-74.4-23.7-179.2-69.6-31.1000114.1E314 L315E314-N318 PolarHBondContact O-N 2.96Å; E314-N318 PolarHBondContact O-ND2 3.04Å; L315-N318 PolarHBondContact O-N 3.45Å
319D45.7Very low46.4Very low154 Ų154129.4 Ų129.482%0.82470%0.696SS**THydrogen-bonded Turntrans-88.60.6178.5-87.6-15.6000114.3
320S41.5Very low45.4Very low89 Ų89136.8 Ų136.862%0.62272%0.721SS**  trans-100.210.4-170.367.40000116.1Q317Q317-S320 PolarHBondContact O-OG 3.1Å
321C31Very low43.8Very low111 Ų111141.3 Ų141.375%0.7574%0.739SS**  trans-111.785.4-178.5-83.90000112.6
322E40.6Very low42.4Very low176 Ų176141.5 Ų141.582%0.82275%0.753SS**  trans-162.3115.9143-113.5-178.9-162.100110.6
323P34.3Very low40.9Very low124 Ų124145.1 Ų145.181%0.80577%0.772SS**  trans-89.8124.8172.133.3-25.3000109
324V45.3Very low40.1Very low138 Ų138147.4 Ų147.484%0.83679%0.791SS**  trans-113.6119.9168.3-157.40000108.1
325E43.6Very low39Very low190 Ų190148.5 Ų148.589%0.88880%0.801SS**  trans-64.6144.2-169.2-62.6178.2152.100113.3
326E34.8Very low38.3Very low193 Ų193148.8 Ų148.890%0.90281%0.807SS**  trans-67.2126.8173.2-67.5176.2140.900111.7
327E40.7Very low37.3Very low198 Ų198146.2 Ų146.293%0.92581%0.809SS**  trans-135133.1145.8-77.5-159.7164.200111.5
328S36.9Very low36.8Very low116 Ų116150.5 Ų150.581%0.81182%0.821SS**  trans-69.6159.8-161.848.40000117.7
329P33.7Very low36.5Very low124 Ų124153 Ų15381%0.80583%0.829SS**  trans-91.9146.9-167.436.1-32.7000113.6
330K41Very low35.7Very low212 Ų212158.3 Ų158.392%0.92284%0.837SS**  trans-135.1133.3159.6-79.7-175.3-178.9168.60111.9
331E32Very low35.3Very low190 Ų190157.6 Ų157.689%0.88884%0.844SS**  trans-54.8148.6-177.4-59.5165141.700114.2
332C29.9Very low35.4Very low132 Ų132161.7 Ų161.789%0.89285%0.849SS**  -170.2125.1122.7-106.50000111.3
333N29Very low35.4Very low163 Ų163160.8 Ų160.887%0.87285%0.85SS**  trans-61.2144.7166.8-72-37.1000111.4
334S36.3Very low35.3Very low117 Ų117162.1 Ų162.182%0.81885%0.85SS**  trans-162.7137.613148.20000111.3
335D30.2Very low35.1Very low158 Ų158162.9 Ų162.985%0.84585%0.85SS**  trans-52.7134.7178.3-58.6-68.3000113.8
336V37Very low34.7Very low121 Ų121162.2 Ų162.273%0.73385%0.847SS**  trans-147.7108.9141.8-171.70000109.6Y338V336-Y338 HydrophobicContact CG1-CD2 3.63Å; V336-Y338 HydrophobicContact CG1-CE2 3.51Å
337S29.6Very low34.9Very low103 Ų103160.9 Ų160.972%0.7285%0.846SS**  trans-68.5135.2162.3540000111
338Y35.8Very low35Very low219 Ų219160 Ų16086%0.85984%0.842SS**  trans-147.3149.5147.9-84-69.2000112.7V336V336-Y338 HydrophobicContact CG1-CD2 3.63Å; V336-Y338 HydrophobicContact CG1-CE2 3.51Å
339E36.8Very low35.3Very low184 Ų184160.4 Ų160.486%0.8684%0.842SS**  trans-90.3156.6-156.5-168.1172.4-17200112.3G341E339-G341 PolarHBondContact O-N 3.33Å
340W29Very low35.6Very low266 Ų266160.5 Ų160.5100%1.00884%0.84SS**  trans-59.2124.9178.4-99.527.8000112.7
341G35Very low35.4Very low74 Ų74156.7 Ų156.776%0.76383%0.829SS**  trans-131.8119.5166.300000109.5E339E339-G341 PolarHBondContact O-N 3.33Å
342K33.1Very low35.7Very low198 Ų198158.1 Ų158.186%0.86183%0.828SS**  trans-48.9142.5171.8-64.9166.7176172.40110.9
343D38.6Very low35.9Very low157 Ų157158.5 Ų158.584%0.8482%0.818SS**  -163.8136.6124.9-96.8-22000111.7
344D34Very low36.2Very low151 Ų151157.5 Ų157.581%0.80781%0.813SS**  trans-62.2127.8176.1-58.6-57.4000110
345N40.5Very low36.1Very low155 Ų155159.1 Ų159.183%0.82981%0.812SS**  trans-154.1126.6146.9-113.6-35.7000112.8
346E34.2Very low36.1Very low175 Ų175157.7 Ų157.782%0.81881%0.81SS**  trans-53.6124175.6-58.5169160.200109.9
347N39.8Very low36Very low165 Ų165159.4 Ų159.488%0.88281%0.814SS**  trans-150116.2155.7-95.3-36.5000110
348E42.2Very low36Very low181 Ų181162 Ų16285%0.84681%0.814SS**  trans-59.7148.5-179.5-64-166.414000112.9V350E348-V350 PolarHBondContact O-N 3.48Å
349P43.1Very low35.9Very low124 Ų124155.4 Ų155.481%0.80581%0.805SS**  trans-77.1117.9167.730.8-28.9000109.8N351P349-N351 PolarHBondContact O-N 3.38Å; P349-N351 VanDerWaalsContact O-N 3.1Å
350V40.5Very low35.6Very low126 Ų126152.6 Ų152.676%0.76480%0.801SS**  trans-56.7111.1171.6-172.80000109.2E348 Y352E348-V350 PolarHBondContact O-N 3.48Å; V350-Y352 HydrophobicContact CG1-CD2 4.36Å; V350-Y352 HydrophobicContact CG1-CE2 4.23Å; V350-Y352 PolarHBondContact O-N 3.42Å
351N36.4Very low35.8Very low132 Ų132147.3 Ų147.371%0.70679%0.787SS**  trans-87.299.9-178.7-159.17.8000109P349 M353P349-N351 PolarHBondContact O-N 3.38Å; P349-N351 VanDerWaalsContact O-N 3.1Å; N351-M353 VanDerWaalsContact C-N 3.25Å; N351-M353 PolarHBondContact O-N 3.45Å
352Y39Very low35.7Very low219 Ų219153.8 Ų153.886%0.85980%0.795SS**  trans-73.583.6167.3-87.8-87.6000109.4V350V350-Y352 HydrophobicContact CG1-CD2 4.36Å; V350-Y352 HydrophobicContact CG1-CE2 4.23Å; V350-Y352 PolarHBondContact O-N 3.42Å
353M34.4Very low35.8Very low141 Ų141151.9 Ų151.970%0.69579%0.789SS**  trans-74.5123.9151.5-76.2-171.8172.400107.8N351N351-M353 VanDerWaalsContact C-N 3.25Å; N351-M353 PolarHBondContact O-N 3.45Å
354N34.5Very low35.5Very low142 Ų142149.8 Ų149.876%0.75979%0.786SS**  trans157.3107.2130.8-76-22.2000110.2
355N33.9Very low35.6Very low150 Ų150147.6 Ų147.680%0.80278%0.783SS**  -173.484.1117.9-91-12.3000109.7L357N355-L357 VanDerWaalsContact C-N 3.31Å; N355-L357 PolarHBondContact O-N 3.11Å; N355-L357 VanDerWaalsContact O-N 3.12Å
356T30.2Very low35.5Very low129 Ų129145.9 Ų145.979%0.79178%0.78SS**  trans-69.791.3155.5-58.90000107.3H358T356-H358 PolarHBondContact O-N 3.4Å
357L35.2Very low35.6Very low157 Ų157144.5 Ų144.582%0.82278%0.779SS**  trans-80.195.9161.3-92.1163.8000108N355 A359N355-L357 VanDerWaalsContact C-N 3.31Å; N355-L357 PolarHBondContact O-N 3.11Å; N355-L357 VanDerWaalsContact O-N 3.12Å; L357-A359 VanDerWaalsContact C-N 3.27Å; L357-A359 PolarHBondContact O-N 3.21Å
358H29.8Very low35.6Very low157 Ų157142.1 Ų142.173%0.72777%0.772SS**  trans-64.886.6163.8-123.6-62.7000108.2T356 T360T356-H358 PolarHBondContact O-N 3.4Å; H358-T360 PolarHBondContact O-N 2.96Å
359A33.2Very low35.2Very low81 Ų81138.5 Ų138.567%0.66977%0.766SS**  trans-84.193.7165.300000108.1L357 E361L357-A359 VanDerWaalsContact C-N 3.27Å; L357-A359 PolarHBondContact O-N 3.21Å; A359-E361 PolarHBondContact O-N 3.14Å
360T30.5Very low34.7Very low125 Ų125136 Ų13677%0.76775%0.752SS**  trans-70.882.9163.245.60000108.8H358H358-T360 PolarHBondContact O-N 2.96Å
361E34.5Very low34.3Very low154 Ų154135.8 Ų135.872%0.7276%0.756SS**  trans-94.6103.5165.1-74.6-174.9160.800108.8A359 E363A359-E361 PolarHBondContact O-N 3.14Å; E361-E363 HydrophobicContact CB-CG 4.38Å; E361-E363 PolarHBondContact O-N 3.18Å
362K31.7Very low34.5Very low211 Ų211138 Ų13892%0.91775%0.754SS**  trans-67.780.8159.4-77.5179.4174.4176.50107.7S364K362-S364 PolarHBondContact O-N 3.04Å
363E34.8Very low34.1Very low157 Ų157139.9 Ų139.973%0.73477%0.771SS**  trans-87.5104.6162.8-70.5-156.6145.800108.8E361 S365E361-E363 HydrophobicContact CB-CG 4.38Å; E361-E363 PolarHBondContact O-N 3.18Å; E363-S365 PolarHBondContact O-N 3.1Å; E363-S365 VanDerWaalsContact O-N 3.1Å
364S32.9Very low34Very low113 Ų113139.9 Ų139.979%0.7978%0.775SS**  trans-56.2109.8164.153.70000108.7K362 P366K362-S364 PolarHBondContact O-N 3.04Å; S364-P366 WeakPolarHBondContact O-CD 3.33Å
365S37.5Very low34Very low105 Ų105139.7 Ų139.773%0.73478%0.775SS**PPolyproline II helixtrans-58.6124.2172.9-47.60000109.6E363 D367E363-S365 PolarHBondContact O-N 3.1Å; E363-S365 VanDerWaalsContact O-N 3.1Å; S365-D367 PolarHBondContact O-N 3.33Å
366P36.4Very low34Very low120 Ų120139.2 Ų139.278%0.77977%0.774SS**PPolyproline II helixtrans-73.2120.415929-25.8000106.9S364S364-P366 WeakPolarHBondContact O-CD 3.33Å
367D37.2Very low34.3Very low146 Ų146139.8 Ų139.878%0.78177%0.773SS**PPolyproline II helixtrans-49.1131.7173.4-77.1-42.3000110.1S365 S369S365-D367 PolarHBondContact O-N 3.33Å; D367-S369 PolarHBondContact O-N 3Å
368P39.7Very low34.2Very low115 Ų115138.7 Ų138.775%0.74777%0.77SS**  trans-67.1104.1168.927.7-29.9000107.2C370P368-C370 PolarHBondContact O-N 3.26Å
369S33.2Very low34.5Very low104 Ų104137.5 Ų137.573%0.72777%0.773SS**  trans-64.278.3163.956.90000109.2D367D367-S369 PolarHBondContact O-N 3Å
370C33.2Very low34.6Very low73 Ų73141.5 Ų141.549%0.49378%0.78SS.*  trans-125.794.5165.3-156.50000104.9P368 W372P368-C370 PolarHBondContact O-N 3.26Å; C370-W372 PolarHBondContact O-N 3.23Å; C370-W372 PolarHBondContact O-NE1 2.79Å
371S32.5Very low34.9Very low121 Ų121142.8 Ų142.885%0.84678%0.781SS**  trans-62.6117.117150.70000108
372W39.4Very low34.9Very low177 Ų177141.8 Ų141.867%0.6779%0.786SS**  trans-93.7115.5171.9-59.593.1000107.3V283 C370V283-W372 HydrophobicContact CG1-CZ3 4.48Å; C370-W372 PolarHBondContact O-N 3.23Å; C370-W372 PolarHBondContact O-NE1 2.79Å
373E30.7Very low35.2Very low260 Ų260135.5 Ų135.5100%1.21577%0.774SS**  trans-970156-83.3-174.5157.200109.2

Retrieved 373 of 373 residues in 261.2 ms (Link to these results)